"PUBCHEM_EXT_DATASOURCE_SMILES","PUBCHEM_EXT_DATASOURCE_INCHI","PUBCHEM_EXT_DATASOURCE_REGID"
"CC1CC2=C(C(=CC=C2)O)C(=O)O1","InChI=1S/C10H10O3/c1-6-5-7-3-2-4-8(11)9(7)10(12)13-6/h2-4,6,11H,5H2,1H3","KWILGNNWGSNMPA-UHFFFAOYSA-N"
"CC[C@@H](C)[C@H]([C@H](C[C@@H](C)CCCCCC[C@H](C[C@@H](CN)O)O)OC(=O)CC(CC(=O)O)C(=O)O)O","InChI=1S/C25H47NO9/c1-4-17(3)24(32)21(35-23(31)13-18(25(33)34)12-22(29)30)11-16(2)9-7-5-6-8-10-19(27)14-20(28)15-26/h16-21,24,27-28,32H,4-15,26H2,1-3H3,(H,29,30)(H,33,34)/t16-,17+,18?,19+,20-,21-,24+/m0/s1","CTXQVLLVFBNZKL-YVEDVMJTSA-N"
"COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4[C@@H]5C=CO[C@@H]5OC4=C1","InChI=1S/C17H12O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h4-6,8,17H,2-3H2,1H3/t8-,17+/m0/s1","OQIQSTLJSLGHID-WNWIJWBNSA-N"
"COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4[C@@H]5CCO[C@@H]5OC4=C1","InChI=1S/C17H14O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h6,8,17H,2-5H2,1H3/t8-,17+/m0/s1","WWSYXEZEXMQWHT-WNWIJWBNSA-N"
"COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4[C@@H]5C=CO[C@@H]5OC4=C1","InChI=1S/C17H12O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h3,5-6,8,17H,2,4H2,1H3/t8-,17+/m0/s1","XWIYFDMXXLINPU-WNWIJWBNSA-N"
"COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4[C@@H]5CCO[C@@H]5OC4=C1","InChI=1S/C17H14O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h6,8,17H,2-5H2,1H3/t8-,17+/m0/s1","WPCVRWVBBXIRMA-WNWIJWBNSA-N"
"COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C(=C1)O[C@@H]5[C@]4(C=CO5)O","InChI=1S/C17H12O7/c1-21-9-6-10-13(17(20)4-5-22-16(17)23-10)14-12(9)7-2-3-8(18)11(7)15(19)24-14/h4-6,16,20H,2-3H2,1H3/t16-,17-/m1/s1","MJBWDEQAUQTVKK-IAGOWNOFSA-N"
"CC(=O)C1=C([C@@H]2[C@@H]3[C@@H](CC4=C5C3=CNC5=CC=C4)C(N2C1=O)(C)C)O","InChI=1S/C20H20N2O3/c1-9(23)14-18(24)17-16-11-8-21-13-6-4-5-10(15(11)13)7-12(16)20(2,3)22(17)19(14)25/h4-6,8,12,16-17,21,24H,7H2,1-3H3/t12-,16+,17+/m1/s1","SZINUGQCTHLQAZ-DQYPLSBCSA-N"
"C[C@]12C[C@@H]([C@H](C=C1C3=CC(=CC(=C3C(=O)O2)O)OC)O)O","InChI=1S/C15H16O6/c1-15-6-12(18)10(16)5-9(15)8-3-7(20-2)4-11(17)13(8)14(19)21-15/h3-5,10,12,16-18H,6H2,1-2H3/t10-,12-,15-/m0/s1","MMHTXEATDNFMMY-WBIUFABUSA-N"
"CC1=CC(=CC2=C1C3=CC(=CC(=C3C(=O)O2)O)O)O","InChI=1S/C14H10O5/c1-6-2-7(15)5-11-12(6)9-3-8(16)4-10(17)13(9)14(18)19-11/h2-5,15-17H,1H3","CEBXXEKPIIDJHL-UHFFFAOYSA-N"
"CC1=CC(=CC2=C1C3=CC(=CC(=C3C(=O)O2)O)OC)O","InChI=1S/C15H12O5/c1-7-3-8(16)4-12-13(7)10-5-9(19-2)6-11(17)14(10)15(18)20-12/h3-6,16-17H,1-2H3","LCSDQFNUYFTXMT-UHFFFAOYSA-N"
"C[C@]1([C@@H]([C@H](C2=C([C@H]1O)C(=O)C3=CC(=CC(=C3C2=O)O)OC)O)O)O","InChI=1S/C16H16O8/c1-16(23)14(21)10-9(13(20)15(16)22)12(19)8-6(11(10)18)3-5(24-2)4-7(8)17/h3-4,13-15,17,20-23H,1-2H3/t13-,14+,15+,16-/m0/s1","VSMBLBOUQJNJIL-JJXSEGSLSA-N"
"C[C@]12CCC[C@H](O1)C3=C(O2)C=C4C(=C3O)C(=O)C5=C(C=C(C=C5C4=O)O)O","InChI=1S/C20H16O7/c1-20-4-2-3-12(26-20)16-13(27-20)7-10-15(19(16)25)18(24)14-9(17(10)23)5-8(21)6-11(14)22/h5-7,12,21-22,25H,2-4H2,1H3/t12-,20-/m0/s1","RYFFZJHGQCKWMV-YUNKPMOVSA-N"
"CC1([C@@H]2C[C@@]34CCCN3C(=O)[C@]2(C[C@]15C(=O)C6=CC=CC=C6N5)NC4=O)C","InChI=1S/C21H23N3O3/c1-18(2)14-10-19-8-5-9-24(19)17(27)20(14,23-16(19)26)11-21(18)15(25)12-6-3-4-7-13(12)22-21/h3-4,6-7,14,22H,5,8-11H2,1-2H3,(H,23,26)/t14-,19+,20+,21-/m0/s1","MWOFPQAPILIIPR-DJJZHVJBSA-N"
"C[C@H]\1C/C=C/[C@H]2[C@H]3[C@](O3)([C@H]([C@@H]4[C@@]2(C(=O)/C=C/C(=O)[C@@H](/C(=C1)/C)O)C(=O)N[C@H]4CC5=CNC6=CC=CC=C65)C)C","InChI=1S/C32H36N2O5/c1-17-8-7-10-22-29-31(4,39-29)19(3)27-24(15-20-16-33-23-11-6-5-9-21(20)23)34-30(38)32(22,27)26(36)13-12-25(35)28(37)18(2)14-17/h5-7,9-14,16-17,19,22,24,27-29,33,37H,8,15H2,1-4H3,(H,34,38)/b10-7+,13-12+,18-14+/t17-,19-,22-,24-,27-,28+,29-,31+,32+/m0/s1","OUMWCYMRLMEZJH-VOXRAUTJSA-N"
"C[C@H]/1C/C=C\[C@H]2[C@H]3[C@](O3)([C@H]([C@@H]4[C@@]2(C(=O)CCC(=O)C(=O)/C(=C1)/C)C(=O)N[C@H]4CC5=CNC6=CC=CC=C65)C)C","InChI=1S/C32H36N2O5/c1-17-8-7-10-22-29-31(4,39-29)19(3)27-24(15-20-16-33-23-11-6-5-9-21(20)23)34-30(38)32(22,27)26(36)13-12-25(35)28(37)18(2)14-17/h5-7,9-11,14,16-17,19,22,24,27,29,33H,8,12-13,15H2,1-4H3,(H,34,38)/b10-7-,18-14-/t17-,19-,22-,24-,27-,29-,31+,32+/m0/s1","RIZAHVBYKWUPHQ-MASOQXDXSA-N"
"C[C@@]12CCCC([C@H]3[C@@H]1[C@@H](C[C@@]2(C3O)C)O)(C)C","InChI=1S/C15H26O2/c1-13(2)6-5-7-14(3)10-9(16)8-15(14,4)12(17)11(10)13/h9-12,16-17H,5-8H2,1-4H3/t9-,10+,11+,12?,14-,15-/m1/s1","VWMGBHVRRNKOAE-PDMNRUCYSA-N"
"C[C@@]12CC[C@H](C([C@H]3[C@@H]1[C@@H](C[C@@]2(C3O)C)O)(C)C)O","InChI=1S/C15H26O3/c1-13(2)9(17)5-6-14(3)10-8(16)7-15(14,4)12(18)11(10)13/h8-12,16-18H,5-7H2,1-4H3/t8-,9-,10+,11+,12?,14-,15-/m1/s1","XFKGEQRMYJCXFK-YTAGIEBCSA-N"
"CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3(C[C@H]([C@H]([C@@]34CO4)O2)O)C)CO","InChI=1S/C15H20O6/c1-7-3-9-14(5-16,11(19)10(7)18)13(2)4-8(17)12(21-9)15(13)6-20-15/h3,8-9,11-12,16-17,19H,4-6H2,1-2H3/t8-,9-,11-,12-,13-,14-,15+/m1/s1","LINOMUASTDIRTM-QGRHZQQGSA-N"
"CC1=C[C@@H]2[C@](C(C1=O)O)([C@]3(C[C@H]([C@H]([C@@]34CO4)O2)OC(=O)C)C)COC(=O)C","InChI=1S/C19H24O8/c1-9-5-13-18(7-24-10(2)20,15(23)14(9)22)17(4)6-12(26-11(3)21)16(27-13)19(17)8-25-19/h5,12-13,15-16,23H,6-8H2,1-4H3/t12-,13-,15?,16-,17-,18-,19+/m1/s1","RANGFOQREJPKIH-QZQWDYNDSA-N"
"CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H]([C@H]([C@H]([C@]34CO4)O2)O)OC(=O)C)C)COC(=O)C","InChI=1S/C19H26O7/c1-10-5-6-18(8-23-11(2)20)13(7-10)26-16-14(22)15(25-12(3)21)17(18,4)19(16)9-24-19/h7,13-16,22H,5-6,8-9H2,1-4H3/t13-,14-,15-,16-,17-,18-,19-/m1/s1","AUGQEEXBDZWUJY-ZLJUKNTDSA-N"
"CC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)O)O","InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3","RHMXXJGYXNZAPX-UHFFFAOYSA-N"
"CCC/C=C/C=C/[C@@H]1C[C@H]([C@H](C(=O)[C@H]1C=O)O)O","InChI=1S/C14H20O4/c1-2-3-4-5-6-7-10-8-12(16)14(18)13(17)11(10)9-15/h4-7,9-12,14,16,18H,2-3,8H2,1H3/b5-4+,7-6+/t10-,11+,12-,14-/m1/s1","MHZVWXOKIRZLCJ-XZQMCIKJSA-N"
"CC1=C[C@@H]2[C@]([C@@H](C1=O)O)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)OC(=O)C)C)CO","InChI=1S/C17H22O8/c1-7-4-9-16(5-18,12(22)10(7)20)15(3)13(24-8(2)19)11(21)14(25-9)17(15)6-23-17/h4,9,11-14,18,21-22H,5-6H2,1-3H3/t9-,11-,12-,13-,14-,15-,16-,17+/m1/s1","XGCUCFKWVIWWNW-CAYGJDLQSA-N"
"CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)CC(C)C)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)O)C)COC(=O)C","InChI=1S/C22H32O8/c1-11(2)6-16(24)29-14-8-21(9-27-13(4)23)15(7-12(14)3)30-19-17(25)18(26)20(21,5)22(19)10-28-22/h7,11,14-15,17-19,25-26H,6,8-10H2,1-5H3/t14-,15+,17+,18+,19+,20+,21+,22-/m0/s1","PNKLMTPXERFKEN-MLXHEQMXSA-N"
"CC12CC3=C(C4=C(C(=O)C=C(C4=O)OC)C(=C3C(O1)C[C@@H](O2)C(=O)O)O)O","InChI=1S/C18H16O9/c1-18-5-6-11(8(26-18)4-10(27-18)17(23)24)16(22)12-7(19)3-9(25-2)15(21)13(12)14(6)20/h3,8,10,20,22H,4-5H2,1-2H3,(H,23,24)/t8?,10-,18?/m1/s1","HNMWDXUKPJZOQD-XPBDJYBLSA-N"
"CCCCCC[C@H]1[C@@H]2CC[C@H]3[C@H](CC[C@H]([C@]3(O2)O1)O)O","InChI=1S/C16H28O4/c1-2-3-4-5-6-13-14-9-7-11-12(17)8-10-15(18)16(11,19-13)20-14/h11-15,17-18H,2-10H2,1H3/t11-,12-,13-,14-,15+,16-/m0/s1","GBDGOAVPCDIMFE-SBOZNWLOSA-N"
"CCCCCC[C@@H]([C@@H]1CCC2=C(O1)[C@@H](CCC2=O)O)O","InChI=1S/C16H26O4/c1-2-3-4-5-6-13(18)15-10-7-11-12(17)8-9-14(19)16(11)20-15/h13-15,18-19H,2-10H2,1H3/t13-,14+,15-/m0/s1","INHVGPIPHZJQOP-ZNMIVQPWSA-N"
"CC1=CC(=C(C2=C1C(=CC(=O)O2)OC)C3=C(C=C(C4=C3OC(=O)C=C4OC)C)OC)OC","InChI=1S/C24H22O8/c1-11-7-13(27-3)21(23-19(11)15(29-5)9-17(25)31-23)22-14(28-4)8-12(2)20-16(30-6)10-18(26)32-24(20)22/h7-10H,1-6H3","CSJOUDOXDHMIAH-UHFFFAOYSA-N"
"CC1=C(C=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)OC)O","InChI=1S/C16H12O5/c1-7-3-9-10(6-12(7)17)16(20)14-11(15(9)19)4-8(21-2)5-13(14)18/h3-6,17-18H,1-2H3","FKTPLNFTYJEAAB-UHFFFAOYSA-N"
"CC(C)(C=C)[C@@]12C=C(C(=O)N\3[C@]1(NC(=O)/C3=C\C4=CN=CN4)N(C5=CC=CC=C25)OC)O","InChI=1S/C23H23N5O4/c1-5-21(2,3)22-11-18(29)20(31)27-17(10-14-12-24-13-25-14)19(30)26-23(22,27)28(32-4)16-9-7-6-8-15(16)22/h5-13,29H,1H2,2-4H3,(H,24,25)(H,26,30)/b17-10+/t22-,23-/m0/s1","JTJJJLSLKZFEPJ-ZAYCRUKZSA-N"
"CC1=C[C@@H]2[C@](C[C@@H]1O)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)OC(=O)C)C)COC(=O)C","InChI=1S/C19H26O8/c1-9-5-13-18(6-12(9)22,7-24-10(2)20)17(4)15(26-11(3)21)14(23)16(27-13)19(17)8-25-19/h5,12-16,22-23H,6-8H2,1-4H3/t12-,13+,14+,15+,16+,17+,18+,19-/m0/s1","TVZHDVCTOCZDNE-WVJYZQHISA-N"
"C[C@@H]1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)O)Cl","InChI=1S/C20H18ClNO6/c1-10-7-12-14(21)9-13(17(23)16(12)20(27)28-10)18(24)22-15(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,15,23H,7-8H2,1H3,(H,22,24)(H,25,26)/t10-,15+/m1/s1","RWQKHEORZBHNRI-BMIGLBTASA-N"
"CC(C)(C=C)[C@@]12C[C@H]3C(=O)N/C(=C/C4=CN=CN4)/C(=O)N3[C@@H]1NC5=CC=CC=C25","InChI=1S/C22H23N5O2/c1-4-21(2,3)22-10-17-18(28)25-16(9-13-11-23-12-24-13)19(29)27(17)20(22)26-15-8-6-5-7-14(15)22/h4-9,11-12,17,20,26H,1,10H2,2-3H3,(H,23,24)(H,25,28)/b16-9+/t17-,20-,22+/m0/s1","SPWSUFUPTSJWNG-JJUKSXGLSA-N"
"COC1=C2C(=C3[C@@H]4C=CO[C@@H]4OC3=C1)OC5=C(C2=O)C(=CC=C5)O","InChI=1S/C18H12O6/c1-21-11-7-12-13(8-5-6-22-18(8)24-12)17-15(11)16(20)14-9(19)3-2-4-10(14)23-17/h2-8,18-19H,1H3/t8-,18+/m0/s1","UTSVPXMQSFGQTM-DCXZOGHSSA-N"
"C1=C(C=C(C(=CC1=O)O)O)C(=O)O","InChI=1S/C8H6O5/c9-5-1-4(8(12)13)2-6(10)7(11)3-5/h1-3,10-11H,(H,12,13)","ZGKNMKBZOSTFCB-UHFFFAOYSA-N"
"CC1=C[C@@H]2[C@](C[C@@H]1OC(=O)CC(C)C)([C@]3([C@@H]([C@H]([C@H]([C@@]34CO4)O2)O)OC(=O)C)C)COC(=O)C","InChI=1S/C24H34O9/c1-12(2)7-18(27)32-16-9-23(10-29-14(4)25)17(8-13(16)3)33-21-19(28)20(31-15(5)26)22(23,6)24(21)11-30-24/h8,12,16-17,19-21,28H,7,9-11H2,1-6H3/t16-,17+,19+,20+,21+,22+,23+,24-/m0/s1","BXFOFFBJRFZBQZ-QYWOHJEZSA-N"
"C[C@@H]1CC(=O)[C@]/2([C@@H]1C[C@]3(CC[C@@H]([C@@H]3C/C=C2/C=O)C(=C)C)C)O","InChI=1S/C20H28O3/c1-12(2)15-7-8-19(4)10-17-13(3)9-18(22)20(17,23)14(11-21)5-6-16(15)19/h5,11,13,15-17,23H,1,6-10H2,2-4H3/b14-5-/t13-,15-,16+,17-,19-,20+/m1/s1","QXVAWAHULUVLPT-FHIBGDQLSA-N"
"CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H](C[C@H]([C@@]34CO4)O2)OC(=O)/C=C\C=C\[C@@H]([C@H](C)O)O)C)CO","InChI=1S/C23H32O7/c1-14-8-9-22(12-24)18(10-14)29-19-11-17(21(22,3)23(19)13-28-23)30-20(27)7-5-4-6-16(26)15(2)25/h4-7,10,15-19,24-26H,8-9,11-13H2,1-3H3/b6-4+,7-5-/t15-,16-,17+,18+,19+,21+,22+,23-/m0/s1","QFKRKMXPKBHGGO-OYWHZMLYSA-N"
"CC1=C[C@@H]2[C@@]3(CC1)COC(=O)/C=C(/CCOC(=O)/C=C/C=C/C(=O)O[C@H]4[C@]3([C@]5(CO5)[C@@H](C4)O2)C)\C","InChI=1S/C27H32O8/c1-17-8-10-26-15-32-24(30)13-18(2)9-11-31-22(28)6-4-5-7-23(29)35-19-14-21(34-20(26)12-17)27(16-33-27)25(19,26)3/h4-7,12-13,19-21H,8-11,14-16H2,1-3H3/b6-4+,7-5+,18-13+/t19-,20-,21-,25-,26-,27+/m1/s1","GXCGYHWSYNQVHU-UGAPSZEOSA-N"
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"CN(C1=CC2=C(C(=C(C=C2)OC)OC)OC1=O)C(=O)C3=NO[C@H]4[C@@H](C=C[C@H]([C@]4(C3)O)O)O","InChI=1S/C21H22N2O9/c1-23(12-8-10-4-6-14(29-2)17(30-3)16(10)31-20(12)27)19(26)11-9-21(28)15(25)7-5-13(24)18(21)32-22-11/h4-8,13,15,18,24-25,28H,9H2,1-3H3/t13-,15-,18+,21+/m1/s1","PCMUPOUDXMFDRE-NYGSYELISA-N"
"C[C@H]1C2=NC3=CC=CC=C3C(=O)N2[C@@H](C(=O)N1)CC4=CNC5=CC=CC=C54","InChI=1S/C21H18N4O2/c1-12-19-24-17-9-5-3-7-15(17)21(27)25(19)18(20(26)23-12)10-13-11-22-16-8-4-2-6-14(13)16/h2-9,11-12,18,22H,10H2,1H3,(H,23,26)/t12-,18+/m0/s1","SUVZUTHVKIBYOH-KPZWWZAWSA-N"
"C/C1=C2[C@H]3[C@H]([C@@](C)(O)O[C@H]3/C(C)=C\C[C@H]4C(C(C)C)=C(OC)C(O[C@]4(C)CC1)=O)C(O/2)=O","InChI=1S/C25H34O7/c1-12(2)16-15-9-8-13(3)20-17-18(25(6,28)31-20)22(26)30-19(17)14(4)10-11-24(15,5)32-23(27)21(16)29-7/h8,12,15,17-18,20,28H,9-11H2,1-7H3/b13-8-,19-14+/t15-,17+,18-,20-,24+,25-/m0/s1","BDGOANHBKYFDGC-KTGRICDKSA-N"
"OC1=C(C(C2=C(O)C=CC=C2C3=O)=O)C3=CC(O4)=C1[C@@]5(O)[C@@H]4OCC5","InChI=1S/C18H12O7/c19-9-3-1-2-7-11(9)15(21)12-8(14(7)20)6-10-13(16(12)22)18(23)4-5-24-17(18)25-10/h1-3,6,17,19,22-23H,4-5H2/t17-,18-/m1/s1","MFMARNFPIVNIHS-QZTJIDSGSA-N"
"CC(C=C)(C1(C(N(O)C2=CC=CC=C12)=O)CC3C(N/C(C(N3)=O)=C/C4=CN=CN4)=O)C","InChI=1S/C22H23N5O4/c1-4-21(2,3)22(14-7-5-6-8-17(14)27(31)20(22)30)10-16-19(29)25-15(18(28)26-16)9-13-11-23-12-24-13/h4-9,11-12,16,31H,1,10H2,2-3H3,(H,23,24)(H,25,29)(H,26,28)/b15-9+","GIYROBMIPLLHQE-OQLLNIDSSA-N"
"CCCC[C@H]([C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)[C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)C[C@H](CCCCCCCC[C@H](O)C(O)C)C)C","InChI=1S/C34H58O14/c1-5-6-14-22(3)32(48-31(42)20-25(34(45)46)18-29(39)40)27(47-30(41)19-24(33(43)44)17-28(37)38)16-21(2)13-11-9-7-8-10-12-15-26(36)23(4)35/h21-27,32,35-36H,5-20H2,1-4H3,(H,37,38)(H,39,40)(H,43,44)(H,45,46)/t21-,22+,23?,24+,25+,26-,27-,32+/m0/s1","ROPHOAFGZRNKDO-SNXTYUPGSA-N"
"CCCC[C@H]([C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)[C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)C[C@H](CCCCCC[C@@H](O)C[C@H](O)C(C)=O)C)C","InChI=1S/C34H56O15/c1-5-6-12-21(3)32(49-31(43)18-24(34(46)47)16-29(40)41)27(48-30(42)17-23(33(44)45)15-28(38)39)14-20(2)11-9-7-8-10-13-25(36)19-26(37)22(4)35/h20-21,23-27,32,36-37H,5-19H2,1-4H3,(H,38,39)(H,40,41)(H,44,45)(H,46,47)/t20-,21+,23+,24+,25+,26-,27-,32+/m0/s1","GZCJIEXTWGJVIN-MKHOGIGVSA-N"
"CCCC[C@H]([C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)[C@@H](OC(C[C@H](C(O)=O)CC(O)=O)=O)C[C@H](CCCCCCCC[C@H](O)C(C)=O)C)C","InChI=1S/C34H56O14/c1-5-6-14-22(3)32(48-31(42)20-25(34(45)46)18-29(39)40)27(47-30(41)19-24(33(43)44)17-28(37)38)16-21(2)13-11-9-7-8-10-12-15-26(36)23(4)35/h21-22,24-27,32,36H,5-20H2,1-4H3,(H,37,38)(H,39,40)(H,43,44)(H,45,46)/t21-,22+,24+,25+,26-,27-,32+/m0/s1","PUZDIGQDECBVJT-FLTFDZFMSA-N"
"O=C(NC(C(C)C)C(NC(CC1=CC=CC=C1)C(NC2CC3=CC=CC=C3)=O)=O)C(C(C)C)NC2=O","InChI=1S/C28H36N4O4/c1-17(2)23-27(35)30-21(15-19-11-7-5-8-12-19)25(33)29-22(16-20-13-9-6-10-14-20)26(34)31-24(18(3)4)28(36)32-23/h5-14,17-18,21-24H,15-16H2,1-4H3,(H,29,33)(H,30,35)(H,31,34)(H,32,36)","OWKLJRMFTXDULF-UHFFFAOYSA-N"
"c1cc(ccc1N)S(=O)(=O)Nc2cncc(n2)Cl","InChI=1S/C10H9ClN4O2S/c11-9-5-13-6-10(14-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)","QKLPUVXBJHRFQZ-UHFFFAOYSA-N"
"c1cc(ccc1N)S(=O)(=O)Nc2ccc(nn2)Cl","InChI=1S/C10H9ClN4O2S/c11-9-5-6-10(14-13-9)15-18(16,17)8-3-1-7(12)2-4-8/h1-6H,12H2,(H,14,15)","XOXHILFPRYWFOD-UHFFFAOYSA-N"
"Cc1cc(nc(n1)NS(=O)(=O)c2ccc(cc2)N)C","InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)","ASWVTGNCAZCNNR-UHFFFAOYSA-N"
"CC1=CC(C)=NC(NS(=O)(=O)C2=CC=C(N)C=C2)=N1","InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)","ASWVTGNCAZCNNR-UHFFFAOYSA-N"
"COc1cc(nc(n1)OC)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)","ZZORFUFYDOWNEF-UHFFFAOYSA-N"
"COc1c(ncnc1OC)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C12H14N4O4S/c1-19-10-11(14-7-15-12(10)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)","PJSFRIWCGOHTNF-UHFFFAOYSA-N"
"c1cnc(nc1)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)","SEEPANYCNGTZFQ-UHFFFAOYSA-N"
"c1cc(ccc1N)S(=O)(=O)NC(=N)N","InChI=1S/C7H10N4O2S/c8-5-1-3-6(4-2-5)14(12,13)11-7(9)10/h1-4H,8H2,(H4,9,10,11)","BRBKOPJOKNSWSG-UHFFFAOYSA-N"
"Cc1c(noc1NS(=O)(=O)c2ccc(cc2)N)C","InChI=1S/C11H13N3O3S/c1-7-8(2)13-17-11(7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6,14H,12H2,1-2H3","NHUHCSRWZMLRLA-UHFFFAOYSA-N"
"COc1ccc(nn1)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C11H12N4O3S/c1-18-11-7-6-10(13-14-11)15-19(16,17)9-4-2-8(12)3-5-9/h2-7H,12H2,1H3,(H,13,15)","VLYWMPOKSSWJAL-UHFFFAOYSA-N"
"Cc1ccnc(n1)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C11H12N4O2S/c1-8-6-7-13-11(14-8)15-18(16,17)10-4-2-9(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)","QPPBRPIAZZHUNT-UHFFFAOYSA-N"
"Cc1nnc(s1)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C9H10N4O2S2/c1-6-11-12-9(16-6)13-17(14,15)8-4-2-7(10)3-5-8/h2-5H,10H2,1H3,(H,12,13)","VACCAVUAMIDAGB-UHFFFAOYSA-N"
"Cc1cc(no1)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)","JLKIGFTWXXRPMT-UHFFFAOYSA-N"
"CC1=CC(NS(=O)(=O)C2=CC=C(N)C=C2)=NO1","InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)","JLKIGFTWXXRPMT-UHFFFAOYSA-N"
"Cc1c(oc(n1)NS(=O)(=O)c2ccc(cc2)N)C","InChI=1S/C11H13N3O3S/c1-7-8(2)17-11(13-7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6H,12H2,1-2H3,(H,13,14)","CYFLXLSBHQBMFT-UHFFFAOYSA-N"
"c1ccnc(c1)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)","GECHUMIMRBOMGK-UHFFFAOYSA-N"
"c1cc(ccc1N)S(=O)(=O)N","InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)","FDDDEECHVMSUSB-UHFFFAOYSA-N"
"NC1=CC=C(C=C1)S(=O)(=O)NC1=NC=CS1","InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)","JNMRHUJNCSQMMB-UHFFFAOYSA-N"
"c1cc(ccc1N)S(=O)(=O)c2ccc(cc2)N","InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2","MQJKPEGWNLWLTK-UHFFFAOYSA-N"
"COc1cnc(nc1)NS(=O)(=O)c2ccc(cc2)N","InChI=1S/C11H12N4O3S/c1-18-9-6-13-11(14-7-9)15-19(16,17)10-4-2-8(12)3-5-10/h2-7H,12H2,1H3,(H,13,14,15)","GPTONYMQFTZPKC-UHFFFAOYSA-N"
"OC(=O)C1=CN(C2CC2)C2=C(C=C(F)C(=C2)N2CCNCC2)C1=O","InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)","MYSWGUAQZAJSOK-UHFFFAOYSA-N"
"CN1C[C@@H]2C[C@H]1CN2C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F","InChI=1S/C19H20FN3O3/c1-21-7-12-4-11(21)8-22(12)17-6-16-13(5-15(17)20)18(24)14(19(25)26)9-23(16)10-2-3-10/h5-6,9-12H,2-4,7-8H2,1H3,(H,25,26)/t11-,12-/m0/s1","QMLVECGLEOSESV-RYUDHWBXSA-N"
"CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F","InChI=1S/C21H19F2N3O3/c1-24-6-8-25(9-7-24)19-11-18-15(10-17(19)23)20(27)16(21(28)29)12-26(18)14-4-2-13(22)3-5-14/h2-5,10-12H,6-9H2,1H3,(H,28,29)","NOCJXYPHIIZEHN-UHFFFAOYSA-N"
"CCN1CCN(CC1)C1=C(F)C=C2C(=O)C(=CN(C3CC3)C2=C1)C(O)=O","InChI=1S/C19H22FN3O3/c1-2-21-5-7-22(8-6-21)17-10-16-13(9-15(17)20)18(24)14(19(25)26)11-23(16)12-3-4-12/h9-12H,2-8H2,1H3,(H,25,26)","SPFYMRJSYKOXGV-UHFFFAOYSA-N"
"CCN1CCN(CC1)c2cc3c(cc2F)c(=O)c(cn3C4CC4)C(=O)O","InChI=1S/C19H22FN3O3/c1-2-21-5-7-22(8-6-21)17-10-16-13(9-15(17)20)18(24)14(19(25)26)11-23(16)12-3-4-12/h9-12H,2-8H2,1H3,(H,25,26)","SPFYMRJSYKOXGV-UHFFFAOYSA-N"
"CC1CCC2=C3N1C=C(C(O)=O)C(=O)C3=CC(F)=C2","InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19)","DPSPPJIUMHPXMA-UHFFFAOYSA-N"
"CC1CCc2cc(cc3c2n1cc(c3=O)C(=O)O)F","InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19)","DPSPPJIUMHPXMA-UHFFFAOYSA-N"
"CN1CCN(CC1)c2c(cc3c4c2OCN(n4cc(c3=O)C(=O)O)C)F","InChI=1S/C17H19FN4O4/c1-19-3-5-21(6-4-19)14-12(18)7-10-13-16(14)26-9-20(2)22(13)8-11(15(10)23)17(24)25/h7-8H,3-6,9H2,1-2H3,(H,24,25)","BPFYOAJNDMUVBL-UHFFFAOYSA-N"
"CCN1C=C(C(O)=O)C(=O)C2=CC(F)=C(C=C12)N1CCNCC1","InChI=1S/C16H18FN3O3/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20/h7-9,18H,2-6H2,1H3,(H,22,23)","OGJPXUAPXNRGGI-UHFFFAOYSA-N"
"CCn1cc(c(=O)c2c1cc(c(c2)F)N3CCNCC3)C(=O)O","InChI=1S/C16H18FN3O3/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20/h7-9,18H,2-6H2,1H3,(H,22,23)","OGJPXUAPXNRGGI-UHFFFAOYSA-N"
"CC1COC2=C3N1C=C(C(O)=O)C(=O)C3=CC(F)=C2N1CCN(C)CC1","InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)","GSDSWSVVBLHKDQ-UHFFFAOYSA-N"
"CCn1cc(c(=O)c2c1cc3c(c2)OCO3)C(=O)O","InChI=1S/C13H11NO5/c1-2-14-5-8(13(16)17)12(15)7-3-10-11(4-9(7)14)19-6-18-10/h3-5H,2,6H2,1H3,(H,16,17)","KYGZCKSPAKDVKC-UHFFFAOYSA-N"
"c1cc(ccc1n2cc(c(=O)c3c2cc(c(c3)F)N4CCNCC4)C(=O)O)F","InChI=1S/C20H17F2N3O3/c21-12-1-3-13(4-2-12)25-11-15(20(27)28)19(26)14-9-16(22)18(10-17(14)25)24-7-5-23-6-8-24/h1-4,9-11,23H,5-8H2,(H,27,28)","XBHBWNFJWIASRO-UHFFFAOYSA-N"
"Cc1nnc(s1)SCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)Cn4cnnn4)SC2)C(=O)O","InChI=1S/C14H14N8O4S3/c1-6-17-18-14(29-6)28-4-7-3-27-12-9(11(24)22(12)10(7)13(25)26)16-8(23)2-21-5-15-19-20-21/h5,9,12H,2-4H2,1H3,(H,16,23)(H,25,26)/t9-,12-/m1/s1","MLYYVTUWGNIJIB-BXKDBHETSA-N"
"CC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)[C@@H](c3ccccc3)N)SC1)C(=O)O","InChI=1S/C16H17N3O4S/c1-8-7-24-15-11(14(21)19(15)12(8)16(22)23)18-13(20)10(17)9-5-3-2-4-6-9/h2-6,10-11,15H,7,17H2,1H3,(H,18,20)(H,22,23)/t10-,11-,15-/m1/s1","ZAIPMKNFIOOWCQ-UEKVPHQBSA-N"
"O=C2N1/C(=C(\CS[C@@H]1[C@@H]2NC(=O)[C@H](c3ccc(O)cc3)NC(=O)N4C(=O)C(=O)N(CC)CC4)CSc5nnnn5C)C(=O)O","InChI=1S/C25H27N9O8S2/c1-3-32-8-9-33(21(39)20(32)38)24(42)27-15(12-4-6-14(35)7-5-12)18(36)26-16-19(37)34-17(23(40)41)13(10-43-22(16)34)11-44-25-28-29-30-31(25)2/h4-7,15-16,22,35H,3,8-11H2,1-2H3,(H,26,36)(H,27,42)(H,40,41)/t15-,16+,22+/m0/s1","GCFBRXLSHGKWDP-WJONJSRFSA-N"
"CO/N=C(/c1csc(n1)N)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)CSC(=O)c4ccco4)C(=O)O","InChI=1S/C19H17N5O7S3/c1-30-23-11(9-7-34-19(20)21-9)14(25)22-12-15(26)24-13(17(27)28)8(5-32-16(12)24)6-33-18(29)10-3-2-4-31-10/h2-4,7,12,16H,5-6H2,1H3,(H2,20,21)(H,22,25)(H,27,28)/b23-11-/t12-,16-/m1/s1","ZBHXIWJRIFEVQY-IHMPYVIRSA-N"
"CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(C)(O)CC(C)CN(C)C(C)C(O)C1(C)O","InChI=1S/C38H72N2O12/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28/h20-33,35,41-43,45-46H,15-19H2,1-14H3","MQTOSJVFKKJCRP-UHFFFAOYSA-N"
"CC[C@@H]1[C@@]([C@@H]([C@H](N(C[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)C)O)(C)O","InChI=1S/C38H72N2O12/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28/h20-33,35,41-43,45-46H,15-19H2,1-14H3/t20-,21-,22+,23-,24-,25+,26+,27-,28+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1","MQTOSJVFKKJCRP-BICOPXKESA-N"
"CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)C(C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O","InChI=1S/C38H72N2O12/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28/h20-33,35,41-43,45-46H,15-19H2,1-14H3/t20-,21-,22?,23-,24-,25+,26+,27-,28+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1","MQTOSJVFKKJCRP-OHJWJPDZSA-N"
"CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)OC)C)C)O)(C)O","InChI=1S/C38H69NO13/c1-15-26-38(10,45)31(42)21(4)28(40)19(2)17-37(9,47-14)33(52-35-29(41)25(39(11)12)16-20(3)48-35)22(5)30(23(6)34(44)50-26)51-27-18-36(8,46-13)32(43)24(7)49-27/h19-27,29-33,35,41-43,45H,15-18H2,1-14H3/t19-,20-,21+,22+,23-,24+,25+,26-,27+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1","AGOYDEPGAOXOCK-KCBOHYOISA-N"
"CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O)OC","InChI=1S/C38H69NO13/c1-15-26-38(10,45)31(42)21(4)28(40)19(2)17-37(9,47-14)33(52-35-29(41)25(39(11)12)16-20(3)48-35)22(5)30(23(6)34(44)50-26)51-27-18-36(8,46-13)32(43)24(7)49-27/h19-27,29-33,35,41-43,45H,15-18H2,1-14H3/t19-,20-,21+,22+,23-,24+,25+,26-,27+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1","AGOYDEPGAOXOCK-KCBOHYOISA-N"
"CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O","InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1","ULGZDMOVFRHVEP-RWJQBGPGSA-N"
"CC[C@@H]1[C@@]([C@@H]([C@H](C(=O)[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O","InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1","ULGZDMOVFRHVEP-RWJQBGPGSA-N"
"CCN(CC)CCSCC(=O)O[C@@H]1C[C@@]([C@H]([C@@H]([C@@]23CC[C@H]([C@@]1([C@@H]2C(=O)CC3)C)C)C)O)(C)C=C","InChI=1S/C28H47NO4S/c1-8-26(6)17-22(33-23(31)18-34-16-15-29(9-2)10-3)27(7)19(4)11-13-28(20(5)25(26)32)14-12-21(30)24(27)28/h8,19-20,22,24-25,32H,1,9-18H2,2-7H3/t19-,20+,22-,24+,25+,26-,27+,28+/m1/s1","UURAUHCOJAIIRQ-QGLSALSOSA-N"
"CC[C@@H]1[C@H](/C=C(/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O)N(C)C)O)CCN3C[C@@H](C[C@@H](C3)C)C)C)\C)CO[C@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)C)O)OC)OC","InChI=1S/C46H80N2O13/c1-13-36-33(24-57-46-44(56-12)43(55-11)40(53)31(8)59-46)19-25(2)14-15-34(49)28(5)20-32(16-17-48-22-26(3)18-27(4)23-48)42(29(6)35(50)21-37(51)60-36)61-45-41(54)38(47(9)10)39(52)30(7)58-45/h14-15,19,26-33,35-36,38-46,50,52-54H,13,16-18,20-24H2,1-12H3/b15-14+,25-19+/t26-,27+,28-,29+,30-,31-,32+,33-,35-,36-,38+,39-,40-,41-,42-,43-,44-,45+,46-/m1/s1","JTSDBFGMPLKDCD-XVFHVFLVSA-N"
"CC[C@@H]1[C@H](/C=C(/C=C/C(=O)[C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C)O[C@H]3C[C@@]([C@H]([C@@H](O3)C)O)(C)O)N(C)C)O)CC=O)C)\C)CO[C@H]4[C@@H]([C@@H]([C@@H]([C@H](O4)C)O)OC)OC","InChI=1S/C46H77NO17/c1-13-33-30(22-58-45-42(57-12)41(56-11)37(52)26(5)60-45)18-23(2)14-15-31(49)24(3)19-29(16-17-48)39(25(4)32(50)20-34(51)62-33)64-44-38(53)36(47(9)10)40(27(6)61-44)63-35-21-46(8,55)43(54)28(7)59-35/h14-15,17-18,24-30,32-33,35-45,50,52-55H,13,16,19-22H2,1-12H3/b15-14+,23-18+/t24-,25+,26-,27-,28+,29+,30-,32-,33-,35+,36-,37-,38-,39-,40-,41-,42-,43+,44+,45-,46-/m1/s1","WBPYTXDJUQJLPQ-VMXQISHHSA-N"
"CCCSC1=CC2=C(NC(NC(=O)OC)=N2)C=C1","InChI=1S/C12H15N3O2S/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)","HXHWSAZORRCQMX-UHFFFAOYSA-N"
"CCCSc1ccc2c(c1)nc([nH]2)NC(=O)OC","InChI=1S/C12H15N3O2S/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)","HXHWSAZORRCQMX-UHFFFAOYSA-N"
"CCCS(=O)(=O)c1ccc2c(c1)[nH]c(n2)/N=C(\O)/OC","InChI=1S/C12H15N3O4S/c1-3-6-20(17,18)8-4-5-9-10(7-8)14-11(13-9)15-12(16)19-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)","CLSJYOLYMZNKJB-UHFFFAOYSA-N"
"CCCS(=O)c1ccc2c(c1)nc([nH]2)NC(=O)OC","InChI=1S/C12H15N3O3S/c1-3-6-19(17)8-4-5-9-10(7-8)14-11(13-9)15-12(16)18-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)","VXTGHWHFYNYFFV-UHFFFAOYSA-N"
"CO/C(=N/c1[nH]c2cc(ccc2n1)Sc3ccccc3)/O","InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)","HDDSHPAODJUKPD-UHFFFAOYSA-N"
"COC(=O)Nc1[nH]c2ccc(cc2n1)C(=O)c3ccc(cc3)F","InChI=1S/C16H12FN3O3/c1-23-16(22)20-15-18-12-7-4-10(8-13(12)19-15)14(21)9-2-5-11(17)6-3-9/h2-8H,1H3,(H2,18,19,20,22)","CPEUVMUXAHMANV-UHFFFAOYSA-N"
"COC(=O)Nc1[nH]c2ccc(cc2n1)C(=O)c3ccccc3","InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21)","OPXLLQIJSORQAM-UHFFFAOYSA-N"
"COC(=O)Nc1[nH]c2ccc(cc2n1)S(=O)c3ccccc3","InChI=1S/C15H13N3O3S/c1-21-15(19)18-14-16-12-8-7-11(9-13(12)17-14)22(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)","BEZZFPOZAYTVHN-UHFFFAOYSA-N"
"c1ccc2c(c1)[nH]c(n2)c3cscn3","InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)","WJCNZQLZVWNLKY-UHFFFAOYSA-N"
"CSc1[nH]c2cc(c(cc2n1)Oc3cccc(c3Cl)Cl)Cl","InChI=1S/C14H9Cl3N2OS/c1-21-14-18-9-5-8(16)12(6-10(9)19-14)20-11-4-2-3-7(15)13(11)17/h2-6H,1H3,(H,18,19)","NQPDXQQQCQDHHW-UHFFFAOYSA-N"
"Cc1ncc(n1CCO)[N+](=O)[O-]","InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3","VAOCPAMSLUNLGC-UHFFFAOYSA-N"
"Cc1ncc(n1CCCO)[N+](=O)[O-]","InChI=1S/C7H11N3O3/c1-6-8-5-7(10(12)13)9(6)3-2-4-11/h5,11H,2-4H2,1H3","DUOHVNSMLSPTMI-UHFFFAOYSA-N"
"Cn1c(cnc1COC(=O)N)[N+](=O)[O-]","InChI=1S/C6H8N4O4/c1-9-4(3-14-6(7)11)8-2-5(9)10(12)13/h2H,3H2,1H3,(H2,7,11)","PQFRTXSWDXZRRS-UHFFFAOYSA-N"
"C[C@H]1C[C@H]2[C@@H]3CC[C@@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C(=O)CO)O","InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1","VHRSUDSXCMQTMA-PJHHCJLFSA-N"
"CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C","InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1","RJKFOVLPORLFTN-LEKSSAKUSA-N"
"C[C@@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)CO","InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1","UREBDLICKHMUKA-CXSFZGCWSA-N"
"c1cc(c(c(c1)Cl)Cn2cnc3c2ncnc3N)F","InChI=1S/C12H9ClFN5/c13-8-2-1-3-9(14)7(8)4-19-6-18-10-11(15)16-5-17-12(10)19/h1-3,5-6H,4H2,(H2,15,16,17)","NAPNOSFRRMHNBJ-UHFFFAOYSA-N"
"Cc1c(c(c(c(n1)C)Cl)O)Cl","InChI=1S/C7H7Cl2NO/c1-3-5(8)7(11)6(9)4(2)10-3/h1-2H3,(H,10,11)","ZDPIZLCVJAAHHR-UHFFFAOYSA-N"
"CCOc1cc(ccc1C(=O)OC)NC(=O)C","InChI=1S/C12H15NO4/c1-4-17-11-7-9(13-8(2)14)5-6-10(11)12(15)16-3/h5-7H,4H2,1-3H3,(H,13,14)","GOVWOKSKFSBNGD-UHFFFAOYSA-N"
"COc1ccc(cc1OC)Cc2cnc(nc2N)N","InChI=1S/C13H16N4O2/c1-18-10-4-3-8(6-11(10)19-2)5-9-7-16-13(15)17-12(9)14/h3-4,6-7H,5H2,1-2H3,(H4,14,15,16,17)","LDBTVAXGKYIFHO-UHFFFAOYSA-N"
"CCN(CCCC(=O)N1CCC(CC1)C(=O)N(C)C)[C@@H](C)CC2=CC=C(C=C2)OC","InChI=1S/C24H39N3O3/c1-6-26(19(2)18-20-9-11-22(30-5)12-10-20)15-7-8-23(28)27-16-13-21(14-17-27)24(29)25(3)4/h9-12,19,21H,6-8,13-18H2,1-5H3/t19-/m0/s1","FUWZBLSXACKFQX-IBGZPJMESA-N"
"CCCCCCCCCCOc1cc2c(cc1OCC)ncc(c2O)C(=O)OCC","InChI=1S/C24H35NO5/c1-4-7-8-9-10-11-12-13-14-30-21-15-18-20(16-22(21)28-5-2)25-17-19(23(18)26)24(27)29-6-3/h15-17H,4-14H2,1-3H3,(H,25,26)","JHAYEQICABJSTP-UHFFFAOYSA-N"
"C1=CC(=CC=C1/C=N/NC(=N)N/N=C/C2=CC=C(C=C2)Cl)Cl","InChI=1S/C15H13Cl2N5/c16-13-5-1-11(2-6-13)9-19-21-15(18)22-20-10-12-3-7-14(17)8-4-12/h1-10H,(H3,18,21,22)/b19-9+,20-10+","MOOFYEJFXBSZGE-LQGKIZFRSA-N"
"CC(C)(C)NCC(c1cc(c(c(c1)Cl)N)Cl)O","InChI=1S/C12H18Cl2N2O/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7/h4-5,10,16-17H,6,15H2,1-3H3","STJMRWALKKWQGH-UHFFFAOYSA-N"
"CC(C)(C)NCC(c1ccc(c(c1)CO)O)O","InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3","NDAUXUAQIAJITI-UHFFFAOYSA-N"
"CC(C)(C)NCC(c1cc(cc(c1)O)O)O","InChI=1S/C12H19NO3/c1-12(2,3)13-7-11(16)8-4-9(14)6-10(15)5-8/h4-6,11,13-16H,7H2,1-3H3","XWTYSIMOBUGWOL-UHFFFAOYSA-N"
"CC(C)(C)NCC(c1cc(c(c(c1)Cl)N)C(F)(F)F)O","InChI=1S/C13H18ClF3N2O/c1-12(2,3)19-6-10(20)7-4-8(13(15,16)17)11(18)9(14)5-7/h4-5,10,19-20H,6,18H2,1-3H3","JSJCTEKTBOKRST-UHFFFAOYSA-N"
"CC(CCc1ccc(cc1)O)NCC(c2ccc(cc2)O)O","InChI=1S/C18H23NO3/c1-13(2-3-14-4-8-16(20)9-5-14)19-12-18(22)15-6-10-17(21)11-7-15/h4-11,13,18-22H,2-3,12H2,1H3","YJQZYXCXBBCEAQ-UHFFFAOYSA-N"
"CC(C)NCC(COc1ccc(cc1)CC(=O)N)O","InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)","METKIMKYRPQLGS-UHFFFAOYSA-N"
"COCCC1=CC=C(OCC(O)CNC(C)C)C=C1","InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3","IUBSYMUCCVWXPE-UHFFFAOYSA-N"
"CC(C)NCC(O)COC1=C2C=CC=CC2=CC=C1","InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3","AQHHHDLHHXJYJD-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=NC3=C(N=C2N)N=C(N=C3N)N","InChI=1S/C12H11N7/c13-9-7(6-4-2-1-3-5-6)16-8-10(14)18-12(15)19-11(8)17-9/h1-5H,(H6,13,14,15,17,18,19)","FNYLWPVRPXGIIP-UHFFFAOYSA-N"
"CC1Cc2ccccc2N1NC(=O)c3ccc(c(c3)S(=O)(=O)N)Cl","InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)","NDDAHWYSQHTHNT-UHFFFAOYSA-N"
"CCCCC(=O)N(CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1)[C@@H](C(C)C)C(O)=O","InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m0/s1","ACWBQPMHZXGDFX-QFIPXVFZSA-N"
"CCCCC(=O)N(Cc1ccc(cc1)c2ccccc2c3n[nH]nn3)[C@@H](C(C)C)C(=O)O","InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m0/s1","ACWBQPMHZXGDFX-QFIPXVFZSA-N"
"Cc1cnc(c(c1OC)C)CS(=O)c2[nH]c3ccc(cc3n2)OC","InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)","SUBDBMMJDZJVOS-UHFFFAOYSA-N"
"CN1C2=C(NC=N2)C(=O)N(C)C1=O","InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)","ZFXYFBGIUFBOJW-UHFFFAOYSA-N"
"CNC(=C[N+](=O)[O-])NCCSCc1ccc(o1)CN(C)C","InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3","VMXUWOKSQNHOCA-UHFFFAOYSA-N"
"CN\C(NCCSCC1=CC=C(CN(C)C)O1)=C/[N+]([O-])=O","InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+","VMXUWOKSQNHOCA-UKTHLTGXSA-N"
"COC1=CC(=CC=C1)[C@@]1(O)CCCC[C@@H]1CN(C)C","InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/t14-,16+/m1/s1","TVYLLZQTGLZFBW-ZBFHGGJFSA-N"
"COC1=CC=CC(=C1)[C@@]1(O)CCCC[C@@H]1CN(C)C","InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/t14-,16+/m1/s1","TVYLLZQTGLZFBW-ZBFHGGJFSA-N"
"c1ccc2c(c1)C=Cc3ccccc3N2C(=O)N","InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)","FFGPTBGBLSHEPO-UHFFFAOYSA-N"
"NC(=O)N1C2=CC=CC=C2C=CC2=CC=CC=C12","InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)","FFGPTBGBLSHEPO-UHFFFAOYSA-N"
"CN(C)CCCN1c2ccccc2Sc3c1cc(cc3)Cl","InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3","ZPEIMTDSQAKGNT-UHFFFAOYSA-N"
"c1cc(ccc1C(=O)CCCN2CCC(CC2)(c3ccc(cc3)Cl)O)F","InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2","LNEPOXFFQSENCJ-UHFFFAOYSA-N"
"C/C(=N\c1ccc(cc1)O)/O","InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)","RZVAJINKPMORJF-UHFFFAOYSA-N"
"CN(C)C(=N)NC(=N)N","InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)","XZWYZXLIPXDOLR-UHFFFAOYSA-N"
"CN(C)C(=N)N=C(N)N","InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)","XZWYZXLIPXDOLR-UHFFFAOYSA-N"
"CCC(C)(C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O)C","InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1","RYMZZMVNJRMUDD-HGQWONQESA-N"
"CC(C)c1c(c(c(n1CC[C@H](C[C@H](CC(=O)O)O)O)c2ccc(cc2)F)c3ccccc3)/C(=N/c4ccccc4)/O","InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-,27-/m1/s1","XUKUURHRXDUEBC-KAYWLYCHSA-N"
"CCOP(=S)(OCC)Oc1ccc2c(c(c(=O)oc2c1)Cl)C","InChI=1S/C14H16ClO5PS/c1-4-17-21(22,18-5-2)20-10-6-7-11-9(3)13(15)14(16)19-12(11)8-10/h6-8H,4-5H2,1-3H3","BXNANOICGRISHX-UHFFFAOYSA-N"
"Cc1ccsc1/C=C/C2=NCCCN2C","InChI=1S/C12H16N2S/c1-10-6-9-15-11(10)4-5-12-13-7-3-8-14(12)2/h4-6,9H,3,7-8H2,1-2H3/b5-4+","NVEPPWDVLBMNMB-SNAWJCMRSA-N"
"C[C@@H]\1C/C(=C/C[C@@H]2C[C@@H](C[C@@]3(O2)C/C(=N\OC)/[C@@H]([C@H](O3)/C(=C/C(C)C)/C)C)OC(=O)[C@@H]4C=C([C@H]([C@@H]5[C@]4(/C(=C/C=C1)/CO5)O)O)C)/C","InChI=1S/C37H53NO8/c1-21(2)14-25(6)33-26(7)31(38-42-8)19-36(46-33)18-29-17-28(45-36)13-12-23(4)15-22(3)10-9-11-27-20-43-34-32(39)24(5)16-30(35(40)44-29)37(27,34)41/h9-12,14,16,21-22,26,28-30,32-34,39,41H,13,15,17-20H2,1-8H3/b10-9+,23-12+,25-14+,27-11+,38-31+/t22-,26-,28+,29-,30-,32+,33+,34+,36-,37+/m0/s1","YZBLFMPOMVTDJY-LSGXYNIPSA-N"
"c1ccc(c(c1)CC(=O)O)Nc2c(cccc2Cl)Cl","InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)","DCOPUUMXTXDBNB-UHFFFAOYSA-N"
"OC(=O)CC1=C(NC2=C(Cl)C=CC=C2Cl)C=CC=C1","InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)","DCOPUUMXTXDBNB-UHFFFAOYSA-N"
"Cc1c(cccc1Nc2c(cccn2)C(=O)O)C(F)(F)F","InChI=1S/C14H11F3N2O2/c1-8-10(14(15,16)17)5-2-6-11(8)19-12-9(13(20)21)4-3-7-18-12/h2-7H,1H3,(H,18,19)(H,20,21)","NOOCSNJCXJYGPE-UHFFFAOYSA-N"
"CC(c1cccc(c1)C(=O)c2ccccc2)C(=O)O","InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)","DKYWVDODHFEZIM-UHFFFAOYSA-N"
"CC(C(O)=O)C1=CC=CC(=C1)C(=O)C1=CC=CC=C1","InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)","DKYWVDODHFEZIM-UHFFFAOYSA-N"
"Cc1cccc(c1C)Nc2ccccc2C(=O)O","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","HYYBABOKPJLUIN-UHFFFAOYSA-N"
"CC1=C(C)C(NC2=CC=CC=C2C(O)=O)=CC=C1","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","HYYBABOKPJLUIN-UHFFFAOYSA-N"
"Cc1cnc(s1)/N=C(/C2=C(c3ccccc3S(=O)(=O)N2C)O)\O","InChI=1S/C14H13N3O4S2/c1-8-7-15-14(22-8)16-13(19)11-12(18)9-5-3-4-6-10(9)23(20,21)17(11)2/h3-7,18H,1-2H3,(H,15,16,19)","ZRVUJXDFFKFLMG-UHFFFAOYSA-N"
"c1cc(cc(c1)Nc2c(cccn2)C(=O)O)C(F)(F)F","InChI=1S/C13H9F3N2O2/c14-13(15,16)8-3-1-4-9(7-8)18-11-10(12(19)20)5-2-6-17-11/h1-7H,(H,17,18)(H,19,20)","JZFPYUNJRRFVQU-UHFFFAOYSA-N"
"Cc1c(cccc1Nc2c(cc(cn2)O)C(=O)O)C(F)(F)F","InChI=1S/C14H11F3N2O3/c1-7-10(14(15,16)17)3-2-4-11(7)19-12-9(13(21)22)5-8(20)6-18-12/h2-6,20H,1H3,(H,18,19)(H,21,22)","JSXNJGKWSWRIGA-UHFFFAOYSA-N"
"CCCCC1C(=O)N(N(C1=O)c2ccccc2)c3ccccc3","InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3","VYMDGNCVAMGZFE-UHFFFAOYSA-N"
"c1ccc(c(c1)CC(=O)OCC(=O)O)Nc2c(cccc2Cl)Cl","InChI=1S/C16H13Cl2NO4/c17-11-5-3-6-12(18)16(11)19-13-7-2-1-4-10(13)8-15(22)23-9-14(20)21/h1-7,19H,8-9H2,(H,20,21)","MNIPYSSQXLZQLJ-UHFFFAOYSA-N"
"Cn1ccnc1S","InChI=1S/C4H6N2S/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)","PMRYVIKBURPHAH-UHFFFAOYSA-N"
"Cc1c(ccc2c1oc(=O)c(c2O)NC(=O)c3ccc(c(c3)CC=C(C)C)O)O[C@H]4[C@@H]([C@@H]([C@H](C(O4)(C)C)OC)OC(=O)N)O","InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25+,26-,29-/m1/s1","YJQPYGGHQPGBLI-KGSXXDOSSA-N"
"c1cc(cc(c1)NC(=O)Nc2cccc(c2)C3=NCCN3)C4=NCCN4","InChI=1S/C19H20N6O/c26-19(24-15-5-1-3-13(11-15)17-20-7-8-21-17)25-16-6-2-4-14(12-16)18-22-9-10-23-18/h1-6,11-12H,7-10H2,(H,20,21)(H,22,23)(H2,24,25,26)","SCEVFJUWLLRELN-UHFFFAOYSA-N"
"C/C(=N\[C@H]1CCc2cc(c(c(c2-c3c1cc(=O)c(cc3)OC)OC)OC)OC)/O","InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1","IAKHMKGGTNLKSZ-INIZCTEOSA-N"
"c1ccc(cc1)[C@H]2CN3CCSC3=N2","InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2/t10-/m1/s1","HLFSDGLLUJUHTE-SNVBAGLBSA-N"
"CN(Cc1cc(cc(c1N)Br)Br)C2CCCCC2","InChI=1S/C14H20Br2N2/c1-18(12-5-3-2-4-6-12)9-10-7-11(15)8-13(16)14(10)17/h7-8,12H,2-6,9,17H2,1H3","OJGDCBLYJGHCIH-UHFFFAOYSA-N"
"COC(=O)N=NC=C1C=[N+](C2=CC=CC=C2N1O)[O-]","InChI=1S/C11H10N4O4/c1-19-11(16)13-12-6-8-7-14(17)9-4-2-3-5-10(9)15(8)18/h2-7,18H,1H3","BPMVRAQIQQEBLN-UHFFFAOYSA-N"
"CC1=CC(=C2C=CC=NC2=C1N(C)C)CC3=CN=C(N=C3N)N","InChI=1S/C17H20N6/c1-10-7-11(8-12-9-21-17(19)22-16(12)18)13-5-4-6-20-14(13)15(10)23(2)3/h4-7,9H,8H2,1-3H3,(H4,18,19,21,22)","AIOWJIMWVFWROP-UHFFFAOYSA-N"
"C[C@H]1/C=C/C=C(\C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)O[C@@](C4=O)(O/C=C/[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)OC(=O)C)C)OC)C)C5=C2N6C=CC(=CC6=N5)C)O)/C","InChI=1S/C43H51N3O11/c1-19-14-16-46-28(18-19)44-32-29-30-37(50)25(7)40-31(29)41(52)43(9,57-40)55-17-15-27(54-10)22(4)39(56-26(8)47)24(6)36(49)23(5)35(48)20(2)12-11-13-21(3)42(53)45-33(34(32)46)38(30)51/h11-18,20,22-24,27,35-36,39,48-51H,1-10H3,(H,45,53)/b12-11+,17-15+,21-13-/t20-,22+,23+,24+,27-,35-,36+,39+,43-/m0/s1","NZCRJKRKKOLAOJ-XRCRFVBUSA-N"
"CCC[C@@H]1C[C@H](N(C)C1)C(=O)N[C@H]([C@@H](C)O)[C@H]1O[C@H](SC)[C@H](O)[C@@H](O)[C@H]1O","InChI=1S/C18H34N2O6S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)/t9-,10-,11+,12-,13+,14-,15-,16-,18-/m1/s1","OJMMVQQUTAEWLP-KIDUDLJLSA-N"
"c1ccc2c(c1)nc(n2C3=CCN(CC3)CCCC(=O)c4ccc(cc4)F)O","InChI=1S/C22H22FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-11H,3,6,12-15H2,(H,24,28)","RMEDXOLNCUSCGS-UHFFFAOYSA-N"
"CCN(CC)CC(=O)NC1=C(C)C=CC=C1C","InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)","NNJVILVZKWQKPM-UHFFFAOYSA-N"
"CC12CCC(CC1CCC3C2C(=O)CC4(C3CCC4(C(=O)CO)O)C)O","InChI=1S/C21H32O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-15,18,22-23,26H,3-11H2,1-2H3","SYGWGHVTLUBCEM-UHFFFAOYSA-N"
"CCCc1cc(nc(n1)S)O","InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)","KNAHARQHSZJURB-UHFFFAOYSA-N"
"CCCC1=CC(=O)NC(=S)N1","InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)","KNAHARQHSZJURB-UHFFFAOYSA-N"
"CN[C@H]1CC[C@@H](C2=CC=C(Cl)C(Cl)=C2)C2=C1C=CC=C2","InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17-/m0/s1","VGKDLMBJGBXTGI-SJCJKPOMSA-N"
"CN[C@H]1CC[C@@H](C2=CC=C(Cl)C(Cl)=C2)C2=CC=CC=C12","InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17-/m0/s1","VGKDLMBJGBXTGI-SJCJKPOMSA-N"
"CN(C)CC(c1ccc(cc1)OC)C2(CCCCC2)O","InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3","PNVNVHUZROJLTJ-UHFFFAOYSA-N"
"CN(C)CCC=C1C2=CC=CC=C2CCC2=CC=CC=C12","InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3","KRMDCWKBEZIMAB-UHFFFAOYSA-N"
"CN(C)CCC=C1c2ccccc2CCc3c1cccc3","InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3","KRMDCWKBEZIMAB-UHFFFAOYSA-N"
"Cc1c(c(=O)n2c(n1)CCCC2)CCN3CCC(CC3)c4c5ccc(cc5on4)F","InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3","RAPZEAPATHNIPO-UHFFFAOYSA-N"
"CN(C)CCCN1c2ccccc2CCc3c1cccc3","InChI=1S/C19H24N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-11H,7,12-15H2,1-2H3","BCGWQEUPMDMJNV-UHFFFAOYSA-N"
"CNCCC(c1ccccc1)Oc2ccc(cc2)C(F)(F)F","InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3","RTHCYVBBDHJXIQ-UHFFFAOYSA-N"
"OC1N=C(C2=CC=CC=C2Cl)C2=C(NC1=O)C=CC(Cl)=C2","InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)","DIWRORZWFLOCLC-UHFFFAOYSA-N"
"c1ccc(c(c1)C2=NC(C(=O)Nc3c2cc(cc3)Cl)O)Cl","InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)","DIWRORZWFLOCLC-UHFFFAOYSA-N"
"CN(C)CCCC1(OCC2=C1C=CC(=C2)C#N)C1=CC=C(F)C=C1","InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3","WSEQXVZVJXJVFP-UHFFFAOYSA-N"
"CN(C)CCCC1(OCC2=CC(=CC=C12)C#N)C1=CC=C(F)C=C1","InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3","WSEQXVZVJXJVFP-UHFFFAOYSA-N"
"c1ccnc(c1)C2=NCC(=Nc3c2cc(cc3)Br)O","InChI=1S/C14H10BrN3O/c15-9-4-5-11-10(7-9)14(17-8-13(19)18-11)12-3-1-2-6-16-12/h1-7H,8H2,(H,18,19)","VMIYHDSEFNYJSL-UHFFFAOYSA-N"
"CCC1(C(=O)NCNC1=O)C1=CC=CC=C1","InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)","DQMZLTXERSFNPB-UHFFFAOYSA-N"
"CCC1(C(=NCN=C1O)O)c2ccccc2","InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)","DQMZLTXERSFNPB-UHFFFAOYSA-N"
"Cc1cc2c(s1)Nc3ccccc3N=C2N4CCN(CC4)C","InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3","KVWDHTXUZHCGIO-UHFFFAOYSA-N"
"FC1=CC=C(C=C1)C1CCNCC1COC1=CC2=C(OCO2)C=C1","InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2","AHOUBRCZNHFOSL-UHFFFAOYSA-N"
"c1cc(ccc1[C@@H]2CCNC[C@H]2COc3ccc4c(c3)OCO4)F","InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1","AHOUBRCZNHFOSL-YOEHRIQHSA-N"
"CN(C)CCCN1c2ccccc2CCc3c1cc(cc3)Cl","InChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3","GDLIGKIOYRNHDA-UHFFFAOYSA-N"
"NC1=NC(N)=C(N=N1)C1=C(Cl)C(Cl)=CC=C1","InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)","PYZRQGJRPPTADH-UHFFFAOYSA-N"
"c1cc(c(c(c1)Cl)Cl)c2c([nH]c(=N)nn2)N","InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)","PYZRQGJRPPTADH-UHFFFAOYSA-N"
"CN(C)CC/C=C\1/c2ccccc2COc3c1cccc3","InChI=1S/C19H21NO/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11-","ODQWQRRAPPTVAG-BOPFTXTBSA-N"
"CC(=O)Oc1ccc2c3c1O[C@@H]4[C@]35CCN([C@H](C2)[C@@H]5C=C[C@@H]4OC(=O)C)C","InChI=1S/C21H23NO5/c1-11(23)25-16-6-4-13-10-15-14-5-7-17(26-12(2)24)20-21(14,8-9-22(15)3)18(13)19(16)27-20/h4-7,14-15,17,20H,8-10H2,1-3H3/t14-,15+,17-,20-,21-/m0/s1","GVGLGOZIDCSQPN-PVHGPHFFSA-N"
"c1ccc(cc1)C2=NCC(=Nc3c2cc(cc3)[N+](=O)[O-])O","InChI=1S/C15H11N3O3/c19-14-9-16-15(10-4-2-1-3-5-10)12-8-11(18(20)21)6-7-13(12)17-14/h1-8H,9H2,(H,17,19)","KJONHKAYOJNZEC-UHFFFAOYSA-N"
"CC(Cc1ccccc1)N","InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3","KWTSXDURSIMDCE-UHFFFAOYSA-N"
"C/N=C\1/C[N+](=C(c2cc(ccc2N1)Cl)c3ccccc3)[O-]","InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19)","ANTSCNMPPGJYLG-UHFFFAOYSA-N"
"CCOC(=O)C1=C(NC(=C(C1c2ccccc2Cl)C(=O)OC)C)COCCN","InChI=1S/C20H25ClN2O5/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21/h5-8,17,23H,4,9-11,22H2,1-3H3","HTIQEAQVCYTUBX-UHFFFAOYSA-N"
"CCC(=O)N(C1CCN(CCC2=CC=CC=C2)CC1)C1=CC=CC=C1","InChI=1S/C22H28N2O/c1-2-22(25)24(20-11-7-4-8-12-20)21-14-17-23(18-15-21)16-13-19-9-5-3-6-10-19/h3-12,21H,2,13-18H2,1H3","PJMPHNIQZUBGLI-UHFFFAOYSA-N"
"c1ccc(c(c1)C2(CCCCC2=O)N)Cl","InChI=1S/C12H14ClNO/c13-10-6-2-1-5-9(10)12(14)8-4-3-7-11(12)15/h1-2,5-6H,3-4,7-8,14H2","BEQZHFIKTBVCAU-UHFFFAOYSA-N"
"C[C@H]([C@H](c1ccccc1)O)N","InChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9-/m1/s1","DLNKOYKMWOXYQA-VXNVDRBHSA-N"
"CN1CCN2C(C1)C1=C(CC3=C2N=CC=C3)C=CC=C1","InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3","RONZAEMNMFQXRA-UHFFFAOYSA-N"
"CN1CCN2C(C1)C1=CC=CC=C1CC1=C2N=CC=C1","InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3","RONZAEMNMFQXRA-UHFFFAOYSA-N"
"CCC(=O)N(c1ccccc1)C2CCNCC2","InChI=1S/C14H20N2O/c1-2-14(17)16(12-6-4-3-5-7-12)13-8-10-15-11-9-13/h3-7,13,15H,2,8-11H2,1H3","PMCBDBWCQQBSRJ-UHFFFAOYSA-N"
"CN1CCN2C(C1)C1=CC=CC=C1CC1=CC(O)=CN=C21","InChI=1S/C17H19N3O/c1-19-6-7-20-16(11-19)15-5-3-2-4-12(15)8-13-9-14(21)10-18-17(13)20/h2-5,9-10,16,21H,6-8,11H2,1H3","DAWYIZBOUQIVNX-UHFFFAOYSA-N"
"CN1C2=C(C=C(Cl)C=C2)C(=NC(O)C1=O)C1=CC=CC=C1","InChI=1S/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3","SEQDDYPDSLOBDC-UHFFFAOYSA-N"
"CN1C2=CC=C(Cl)C=C2C(=NC(O)C1=O)C1=CC=CC=C1","InChI=1S/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3","SEQDDYPDSLOBDC-UHFFFAOYSA-N"
"CC1=NC=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4F","InChI=1S/C18H13ClFN3/c1-11-21-9-13-10-22-18(14-4-2-3-5-16(14)20)15-8-12(19)6-7-17(15)23(11)13/h2-9H,10H2,1H3","DDLIGBOFAVUZHB-UHFFFAOYSA-N"
"CC(Cc1ccccc1)NC","InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3","MYWUZJCMWCOHBA-UHFFFAOYSA-N"
"ClC1=CC2=C(C=C1)N=C1C=CC=CC1=C(N2)N1CCNCC1","InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19,21H,7-10H2","HESZUPIXRNZIOI-UHFFFAOYSA-N"
"N[C@H]1CC[C@@H](C2=CC(Cl)=C(Cl)C=C2)C2=CC=CC=C12","InChI=1S/C16H15Cl2N/c17-14-7-5-10(9-15(14)18)11-6-8-16(19)13-4-2-1-3-12(11)13/h1-5,7,9,11,16H,6,8,19H2/t11-,16-/m0/s1","SRPXSILJHWNFMK-ZBEGNZNMSA-N"
"CNCCC=C1c2ccccc2CCc3c1cccc3","InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-11,20H,6,12-14H2,1H3","PHVGLTMQBUFIQQ-UHFFFAOYSA-N"
"CC1=C(CCN2CCC(CC2)C2=NOC3=CC(F)=CC=C23)C(=O)N2CCCC(O)C2=N1","InChI=1S/C23H27FN4O3/c1-14-17(23(30)28-9-2-3-19(29)22(28)25-14)8-12-27-10-6-15(7-11-27)21-18-5-4-16(24)13-20(18)31-26-21/h4-5,13,15,19,29H,2-3,6-12H2,1H3","PMXMIIMHBWHSKN-UHFFFAOYSA-N"
"C1=C(CCN2CCC(CC2)C2=NOC3=CC(F)=CC=C23)C(=O)N2CCCC(O)C2=N1","InChI=1S/C22H25FN4O3/c23-16-3-4-17-19(12-16)30-25-20(17)14-5-9-26(10-6-14)11-7-15-13-24-21-18(28)2-1-8-27(21)22(15)29/h3-4,12-14,18,28H,1-2,5-11H2","CSQXUYGPAMNXJT-UHFFFAOYSA-N"
"Cc1nnc2n1-c3ccc(cc3C(=NC2)c4ccccc4)Cl","InChI=1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3","VREFGVBLTWBCJP-UHFFFAOYSA-N"
"CC(=O)OC(C=5)C(O2)C(C4)(c13)C([H])(C5)C(N(C)C4)Cc(ccc(O)c23)1","InChI=1S/C19H21NO4/c1-10(21)23-15-6-4-12-13-9-11-3-5-14(22)17-16(11)19(12,18(15)24-17)7-8-20(13)2/h3-6,12-13,15,18,22H,7-9H2,1-2H3","JJGYGPZNTOPXGV-UHFFFAOYSA-N"
"CN1CCN(CC1)C(=O)OC2c3c(nccn3)C(=O)N2c4ccc(cn4)Cl","InChI=1S/C17H17ClN6O3/c1-22-6-8-23(9-7-22)17(26)27-16-14-13(19-4-5-20-14)15(25)24(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3","GBBSUAFBMRNDJC-UHFFFAOYSA-N"
"CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)O)O[C@H]3[C@H](C=C4)O","InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1","BQJCRHHNABKAKU-KBQPJGBKSA-N"
"CCCCCC1=CC2=C(C3C=C(CCC3C(O2)(C)C)C)C(=C1)O","InChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3","CYQFCXCEBYINGO-UHFFFAOYSA-N"
"CNC1(CCCCC1=O)C1=CC=CC=C1Cl","InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3","YQEZLKZALYSWHR-UHFFFAOYSA-N"
"CNC1(CCCCC1=O)c2ccccc2Cl","InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3","YQEZLKZALYSWHR-UHFFFAOYSA-N"
"CN1C2CCC1[C@H]([C@H](C2)OC(=O)C1=CC=CC=C1)C(O)=O","InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11?,12?,13-,14+/m0/s1","GVGYEFKIHJTNQZ-CLRIEMFWSA-N"
"CN1C2=C(C=C(C=C2)[N+]([O-])=O)C(=NCC1=O)C1=C(F)C=CC=C1","InChI=1S/C16H12FN3O3/c1-19-14-7-6-10(20(22)23)8-12(14)16(18-9-15(19)21)11-4-2-3-5-13(11)17/h2-8H,9H2,1H3","PPTYJKAXVCCBDU-UHFFFAOYSA-N"
"CN1C2=CC=C(N)C=C2C(=NCC1=O)C1=CC=CC=C1F","InChI=1S/C16H14FN3O/c1-20-14-7-6-10(18)8-12(14)16(19-9-15(20)21)11-4-2-3-5-13(11)17/h2-8H,9,18H2,1H3","LTCDLGUFORGHGY-UHFFFAOYSA-N"
"CN1c2ccc(cc2N(C(=O)CC1=O)c3ccccc3)Cl","InChI=1S/C16H13ClN2O2/c1-18-13-8-7-11(17)9-14(13)19(16(21)10-15(18)20)12-5-3-2-4-6-12/h2-9H,10H2,1H3","CXOXHMZGEKVPMT-UHFFFAOYSA-N"
"CN1CCN(CC1)C1=C2C=CC=CC2=NC2=C(N1)C=C(Cl)C=C2","InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,21H,8-11H2,1H3","ZUXABONWMNSFBN-UHFFFAOYSA-N"
"CN1CCN(CC1)C1=NC2=C(NC3=CC=CC=C13)C=CC(Cl)=C2","InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3","QZUDBNBUXVUHMW-UHFFFAOYSA-N"
"CN1CC[C@]23c4c5ccc(c4O[C@H]2C(=O)CC[C@]3([C@H]1C5)O)OC","InChI=1S/C18H21NO4/c1-19-8-7-17-14-10-3-4-12(22-2)15(14)23-16(17)11(20)5-6-18(17,21)13(19)9-10/h3-4,13,16,21H,5-9H2,1-2H3/t13-,16+,17+,18-/m1/s1","BRUQQQPBMZOVGD-XFKAJCMBSA-N"
"CC[C@H](C(=O)N)N1CCCC1=O","InChI=1S/C8H14N2O2/c1-2-6(8(9)12)10-5-3-4-7(10)11/h6H,2-5H2,1H3,(H2,9,12)/t6-/m1/s1","HPHUVLMMVZITSG-ZCFIWIBFSA-N"
"CN1C2=C(C=C(Cl)C=C2)C(=NCC1=O)C1=CC=CC=C1","InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3","AAOVKJBEBIDNHE-UHFFFAOYSA-N"
"ClC1=CC2=C(NC(=O)CN=C2C2=CC=CC=C2)C=C1","InChI=1S/C15H11ClN2O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)","AKPLHCDWDRPJGD-UHFFFAOYSA-N"
"C\C=C1/N(C)C(C)CC1(C1=CC=CC=C1)C1=CC=CC=C1","InChI=1S/C20H23N/c1-4-19-20(15-16(2)21(19)3,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h4-14,16H,15H2,1-3H3/b19-4-","AJRJPORIQGYFMT-PVOVUMCXSA-N"
"COC(=O)[C@@H]1C2CCC(C[C@@H]1O)N2C","InChI=1S/C10H17NO3/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2/h6-9,12H,3-5H2,1-2H3/t6?,7?,8-,9+/m0/s1","QIQNNBXHAYSQRY-ABIFROTESA-N"
"CN1[C@H]2CC[C@@H]1[C@H]([C@H](C2)OC(=O)c3ccccc3)C(=O)OC","InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1","ZPUCINDJVBIVPJ-LJISPDSOSA-N"
"CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](C=C4)O","InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1","OROGSEYTTFOCAN-DNJOTXNNSA-N"
"CCN(CC)C(=O)C1CN(C2CC3=CNC4=CC=CC(=C34)C2=C1)C","InChI=1S/C20H25N3O/c1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19(15)13(11-21-17)10-18(16)22(3)12-14/h6-9,11,14,18,21H,4-5,10,12H2,1-3H3","VAYOSLLFUXYJDT-UHFFFAOYSA-N"
"CCC(=O)C(CC(C)N(C)C)(C1=CC=CC=C1)C1=CC=CC=C1","InChI=1S/C21H27NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3","USSIQXCVUWKGNF-UHFFFAOYSA-N"
"CCN(CC)CCN1c2ccc(cc2C(=NCC1=O)c3ccccc3F)Cl","InChI=1S/C21H23ClFN3O/c1-3-25(4-2)11-12-26-19-10-9-15(22)13-17(19)21(24-14-20(26)27)16-7-5-6-8-18(16)23/h5-10,13H,3-4,11-12,14H2,1-2H3","SAADBVWGJQAEFS-UHFFFAOYSA-N"
"C[C@]([C@H]1C[C@@]23CC[C@@]1([C@H]4[C@@]25CCN[C@@H]3Cc6c5c(c(cc6)O)O4)OC)(C(C)(C)C)O","InChI=1S/C25H35NO4/c1-21(2,3)22(4,28)16-13-23-8-9-25(16,29-5)20-24(23)10-11-26-17(23)12-14-6-7-15(27)19(30-20)18(14)24/h6-7,16-17,20,26-28H,8-13H2,1-5H3/t16-,17-,20-,22+,23-,24+,25-/m1/s1","YOYLLRBMGQRFTN-IOMBULRVSA-N"
"CC(C)C[C@H](CN)CC(O)=O","InChI=1S/C8H17NO2/c1-6(2)3-7(5-9)4-8(10)11/h6-7H,3-5,9H2,1-2H3,(H,10,11)/t7-/m0/s1","AYXYPKUFHZROOJ-ZETCQYMHSA-N"
"NCC1(CC(O)=O)CCCCC1","InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)","UGJMXCAKCUNAIE-UHFFFAOYSA-N"
"CCN1CCCC1CNC(=O)C1=C(OC)C=CC(=C1)S(N)(=O)=O","InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)","BGRJTUBHPOOWDU-UHFFFAOYSA-N"
"c1ccc(cc1)CN2CCNCC2","InChI=1S/C11H16N2/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13/h1-5,12H,6-10H2","IQXXEPZFOOTTBA-UHFFFAOYSA-N"
"Cc1ccc(cc1)C(=O)C(C)NC","InChI=1S/C11H15NO/c1-8-4-6-10(7-5-8)11(13)9(2)12-3/h4-7,9,12H,1-3H3","YELGFTGWJGBAQU-UHFFFAOYSA-N"
"Cc1ccc(cc1)C(=O)C(C)N2CCCC2","InChI=1S/C14H19NO/c1-11-5-7-13(8-6-11)14(16)12(2)15-9-3-4-10-15/h5-8,12H,3-4,9-10H2,1-2H3","APSJUNFBAXIXLK-UHFFFAOYSA-N"
"CCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43","InChI=1S/C23H21NO/c1-2-3-15-24-16-21(19-12-6-7-14-22(19)24)23(25)20-13-8-10-17-9-4-5-11-18(17)20/h4-14,16H,2-3,15H2,1H3","VCHHHSMPMLNVGS-UHFFFAOYSA-N"
"CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=CC4=CC=CC=C43","InChI=1S/C24H23NO/c1-2-3-8-16-25-17-22(20-13-6-7-15-23(20)25)24(26)21-14-9-11-18-10-4-5-12-19(18)21/h4-7,9-15,17H,2-3,8,16H2,1H3","JDNLPKCAXICMBW-UHFFFAOYSA-N"
"CC(Cc1ccc2c(c1)OCO2)NC","InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3","SHXWCVYOXRDMCX-UHFFFAOYSA-N"
"CC(NCC)Cc1ccc2COOc2c1","InChI=1S/C12H17NO2/c1-3-13-9(2)6-10-4-5-11-8-14-15-12(11)7-10/h4-5,7,9,13H,3,6,8H2,1-2H3","SKPIISDJIUTQMZ-UHFFFAOYSA-N"
"Cc1cc(=O)[nH]c(=S)[nH]1","InChI=1S/C5H6N2OS/c1-3-2-4(8)7-5(9)6-3/h2H,1H3,(H2,6,7,8,9)","HWGBHCRJGXAGEU-UHFFFAOYSA-N"
"CN1N(C(=O)C(NC(C)=O)=C1C)C1=CC=CC=C1","InChI=1S/C13H15N3O2/c1-9-12(14-10(2)17)13(18)16(15(9)3)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,17)","OIAGWXKSCXPNNZ-UHFFFAOYSA-N"
"CC1OC(C(OC(C)=O)C1OC(C)=O)N1C=C(F)C(N)=NC1=O","InChI=1S/C13H16FN3O6/c1-5-9(22-6(2)18)10(23-7(3)19)12(21-5)17-4-8(14)11(15)16-13(17)20/h4-5,9-10,12H,1-3H3,(H2,15,16,20)","NWJBWNIUGNXJGO-UHFFFAOYSA-N"
"c1ccc2c(c1)[nH]c(=N)[nH]2","InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)","JWYUFVNJZUSCSM-UHFFFAOYSA-N"
"NC1=NC2=C(N1)C=CC=C2","InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)","JWYUFVNJZUSCSM-UHFFFAOYSA-N"
"COC1=NC(N)=NC(C)=N1","InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)","NXFQWRWXEYTOTK-UHFFFAOYSA-N"
"CC1=NC(OC)=NC(N)=N1","InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)","NXFQWRWXEYTOTK-UHFFFAOYSA-N"
"c1ccc(cc1)Oc2cccc(c2)C(=O)O","InChI=1S/C13H10O3/c14-13(15)10-5-4-8-12(9-10)16-11-6-2-1-3-7-11/h1-9H,(H,14,15)","NXTDJHZGHOFSQG-UHFFFAOYSA-N"
"Cc1c(c(=O)n(n1C)c2ccccc2)/N=C/O","InChI=1S/C12H13N3O2/c1-9-11(13-8-16)12(17)15(14(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)","WSJBSKRPKADYRQ-UHFFFAOYSA-N"
"Oc1ccc(C(F)(F)F)cc1","InChI=1S/C7H5F3O/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4,11H","BAYGVMXZJBFEMB-UHFFFAOYSA-N"
"CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=NC=CS1","InChI=1S/C11H11N3O3S2/c1-8(15)13-9-2-4-10(5-3-9)19(16,17)14-11-12-6-7-18-11/h2-7H,1H3,(H,12,14)(H,13,15)","KXNXWINFSDKMHD-UHFFFAOYSA-N"
"COC1=CC(OC)=NC(NS(=O)(=O)C2=CC=C(NC(C)=O)C=C2)=N1","InChI=1S/C14H16N4O5S/c1-9(19)15-10-4-6-11(7-5-10)24(20,21)18-14-16-12(22-2)8-13(17-14)23-3/h4-8H,1-3H3,(H,15,19)(H,16,17,18)","DQWIIKBKAIPUPY-UHFFFAOYSA-N"
"Cc1cc(nc(n1)NS(=O)(=O)c2ccc(cc2)/N=C(\C)/O)C","InChI=1S/C14H16N4O3S/c1-9-8-10(2)16-14(15-9)18-22(20,21)13-6-4-12(5-7-13)17-11(3)19/h4-8H,1-3H3,(H,17,19)(H,15,16,18)","LJKAKWDUZRJNPJ-UHFFFAOYSA-N"
"CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=NC=CC=N1","InChI=1S/C12H12N4O3S/c1-9(17)15-10-3-5-11(6-4-10)20(18,19)16-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,17)(H,13,14,16)","NJIZUWGMNCUKGU-UHFFFAOYSA-N"
"CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC1=NOC(C)=C1","InChI=1S/C12H13N3O4S/c1-8-7-12(14-19-8)15-20(17,18)11-5-3-10(4-6-11)13-9(2)16/h3-7H,1-2H3,(H,13,16)(H,14,15)","GXPIUNZCALHVBA-UHFFFAOYSA-N"
"COC1=CC=CC(=C1)C1(O)CCCCC1CN","InChI=1S/C14H21NO2/c1-17-13-7-4-6-11(9-13)14(16)8-3-2-5-12(14)10-15/h4,6-7,9,12,16H,2-3,5,8,10,15H2,1H3","QNPPIKMBCJUUTG-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C(CN)C1(O)CCCCC1","InChI=1S/C15H23NO2/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15/h5-8,14,17H,2-4,9-11,16H2,1H3","SUQHIQRIIBKNOR-UHFFFAOYSA-N"
"CNCC(C1=CC=C(O)C=C1)C1(O)CCCCC1","InChI=1S/C15H23NO2/c1-16-11-14(12-5-7-13(17)8-6-12)15(18)9-3-2-4-10-15/h5-8,14,16-18H,2-4,9-11H2,1H3","MMSWXJSQCAEDLK-UHFFFAOYSA-N"
"Cc1ccc(c(c1)C)N(C)C=N","InChI=1S/C10H14N2/c1-8-4-5-10(9(2)6-8)12(3)7-11/h4-7,11H,1-3H3","UBLNTZNUSGCINZ-UHFFFAOYSA-N"
"CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(NC)C2O)C(C)(CC(C)C(=O)C(C)C(O)C1(C)O)OC","InChI=1S/C37H67NO13/c1-14-25-37(10,44)30(41)20(4)27(39)18(2)16-36(9,46-13)32(51-34-28(40)24(38-11)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-35(8,45-12)31(42)23(7)48-26/h18-26,28-32,34,38,40-42,44H,14-17H2,1-13H3","CIJTVUQEURKBDL-UHFFFAOYSA-N"
"CN(C)CC(C1=CC=C(O)C=C1)C1(O)CCCCC1","InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3","KYYIDSXMWOZKMP-UHFFFAOYSA-N"
"c1(nc(nc(n1)Cl)N)N","InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)","FVFVNNKYKYZTJU-UHFFFAOYSA-N"
"CC(C)/N=c\1/[nH]c(=N)nc([nH]1)O","InChI=1S/C6H11N5O/c1-3(2)8-5-9-4(7)10-6(12)11-5/h3H,1-2H3,(H4,7,8,9,10,11,12)","GCKLGRUZDXSATG-UHFFFAOYSA-N"
"NCC(O)COC1=CC=C(CC(N)=O)C=C1","InChI=1S/C11H16N2O3/c12-6-9(14)7-16-10-3-1-8(2-4-10)5-11(13)15/h1-4,9,14H,5-7,12H2,(H2,13,15)","UWMXVJVTKRSOPW-UHFFFAOYSA-N"
"CC(C)NCC(O)COC1=CC=C(CC(O)=O)C=C1","InChI=1S/C14H21NO4/c1-10(2)15-8-12(16)9-19-13-5-3-11(4-6-13)7-14(17)18/h3-6,10,12,15-16H,7-9H2,1-2H3,(H,17,18)","PUQIRTNPJRFRCZ-UHFFFAOYSA-N"
"CCC1=CC=CC(CC)=C1N(COC)C(=O)C(O)=O","InChI=1S/C14H19NO4/c1-4-10-7-6-8-11(5-2)12(10)15(9-19-3)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)","MHCYOELBTPOBIU-UHFFFAOYSA-N"
"CCOCN(C(=O)C(O)=O)C1=C(C)C=CC=C1CC","InChI=1S/C14H19NO4/c1-4-11-8-6-7-10(3)12(11)15(9-19-5-2)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)","OTKTUNJJKYTOFF-UHFFFAOYSA-N"
"CCOCN(C(=O)CS(O)(=O)=O)C1=C(C)C=CC=C1CC","InChI=1S/C14H21NO5S/c1-4-12-8-6-7-11(3)14(12)15(10-20-5-2)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19)","HXAIQOCRALNGKB-UHFFFAOYSA-N"
"CO\C=C(\C(O)=O)c1ccccc1Oc1cc(Oc2ccccc2C#N)ncn1","InChI=1S/C21H15N3O5/c1-27-12-16(21(25)26)15-7-3-5-9-18(15)29-20-10-19(23-13-24-20)28-17-8-4-2-6-14(17)11-22/h2-10,12-13H,1H3,(H,25,26)/b16-12+","IKCXDZCEWZARFL-FOWTUZBSSA-N"
"C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(O)C(=O)COC(C)=O","InChI=1S/C24H31FO6/c1-13-9-18-17-6-5-15-10-16(27)7-8-21(15,3)23(17,25)19(28)11-22(18,4)24(13,30)20(29)12-31-14(2)26/h7-8,10,13,17-19,28,30H,5-6,9,11-12H2,1-4H3/t13-,17-,18-,19-,21-,22-,23-,24-/m0/s1","AKUJBENLRBOFTD-QZIXMDIESA-N"
"NC1=C(Cl)C(=O)NN=C1","InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)","FEWPCPCEGBPTAL-UHFFFAOYSA-N"
"ClC(=C(C=N1)N)C(=O)N1C","InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3","XNSGCNYTNLWRKM-UHFFFAOYSA-N"
"CN1N=CC(N)=C(Cl)C1=O","InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3","XNSGCNYTNLWRKM-UHFFFAOYSA-N"
"NC(=O)N1C2=C(C=CC=C2)C2OC2C2=C1C=CC=C2","InChI=1S/C15H12N2O2/c16-15(18)17-11-7-3-1-5-9(11)13-14(19-13)10-6-2-4-8-12(10)17/h1-8,13-14H,(H2,16,18)","ZRWWEEVEIOGMMT-UHFFFAOYSA-N"
"c1ccc2c(c1)[C@@H]([C@H](c3ccccc3N2C(=N)O)O)O","InChI=1S/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14-/m0/s1","PRGQOPPDPVELEG-KBPBESRZSA-N"
"COCC(C)N(C(=O)C(O)=O)c1c(C)csc1C","InChI=1S/C12H17NO4S/c1-7-6-18-9(3)10(7)13(8(2)5-17-4)11(14)12(15)16/h6,8H,5H2,1-4H3,(H,15,16)","HOYCASTVMCEOTP-UHFFFAOYSA-N"
"COCC(C)N(C(=O)CS(O)(=O)=O)c1c(C)csc1C","InChI=1S/C12H19NO5S2/c1-8-6-19-10(3)12(8)13(9(2)5-18-4)11(14)7-20(15,16)17/h6,9H,5,7H2,1-4H3,(H,15,16,17)","YMYKMSAZEZQEER-UHFFFAOYSA-N"
"COCC(C)N(C(=O)CS(O)(=O)=O)C1=C(C)SC=C1C","InChI=1S/C12H19NO5S2/c1-8-6-19-10(3)12(8)13(9(2)5-18-4)11(14)7-20(15,16)17/h6,9H,5,7H2,1-4H3,(H,15,16,17)","YMYKMSAZEZQEER-UHFFFAOYSA-N"
"CN(C)S(=O)(=O)NC1=CC=CC=C1","InChI=1S/C8H12N2O2S/c1-10(2)13(11,12)9-8-6-4-3-5-7-8/h3-7,9H,1-2H3","QCDQDISRALTLNQ-UHFFFAOYSA-N"
"COCCN(C(=O)CS(O)(=O)=O)c1c(C)cccc1C","InChI=1S/C13H19NO5S/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18/h4-6H,7-9H2,1-3H3,(H,16,17,18)","RVSCDWJKJDBFRS-UHFFFAOYSA-N"
"COCCN(C(=O)C(O)=O)c1c(C)cccc1C","InChI=1S/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)","MHGMSAFPNAKIRZ-UHFFFAOYSA-N"
"CNCCCC(C#N)(C(C)C)C1=CC(OC)=C(OC)C=C1","InChI=1S/C17H26N2O2/c1-13(2)17(12-18,9-6-10-19-3)14-7-8-15(20-4)16(11-14)21-5/h7-8,11,13,19H,6,9-10H2,1-5H3","WLOBUUJURNEQCL-UHFFFAOYSA-N"
"S(C)-c(nc(n1)N)nc1NC(C)(C)C","InChI=1S/C8H15N5S/c1-8(2,3)13-6-10-5(9)11-7(12-6)14-4/h1-4H3,(H3,9,10,11,12,13)","MWWBDLRPMWTLRX-UHFFFAOYSA-N"
"CC(C)(C)NC1=NC(=NC(=N1)N)SC","InChI=1S/C8H15N5S/c1-8(2,3)13-6-10-5(9)11-7(12-6)14-4/h1-4H3,(H3,9,10,11,12,13)","MWWBDLRPMWTLRX-UHFFFAOYSA-N"
"N1C2=C(C=CC=C2)C=CC2=C1C=CC=C2","InChI=1S/C14H11N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-10,15H","LCGTWRLJTMHIQZ-UHFFFAOYSA-N"
"c1cc(ncc1CN2CCN=C2O)Cl","InChI=1S/C9H10ClN3O/c10-8-2-1-7(5-12-8)6-13-4-3-11-9(13)14/h1-2,5H,3-4,6H2,(H,11,14)","ADWTYURAFSWNSU-UHFFFAOYSA-N"
"CC1C(C)(C)c2cc3C(C)COC(=O)c3cc2C1(C)C","InChI=1S/C18H24O2/c1-10-9-20-16(19)13-8-15-14(7-12(10)13)17(3,4)11(2)18(15,5)6/h7-8,10-11H,9H2,1-6H3","PGMHPYRIXBRRQD-UHFFFAOYSA-N"
"CC(C)N(C(=O)CS(O)(=O)=O)C1=CC=C(F)C=C1","InChI=1S/C11H14FNO4S/c1-8(2)13(11(14)7-18(15,16)17)10-5-3-9(12)4-6-10/h3-6,8H,7H2,1-2H3,(H,15,16,17)","SZCMHDLOUVZYST-UHFFFAOYSA-N"
"CC(C)N(C(=O)C(O)=O)C1=CC=C(F)C=C1","InChI=1S/C11H12FNO3/c1-7(2)13(10(14)11(15)16)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,15,16)","FFKNXXCOXIZLJD-UHFFFAOYSA-N"
"CC(C)(OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1)C(O)=O","InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)","MQOBSOSZFYZQOK-UHFFFAOYSA-N"
"CCC1=CC=CC(C)=C1N(C(C)COC)C(=O)C(O)=O","InChI=1S/C15H21NO4/c1-5-12-8-6-7-10(2)13(12)16(11(3)9-20-4)14(17)15(18)19/h6-8,11H,5,9H2,1-4H3,(H,18,19)","LNOOSYCKMKZOJB-UHFFFAOYSA-N"
"CCC1=CC=CC(C)=C1N1C(C)COCC1=O","InChI=1S/C14H19NO2/c1-4-12-7-5-6-10(2)14(12)15-11(3)8-17-9-13(15)16/h5-7,11H,4,8-9H2,1-3H3","DVBDYPDVNRJKNJ-UHFFFAOYSA-N"
"CCC1=CC=CC(C)=C1N(C(C)COC)C(=O)CS(O)(=O)=O","InChI=1S/C15H23NO5S/c1-5-13-8-6-7-11(2)15(13)16(12(3)9-21-4)14(17)10-22(18,19)20/h6-8,12H,5,9-10H2,1-4H3,(H,18,19,20)","CIGKZVUEZXGYSV-UHFFFAOYSA-N"
"Cc1cccc(C)c1N(Cn1cccn1)C(=O)CS(O)(=O)=O","InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)","IPVCSECPEVHQOV-UHFFFAOYSA-N"
"CC1=CC=CC(C)=C1N(CN1C=CC=N1)C(=O)CS(O)(=O)=O","InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)","IPVCSECPEVHQOV-UHFFFAOYSA-N"
"Cc1cccc(C)c1N(Cn1cccn1)C(=O)C(O)=O","InChI=1S/C14H15N3O3/c1-10-5-3-6-11(2)12(10)17(13(18)14(19)20)9-16-8-4-7-15-16/h3-8H,9H2,1-2H3,(H,19,20)","PHMHHVKFXZNTKU-UHFFFAOYSA-N"
"CNC(=O)OC1=CC(C)=C(C(C)=C1)S(C)=O","InChI=1S/C11H15NO3S/c1-7-5-9(15-11(13)12-3)6-8(2)10(7)16(4)14/h5-6H,1-4H3,(H,12,13)","FNCMBMZOZQAWJA-UHFFFAOYSA-N"
"CC1=NC(=O)C(=NN1)C1=CC=CC=C1","InChI=1S/C10H9N3O/c1-7-11-10(14)9(13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,12,14)","OUSYWCQYMPDAEO-UHFFFAOYSA-N"
"CSC1=NC(=O)C(=NN1)C(C)(C)C","InChI=1S/C8H13N3OS/c1-8(2,3)5-6(12)9-7(13-4)11-10-5/h1-4H3,(H,9,11,12)","MIWRSUQXSCLDNV-UHFFFAOYSA-N"
"CCC(CC)O[C@@H]1C=C(C[C@H](N)[C@H]1NC(C)=O)C(O)=O","InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19)/t11-,12+,13+/m0/s1","NENPYTRHICXVCS-YNEHKIRRSA-N"
"CCOC(=O)C1=C[C@@H](OC(CC)CC)[C@H](NC(C)=O)[C@@H](N)C1","InChI=1S/C16H28N2O4/c1-5-12(6-2)22-14-9-11(16(20)21-7-3)8-13(17)15(14)18-10(4)19/h9,12-15H,5-8,17H2,1-4H3,(H,18,19)/t13-,14+,15+/m0/s1","VSZGPKBBMSAYNT-RRFJBIMHSA-N"
"CC(C)C1=NC(=O)C=C(C)N1","InChI=1S/C8H12N2O/c1-5(2)8-9-6(3)4-7(11)10-8/h4-5H,1-3H3,(H,9,10,11)","AJPIUNPJBFBUKK-UHFFFAOYSA-N"
"CC(C)N(C(=O)CS(O)(=O)=O)C1=CC=CC=C1","InChI=1S/C11H15NO4S/c1-9(2)12(10-6-4-3-5-7-10)11(13)8-17(14,15)16/h3-7,9H,8H2,1-2H3,(H,14,15,16)","BFSZJLBDHMMCAH-UHFFFAOYSA-N"
"CC(C)N(C(=O)C(O)=O)C1=CC=CC=C1","InChI=1S/C11H13NO3/c1-8(2)12(10(13)11(14)15)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,14,15)","HYHJOUPYTUBFIX-UHFFFAOYSA-N"
"CC(C)NC1=NC(=O)N=C(NC(C)C)N1","InChI=1S/C9H17N5O/c1-5(2)10-7-12-8(11-6(3)4)14-9(15)13-7/h5-6H,1-4H3,(H3,10,11,12,13,14,15)","RUOTUMSRCIMLJK-UHFFFAOYSA-N"
"C[N+](C)(CCC(c1ccccc1)c2ccccn2)[O-]","InChI=1S/C16H20N2O/c1-18(2,19)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3","OBBDJQMNZLQVAZ-UHFFFAOYSA-N"
"CCNC1=NC(=O)N=C(NCC)N1","InChI=1S/C7H13N5O/c1-3-8-5-10-6(9-4-2)12-7(13)11-5/h3-4H2,1-2H3,(H3,8,9,10,11,12,13)","YQIXRXMOJFQVBV-UHFFFAOYSA-N"
"CCNC1=NC(NCC)=NC(O)=N1","InChI=1S/C7H13N5O/c1-3-8-5-10-6(9-4-2)12-7(13)11-5/h3-4H2,1-2H3,(H3,8,9,10,11,12,13)","YQIXRXMOJFQVBV-UHFFFAOYSA-N"
"NC(=O)N=C1SCCN1CC1=CN=C(Cl)C=C1","InChI=1S/C10H11ClN4OS/c11-8-2-1-7(5-13-8)6-15-3-4-17-10(15)14-9(12)16/h1-2,5H,3-4,6H2,(H2,12,16)","LEZHOZPJYAQQNU-UHFFFAOYSA-N"
"NC(=O)\N=C1/SCCN1CC1=CN=C(Cl)C=C1","InChI=1S/C10H11ClN4OS/c11-8-2-1-7(5-13-8)6-15-3-4-17-10(15)14-9(12)16/h1-2,5H,3-4,6H2,(H2,12,16)/b14-10-","LEZHOZPJYAQQNU-UVTDQMKNSA-N"
"CCNC1=NC(=O)N=C(NC(C)(C)C)N1","InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)","OYTCZOJKXCTBHG-UHFFFAOYSA-N"
"CC(C)(C)NC1=NC(=O)N=C(N)N1","InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)","NUISVCFZNCYUIM-UHFFFAOYSA-N"
"COC1=CC=CC(=C1)C1(O)CCCCC1C[N+](C)(C)[O-]","InChI=1S/C16H25NO3/c1-17(2,19)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)20-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3","HBXKSXMNNGHBEA-UHFFFAOYSA-N"
"CCCCC1=NC2(CCCC2)C(=O)N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1","InChI=1S/C25H28N6O/c1-2-3-10-22-26-25(15-6-7-16-25)24(32)31(22)17-18-11-13-19(14-12-18)20-8-4-5-9-21(20)23-27-29-30-28-23/h4-5,8-9,11-14H,2-3,6-7,10,15-17H2,1H3,(H,27,28,29,30)","YOSHYTLCDANDAN-UHFFFAOYSA-N"
"CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)CC[C@@]43C)F)O)C)O","InChI=1S/C23H31FO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h10,16-18,27,29H,4-9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1","SYWHXTATXSMDSB-GSLJADNHSA-N"
"CC(C)n1c2ccccc2c(c1/C=C/[C@H](C[C@H](CC(=O)O)O)O)c3ccc(cc3)F","InChI=1S/C24H26FNO4/c1-15(2)26-21-6-4-3-5-20(21)24(16-7-9-17(25)10-8-16)22(26)12-11-18(27)13-19(28)14-23(29)30/h3-12,15,18-19,27-28H,13-14H2,1-2H3,(H,29,30)/b12-11+/t18-,19-/m1/s1","FJLGEFLZQAZZCD-MCBHFWOFSA-N"
"NC1=NC(=O)N(C=C1)[C@@H]1O[C@H](CO)[C@@H](O)C1(F)F","InChI=1S/C9H11F2N3O4/c10-9(11)6(16)4(3-15)18-7(9)14-2-1-5(12)13-8(14)17/h1-2,4,6-7,15-16H,3H2,(H2,12,13,17)/t4-,6-,7-/m1/s1","SDUQYLNIPVEERB-QPPQHZFASA-N"
"c1ccc(cc1)C(CCN)Oc2ccc(cc2)C(F)(F)F","InChI=1S/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2","WIQRCHMSJFFONW-UHFFFAOYSA-N"
"CCNCC(=O)NC1=C(C)C=CC=C1C","InChI=1S/C12H18N2O/c1-4-13-8-11(15)14-12-9(2)6-5-7-10(12)3/h5-7,13H,4,8H2,1-3H3,(H,14,15)","WRMRXPASUROZGT-UHFFFAOYSA-N"
"CC[N+]([O-])(CC)CC(=O)NC1=C(C)C=CC=C1C","InChI=1S/C14H22N2O2/c1-5-16(18,6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)","YDVXPJXUHRROBA-UHFFFAOYSA-N"
"CC(N)CC1=CC(=CC=C1)C(F)(F)F","InChI=1S/C10H12F3N/c1-7(14)5-8-3-2-4-9(6-8)10(11,12)13/h2-4,6-7H,5,14H2,1H3","MLBHFBKZUPLWBD-UHFFFAOYSA-N"
"C1=C(C=C(C=C1)CC(C)N(N=O)CC)C(F)(F)F","InChI=1S/C12H15F3N2O/c1-3-17(16-18)9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9H,3,7H2,1-2H3","JVGWNJLSTCQSCZ-UHFFFAOYSA-N"
"CC(CC1=CC=CC=C1)[N+](C)([O-])CC#C","InChI=1S/C13H17NO/c1-4-10-14(3,15)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3","IVFPCTFUZXEDKP-UHFFFAOYSA-N"
"CC(CC1=CC=CC=C1)NCC#C","InChI=1S/C12H15N/c1-3-9-13-11(2)10-12-7-5-4-6-8-12/h1,4-8,11,13H,9-10H2,2H3","UUFAJPMQSFXDFR-UHFFFAOYSA-N"
"C[C@H](CC1=CC=CC=C1)N(C)CC#C","InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1","MEZLKOACVSPNER-GFCCVEGCSA-N"
"OC1(C(C2=CC=C(OC)C=C2)C[N+](C)(C)[O-])CCCCC1","InChI=1S/C17H27NO3/c1-18(2,20)13-16(17(19)11-5-4-6-12-17)14-7-9-15(21-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3","LASJEFFANGIOGZ-UHFFFAOYSA-N"
"CNCCC(C1=CC=CC=C1)C2=CC=CC=N2","InChI=1S/C15H18N2/c1-16-12-10-14(13-7-3-2-4-8-13)15-9-5-6-11-17-15/h2-9,11,14,16H,10,12H2,1H3","GDCVFNAQLOMGMS-UHFFFAOYSA-N"
"N1([C@@H](c2ccc(Cl)cc2)c2ccccc2)CCN(CCOCC(O)=O)CC1","InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)/t21-/m1/s1","ZKLPARSLTMPFCP-OAQYLSRUSA-N"
"OC(=O)COCCN1CCN(CC1)C(C1=CC=CC=C1)C1=CC=C(Cl)C=C1","InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)","ZKLPARSLTMPFCP-UHFFFAOYSA-N"
"OC(=O)COCC[N+]1([O-])CCN(CC1)C(C1=CC=CC=C1)C1=CC=C(Cl)C=C1","InChI=1S/C21H25ClN2O4/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)23-10-12-24(27,13-11-23)14-15-28-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)","IVDOUUOLLFEMJQ-UHFFFAOYSA-N"
"CC1(C[C@@H]1/C(=N/C(=C\CCCCSC[C@@H](C(=O)O)N)/C(=O)O)/O)C","InChI=1S/C16H26N2O5S/c1-16(2)8-10(16)13(19)18-12(15(22)23)6-4-3-5-7-24-9-11(17)14(20)21/h6,10-11H,3-5,7-9,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23)/b12-6-/t10-,11+/m1/s1","DHSUYTOATWAVLW-WFVMDLQDSA-N"
"CCOC1=NC2=CC=CC(C(O)=O)=C2N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NNN=N1","InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)","HTQMVQVXFRQIKW-UHFFFAOYSA-N"
"CCOC1=NC2=CC=CC(C(O)=O)=C2N1CC1=CC=C(C=C1)C1=CC=CC=C1C1=NN=NN1","InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)","HTQMVQVXFRQIKW-UHFFFAOYSA-N"
"CCCCCOC(=O)NC1=NC(=O)N(C=C1F)[C@@H]1O[C@H](C)[C@@H](O)[C@H]1O","InChI=1S/C15H22FN3O6/c1-3-4-5-6-24-15(23)18-12-9(16)7-19(14(22)17-12)13-11(21)10(20)8(2)25-13/h7-8,10-11,13,20-21H,3-6H2,1-2H3,(H,17,18,22,23)/t8-,10-,11-,13-/m1/s1","GAGWJHPBXLXJQN-UORFTKCHSA-N"
"Cn1c(=O)cc(s1)Cl","InChI=1S/C4H4ClNOS/c1-6-4(7)2-3(5)8-6/h2H,1H3","DHNRXBZYEKSXIM-UHFFFAOYSA-N"
"CCN1CCCC1CNC(=O)C1=C(OC)C=C(N)C(=C1)S(=O)(=O)CC","InChI=1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)","NTJOBXMMWNYJFB-UHFFFAOYSA-N"
"CC[N+]1([O-])CCCC1CNC(=O)C1=CC(=C(N)C=C1OC)S(=O)(=O)CC","InChI=1S/C17H27N3O5S/c1-4-20(22)8-6-7-12(20)11-19-17(21)13-9-16(26(23,24)5-2)14(18)10-15(13)25-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)","LLIKIPAUZJTRGB-UHFFFAOYSA-N"
"C/C(=N/CCCS(=O)(=O)O)/O","InChI=1S/C5H11NO4S/c1-5(7)6-3-2-4-11(8,9)10/h2-4H2,1H3,(H,6,7)(H,8,9,10)","AFCGFAGUEYAMAO-UHFFFAOYSA-N"
"CC(C)(C)[C@@H](C(=O)N[C@@H](Cc1ccccc1)[C@H](CN(Cc2ccc(cc2)c3ccccn3)NC(=O)[C@H](C(C)(C)C)NC(=O)OC)O)NC(=O)OC","InChI=1S/C38H52N6O7/c1-37(2,3)31(41-35(48)50-7)33(46)40-29(22-25-14-10-9-11-15-25)30(45)24-44(43-34(47)32(38(4,5)6)42-36(49)51-8)23-26-17-19-27(20-18-26)28-16-12-13-21-39-28/h9-21,29-32,45H,22-24H2,1-8H3,(H,40,46)(H,41,48)(H,42,49)(H,43,47)/t29-,30-,31+,32+/m0/s1","AXRYRYVKAWYZBR-GASGPIRDSA-N"
"Cc1c(c2cc(ccc2n1C(=O)c3ccc(cc3)Cl)OC)CC(=O)OCC(=O)O","InChI=1S/C21H18ClNO6/c1-12-16(10-20(26)29-11-19(24)25)17-9-15(28-2)7-8-18(17)23(12)21(27)13-3-5-14(22)6-4-13/h3-9H,10-11H2,1-2H3,(H,24,25)","FSQKKOOTNAMONP-UHFFFAOYSA-N"
"c1ccc(cc1)C(=N)N","InChI=1S/C7H8N2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H3,8,9)","PXXJHWLDUBFPOL-UHFFFAOYSA-N"
"CN1CC[C@]23c4c5ccc(c4O[C@H]2[C@H](CC[C@H]3[C@H]1C5)O)OC","InChI=1S/C18H23NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-13,17,20H,4-5,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1","RBOXVHNMENFORY-DNJOTXNNSA-N"
"CC(C)CN(C[C@H]([C@H](Cc1ccccc1)NC(=O)O[C@H]2CO[C@@H]3[C@H]2CCO3)O)S(=O)(=O)c4ccc(cc4)N","InChI=1S/C27H37N3O7S/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32)/t22-,23-,24+,25-,26+/m0/s1","CJBJHOAVZSMMDJ-HEXNFIEUSA-N"
"CCCCc1c(c2cc(ccc2o1)NS(=O)(=O)C)C(=O)c3ccc(cc3)OCCCN(CCCC)CCCC","InChI=1S/C31H44N2O5S/c1-5-8-12-29-30(27-23-25(32-39(4,35)36)15-18-28(27)38-29)31(34)24-13-16-26(17-14-24)37-22-11-21-33(19-9-6-2)20-10-7-3/h13-18,23,32H,5-12,19-22H2,1-4H3","ZQTNQVWKHCQYLQ-UHFFFAOYSA-N"
"C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@H]4C(=O)CO)C)O","InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1","OMFXVFTZEKFJBZ-HJTSIMOOSA-N"
"CC[C@@H]1[C@@]([C@@H]([C@H](/C(=N/OCOCCOC)/[C@@H](C[C@@]([C@@H]([C@H]([C@@H]([C@H](C(=O)O1)C)O[C@H]2C[C@@]([C@H]([C@@H](O2)C)O)(C)OC)C)O[C@H]3[C@@H]([C@H](C[C@H](O3)C)N(C)C)O)(C)O)C)C)O)(C)O","InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/b42-31+/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1","RXZBMPWDPOLZGW-XMRMVWPWSA-N"
"CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)C)[C@](C)(O)C[C@@H](C)C(=NOCOCCOC)[C@H](C)[C@@H](O)[C@]1(C)O","InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1","RXZBMPWDPOLZGW-HITVVWEBSA-N"
"CCOc1cc(ccc1C(=O)O)CC(=O)N[C@@H](CC(C)C)c2ccccc2N3CCCCC3","InChI=1S/C27H36N2O4/c1-4-33-25-17-20(12-13-22(25)27(31)32)18-26(30)28-23(16-19(2)3)21-10-6-7-11-24(21)29-14-8-5-9-15-29/h6-7,10-13,17,19,23H,4-5,8-9,14-16,18H2,1-3H3,(H,28,30)(H,31,32)/t23-/m0/s1","FAEKWTJYAYMJKF-QHCPKHFHSA-N"
"CC(C)c1nc(cs1)CN(C)/C(=N\[C@@H](C(C)C)/C(=N\[C@@H](Cc2ccccc2)C[C@@H]([C@H](Cc3ccccc3)/N=C(\O)/OCc4cncs4)O)/O)/O","InChI=1S/C37H48N6O5S2/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)/t28-,31-,32-,33-/m0/s1","NCDNCNXCDXHOMX-XGKFQTDJSA-N"
"CN\C(NCCS(=O)CC1=CC=C(CN(C)C)O1)=C/[N+]([O-])=O","InChI=1S/C13H22N4O4S/c1-14-13(9-17(18)19)15-6-7-22(20)10-12-5-4-11(21-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+","SKHXRNHSZTXSLP-UKTHLTGXSA-N"
"CN\C(NCCSCC1=CC=C(C[N+](C)(C)[O-])O1)=C/[N+]([O-])=O","InChI=1S/C13H22N4O4S/c1-14-13(8-16(18)19)15-6-7-22-10-12-5-4-11(21-12)9-17(2,3)20/h4-5,8,14-15H,6-7,9-10H2,1-3H3/b13-8+","DFJVUWAHTQPQCV-MDWZMJQESA-N"
"C[C@]12CC(=O)[C@H]3[C@H]([C@@H]1CC[C@@]2(C(=O)CO)O)CCC4=CC(=O)C=C[C@]34C","InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1","XOFYZVNMUHMLCC-ZPOLXVRWSA-N"
"C1CC(NC1)C(=O)N","InChI=1S/C5H10N2O/c6-5(8)4-2-1-3-7-4/h4,7H,1-3H2,(H2,6,8)","VLJNHYLEOZPXFW-UHFFFAOYSA-N"
"c1ccc2c(c1)CCN3C2CN(CC3=O)C(=O)C4CCCCC4","InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2","FSVJFNAIGNNGKK-UHFFFAOYSA-N"
"CCC1=CN=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)C=C1","InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23)","HYAFETHFCAUJAY-UHFFFAOYSA-N"
"CCc1ccc(nc1)CCOc2ccc(cc2)CC3C(=O)NC(=O)S3","InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23)","HYAFETHFCAUJAY-UHFFFAOYSA-N"
"CC(C)NCC(COc1ccccc1OCC=C)O","InChI=1S/C15H23NO3/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3/h4-8,12-13,16-17H,1,9-11H2,2-3H3","CEMAWMOMDPGJMB-UHFFFAOYSA-N"
"CN(C)CC/C=C\1/c2ccccc2COc3c1cc(cc3)CC(=O)O","InChI=1S/C21H23NO3/c1-22(2)11-5-8-18-17-7-4-3-6-16(17)14-25-20-10-9-15(12-19(18)20)13-21(23)24/h3-4,6-10,12H,5,11,13-14H2,1-2H3,(H,23,24)/b18-8-","JBIMVDZLSHOPLA-LSCVHKIXSA-N"
"CC[C@H](C)C(=O)O[C@H]1C[C@H](C=C2[C@H]1[C@H]([C@H](C=C2)C)CC[C@@H]3C[C@H](CC(=O)O3)O)C","InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1","PCZOHLXUXFIOCF-BXMDZJJMSA-N"
"CNCCCC12CCC(c3c1cccc3)c4c2cccc4","InChI=1S/C20H23N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-5,7-10,15,21H,6,11-14H2,1H3","QSLMDECMDJKHMQ-UHFFFAOYSA-N"
"C1CNC(C1)C1=CC=CN=C1","InChI=1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2","MYKUKUCHPMASKF-UHFFFAOYSA-N"
"c1ccc2c(c1)Cc3ccccc3N4C2CNCC4","InChI=1S/C17H18N2/c1-3-7-15-13(5-1)11-14-6-2-4-8-16(14)19-10-9-18-12-17(15)19/h1-8,17-18H,9-12H2","ZBILSSSEXRZGKS-UHFFFAOYSA-N"
"C1CNCCC1C(=O)N","InChI=1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9)","DPBWFNDFMCCGGJ-UHFFFAOYSA-N"
"CN1CCN(C1=O)C","InChI=1S/C5H10N2O/c1-6-3-4-7(2)5(6)8/h3-4H2,1-2H3","CYSGHNMQYZDMIA-UHFFFAOYSA-N"
"c1ccc2c(c1)nnn2O","InChI=1S/C6H5N3O/c10-9-6-4-2-1-3-5(6)7-8-9/h1-4,10H","ASOKPJOREAFHNY-UHFFFAOYSA-N"
"C1=CC2=NNN=C2C(=C1)O","InChI=1S/C6H5N3O/c10-5-3-1-2-4-6(5)8-9-7-4/h1-3,10H,(H,7,8,9)","JMTMSDXUXJISAY-UHFFFAOYSA-N"
"FC=1\C=N/C(=O)NC=1N","InChI=1S/C4H4FN3O/c5-2-1-7-4(9)8-3(2)6/h1H,(H3,6,7,8,9)","XRECTZIEBJDKEO-UHFFFAOYSA-N"
"Cn1c2ccccc2nn1","InChI=1S/C7H7N3/c1-10-7-5-3-2-4-6(7)8-9-10/h2-5H,1H3","HXQHRUJXQJEGER-UHFFFAOYSA-N"
"C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC(=C)C4=CC(=O)C=C[C@]34C","InChI=1S/C20H24O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h6,8,11,14-16H,1,4-5,7,9-10H2,2-3H3/t14-,15-,16-,19+,20-/m0/s1","BFYIZQONLCFLEV-DAELLWKTSA-N"
"O=C(CP(=O)(CCCCc1ccccc1)OC(OC(=O)CC)C(C)C)N2C[C@@H](C[C@H]2C(O)=O)C3CCCCC3","InChI=1S/C30H46NO7P/c1-4-28(33)37-30(22(2)3)38-39(36,18-12-11-15-23-13-7-5-8-14-23)21-27(32)31-20-25(19-26(31)29(34)35)24-16-9-6-10-17-24/h5,7-8,13-14,22,24-26,30H,4,6,9-12,15-21H2,1-3H3,(H,34,35)/t25-,26+,30?,39?/m1/s1","BIDNLKIUORFRQP-FKDWWROVSA-N"
"CCNC(C)CC1=CC(=CC=C1)C(F)(F)F","InChI=1S/C12H16F3N/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9,16H,3,7H2,1-2H3","DBGIVFWFUFKIQN-UHFFFAOYSA-N"
"CCCc1nc2c(cc(cc2n1Cc3ccc(cc3)c4ccccc4C(=O)O)c5nc6ccccc6n5C)C","InChI=1S/C33H30N4O2/c1-4-9-30-35-31-21(2)18-24(32-34-27-12-7-8-13-28(27)36(32)3)19-29(31)37(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(38)39/h5-8,10-19H,4,9,20H2,1-3H3,(H,38,39)","RMMXLENWKUUMAY-UHFFFAOYSA-N"
"CCCC1=NC2=C(C)C=C(C=C2N1CC1=CC=C(C=C1)C1=CC=CC=C1C(O)=O)C1=NC2=CC=CC=C2N1C","InChI=1S/C33H30N4O2/c1-4-9-30-35-31-21(2)18-24(32-34-27-12-7-8-13-28(27)36(32)3)19-29(31)37(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(38)39/h5-8,10-19H,4,9,20H2,1-3H3,(H,38,39)","RMMXLENWKUUMAY-UHFFFAOYSA-N"
"c1c(c(cc(c1F)F)F)C[C@H](CC(=O)N2CCn3c(nnc3C(F)(F)F)C2)N","InChI=1S/C16H15F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1","MFFMDFFZMYYVKS-SECBINFHSA-N"
"COC1=CC=C(CCN(C)CCCC(C#N)(C(C)C)C2=CC(OC)=C(OC)C=C2)C=C1OC","InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3","SGTNSNPWRIOYBX-UHFFFAOYSA-N"
"CCOP(=O)(OCC)OCC","InChI=1S/C6H15O4P/c1-4-8-11(7,9-5-2)10-6-3/h4-6H2,1-3H3","DQWPFSLDHJDLRL-UHFFFAOYSA-N"
"C1C[C@H](N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C#N","InChI=1S/C17H25N3O2/c18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16/h12-14,19,22H,1-8,10-11H2/t12?,13?,14-,16?,17?/m0/s1","SYOKIDBDQMKNDQ-XWTIBIIYSA-N"
"CC(=O)CCCCn1c(=O)c2c(ncn2C)n(c1=O)C","InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3","BYPFEZZEUUWMEJ-UHFFFAOYSA-N"
"CCOC(=O)N1CCC(=C2c3ccc(cc3CCc4c2nccc4)Cl)CC1","InChI=1S/C22H23ClN2O2/c1-2-27-22(26)25-12-9-15(10-13-25)20-19-8-7-18(23)14-17(19)6-5-16-4-3-11-24-21(16)20/h3-4,7-8,11,14H,2,5-6,9-10,12-13H2,1H3","JCCNYMKQOSZNPW-UHFFFAOYSA-N"
"CN(C)C[C@@H]1CCCC([C@H]1C2=CC(=CC=C2)O)O","InChI=1S/C15H23NO2/c1-16(2)10-12-6-4-8-14(18)15(12)11-5-3-7-13(17)9-11/h3,5,7,9,12,14-15,17-18H,4,6,8,10H2,1-2H3/t12-,14?,15-/m0/s1","RSMYYINTIXFRCJ-JDLVMGNASA-N"
"CN(C)C[C@H]1CCCC[C@@]1(C2=CC(=CC=C2)O)O","InChI=1S/C15H23NO2/c1-16(2)11-13-6-3-4-9-15(13,18)12-7-5-8-14(17)10-12/h5,7-8,10,13,17-18H,3-4,6,9,11H2,1-2H3/t13-,15+/m1/s1","UWJUQVWARXYRCG-HIFRSBDPSA-N"
"c1ccn2c(c1)nn(c2=O)CCCN3CCN(CC3)c4cccc(c4)Cl","InChI=1S/C19H22ClN5O/c20-16-5-3-6-17(15-16)23-13-11-22(12-14-23)8-4-10-25-19(26)24-9-2-1-7-18(24)21-25/h1-3,5-7,9,15H,4,8,10-14H2","PHLBKPHSAVXXEF-UHFFFAOYSA-N"
"Cc1c(c(=O)n(n1C)c2ccccc2)C(C)C","InChI=1S/C14H18N2O/c1-10(2)13-11(3)15(4)16(14(13)17)12-8-6-5-7-9-12/h5-10H,1-4H3","PXWLVJLKJGVOKE-UHFFFAOYSA-N"
"Cc1cc(=O)n(n1C)c2ccccc2","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3","VEQOALNAAJBPNY-UHFFFAOYSA-N"
"COc1ccnc(c1OC)CS(=O)c2[nH]c3ccc(cc3n2)OC(F)F","InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)","IQPSEEYGBUAQFF-UHFFFAOYSA-N"
"CN1[C@@H](C[C@H](C1=O)O)c2cccnc2","InChI=1S/C10H12N2O2/c1-12-8(5-9(13)10(12)14)7-3-2-4-11-6-7/h2-4,6,8-9,13H,5H2,1H3/t8-,9+/m0/s1","XOKCJXZZNAUIQN-DTWKUNHWSA-N"
"c1cc(c(cc1OCC(F)(F)F)C(=O)NCC2CCCCN2)OCC(F)(F)F","InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)","DJBNUMBKLMJRSA-UHFFFAOYSA-N"
"C1C2=CN=C(N2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4F)CO","InChI=1S/C18H13ClFN3O/c19-11-5-6-16-14(7-11)18(13-3-1-2-4-15(13)20)22-9-12-8-21-17(10-24)23(12)16/h1-8,24H,9-10H2","QHSMEGADRFZVNE-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c1cc(ccc1OC)S(=O)(=O)C","InChI=1S/C15H24N2O4S/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18)","JTVPZMFULRWINT-UHFFFAOYSA-N"
"c1cc(ccc1C(=O)NCCN2CCOCC2)Cl","InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)","YHXISWVBGDMDLQ-UHFFFAOYSA-N"
"CCCCc1nc(c(n1Cc2ccc(cc2)c3ccccc3c4[nH]nnn4)CO)Cl","InChI=1S/C22H23ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28)","PSIFNNKUMBGKDQ-UHFFFAOYSA-N"
"CCCC(=O)Nc1ccc(c(c1)C(=O)C)OCC(CNC(C)C)O","InChI=1S/C18H28N2O4/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23)","GOEMGAFJFRBGGG-UHFFFAOYSA-N"
"c1ccc2c(c1)CC(c3ccccc3N2C(=O)N)O","InChI=1S/C15H14N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-8,14,18H,9H2,(H2,16,19)","BMPDWHIDQYTSHX-UHFFFAOYSA-N"
"CN1[C@@H](CCC1=O)c2cccnc2","InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1","UIKROCXWUNQSPJ-VIFPVBQESA-N"
"COC(=O)[C@H](c1ccccc1Cl)N2CCc3c(ccs3)C2","InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m0/s1","GKTWGGQPFAXNFI-HNNXBMFYSA-N"
"CCCNCC(COc1ccccc1C(=O)CCc2ccccc2)O","InChI=1S/C21H27NO3/c1-2-14-22-15-18(23)16-25-21-11-7-6-10-19(21)20(24)13-12-17-8-4-3-5-9-17/h3-11,18,22-23H,2,12-16H2,1H3","JWHAUXFOSRPERK-UHFFFAOYSA-N"
"c1ccc(c(c1)C2=NCC(=O)Nc3c2cc(cc3)Cl)F","InChI=1S/C15H10ClFN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)","UVCOILFBWYKHHB-UHFFFAOYSA-N"
"O[C@]2(c1cc(O)ccc1)CCCC[C@@H]2CN(C)C","InChI=1S/C15H23NO2/c1-16(2)11-13-6-3-4-9-15(13,18)12-7-5-8-14(17)10-12/h5,7-8,10,13,17-18H,3-4,6,9,11H2,1-2H3/t13-,15+/m1/s1","UWJUQVWARXYRCG-HIFRSBDPSA-N"
"Cc1cccc(c1OCC(=O)N[C@@H](Cc2ccccc2)[C@H](C[C@H](Cc3ccccc3)NC(=O)[C@H](C(C)C)N4CCCNC4=O)O)C","InChI=1S/C37H48N4O5/c1-25(2)34(41-20-12-19-38-37(41)45)36(44)39-30(21-28-15-7-5-8-16-28)23-32(42)31(22-29-17-9-6-10-18-29)40-33(43)24-46-35-26(3)13-11-14-27(35)4/h5-11,13-18,25,30-32,34,42H,12,19-24H2,1-4H3,(H,38,45)(H,39,44)(H,40,43)/t30-,31-,32-,34-/m0/s1","KJHKTHWMRKYKJE-SUGCFTRWSA-N"
"CCN(CC)CCNC(=O)c1cc(c(cc1OC)N)Cl","InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)","TTWJBBZEZQICBI-UHFFFAOYSA-N"
"CN(C)CCN1c2ccccc2S[C@H]([C@H](C1=O)O)c3ccc(cc3)OC","InChI=1S/C20H24N2O3S/c1-21(2)12-13-22-16-6-4-5-7-17(16)26-19(18(23)20(22)24)14-8-10-15(25-3)11-9-14/h4-11,18-19,23H,12-13H2,1-3H3/t18-,19+/m1/s1","NZHUXMZTSSZXSB-MOPGFXCFSA-N"
"CN(C)C1=CC=C(C=C1)C(=O)C1=CC=C(C=C1)N(C)C","InChI=1S/C17H20N2O/c1-18(2)15-9-5-13(6-10-15)17(20)14-7-11-16(12-8-14)19(3)4/h5-12H,1-4H3","VVBLNCFGVYUYGU-UHFFFAOYSA-N"
"CN1C(N)=NC2=C1C=CC1=NC=C(C)N=C21","InChI=1S/C11H11N5/c1-6-5-13-7-3-4-8-10(9(7)14-6)15-11(12)16(8)2/h3-5H,1-2H3,(H2,12,15)","DVCCCQNKIYNAKB-UHFFFAOYSA-N"
"CN1C(N)=NC2=NC=C(C=C12)C1=CC=CC=C1","InChI=1S/C13H12N4/c1-17-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(17)14/h2-8H,1H3,(H2,14,15,16)","UQVKZNNCIHJZLS-UHFFFAOYSA-N"
"CN1C(N)=NC2=C1C=CC1=NC=CC=C21","InChI=1S/C11H10N4/c1-15-9-5-4-8-7(3-2-6-13-8)10(9)14-11(15)12/h2-6H,1H3,(H2,12,14)","ARZWATDYIYAUTA-UHFFFAOYSA-N"
"CCCCOCCOCCOCC1=CC2=C(OCO2)C=C1CCC","InChI=1S/C19H30O5/c1-3-5-7-20-8-9-21-10-11-22-14-17-13-19-18(23-15-24-19)12-16(17)6-4-2/h12-13H,3-11,14-15H2,1-2H3","FIPWRIJSWJWJAI-UHFFFAOYSA-N"
"CC(C)(C)C1=CC=CC(=C1O)C(C)(C)C","InChI=1S/C14H22O/c1-13(2,3)10-8-7-9-11(12(10)15)14(4,5)6/h7-9,15H,1-6H3","DKCPKDPYUFEZCP-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)[N+]([O-])=O","InChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H","BTJIUGUIPKRLHP-UHFFFAOYSA-N"
"CCCCNS(=O)(=O)C1=CC=CC=C1","InChI=1S/C10H15NO2S/c1-2-3-9-11-14(12,13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3","IPRJXAGUEGOFGG-UHFFFAOYSA-N"
"OS(=O)(=O)C1=CC=C2C=CC=CC2=C1","InChI=1S/C10H8O3S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,11,12,13)","KVBGVZZKJNLNJU-UHFFFAOYSA-N"
"OP(=O)(OC1=CC=CC=C1)OC1=CC=CC=C1","InChI=1S/C12H11O4P/c13-17(14,15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H,(H,13,14)","ASMQGLCHMVWBQR-UHFFFAOYSA-N"
"OC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O","InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H","UFBJCMHMOXMLKC-UHFFFAOYSA-N"
"NS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8H2F17NO2S/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)29(26,27)28/h(H2,26,27,28)","RRRXPPIDPYTNJG-UHFFFAOYSA-N"
"OS(=O)(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8H5F13O3S/c9-3(10,1-2-25(22,23)24)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1-2H2,(H,22,23,24)","VIONGDJUYAYOPU-UHFFFAOYSA-N"
"OCC(NC(=O)C(Cl)Cl)C(O)C1=CC=C(C=C1)[N+]([O-])=O","InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)","WIIZWVCIJKGZOK-UHFFFAOYSA-N"
"CCCC(C)C1(CC=C)C(=O)NC(=O)NC1=O","InChI=1S/C12H18N2O3/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)","KQPKPCNLIDLUMF-UHFFFAOYSA-N"
"ClC1=CC2=NNN=C2C=C1","InChI=1S/C6H4ClN3/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,8,9,10)","PZBQVZFITSVHAW-UHFFFAOYSA-N"
"CCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC(=C1)[N+]([O-])=O)C(=O)OC","InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3","PVHUJELLJLJGLN-UHFFFAOYSA-N"
"O=C1C2=CC=CC=C2NC2=CC=CC=C12","InChI=1S/C13H9NO/c15-13-9-5-1-3-7-11(9)14-12-8-4-2-6-10(12)13/h1-8H,(H,14,15)","FZEYVTFCMJSGMP-UHFFFAOYSA-N"
"COC(=O)C1=CC(=CC(=C1)C(=O)OC)S(O)(=O)=O","InChI=1S/C10H10O7S/c1-16-9(11)6-3-7(10(12)17-2)5-8(4-6)18(13,14)15/h3-5H,1-2H3,(H,13,14,15)","HTXMGVTWXZBZNC-UHFFFAOYSA-N"
"OC1=CC(=O)OC2=CC=CC=C12","InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H","VXIXUWQIVKSKSA-UHFFFAOYSA-N"
"CC(C)N1C(=O)C2=CC=CC=C2NS1(=O)=O","InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3","ZOMSMJKLGFBRBS-UHFFFAOYSA-N"
"CN(C)C(=O)NC1=CC(Cl)=C(C)C=C1","InChI=1S/C10H13ClN2O/c1-7-4-5-8(6-9(7)11)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)","JXCGFZXSOMJFOA-UHFFFAOYSA-N"
"FC1=CC=C(NC(=O)C2=CC=CN=C2OC2=CC=CC(=C2)C(F)(F)F)C(F)=C1","InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)","WYEHFWKAOXOVJD-UHFFFAOYSA-N"
"CC1=NN=C(C(=O)N1N)C1=CC=CC=C1","InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3","VHCNQEUWZYOAEV-UHFFFAOYSA-N"
"NC1=C(Cl)C(=O)N(N=C1)C1=CC=CC=C1","InChI=1S/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2","WYKYKTKDBLFHCY-UHFFFAOYSA-N"
"CNC1=C(C(=O)C(O1)C1=CC=CC=C1)C1=CC=CC(=C1)C(F)(F)F","InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3","NYRMIJKDBAQCHC-UHFFFAOYSA-N"
"FC1=CC=C(NC(=O)C2=NC(OC3=CC=CC(=C3)C(F)(F)F)=CC=C2)C=C1","InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)","CWKFPEBMTGKLKX-UHFFFAOYSA-N"
"CC(C)(NC(=O)C1=CC(Cl)=CC(Cl)=C1)C#C","InChI=1S/C12H11Cl2NO/c1-4-12(2,3)15-11(16)8-5-9(13)7-10(14)6-8/h1,5-7H,2-3H3,(H,15,16)","PHNUZKMIPFFYSO-UHFFFAOYSA-N"
"[O-][N+](=O)\N=C1/NCCN1CC1=CN=C(Cl)C=C1","InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)","YWTYJOPNNQFBPC-UHFFFAOYSA-N"
"CON(C)C(=O)NC1=CC=C(Cl)C(Cl)=C1","InChI=1S/C9H10Cl2N2O2/c1-13(15-2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","XKJMBINCVNINCA-UHFFFAOYSA-N"
"OC1=C(Cl)C(Cl)=C(C#N)C(Cl)=C1C#N","InChI=1S/C8HCl3N2O/c9-5-3(1-12)6(10)7(11)8(14)4(5)2-13/h14H","MDQKYGOECVSPIW-UHFFFAOYSA-N"
"ClC1=CC=C(C=C1)C1=CC=CC=C1NC(=O)C1=CC=CN=C1Cl","InChI=1S/C18H12Cl2N2O/c19-13-9-7-12(8-10-13)14-4-1-2-6-16(14)22-18(23)15-5-3-11-21-17(15)20/h1-11H,(H,22,23)","WYEMLYFITZORAB-UHFFFAOYSA-N"
"CN(CC1=CC=C(Cl)N=C1)C(C)=NC#N","InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3","WCXDHFDTOYPNIE-UHFFFAOYSA-N"
"CN(CC1=CN=C(Cl)C=C1)C(\C)=N\C#N","InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3/b14-8+","WCXDHFDTOYPNIE-RIYZIHGNSA-N"
"CN\C(NCC1=CN=C(Cl)S1)=N/[N+]([O-])=O","InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)","PGOOBECODWQEAB-UHFFFAOYSA-N"
"NC(=O)C1=C(C(Cl)=C(Cl)C(C#N)=C1Cl)S(O)(=O)=O","InChI=1S/C8H3Cl3N2O4S/c9-4-2(1-12)5(10)6(11)7(18(15,16)17)3(4)8(13)14/h(H2,13,14)(H,15,16,17)","JNMMKKYUIIQPDG-UHFFFAOYSA-N"
"CCC(C)C1=C(O)C(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O","InChI=1S/C10H12N2O5/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17/h4-6,13H,3H2,1-2H3","OWZPCEFYPSAJFR-UHFFFAOYSA-N"
"CCC(=O)NC1=CC(Cl)=C(Cl)C=C1","InChI=1S/C9H9Cl2NO/c1-2-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)","LFULEKSKNZEWOE-UHFFFAOYSA-N"
"FC1=CC=CC(F)=C1C(=O)NC(=O)NC1=CC=C(Cl)C=C1","InChI=1S/C14H9ClF2N2O2/c15-8-4-6-9(7-5-8)18-14(21)19-13(20)12-10(16)2-1-3-11(12)17/h1-7H,(H2,18,19,20,21)","QQQYTWIFVNKMRW-UHFFFAOYSA-N"
"CCCN(CCC)C1=C(C=C(C=C1[N+]([O-])=O)S(N)(=O)=O)[N+]([O-])=O","InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)","UNAHYJYOSSSJHH-UHFFFAOYSA-N"
"FC1=CC(OC2=CC=C(C=C2Cl)C(F)(F)F)=CC=C1NC(=O)NC(=O)C1=C(F)C=CC=C1F","InChI=1S/C21H11ClF6N2O3/c22-12-8-10(21(26,27)28)4-7-17(12)33-11-5-6-16(15(25)9-11)29-20(32)30-19(31)18-13(23)2-1-3-14(18)24/h1-9H,(H2,29,30,31,32)","RYLHNOVXKPXDIP-UHFFFAOYSA-N"
"[H]\C(Cl)=C(\[H])CON=C(CC)C1=C(O)CC(CC1=O)C1CCOCC1","InChI=1S/C17H24ClNO4/c1-2-14(19-23-7-3-6-18)17-15(20)10-13(11-16(17)21)12-4-8-22-9-5-12/h3,6,12-13,20H,2,4-5,7-11H2,1H3/b6-3+,19-14?","IOYNQIMAUDJVEI-ZFNPBRLTSA-N"
"NS(=O)(=O)C1=C(C=CC=C1)C(F)(F)F","InChI=1S/C7H6F3NO2S/c8-7(9,10)5-3-1-2-4-6(5)14(11,12)13/h1-4H,(H2,11,12,13)","AFFPZJFLSDVZBV-UHFFFAOYSA-N"
"CC1=CC(O)=CC(C)=C1S(C)=O","InChI=1S/C9H12O2S/c1-6-4-8(10)5-7(2)9(6)12(3)11/h4-5,10H,1-3H3","ZHBBDQFXEDCQFI-UHFFFAOYSA-N"
"FC(F)(F)C1=NNC(=O)S1","InChI=1S/C3HF3N2OS/c4-3(5,6)1-7-8-2(9)10-1/h(H,8,9)","JFZSAWUKZISBJM-UHFFFAOYSA-N"
"CCC1=CC=CC(C)=C1NC(=O)CS(O)(=O)=O","InChI=1S/C11H15NO4S/c1-3-9-6-4-5-8(2)11(9)12-10(13)7-17(14,15)16/h4-6H,3,7H2,1-2H3,(H,12,13)(H,14,15,16)","QPVPJECIHVSBLZ-UHFFFAOYSA-N"
"CC(C)(OC1=CC=C(CCNC(=O)C2=CC=C(Cl)C=C2)C=C1)C(O)=O","InChI=1S/C19H20ClNO4/c1-19(2,18(23)24)25-16-9-3-13(4-10-16)11-12-21-17(22)14-5-7-15(20)8-6-14/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)","IIBYAHWJQTYFKB-UHFFFAOYSA-N"
"CCC(C)C(=O)OC1CC(O)C=C2C=CC(C)C(CCC(O)CC(O)CC(O)=O)C12","InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)","TUZYXOIXSAXUGO-UHFFFAOYSA-N"
"NC1=CC=C(C=C1)S(=O)(=O)NC1=NC=CC=C1","InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)","GECHUMIMRBOMGK-UHFFFAOYSA-N"
"CC(C)CC1=CC=C(C=C1)C(C)C(O)=O","InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)","HEFNNWSXXWATRW-UHFFFAOYSA-N"
"NC(=O)N1C2=CC=CC=C2C=CC2=CC(O)=CC=C12","InChI=1S/C15H12N2O2/c16-15(19)17-13-4-2-1-3-10(13)5-6-11-9-12(18)7-8-14(11)17/h1-9,18H,(H2,16,19)","VPZIYMMSJFWLSP-UHFFFAOYSA-N"
"CC(O)(CS(=O)(=O)C1=CC=C(F)C=C1)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F","InChI=1S/C18H14F4N2O4S/c1-17(26,10-29(27,28)14-6-3-12(19)4-7-14)16(25)24-13-5-2-11(9-23)15(8-13)18(20,21)22/h2-8,26H,10H2,1H3,(H,24,25)","LKJPYSCBVHEWIU-UHFFFAOYSA-N"
"CC(C)C(=O)NC1=CC(=C(C=C1)[N+]([O-])=O)C(F)(F)F","InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17)","MKXKFYHWDHIYRV-UHFFFAOYSA-N"
"OC(CN1C=NC=N1)(CN1C=NC=N1)C1=C(F)C=C(F)C=C1","InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2","RFHAOTPXVQNOHP-UHFFFAOYSA-N"
"COC1=C(C=C(Cl)C=C1)C(=O)NCCC1=CC=C(C=C1)S(=O)(=O)NC(=O)NC1CCCCC1","InChI=1S/C23H28ClN3O5S/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29)","ZNNLBTZKUZBEKO-UHFFFAOYSA-N"
"CCC1=C(C)CN(C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC2CCC(C)CC2)C1=O","InChI=1S/C24H34N4O5S/c1-4-21-17(3)15-28(22(21)29)24(31)25-14-13-18-7-11-20(12-8-18)34(32,33)27-23(30)26-19-9-5-16(2)6-10-19/h7-8,11-12,16,19H,4-6,9-10,13-15H2,1-3H3,(H,25,31)(H2,26,27,30)","WIGIZIANZCJQQY-UHFFFAOYSA-N"
"CC1=CC=C(C=C1)C1=CC(=NN1C1=CC=C(C=C1)S(N)(=O)=O)C(F)(F)F","InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)","RZEKVGVHFLEQIL-UHFFFAOYSA-N"
"FC(F)(F)C1(OC(=O)NC2=C1C=C(Cl)C=C2)C#CC1CC1","InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)","XPOQHMRABVBWPR-UHFFFAOYSA-N"
"CCCC1=NC(C)=C2N1NC(=NC2=O)C1=C(OCC)C=CC(=C1)S(=O)(=O)N1CCN(CC)CC1","InChI=1S/C23H32N6O4S/c1-5-8-20-24-16(4)21-23(30)25-22(26-29(20)21)18-15-17(9-10-19(18)33-7-3)34(31,32)28-13-11-27(6-2)12-14-28/h9-10,15H,5-8,11-14H2,1-4H3,(H,25,26,30)","SECKRCOLJRRGGV-UHFFFAOYSA-N"
"[O-][N+](=O)C1=CC=C(O1)\C=N\N1CC(=O)NC1=O","InChI=1S/C8H6N4O5/c13-6-4-11(8(14)10-6)9-3-5-1-2-7(17-5)12(15)16/h1-3H,4H2,(H,10,13,14)/b9-3+","NXFQHRVNIOXGAQ-YCRREMRBSA-N"
"CCCCCCCCCCC[C@@H](C[C@@H]1OC(=O)[C@H]1CCCCCC)OC(=O)[C@H](CC(C)C)NC=O","InChI=1S/C29H53NO5/c1-5-7-9-11-12-13-14-15-16-18-24(34-29(33)26(30-22-31)20-23(3)4)21-27-25(28(32)35-27)19-17-10-8-6-2/h22-27H,5-21H2,1-4H3,(H,30,31)/t24-,25-,26-,27-/m0/s1","AHLBNYSZXLDEJQ-FWEHEUNISA-N"
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"CC(C)NC(=O)NS(=O)(=O)C1=CN=CC=C1NC1=CC=CC(C)=C1","InChI=1S/C16H20N4O3S/c1-11(2)18-16(21)20-24(22,23)15-10-17-8-7-14(15)19-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,19)(H2,18,20,21)","NGBFQHCMQULJNZ-UHFFFAOYSA-N"
"OC1=CC=C(Cl)C=C1CC1=CC=CC=C1","InChI=1S/C13H11ClO/c14-12-6-7-13(15)11(9-12)8-10-4-2-1-3-5-10/h1-7,9,15H,8H2","NCKMMSIFQUPKCK-UHFFFAOYSA-N"
"CCOC(=O)C1=CC=C(O)C=C1","InChI=1S/C9H10O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3","NUVBSKCKDOMJSU-UHFFFAOYSA-N"
"CCCCOC(=O)C1=CC=C(O)C=C1","InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3","QFOHBWFCKVYLES-UHFFFAOYSA-N"
"OC1=C(C=C(Cl)C=C1Cl)C(=O)NC1=CC=C(Cl)C(Cl)=C1","InChI=1S/C13H7Cl4NO2/c14-6-3-8(12(19)11(17)4-6)13(20)18-7-1-2-9(15)10(16)5-7/h1-5,19H,(H,18,20)","SJQBHPJLLIJASD-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)S(=O)(=O)C1=CC=C(O)C=C1","InChI=1S/C12H10O4S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8,13-14H","VPWNQTHUCYMVMZ-UHFFFAOYSA-N"
"COC(=O)C1=CC=C(O)C=C1","InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3","LXCFILQKKLGQFO-UHFFFAOYSA-N"
"CCCOC(=O)C1=CC=C(O)C=C1","InChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3","QELSKZZBTMNZEB-UHFFFAOYSA-N"
"OC1=CC(Cl)=C(Cl)C(Cl)=C1","InChI=1S/C6H3Cl3O/c7-4-1-3(10)2-5(8)6(4)9/h1-2,10H","GBNHEBQXJVDXSW-UHFFFAOYSA-N"
"OC1=C(Br)C=C(Cl)C=C1CC1=CC(Cl)=CC(Br)=C1O","InChI=1S/C13H8Br2Cl2O2/c14-10-4-8(16)2-6(12(10)18)1-7-3-9(17)5-11(15)13(7)19/h2-5,18-19H,1H2","TYBHZVUFOINFDV-UHFFFAOYSA-N"
"OC1=CC=C(Cl)C=C1CC1=C(O)C=CC(Cl)=C1","InChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2","MDNWOSOZYLHTCG-UHFFFAOYSA-N"
"CC1=CC(=O)NS(=O)(=O)O1","InChI=1S/C4H5NO4S/c1-3-2-4(6)5-10(7,8)9-3/h2H,1H3,(H,5,6)","YGCFIWIQZPHFLU-UHFFFAOYSA-N"
"OS(=O)(=O)NC1CCCCC1","InChI=1S/C6H13NO3S/c8-11(9,10)7-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,9,10)","HCAJEUSONLESMK-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C4HF7O2/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H,12,13)","YPJUNDFVDDCYIH-UHFFFAOYSA-N"
"OC(=O)C1=C(O)C=CC=C1","InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)","YGSDEFSMJLZEOE-UHFFFAOYSA-N"
"CC(C)NCC(O)C1=CC=C(NS(C)(=O)=O)C=C1","InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3","ZBMZVLHSJCTVON-UHFFFAOYSA-N"
"CS(=O)(=O)C1=CC(Cl)=C(C=C1)C(=O)C1C(=O)CCCC1=O","InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","PQTBTIFWAXVEPB-UHFFFAOYSA-N"
"OS(=O)(=O)C1=CC=CC=C1","InChI=1S/C6H6O3S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H,7,8,9)","SRSXLGNVWSONIS-UHFFFAOYSA-N"
"OC1=NC=NC2=C1C=NN2","InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)","OFCNXPDARWKPPY-UHFFFAOYSA-N"
"NC1=C2C=CC(=CC2=CC=C1)S(O)(=O)=O","InChI=1S/C10H9NO3S/c11-10-3-1-2-7-6-8(15(12,13)14)4-5-9(7)10/h1-6H,11H2,(H,12,13,14)","UWPJYQYRSWYIGZ-UHFFFAOYSA-N"
"C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CCC2=O","InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1","DNXHEGUUPJUMQT-CBZIJGRNSA-N"
"C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O)=C4)[C@@H]1C[C@@H](O)[C@@H]2O","InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1","PROQIPRRNZUXQM-ZXXIGWHRSA-N"
"C[C@]12CC(=O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1","MFYSYFVPBJMHGN-ZPOLXVRWSA-N"
"CC12CC[C@H]3C(C=CC4=CC(=O)CCC34C)[C@@H]1CCC21CCC(=O)O1","InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16?,17-,18-,20?,21?,22?/m0/s1","UJVLDDZCTMKXJK-AFDHUMPMSA-N"
"[H][C@@]12CC[C@](O)(C(C)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])C[C@H](C)C2=CC(=O)CC[C@]12C","InChI=1S/C22H32O3/c1-13-11-16-17(20(3)8-5-15(24)12-19(13)20)6-9-21(4)18(16)7-10-22(21,25)14(2)23/h12-13,16-18,25H,5-11H2,1-4H3/t13-,16+,17-,18-,20+,21-,22-/m0/s1","FRQMUZJSZHZSGN-HBNHAYAOSA-N"
"CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@]12C","InChI=1S/C22H27ClO3/c1-11(24)22(26)7-5-14-12-9-18(23)17-10-19(25)13-8-16(13)21(17,3)15(12)4-6-20(14,22)2/h9-10,12-16,26H,4-8H2,1-3H3/t12-,13+,14-,15-,16-,20-,21-,22-/m0/s1","DUSHUSLJJMDGTE-ZJPMUUANSA-N"
"CC(=O)C1(O)CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C","InChI=1S/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3","DBPWSSGDRRHUNT-UHFFFAOYSA-N"
"C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1","OIGNJSKKLXVSLS-VWUMJDOOSA-N"
"[H][C@@]12C[C@H](C)[C@](O)(C(=O)CCl)[C@@]1(C)C[C@H](O)[C@@]1(F)[C@@]2([H])CCC2=CC(=O)C=C[C@]12C","InChI=1S/C22H28ClFO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,24)17(26)10-20(16,3)22(12,28)18(27)11-23/h6-7,9,12,15-17,26,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,17-,19-,20-,21-,22-/m0/s1","FCSHDIVRCWTZOX-DVTGEIKXSA-N"
"C[C@]12C[C@H](O)[C@@]3(F)[C@@H](CCC4=CC(=O)C=C[C@]34C)[C@@H]1C[C@@H](O)[C@]2(O)C(=O)CO","InChI=1S/C21H27FO6/c1-18-6-5-12(24)7-11(18)3-4-13-14-8-15(25)21(28,17(27)10-23)19(14,2)9-16(26)20(13,18)22/h5-7,13-16,23,25-26,28H,3-4,8-10H2,1-2H3/t13-,14-,15+,16-,18-,19-,20-,21-/m0/s1","GFNANZIMVAIWHM-OBYCQNJPSA-N"
"[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)CC(=O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)C=C[C@]12C","InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1","XOFYZVNMUHMLCC-ZPOLXVRWSA-N"
"CC1(C)O[C@@H]2C[C@H]3[C@@H]4C[C@H](F)C5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]2(O1)C(=O)CO","InChI=1S/C24H30F2O6/c1-20(2)31-19-9-13-14-8-16(25)15-7-12(28)5-6-21(15,3)23(14,26)17(29)10-22(13,4)24(19,32-20)18(30)11-27/h5-7,13-14,16-17,19,27,29H,8-11H2,1-4H3/t13-,14-,16-,17-,19+,21-,22-,23-,24+/m0/s1","FEBLZLNTKCEFIT-VSXGLTOVSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C10HF19O2/c11-2(12,1(30)31)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)29/h(H,30,31)","PCIUEQPBYFRTEM-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h(H,24,25)","SNGREZUHAYWORS-UHFFFAOYSA-N"
"OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8HF17O3S/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)29(26,27)28/h(H,26,27,28)","YFSUTJLHUFNCNZ-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C6HF11O2/c7-2(8,1(18)19)3(9,10)4(11,12)5(13,14)6(15,16)17/h(H,18,19)","PXUULQAPEKKVAH-UHFFFAOYSA-N"
"CCCCCCCCCCCCOS(=O)(=O)O","InChI=1S/C12H26O4S/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h2-12H2,1H3,(H,13,14,15)","MOTZDAYCYVMXPC-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)NCC(C)O","InChI=1S/C15H31NO2/c1-3-4-5-6-7-8-9-10-11-12-15(18)16-13-14(2)17/h14,17H,3-13H2,1-2H3,(H,16,18)","MMBILEWCGWTAOV-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C14HF27O2/c15-2(16,1(42)43)3(17,18)4(19,20)5(21,22)6(23,24)7(25,26)8(27,28)9(29,30)10(31,32)11(33,34)12(35,36)13(37,38)14(39,40)41/h(H,42,43)","RUDINRUXCKIXAJ-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22)","ZWBAMYVPMDSJGQ-UHFFFAOYSA-N"
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"CN(C)C(=O)NC1=CC=C(Cl)C(Cl)=C1","InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","XMTQQYYKAHVGBJ-UHFFFAOYSA-N"
"NC1=C(C(=NN1C1=C(Cl)C=C(C=C1Cl)C(F)(F)F)C#N)S(=O)C(F)(F)F","InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2","ZOCSXAVNDGMNBV-UHFFFAOYSA-N"
"N1N=NC2=CC=CC=C12","InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)","QRUDEWIWKLJBPS-UHFFFAOYSA-N"
"CC(=O)CC(C1=CC=CC=C1)C1=C(O)C2=CC=CC=C2OC1=O","InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3","PJVWKTKQMONHTI-UHFFFAOYSA-N"
"CC1=CC=C2NN=NC2=C1","InChI=1S/C7H7N3/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","LRUDIIUSNGCQKF-UHFFFAOYSA-N"
"ClC1=CC=C(NC(=O)NC2=CC(Cl)=C(Cl)C=C2)C=C1","InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)","ICUTUKXCWQYESQ-UHFFFAOYSA-N"
"NC(=O)NC1=CC(Cl)=C(Cl)C=C1","InChI=1S/C7H6Cl2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12)","CYESCLHCWJKRKM-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)C1=COC2=CC(O)=CC(O)=C2C1=O","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H","TZBJGXHYKVUXJN-UHFFFAOYSA-N"
"NC1=C(SC(F)(F)F)C(=NN1C1=C(Cl)C=C(C=C1Cl)C(F)(F)F)C#N","InChI=1S/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2","FQXWEKADCSXYOC-UHFFFAOYSA-N"
"NC1=C(C(=NN1C1=C(Cl)C=C(C=C1Cl)C(F)(F)F)C#N)S(=O)(=O)C(F)(F)F","InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2","LGHZJDKSVUTELU-UHFFFAOYSA-N"
"NC1=C(C(=NN1C1=C(Cl)C=C(C=C1Cl)C(F)(F)F)C#N)C(F)(F)F","InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2","JWKXVHLIRTVXLD-UHFFFAOYSA-N"
"Cl\C=C/C[N+]12CN3CN(CN(C3)C1)C2","InChI=1S/C9H16ClN4/c10-2-1-3-14-7-11-4-12(8-14)6-13(5-11)9-14/h1-2H,3-9H2/q+1/b2-1-","LDLCEGCJYSDJLX-UPHRSURJSA-N"
"NC1=CC=C(C=C1Cl)C1=CC=C(N)C(Cl)=C1","InChI=1S/C12H10Cl2N2/c13-9-5-7(1-3-11(9)15)8-2-4-12(16)10(14)6-8/h1-6H,15-16H2","HUWXDEQWWKGHRV-UHFFFAOYSA-N"
"CC(C)NC1=CC=C(NC2=CC=CC=C2)C=C1","InChI=1S/C15H18N2/c1-12(2)16-14-8-10-15(11-9-14)17-13-6-4-3-5-7-13/h3-12,16-17H,1-2H3","OUBMGJOQLXMSNT-UHFFFAOYSA-N"
"N(C1=CC=CC=C1)C1=CC=CC2=C1C=CC=C2","InChI=1S/C16H13N/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12,17H","XQVWYOYUZDUNRW-UHFFFAOYSA-N"
"COC1=CC(=CC=C1N)C1=CC(OC)=C(N)C=C1","InChI=1S/C14H16N2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,15-16H2,1-2H3","JRBJSXQPQWSCCF-UHFFFAOYSA-N"
"NC1=CC=C(C=C1)\N=N\C1=CC=CC=C1","InChI=1S/C12H11N3/c13-10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h1-9H,13H2/b15-14+","QPQKUYVSJWQSDY-CCEZHUSRSA-N"
"NC1=CC=C(SC2=CC=C(N)C=C2)C=C1","InChI=1S/C12H12N2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,13-14H2","ICNFHJVPAJKPHW-UHFFFAOYSA-N"
"CC(C)C1=CC=C(N)C=C1","InChI=1S/C9H13N/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,10H2,1-2H3","LRTFPLFDLJYEKT-UHFFFAOYSA-N"
"NC1=CC=C(C=C1)C1=CC=C(N)C=C1","InChI=1S/C12H12N2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H,13-14H2","HFACYLZERDEVSX-UHFFFAOYSA-N"
"CC1=CC(=CC=C1N)C1=CC=C(N)C(C)=C1","InChI=1S/C14H16N2/c1-9-7-11(3-5-13(9)15)12-4-6-14(16)10(2)8-12/h3-8H,15-16H2,1-2H3","NUIURNJTPRWVAP-UHFFFAOYSA-N"
"NC1=NC=CC=C1","InChI=1S/C5H6N2/c6-5-3-1-2-4-7-5/h1-4H,(H2,6,7)","ICSNLGPSRYBMBD-UHFFFAOYSA-N"
"CC(=O)C1=CC(N)=CC=C1","InChI=1S/C8H9NO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,9H2,1H3","CKQHAYFOPRIUOM-UHFFFAOYSA-N"
"C1=CC=C(C=C1)\N=N\C1=CC=CC=C1","InChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+","DMLAVOWQYNRWNQ-BUHFOSPRSA-N"
"NC1CCCCC1","InChI=1S/C6H13N/c7-6-4-2-1-3-5-6/h6H,1-5,7H2","PAFZNILMFXTMIY-UHFFFAOYSA-N"
"CCCCN(CCCC)CCCC","InChI=1S/C12H27N/c1-4-7-10-13(11-8-5-2)12-9-6-3/h4-12H2,1-3H3","IMFACGCPASFAPR-UHFFFAOYSA-N"
"NC1=NC2=C(C=C1)C1=CC=CC=C1N2","InChI=1S/C11H9N3/c12-10-6-5-8-7-3-1-2-4-9(7)13-11(8)14-10/h1-6H,(H3,12,13,14)","FJTNLJLPLJDTRM-UHFFFAOYSA-N"
"C(OC1=CC=C2C=CC=CC2=C1)C1=CC=CC=C1","InChI=1S/C17H14O/c1-2-6-14(7-3-1)13-18-17-11-10-15-8-4-5-9-16(15)12-17/h1-12H,13H2","WLTCCDHHWYAMCG-UHFFFAOYSA-N"
"CC(=O)C1=CC=C2C=CC=CC2=C1","InChI=1S/C12H10O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H3","XSAYZAUNJMRRIR-UHFFFAOYSA-N"
"CC(=O)C1=C2CCC(C)(C)C2=CC(=C1)C(C)(C)C","InChI=1S/C17H24O/c1-11(18)14-9-12(16(2,3)4)10-15-13(14)7-8-17(15,5)6/h9-10H,7-8H2,1-6H3","IKTHMQYJOWTSJO-UHFFFAOYSA-N"
"CC1C(C)(C)C2=C(C(=O)CCC2)C1(C)C","InChI=1S/C14H22O/c1-9-13(2,3)10-7-6-8-11(15)12(10)14(9,4)5/h9H,6-8H2,1-5H3","MIZGSAALSYARKU-UHFFFAOYSA-N"
"CC1C(C)(C)C2=CC3=C(C=C2C1(C)C)C(C)COC3","InChI=1S/C18H26O/c1-11-9-19-10-13-7-15-16(8-14(11)13)18(5,6)12(2)17(15,3)4/h7-8,11-12H,9-10H2,1-6H3","ONKNPOPIGWHAQC-UHFFFAOYSA-N"
"CC1C(C)(C)C2=C(C=C(C(C)=O)C(C)=C2)C1(C)C","InChI=1S/C17H24O/c1-10-8-14-15(9-13(10)11(2)18)17(6,7)12(3)16(14,4)5/h8-9,12H,1-7H3","VDBHOHJWUDKDRW-UHFFFAOYSA-N"
"CC1=CC=C(C=C2C3CCC(C)(C2=O)C3(C)C)C=C1","InChI=1S/C18H22O/c1-12-5-7-13(8-6-12)11-14-15-9-10-18(4,16(14)19)17(15,2)3/h5-8,11,15H,9-10H2,1-4H3","HEOCBCNFKCOKBX-UHFFFAOYSA-N"
"O=C1CCCCC\C=C/CCCCCCCCO1","InChI=1S/C16H28O2/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18-16/h2,4H,1,3,5-15H2/b4-2-","NVIPUOMWGQAOIT-RQOWECAXSA-N"
"CC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C","InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3","NLZUEZXRPGMBCV-UHFFFAOYSA-N"
"CC(=O)C1=C(C)C(=C(C(=C1C)[N+]([O-])=O)C(C)(C)C)[N+]([O-])=O","InChI=1S/C14H18N2O5/c1-7-10(9(3)17)8(2)13(16(20)21)11(14(4,5)6)12(7)15(18)19/h1-6H3","WXCMHFPAUCOJIG-UHFFFAOYSA-N"
"C1CCCCCCOC(=O)/C=C/CCCCC1","InChI=1S/C15H26O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h11,13H,1-10,12,14H2/b13-11+","KHLFMZDGADSQGR-ACCUITESSA-N"
"O=C1CCCCCCCCCCC=CCCC1","InChI=1S/C16H28O/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h6,8H,1-5,7,9-15H2","ABRIMXGLNHCLIP-UHFFFAOYSA-N"
"CC(C)=CC1C(C(=O)OC2CC(=O)C(CC=C)=C2C)C1(C)C","InChI=1S/C19H26O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h7,9,14,16-17H,1,8,10H2,2-6H3","ZCVAOQKBXKSDMS-UHFFFAOYSA-N"
"CC(C)(C)C1=CC(=O)C=C(C1=O)C(C)(C)C","InChI=1S/C14H20O2/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8H,1-6H3","RDQSIADLBQFVMY-UHFFFAOYSA-N"
"N1C2=CC=CC=C2C=CC2=CC=CC=C12","InChI=1S/C14H11N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-10,15H","LCGTWRLJTMHIQZ-UHFFFAOYSA-N"
"CN(C)S(=O)(=O)C1=CC=C(N)C=C1","InChI=1S/C8H12N2O2S/c1-10(2)13(11,12)8-5-3-7(9)4-6-8/h3-6H,9H2,1-2H3","BABGMPQXLCJMSK-UHFFFAOYSA-N"
"ClCCOP(=O)(OCCCl)OCCCl","InChI=1S/C6H12Cl3O4P/c7-1-4-11-14(10,12-5-2-8)13-6-3-9/h1-6H2","HQUQLFOMPYWACS-UHFFFAOYSA-N"
"O=P(OC1=CC=CC=C1)(OC1=CC=CC=C1)OC1=CC=CC=C1","InChI=1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H","XZZNDPSIHUTMOC-UHFFFAOYSA-N"
"CC(C)C1=CC=C2SC3=C(C=CC=C3)C(=O)C2=C1","InChI=1S/C16H14OS/c1-10(2)11-7-8-15-13(9-11)16(17)12-5-3-4-6-14(12)18-15/h3-10H,1-2H3","KTALPKYXQZGAEG-UHFFFAOYSA-N"
"CCOC(=O)C1=CC=C(C=C1)N(C)C","InChI=1S/C11H15NO2/c1-4-14-11(13)9-5-7-10(8-6-9)12(2)3/h5-8H,4H2,1-3H3","FZUGPQWGEGAKET-UHFFFAOYSA-N"
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"[O-][N+]1=CC=CC2=CC=CC=C12","InChI=1S/C9H7NO/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H","GIIWGCBLYNDKBO-UHFFFAOYSA-N"
"C1=CN(C=N1)C(C1=CC=CC=C1)C1=CC=C(C=C1)C1=CC=CC=C1","InChI=1S/C22H18N2/c1-3-7-18(8-4-1)19-11-13-21(14-12-19)22(24-16-15-23-17-24)20-9-5-2-6-10-20/h1-17,22H","OCAPBUJLXMYKEJ-UHFFFAOYSA-N"
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"[O-][N+](=O)C1=CC=[N+]([O-])C2=CC=CC=C12","InChI=1S/C9H6N2O3/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6H","YHQDZJICGQWFHK-UHFFFAOYSA-N"
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"O=C(\C=C\C=C\C1=CC2=C(OCO2)C=C1)N1CCCCC1","InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+","MXXWOMGUGJBKIW-YPCIICBESA-N"
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"CNC(=O)C(=N\OC)\C1=CC=CC=C1COC1=CC(C)=CC=C1C","InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)/b21-18+","WXUZAHCNPWONDH-DYTRJAOYSA-N"
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"[H][C@]1(C[C@@]2([H])C=C[C@@]3([H])[C@]4([H])CC(=O)O[C@@]([H])(CC)CCC[C@]([H])(O[C@@]5([H])CC[C@]([H])(N(C)C)[C@@]([H])(C)O5)[C@@]([H])(C)C(=O)C4=C[C@@]3([H])[C@]2([H])C1)O[C@]1([H])O[C@@]([H])(C)[C@]([H])(OC)[C@@]([H])(OC)[C@@]1([H])OC","InChI=1S/C41H65NO10/c1-10-26-12-11-13-34(52-36-17-16-33(42(5)6)23(3)48-36)22(2)37(44)32-20-30-28(31(32)21-35(43)50-26)15-14-25-18-27(19-29(25)30)51-41-40(47-9)39(46-8)38(45-7)24(4)49-41/h14-15,20,22-31,33-34,36,38-41H,10-13,16-19,21H2,1-9H3/t22-,23-,24+,25-,26+,27-,28-,29-,30-,31+,33+,34+,36+,38+,39-,40-,41+/m1/s1","SRJQTHAZUNRMPR-UYQKXTDMSA-N"
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"OC(=O)CCC(=O)C1=CC=C(F)C=C1","InChI=1S/C10H9FO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)","WUYWHIAAQYQKPP-UHFFFAOYSA-N"
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"CN(CC1=NC2=C(N=C1)N=C(N)N=C2N)C1=CC=C(C=C1)C(=O)N[C@@H](CCC(O)=O)C(O)=O","InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)/t13-/m0/s1","FBOZXECLQNJBKD-ZDUSSCGKSA-N"
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"S=C1N=CNC2=C1NC=N2","InChI=1S/C5H4N4S/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)","GLVAUDGFNGKCSF-UHFFFAOYSA-N"
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"C[C@]12C[C@H](O)[C@H]3[C@@H](C[C@@H](O)C4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)CO","InChI=1S/C21H30O6/c1-19-5-3-11(23)7-14(19)15(24)8-12-13-4-6-21(27,17(26)10-22)20(13,2)9-16(25)18(12)19/h7,12-13,15-16,18,22,24-25,27H,3-6,8-10H2,1-2H3/t12-,13-,15+,16-,18+,19-,20-,21-/m0/s1","GNFTWPCIRXSCQF-UJXAPRPESA-N"
"CCCCCCCCCCCC[N+](C)(C)[O-]","InChI=1S/C14H31NO/c1-4-5-6-7-8-9-10-11-12-13-14-15(2,3)16/h4-14H2,1-3H3","SYELZBGXAIXKHU-UHFFFAOYSA-N"
"CC(C)(C)CC(C)(C)C1=CC=C(OCCOCC[N+](C)(C)CC2=CC=CC=C2)C=C1","InChI=1S/C27H42NO2/c1-26(2,3)22-27(4,5)24-13-15-25(16-14-24)30-20-19-29-18-17-28(6,7)21-23-11-9-8-10-12-23/h8-16H,17-22H2,1-7H3/q+1","SIYLLGKDQZGJHK-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1","InChI=1S/C25H46N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-26(2,3)24-25-21-18-17-19-22-25/h17-19,21-22H,4-16,20,23-24H2,1-3H3/q+1","QDYLMAYUEZBUFO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC[N+](C)(C)C","InChI=1S/C19H42N/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4/h5-19H2,1-4H3/q+1","RLGQACBPNDBWTB-UHFFFAOYSA-N"
"CCCCCCCCCC[N+](C)(C)CCCCCCCCCC","InChI=1S/C22H48N/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2/h5-22H2,1-4H3/q+1","JGFDZZLUDWMUQH-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)N(CCO)CCO","InChI=1S/C16H33NO3/c1-2-3-4-5-6-7-8-9-10-11-16(20)17(12-14-18)13-15-19/h18-19H,2-15H2,1H3","AOMUHOFOVNGZAN-UHFFFAOYSA-N"
"CCCCCCCC[N+](C)(C)C","InChI=1S/C11H26N/c1-5-6-7-8-9-10-11-12(2,3)4/h5-11H2,1-4H3/q+1","HTKPDYSCAPSXIR-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CCCS(O)(=O)=O","InChI=1S/C22H46N2O4S/c1-4-5-6-7-8-9-10-11-12-13-14-17-22(25)23-18-15-19-24(2,3)20-16-21-29(26,27)28/h4-21H2,1-3H3,(H-,23,25,26,27,28)/p+1","UTSXERRKRAEDOV-UHFFFAOYSA-O"
"CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(O)=O","InChI=1S/C19H38N2O3/c1-4-5-6-7-8-9-10-11-12-14-18(22)20-15-13-16-21(2,3)17-19(23)24/h4-17H2,1-3H3,(H-,20,22,23,24)/p+1","MRUAUOIMASANKQ-UHFFFAOYSA-O"
"CCCCCCCCCCCCNC","InChI=1S/C13H29N/c1-3-4-5-6-7-8-9-10-11-12-13-14-2/h14H,3-13H2,1-2H3","OMEMQVZNTDHENJ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC[N+](C)(C)CC1=CC=CC=C1","InChI=1S/C23H42N/c1-4-5-6-7-8-9-10-11-12-13-14-18-21-24(2,3)22-23-19-16-15-17-20-23/h15-17,19-20H,4-14,18,21-22H2,1-3H3/q+1","WNBGYVXHFTYOBY-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC[N+](C)(C)[O-]","InChI=1S/C16H35NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)18/h4-16H2,1-3H3","ONHFWHCMZAJCFB-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C)C","InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3","YWFWDNVOPHGWMX-UHFFFAOYSA-N"
"CCCCCCCCCCN(C)C","InChI=1S/C12H27N/c1-4-5-6-7-8-9-10-11-12-13(2)3/h4-12H2,1-3H3","YWWNNLPSZSEZNZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCN(C)C","InChI=1S/C16H35N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)3/h4-16H2,1-3H3","SFBHPFQSSDCYSL-UHFFFAOYSA-N"
"CCOC(=O)CC(O)(CC(=O)OCC)C(=O)OCC","InChI=1S/C12H20O7/c1-4-17-9(13)7-12(16,11(15)19-6-3)8-10(14)18-5-2/h16H,4-8H2,1-3H3","DOOTYTYQINUNNV-UHFFFAOYSA-N"
"ClC1=CC=C(C(CN2C=CN=C2)OCC=C)C(Cl)=C1","InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2","PZBPKYOVPCNPJY-UHFFFAOYSA-N"
"OS(=O)(=O)C1=CC=C2NC(=NC2=C1)C1=CC=CC=C1","InChI=1S/C13H10N2O3S/c16-19(17,18)10-6-7-11-12(8-10)15-13(14-11)9-4-2-1-3-5-9/h1-8H,(H,14,15)(H,16,17,18)","UVCJGUGAGLDPAA-UHFFFAOYSA-N"
"N1C2=CC=CC=C2N=C1C1=CSC=N1","InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)","WJCNZQLZVWNLKY-UHFFFAOYSA-N"
"COC(=O)NC1=NC2=CC=CC=C2N1","InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)","TWFZGCMQGLPBSX-UHFFFAOYSA-N"
"O=C1NSC2=CC=CC=C12","InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)","DMSMPAJRVJJAGA-UHFFFAOYSA-N"
"CCNC1=NC(NC(C)(C)C)=NC(SC)=N1","InChI=1S/C10H19N5S/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15)","IROINLKCQGIITA-UHFFFAOYSA-N"
"CCCCCCCCN1SC=CC1=O","InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3","JPMIIZHYYWMHDT-UHFFFAOYSA-N"
"COC1=CC(O)=C(C=C1S(O)(=O)=O)C(=O)C1=CC=CC=C1","InChI=1S/C14H12O6S/c1-20-12-8-11(15)10(7-13(12)21(17,18)19)14(16)9-5-3-2-4-6-9/h2-8,15H,1H3,(H,17,18,19)","CXVGEDCSTKKODG-UHFFFAOYSA-N"
"CCCCNC(=O)OCC#CI","InChI=1S/C8H12INO2/c1-2-3-6-10-8(11)12-7-4-5-9/h2-3,6-7H2,1H3,(H,10,11)","WYVVKGNFXHOCQV-UHFFFAOYSA-N"
"CC1=CC=C(C=C1)S(N)(=O)=O","InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)","LMYRWZFENFIFIT-UHFFFAOYSA-N"
"CC(C)C1=NC(C)=CC(=O)N1","InChI=1S/C8H12N2O/c1-5(2)8-9-6(3)4-7(11)10-8/h4-5H,1-3H3,(H,9,10,11)","AJPIUNPJBFBUKK-UHFFFAOYSA-N"
"CN1SC(Cl)=CC1=O","InChI=1S/C4H4ClNOS/c1-6-4(7)2-3(5)8-6/h2H,1H3","DHNRXBZYEKSXIM-UHFFFAOYSA-N"
"CCC(C)OC(=O)N1CCCCC1CCO","InChI=1S/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3","QLHULAHOXSSASE-UHFFFAOYSA-N"
"OS(=O)(=O)C1=NC2=CC=CC=C2S1","InChI=1S/C7H5NO3S2/c9-13(10,11)7-8-5-3-1-2-4-6(5)12-7/h1-4H,(H,9,10,11)","ZCXGMSGCBDSEOY-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)C1=COC2=C(C=CC(O)=C2)C1=O","InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H","ZQSIJRDFPHDXIC-UHFFFAOYSA-N"
"CCCCCCCCN1SC(Cl)=C(Cl)C1=O","InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3","PORQOHRXAJJKGK-UHFFFAOYSA-N"
"CC[N+](CC)(CC(=O)NC1=C(C)C=CC=C1C)CC1=CC=CC=C1","InChI=1S/C21H28N2O/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4/h7-14H,5-6,15-16H2,1-4H3/p+1","ZFQMTVNLDNXRNQ-UHFFFAOYSA-O"
"C1CN(CCO1)C1=NC2=CC=CC=C2S1","InChI=1S/C11H12N2OS/c1-2-4-10-9(3-1)12-11(15-10)13-5-7-14-8-6-13/h1-4H,5-8H2","VVUVJGRVEYHIHC-UHFFFAOYSA-N"
"C1CN(CCO1)SC1=NC2=CC=CC=C2S1","InChI=1S/C11H12N2OS2/c1-2-4-10-9(3-1)12-11(15-10)16-13-5-7-14-8-6-13/h1-4H,5-8H2","MHKLKWCYGIBEQF-UHFFFAOYSA-N"
"C1CCC(CC1)NC1=NC2=CC=CC=C2S1","InChI=1S/C13H16N2S/c1-2-6-10(7-3-1)14-13-15-11-8-4-5-9-12(11)16-13/h4-5,8-10H,1-3,6-7H2,(H,14,15)","UPWPIFMHSFSVLE-UHFFFAOYSA-N"
"CC1=NC=CC2=C1NC1=C2C=CC=C1","InChI=1S/C12H10N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-7,14H,1H3","PSFDQSOCUJVVGF-UHFFFAOYSA-N"
"N1C2=C(C=CC=C2)C2=C1C=CN=C2","InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-7,13H","RDMFHRSPDKWERA-UHFFFAOYSA-N"
"N1C2=C(C=CC=C2)C2=C1N=CC=C2","InChI=1S/C11H8N2/c1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10/h1-7H,(H,12,13)","BPMFPOGUJAAYHL-UHFFFAOYSA-N"
"N1C2=C(C=CC=C2)C2=C1C=NC=C2","InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H","AIFRHYZBTHREPW-UHFFFAOYSA-N"
"COC1=CC2=C(C=C1)C1=C(N2)C(C)=NC=C1","InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3","BXNJHAXVSOCGBA-UHFFFAOYSA-N"
"P(SCC(NC)=O)(OC)(OC)=S","InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)","MCWXGJITAZMZEV-UHFFFAOYSA-N"
"CNC(=O)CSP(=S)(OC)OC","InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)","MCWXGJITAZMZEV-UHFFFAOYSA-N"
"Cc1cc(ccc1S(=O)C)OP(=S)(OC)OC","InChI=1S/C10H15O4PS2/c1-8-7-9(5-6-10(8)17(4)11)14-15(16,12-2)13-3/h5-7H,1-4H3","DLAPIMGBBDILHJ-UHFFFAOYSA-N"
"C1CC1Nc2nc(nc(n2)N)N","InChI=1S/C6H10N6/c7-4-10-5(8)12-6(11-4)9-3-1-2-3/h3H,1-2H2,(H5,7,8,9,10,11,12)","LVQDKIWDGQRHTE-UHFFFAOYSA-N"
"CN(C=NC1=C(C)C=C(C)C=C1)C=NC1=C(C)C=C(C)C=C1","InChI=1S/C19H23N3/c1-14-6-8-18(16(3)10-14)20-12-22(5)13-21-19-9-7-15(2)11-17(19)4/h6-13H,1-5H3","QXAITBQSYVNQDR-UHFFFAOYSA-N"
"C1CSC(=NC#N)N1CC2=CN=C(C=C2)Cl","InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2","HOKKPVIRMVDYPB-UHFFFAOYSA-N"
"ClC1=CC=C(CN2CCS\C2=N\C#N)C=N1","InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2/b14-10+","HOKKPVIRMVDYPB-GXDHUFHOSA-N"
"CNC(=O)CSP(=O)(OC)OC","InChI=1S/C5H12NO4PS/c1-6-5(7)4-12-11(8,9-2)10-3/h4H2,1-3H3,(H,6,7)","PZXOQEXFMJCDPG-UHFFFAOYSA-N"
"[O-][N+](=O)NC1=NCCN1CC1=CN=C(Cl)C=C1","InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)","YWTYJOPNNQFBPC-UHFFFAOYSA-N"
"CCNC1=NC(NC(C)C)=NC(Cl)=N1","InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)","MXWJVTOOROXGIU-UHFFFAOYSA-N"
"CC(=O)NP(=O)(OC)SC","InChI=1S/C4H10NO3PS/c1-4(6)5-9(7,8-2)10-3/h1-3H3,(H,5,6,7)","YASYVMFAVPKPKE-UHFFFAOYSA-N"
"CCOP(=S)(OCC)OC1=NC(=NC(C)=C1)C(C)C","InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3","FHIVAFMUCKRCQO-UHFFFAOYSA-N"
"CSC1=NN=C(C(=O)N1N)C(C)(C)C","InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3","FOXFZRUHNHCZPX-UHFFFAOYSA-N"
"C/C(=C\C(=N\C)\O)/OP(=O)(OC)OC","InChI=1S/C7H14NO5P/c1-6(5-7(9)8-2)13-14(10,11-3)12-4/h5H,1-4H3,(H,8,9)/b6-5+","KRTSDMXIXPKRQR-AATRIKPKSA-N"
"CN(C)S(=O)(=O)N(SC(F)(Cl)Cl)C1=CC=CC=C1","InChI=1S/C9H11Cl2FN2O2S2/c1-13(2)18(15,16)14(17-9(10,11)12)8-6-4-3-5-7-8/h3-7H,1-2H3","WURGXGVFSMYFCG-UHFFFAOYSA-N"
"CCNC1=NC(NCC)=NC(Cl)=N1","InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)","ODCWYMIRDDJXKW-UHFFFAOYSA-N"
"COP(=S)(OC)OC1=CC(C)=C(SC)C=C1","InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3","PNVJTZOFSHSLTO-UHFFFAOYSA-N"
"COP(=S)(OC)OC1=CC=C(SC)C(C)=C1","InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3","PNVJTZOFSHSLTO-UHFFFAOYSA-N"
"CS(=O)(=O)C1=CC=C(C(=O)C2C(=O)CCCC2=O)C(=C1)[N+]([O-])=O","InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","KPUREKXXPHOJQT-UHFFFAOYSA-N"
"CCOCN(C(=O)CCl)C1=C(CC)C=CC=C1C","InChI=1S/C14H20ClNO2/c1-4-12-8-6-7-11(3)14(12)16(10-18-5-2)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3","VTNQPKFIQCLBDU-UHFFFAOYSA-N"
"CCOCN(C(=O)CCl)C1=C(C)C=CC=C1CC","InChI=1S/C14H20ClNO2/c1-4-12-8-6-7-11(3)14(12)16(10-18-5-2)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3","VTNQPKFIQCLBDU-UHFFFAOYSA-N"
"CCC1=CC=CC(CC)=C1N(COC)C(=O)CCl","InChI=1S/C14H20ClNO2/c1-4-11-7-6-8-12(5-2)14(11)16(10-18-3)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3","XCSGPAVHZFQHGE-UHFFFAOYSA-N"
"CO/C=C(\C1=CC=CC=C1OC2=NC=NC(=C2)OC3=CC=CC=C3C#N)/C(=O)OC","InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+","WFDXOXNFNRHQEC-GHRIWEEISA-N"
"c12c(C(N(C(C)C)S(N1)(=O)=O)=O)cccc2","InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3","ZOMSMJKLGFBRBS-UHFFFAOYSA-N"
"CCN(CC)C(=O)C1=CC(C)=CC=C1","InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3","MMOXZBCLCQITDF-UHFFFAOYSA-N"
"CCN(CC)C(=O)C1=CC=CC(C)=C1","InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3","MMOXZBCLCQITDF-UHFFFAOYSA-N"
"NC(=O)C1=C(Cl)C=CC=C1Cl","InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)","JHSPCUHPSIUQRB-UHFFFAOYSA-N"
"COCCN(C(=O)CCl)C1=C(C)C=CC=C1C","InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3","SCCDDNKJYDZXMM-UHFFFAOYSA-N"
"COCC(C)N(C(=O)CCl)C1=C(C)SC=C1C","InChI=1S/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3","JLYFCTQDENRSOL-UHFFFAOYSA-N"
"CN(C)C(=O)NC1=CC(Cl)=C(Cl)C=C1","InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","XMTQQYYKAHVGBJ-UHFFFAOYSA-N"
"c1c(cc(c(c1Cl)n2c(c(c(n2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F","InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2","ZOCSXAVNDGMNBV-UHFFFAOYSA-N"
"CC(C)C1=CC=C(NC(=O)N(C)C)C=C1","InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)","PUIYMUZLKQOUOZ-UHFFFAOYSA-N"
"CC1=CC=CC(C)=C1N(CN1C=CC=N1)C(=O)CCl","InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3","STEPQTYSZVCJPV-UHFFFAOYSA-N"
"CCC1=C(N(C(C)COC)C(=O)CCl)C(C)=CC=C1","InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3","WVQBLGZPHOPPFO-UHFFFAOYSA-N"
"CCC1=CC=CC(C)=C1N(C(C)COC)C(=O)CCl","InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3","WVQBLGZPHOPPFO-UHFFFAOYSA-N"
"CCN(CC)C(=O)C(C)OC1=C2C=CC=CC2=CC=C1","InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3","WXZVAROIGSFCFJ-UHFFFAOYSA-N"
"COC1=NC(NC(C)C)=NC(NC(C)C)=N1","InChI=1S/C10H19N5O/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)","ISEUFVQQFVOBCY-UHFFFAOYSA-N"
"CC(C)N(C(=O)CCl)C1=CC=CC=C1","InChI=1S/C11H14ClNO/c1-9(2)13(11(14)8-12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","MFOUDYKPLGXPGO-UHFFFAOYSA-N"
"CCNC1=NC(NC(C)(C)C)=NC(Cl)=N1","InChI=1S/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)","FZXISNSWEXTPMF-UHFFFAOYSA-N"
"CCNC1=NC(Cl)=NC(NC(C)(C)C)=N1","InChI=1S/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)","FZXISNSWEXTPMF-UHFFFAOYSA-N"
"COC(=O)C1=C(C=CS1)S(=O)(=O)NC(=O)NC1=NC(C)=NC(OC)=N1","InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)","AHTPATJNIAFOLR-UHFFFAOYSA-N"
"CO\N=C(/C(=O)OC)C1=C(CO\N=C(/C)C2=CC(=CC=C2)C(F)(F)F)C=CC=C1","InChI=1S/C20H19F3N2O4/c1-13(14-8-6-9-16(11-14)20(21,22)23)24-29-12-15-7-4-5-10-17(15)18(25-28-3)19(26)27-2/h4-11H,12H2,1-3H3/b24-13+,25-18-","ONCZDRURRATYFI-QTCHDTBASA-N"
"CO\N=C(\C(=O)OC)C1=C(CO\N=C(/C)C2=CC=CC(=C2)C(F)(F)F)C=CC=C1","InChI=1S/C20H19F3N2O4/c1-13(14-8-6-9-16(11-14)20(21,22)23)24-29-12-15-7-4-5-10-17(15)18(25-28-3)19(26)27-2/h4-11H,12H2,1-3H3/b24-13+,25-18+","ONCZDRURRATYFI-TVJDWZFNSA-N"
"CC/N=c\1/[nH]c(=N)nc([nH]1)Cl","InChI=1S/C5H8ClN5/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H3,7,8,9,10,11)","IVENSCMCQBJAKW-UHFFFAOYSA-N"
"CCOC(=O)NC1=CC=CC(OC(=O)NC2=CC=CC=C2)=C1","InChI=1S/C16H16N2O4/c1-2-21-15(19)18-13-9-6-10-14(11-13)22-16(20)17-12-7-4-3-5-8-12/h3-11H,2H2,1H3,(H,17,20)(H,18,19)","WZJZMXBKUWKXTQ-UHFFFAOYSA-N"
"COC(=O)NC1=CC=CC(OC(=O)NC2=CC(C)=CC=C2)=C1","InChI=1S/C16H16N2O4/c1-11-5-3-6-12(9-11)18-16(20)22-14-8-4-7-13(10-14)17-15(19)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)","IDOWTHOLJBTAFI-UHFFFAOYSA-N"
"CC(C)N(C(=O)COC1=NN=C(S1)C(F)(F)F)C1=CC=C(F)C=C1","InChI=1S/C14H13F4N3O2S/c1-8(2)21(10-5-3-9(15)4-6-10)11(22)7-23-13-20-19-12(24-13)14(16,17)18/h3-6,8H,7H2,1-2H3","IANUJLZYFUDJIH-UHFFFAOYSA-N"
"CN(C)C1CSSSC1","InChI=1S/C5H11NS3/c1-6(2)5-3-7-9-8-4-5/h5H,3-4H2,1-2H3","DNVLJEWNNDHELH-UHFFFAOYSA-N"
"CC1=CC(C)=C(NC=O)C=C1","InChI=1S/C9H11NO/c1-7-3-4-9(10-6-11)8(2)5-7/h3-6H,1-2H3,(H,10,11)","JOFDPSBOUCXJCC-UHFFFAOYSA-N"
"C=CCN(CC=C)C(=O)C(Cl)Cl","InChI=1S/C8H11Cl2NO/c1-3-5-11(6-4-2)8(12)7(9)10/h3-4,7H,1-2,5-6H2","YRMLFORXOOIJDR-UHFFFAOYSA-N"
"c1(nc(nc(n1)N)N)N","InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)","JDSHMPZPIAZGSV-UHFFFAOYSA-N"
"NC1=NC(N)=NC(N)=N1","InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)","JDSHMPZPIAZGSV-UHFFFAOYSA-N"
"CCC1=NN(C(=C1Cl)C(=O)NCC2=CC=C(C=C2)OC3=CC=C(C=C3)C)C","InChI=1S/C21H22ClN3O2/c1-4-18-19(22)20(25(3)24-18)21(26)23-13-15-7-11-17(12-8-15)27-16-9-5-14(2)6-10-16/h5-12H,4,13H2,1-3H3,(H,23,26)","WPALTCMYPARVNV-UHFFFAOYSA-N"
"CNC(=O)NC1=CC(Cl)=C(Cl)C=C1","InChI=1S/C8H8Cl2N2O/c1-11-8(13)12-5-2-3-6(9)7(10)4-5/h2-4H,1H3,(H2,11,12,13)","IDQHRQQSSQDLTR-UHFFFAOYSA-N"
"c1cc(c(cc1N)Cl)Cl","InChI=1S/C6H5Cl2N/c7-5-2-1-4(9)3-6(5)8/h1-3H,9H2","SDYWXFYBZPNOFX-UHFFFAOYSA-N"
"CSC1=NC(NC(C)(C)C)=NC(NC2CC2)=N1","InChI=1S/C11H19N5S/c1-11(2,3)16-9-13-8(12-7-5-6-7)14-10(15-9)17-4/h7H,5-6H2,1-4H3,(H2,12,13,14,15,16)","HDHLIWCXDDZUFH-UHFFFAOYSA-N"
"N1N=C2C=CC=CC2=N1","InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)","QRUDEWIWKLJBPS-UHFFFAOYSA-N"
"c12c(cc(C)cc2)nn[nH]1","InChI=1S/C7H7N3/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","LRUDIIUSNGCQKF-UHFFFAOYSA-N"
"Cc1cccc2c1[nH]nn2","InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","CMGDVUCDZOBDNL-UHFFFAOYSA-N"
"Cc1cc2c(cc1C)nn[nH]2","InChI=1S/C8H9N3/c1-5-3-7-8(4-6(5)2)10-11-9-7/h3-4H,1-2H3,(H,9,10,11)","MVPKIPGHRNIOPT-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)N=NN2Cl","InChI=1S/C6H4ClN3/c7-10-6-4-2-1-3-5(6)8-9-10/h1-4H","INOGLHRUEYDAHX-UHFFFAOYSA-N"
"c1ccc2c(c1)ncs2","InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H","IOJUPLGTWVMSFF-UHFFFAOYSA-N"
"c12c(scn1)cccc2","InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H","IOJUPLGTWVMSFF-UHFFFAOYSA-N"
"c1ccc2c(c1)nc(s2)N","InChI=1S/C7H6N2S/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H2,8,9)","UHGULLIUJBCTEF-UHFFFAOYSA-N"
"CSc1nc2ccccc2s1","InChI=1S/C8H7NS2/c1-10-8-9-6-4-2-3-5-7(6)11-8/h2-5H,1H3","UTBVIMLZIRIFFR-UHFFFAOYSA-N"
"c1ccc2c(c1)nc(s2)O","InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)","YEDUAINPPJYDJZ-UHFFFAOYSA-N"
"O=C1NC2=CC=CC=C2S1","InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)","YEDUAINPPJYDJZ-UHFFFAOYSA-N"
"C(CCC(=O)N(CCO)CCO)CC(=O)N(CCO)CCO","InChI=1S/C14H28N2O6/c17-9-5-15(6-10-18)13(21)3-1-2-4-14(22)16(7-11-19)8-12-20/h17-20H,1-12H2","OKRNLSUTBJUVKA-UHFFFAOYSA-N"
"CCCCCCCCCCCCOCCOCCOCCOCCO","InChI=1S/C20H42O5/c1-2-3-4-5-6-7-8-9-10-11-13-22-15-17-24-19-20-25-18-16-23-14-12-21/h21H,2-20H2,1H3","WPMWEFXCIYCJSA-UHFFFAOYSA-N"
"c1cc(cc(c1)S(=O)(=O)O)[N+](=O)[O-]","InChI=1S/C6H5NO5S/c8-7(9)5-2-1-3-6(4-5)13(10,11)12/h1-4H,(H,10,11,12)","ONMOULMPIIOVTQ-UHFFFAOYSA-N"
"c1cc(ccc1O)S(=O)(=O)O","InChI=1S/C6H6O4S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4,7H,(H,8,9,10)","FEPBITJSIHRMRT-UHFFFAOYSA-N"
"CCCN(CCC)CCC","InChI=1S/C9H21N/c1-4-7-10(8-5-2)9-6-3/h4-9H2,1-3H3","YFTHZRPMJXBUME-UHFFFAOYSA-N"
"NCCc(c1)ccc(O)c1","InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2","DZGWFCGJZKJUFP-UHFFFAOYSA-N"
"C(CCNC(=N)N)CN","InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)","QYPPJABKJHAVHS-UHFFFAOYSA-N"
"c1ccc(cc1)CCN","InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2","BHHGXPLMPWCGHP-UHFFFAOYSA-N"
"CCC(C)C(C(=O)O)N","InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)","AGPKZVBTJJNPAG-UHFFFAOYSA-N"
"c1c([nH]cn1)CCN","InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)","NTYJJOPFIAHURM-UHFFFAOYSA-N"
"c1ccc(cc1)/N=N/c2c3ccccc3ccc2O","InChI=1S/C16H12N2O/c19-15-11-10-12-6-4-5-9-14(12)16(15)18-17-13-7-2-1-3-8-13/h1-11,19H/b18-17+","MRQIXHXHHPWVIL-ISLYRVAYSA-N"
"c1ccc(cc1)/N=N\c2ccc(cc2)/N=N/c3c4ccccc4ccc3O","InChI=1S/C22H16N4O/c27-21-15-10-16-6-4-5-9-20(16)22(21)26-25-19-13-11-18(12-14-19)24-23-17-7-2-1-3-8-17/h1-15,27H/b24-23-,26-25+","FHNINJWBTRXEBC-HXEHWPEMSA-N"
"Cc1ccccc1/N=N/c2ccc(c(c2)C)/N=N/c3c4ccccc4ccc3O","InChI=1S/C24H20N4O/c1-16-7-3-6-10-21(16)26-25-19-12-13-22(17(2)15-19)27-28-24-20-9-5-4-8-18(20)11-14-23(24)29/h3-15,29H,1-2H3/b26-25+,28-27+","RCTGMCJBQGBLKT-PAMTUDGESA-N"
"CN(C)c1ccc(cc1)C(c2ccccc2)c3ccc(cc3)N(C)C","InChI=1S/C23H26N2/c1-24(2)21-14-10-19(11-15-21)23(18-8-6-5-7-9-18)20-12-16-22(17-13-20)25(3)4/h5-17,23H,1-4H3","WZKXBGJNNCGHIC-UHFFFAOYSA-N"
"C[C@H](C(=O)NC1C(SC1(C)C)(C)C)NC(=O)[C@H](CC(=O)O)N","InChI=1S/C14H25N3O4S/c1-7(16-11(21)8(15)6-9(18)19)10(20)17-12-13(2,3)22-14(12,4)5/h7-8,12H,6,15H2,1-5H3,(H,16,21)(H,17,20)(H,18,19)/t7-,8+/m1/s1","IVBOUFAWPCPFTQ-SFYZADRCSA-N"
"COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)O)N","InChI=1S/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m0/s1","IAOZJIPTCAWIRG-QWRGUYRKSA-N"
"CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4","InChI=1S/C21H24O4/c1-21(2,15-3-7-17(8-4-15)22-11-19-13-24-19)16-5-9-18(10-6-16)23-12-20-14-25-20/h3-10,19-20H,11-14H2,1-2H3","LCFVJGUPQDGYKZ-UHFFFAOYSA-N"
"CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC(CCl)O","InChI=1S/C21H25ClO4/c1-21(2,15-3-7-18(8-4-15)24-12-17(23)11-22)16-5-9-19(10-6-16)25-13-20-14-26-20/h3-10,17,20,23H,11-14H2,1-2H3","HLLOKZYCSSQYEB-UHFFFAOYSA-N"
"CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC(CO)O","InChI=1S/C21H26O5/c1-21(2,15-3-7-18(8-4-15)24-12-17(23)11-22)16-5-9-19(10-6-16)25-13-20-14-26-20/h3-10,17,20,22-23H,11-14H2,1-2H3","NBLIPZBCGXIEFO-UHFFFAOYSA-N"
"CC(C)(C1=CC=C(C=C1)OCC(CCl)O)C2=CC=C(C=C2)OCC(CCl)O","InChI=1S/C21H26Cl2O4/c1-21(2,15-3-7-19(8-4-15)26-13-17(24)11-22)16-5-9-20(10-6-16)27-14-18(25)12-23/h3-10,17-18,24-25H,11-14H2,1-2H3","PTCFDJRJOGPUFE-UHFFFAOYSA-N"
"C1CC2=C3C1=CC=CC3=CC=C2","InChI=1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2","CWRYPZZKDGJXCA-UHFFFAOYSA-N"
"ClC(Cl)=C(C1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1","InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H","UCNVFOCBFJOQAL-UHFFFAOYSA-N"
"C1=CC2=C3C1=CC=CC3=CC=C2","InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H","HXGDTGSAIMULJN-UHFFFAOYSA-N"
"C1=CC2=CC3=C(C=CC=C3)C=C2C=C1","InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H","MWPLVEDNUUSJAV-UHFFFAOYSA-N"
"C1=CC2=C(C=C1)C=C1C(C=CC3=C1C=CC=C3)=C2","InChI=1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H","DXBHBZVCASKNBY-UHFFFAOYSA-N"
"C1=CC2=CC3=CC=C4C=CC=C5C=CC(=C2C=C1)C3=C45","InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H","FMMWHPNWAFZXNH-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C1=CC=CC3=C4C=CC=CC4=CC2=C13","InChI=1S/C20H12/c1-2-7-14-13(6-1)12-19-16-9-4-3-8-15(16)18-11-5-10-17(14)20(18)19/h1-12H","FTOVXSOBNPWTSH-UHFFFAOYSA-N"
"C1=CC2=CC3=C(C=C2C=C1)C1=C2C3=CC=CC2=CC=C1","InChI=1S/C20H12/c1-2-6-15-12-19-17-10-4-8-13-7-3-9-16(20(13)17)18(19)11-14(15)5-1/h1-12H","HAXBIWFMXWRORI-UHFFFAOYSA-N"
"C1=CC2=C(C=C1)C1=C(C=C2)C2=C(C=CC=C2)C=C1","InChI=1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H","WDECIBYCCFPHNR-UHFFFAOYSA-N"
"ClC1=C(Cl)[C@]2(Cl)[C@@H]3[C@@H]4C[C@@H]([C@H]5O[C@@H]45)[C@@H]3[C@@]1(Cl)C2(Cl)Cl","InChI=1S/C12H8Cl6O/c13-8-9(14)11(16)5-3-1-2(6-7(3)19-6)4(5)10(8,15)12(11,17)18/h2-7H,1H2/t2-,3+,4+,5-,6-,7+,10+,11-","DFBKLUNHFCTMDC-PICURKEMSA-N"
"ClC1=C(Cl)C2(Cl)C3COS(=O)(=O)OCC3C1(Cl)C2(Cl)Cl","InChI=1S/C9H6Cl6O4S/c10-5-6(11)8(13)4-2-19-20(16,17)18-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2","AAPVQEMYVNZIOO-UHFFFAOYSA-N"
"C1=CC2=C(C=C1)C1=C3C2=CC=CC3=CC=C1","InChI=1S/C16H10/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14/h1-10H","GVEPBJHOBDJJJI-UHFFFAOYSA-N"
"C1C2=C(C=CC=C2)C2=C1C=CC=C2","InChI=1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2","NIHNNTQXNPWCJQ-UHFFFAOYSA-N"
"ClC1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl","InChI=1S/C6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9","CKAPSXZOOQJIBF-UHFFFAOYSA-N"
"C1=CC2=CC=CC=C2C=C1","InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H","UFWIBTONFRDIAS-UHFFFAOYSA-N"
"ClC1=CC(=C(Cl)C=C1)C1=C(Cl)C=C(Cl)C(Cl)=C1","InChI=1S/C12H5Cl5/c13-6-1-2-9(14)7(3-6)8-4-11(16)12(17)5-10(8)15/h1-5H","LAHWLEDBADHJGA-UHFFFAOYSA-N"
"ClC1=CC(Cl)=C(C=C1Cl)C1=C(Cl)C(Cl)=C(Cl)C=C1","InChI=1S/C12H4Cl6/c13-7-2-1-5(11(17)12(7)18)6-3-9(15)10(16)4-8(6)14/h1-4H","RPUMZMSNLZHIGZ-UHFFFAOYSA-N"
"ClC1=CC(Cl)=C(C=C1Cl)C1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1","InChI=1S/C12H3Cl7/c13-6-3-8(15)7(14)1-4(6)5-2-9(16)11(18)12(19)10(5)17/h1-3H","WBHQEUPUMONIKF-UHFFFAOYSA-N"
"ClC1=C(Cl)C(Cl)=C(C(Cl)=C1Cl)C1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1Cl","InChI=1S/C12Cl10/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16","ONXPZLFXDMAPRO-UHFFFAOYSA-N"
"ClC1=CC=C(C=C1)C1=C(Cl)C=C(Cl)C=C1","InChI=1S/C12H7Cl3/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11)15/h1-7H","BZTYNSQSZHARAZ-UHFFFAOYSA-N"
"ClC1=CC(=C(Cl)C=C1)C1=C(Cl)C=CC(Cl)=C1","InChI=1S/C12H6Cl4/c13-7-1-3-11(15)9(5-7)10-6-8(14)2-4-12(10)16/h1-6H","HCWZEPKLWVAEOV-UHFFFAOYSA-N"
"C1=CC2=C(C=C1)C1=C(C=CC=C1)C=C2","InChI=1S/C14H10/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-10H","YNPNZTXNASCQKK-UHFFFAOYSA-N"
"C1=CC2=C3C(C=CC4=CC=CC(C=C2)=C34)=C1","InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H","BBEAQIROQSPTKN-UHFFFAOYSA-N"
"C(C(C(=O)O)(F)F)(OC(C(C(OC(F)(F)F)(F)F)(F)F)(F)F)F","InChI=1S/C7H2F12O4/c8-1(3(9,10)2(20)21)22-5(13,14)4(11,12)6(15,16)23-7(17,18)19/h1H,(H,20,21)","AFDRCEOKCOUICI-UHFFFAOYSA-N"
"OS(=O)(=O)C(F)(F)C(F)(F)OC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)Cl","InChI=1S/C8HClF16O4S/c9-5(18,19)3(14,15)1(10,11)2(12,13)4(16,17)6(20,21)29-7(22,23)8(24,25)30(26,27)28/h(H,26,27,28)","GGOUUEMCWBTDMT-UHFFFAOYSA-N"
"C(C(C(C(C(F)(F)S(=O)(=O)N)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F","InChI=1S/C8H2F17NO2S/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)29(26,27)28/h(H2,26,27,28)","RRRXPPIDPYTNJG-UHFFFAOYSA-N"
"CN(CC(=O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F","InChI=1S/C11H6F17NO4S/c1-29(2-3(30)31)34(32,33)11(27,28)9(22,23)7(18,19)5(14,15)4(12,13)6(16,17)8(20,21)10(24,25)26/h2H2,1H3,(H,30,31)","QNDHIRFIMVNHBN-UHFFFAOYSA-N"
"CCN(CC(=O)O)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F","InChI=1S/C12H8F17NO4S/c1-2-30(3-4(31)32)35(33,34)12(28,29)10(23,24)8(19,20)6(15,16)5(13,14)7(17,18)9(21,22)11(25,26)27/h2-3H2,1H3,(H,31,32)","CKRXVVGETMYFIO-UHFFFAOYSA-N"
"CC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)S(O)(=O)=O","InChI=1S/C6H5F9O3S/c1-2(7)3(8,9)4(10,11)5(12,13)6(14,15)19(16,17)18/h2H,1H3,(H,16,17,18)","OYEMCXOSIPKXPY-UHFFFAOYSA-N"
"C(CS(=O)(=O)O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F","InChI=1S/C8H5F13O3S/c9-3(10,1-2-25(22,23)24)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1-2H2,(H,22,23,24)","VIONGDJUYAYOPU-UHFFFAOYSA-N"
"C(CS(=O)(=O)O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F","InChI=1S/C10H5F17O3S/c11-3(12,1-2-31(28,29)30)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2,(H,28,29,30)","ALVYVCQIFHTIRD-UHFFFAOYSA-N"
"C(=O)(C(C(C(F)(F)F)(F)F)(F)F)O","InChI=1S/C4HF7O2/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H,12,13)","YPJUNDFVDDCYIH-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C5HF9O2/c6-2(7,1(15)16)3(8,9)4(10,11)5(12,13)14/h(H,15,16)","CXZGQIAOTKWCDB-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C6HF11O2/c7-2(8,1(18)19)3(9,10)4(11,12)5(13,14)6(15,16)17/h(H,18,19)","PXUULQAPEKKVAH-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22)","ZWBAMYVPMDSJGQ-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C8HF15O2/c9-2(10,1(24)25)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h(H,24,25)","SNGREZUHAYWORS-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C9HF17O2/c10-2(11,1(27)28)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)26/h(H,27,28)","UZUFPBIDKMEQEQ-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C10HF19O2/c11-2(12,1(30)31)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)29/h(H,30,31)","PCIUEQPBYFRTEM-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C11HF21O2/c12-2(13,1(33)34)3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)11(30,31)32/h(H,33,34)","SIDINRCMMRKXGQ-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C12HF23O2/c13-2(14,1(36)37)3(15,16)4(17,18)5(19,20)6(21,22)7(23,24)8(25,26)9(27,28)10(29,30)11(31,32)12(33,34)35/h(H,36,37)","CXGONMQFMIYUJR-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C13HF25O2/c14-2(15,1(39)40)3(16,17)4(18,19)5(20,21)6(22,23)7(24,25)8(26,27)9(28,29)10(30,31)11(32,33)12(34,35)13(36,37)38/h(H,39,40)","LVDGGZAZAYHXEY-UHFFFAOYSA-N"
"C(=O)(C(C(C(C(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O","InChI=1S/C14HF27O2/c15-2(16,1(42)43)3(17,18)4(19,20)5(21,22)6(23,24)7(25,26)8(27,28)9(29,30)10(31,32)11(33,34)12(35,36)13(37,38)14(39,40)41/h(H,42,43)","RUDINRUXCKIXAJ-UHFFFAOYSA-N"
"C(C(C(F)(F)S(=O)(=O)O)(F)F)(C(F)(F)F)(F)F","InChI=1S/C4HF9O3S/c5-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h(H,14,15,16)","JGTNAGYHADQMCM-UHFFFAOYSA-N"
"C(C(C(F)(F)F)(F)F)(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F","InChI=1S/C5HF11O3S/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)20(17,18)19/h(H,17,18,19)","ACEKLXZRZOWKRY-UHFFFAOYSA-N"
"C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F","InChI=1S/C6HF13O3S/c7-1(8,3(11,12)5(15,16)17)2(9,10)4(13,14)6(18,19)23(20,21)22/h(H,20,21,22)","QZHDEAJFRJCDMF-UHFFFAOYSA-N"
"C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F","InChI=1S/C7HF15O3S/c8-1(9,2(10,11)4(14,15)6(18,19)20)3(12,13)5(16,17)7(21,22)26(23,24)25/h(H,23,24,25)","OYGQVDSRYXATEL-UHFFFAOYSA-N"
"C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F","InChI=1S/C8HF17O3S/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)29(26,27)28/h(H,26,27,28)","YFSUTJLHUFNCNZ-UHFFFAOYSA-N"
"OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C9HF19O3S/c10-1(11,2(12,13)4(16,17)6(20,21)8(24,25)26)3(14,15)5(18,19)7(22,23)9(27,28)32(29,30)31/h(H,29,30,31)","MNEXVZFQQPKDHC-UHFFFAOYSA-N"
"C(C(C(C(C(C(F)(F)S(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F","InChI=1S/C10HF21O3S/c11-1(12,3(15,16)5(19,20)7(23,24)9(27,28)29)2(13,14)4(17,18)6(21,22)8(25,26)10(30,31)35(32,33)34/h(H,32,33,34)","HYWZIAVPBSTISZ-UHFFFAOYSA-N"
"COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C5C=COC5OC4=C1","InChI=1S/C17H12O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h4-6,8,17H,2-3H2,1H3","OQIQSTLJSLGHID-UHFFFAOYSA-N"
"COC1=C2C3=C(C(=O)CC3)C(=O)OC2=C4C5CCOC5OC4=C1","InChI=1S/C17H14O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h6,8,17H,2-5H2,1H3","WWSYXEZEXMQWHT-UHFFFAOYSA-N"
"COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4C5C=COC5OC4=C1","InChI=1S/C17H12O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h3,5-6,8,17H,2,4H2,1H3","XWIYFDMXXLINPU-UHFFFAOYSA-N"
"COC1=C2C3=C(C(=O)OCC3)C(=O)OC2=C4C5CCOC5OC4=C1","InChI=1S/C17H14O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h6,8,17H,2-5H2,1H3","WPCVRWVBBXIRMA-UHFFFAOYSA-N"
"CC1CC2=C(C=C(C(=C2C(=O)O1)O)C(=O)NC(CC3=CC=CC=C3)C(=O)O)Cl","InChI=1S/C20H18ClNO6/c1-10-7-12-14(21)9-13(17(23)16(12)20(27)28-10)18(24)22-15(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,15,23H,7-8H2,1H3,(H,22,24)(H,25,26)","RWQKHEORZBHNRI-UHFFFAOYSA-N"
"CC1=CC2C(C(C1=O)O)(C3(CC(C(C34CO4)O2)O)C)CO","InChI=1S/C15H20O6/c1-7-3-9-14(5-16,11(19)10(7)18)13(2)4-8(17)12(21-9)15(13)6-20-15/h3,8-9,11-12,16-17,19H,4-6H2,1-2H3","LINOMUASTDIRTM-UHFFFAOYSA-N"
"CCCCC(C)C(C(CC(C)CC(CCCCC(CC(C(C)N)O)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O","InChI=1S/C34H59NO15/c1-5-6-9-20(3)32(50-31(44)17-23(34(47)48)15-29(41)42)27(49-30(43)16-22(33(45)46)14-28(39)40)13-19(2)12-24(36)10-7-8-11-25(37)18-26(38)21(4)35/h19-27,32,36-38H,5-18,35H2,1-4H3,(H,39,40)(H,41,42)(H,45,46)(H,47,48)","UVBUBMSSQKOIBE-UHFFFAOYSA-N"
"CCCCC(C)C(C(CC(C)CCCCCCC(CC(C(C)N)O)O)OC(=O)CC(CC(=O)O)C(=O)O)OC(=O)CC(CC(=O)O)C(=O)O","InChI=1S/C34H59NO14/c1-5-6-12-21(3)32(49-31(43)18-24(34(46)47)16-29(40)41)27(48-30(42)17-23(33(44)45)15-28(38)39)14-20(2)11-9-7-8-10-13-25(36)19-26(37)22(4)35/h20-27,32,36-37H,5-19,35H2,1-4H3,(H,38,39)(H,40,41)(H,44,45)(H,46,47)","UXDPXZQHTDAXOZ-UHFFFAOYSA-N"
"CC1CCCC(=O)CCCC=CC2=C(C(=CC(=C2)O)O)C(=O)O1","InChI=1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3","MBMQEIFVQACCCH-UHFFFAOYSA-N"
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"CC(CCC(=O)O)C1CCC2C1(CCC3C2CCC4C3(CCC(=O)C4)C)C","InChI=1S/C24H38O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-16,18-21H,4-14H2,1-3H3,(H,26,27)","KIQFUORWRVZTHT-UHFFFAOYSA-N"
"CC(CCC(=O)O)C1CCC2C1(CCC3C2CC(=O)C4C3(CCC(C4)O)C)C","InChI=1S/C24H38O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-20,25H,4-13H2,1-3H3,(H,27,28)","JWZBXKZZDYMDCJ-UHFFFAOYSA-N"
"C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]1(C)CC[C@@H](O)C[C@H]1CC3=O","InChI=1S/C24H38O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-19,22,25H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,22+,23+,24-/m1/s1","DXOCDBGWDZAYRQ-AURDAFMXSA-N"
"C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(C(=O)C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C","InChI=1S/C24H38O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-20,25H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,20+,23+,24-/m1/s1","CVNYHSDFZXHMMJ-VPUMZWJWSA-N"
"CC(CCC(=O)NCC(=O)O)C1CCC2C1(CCC3C2CC(C4C3(CCC(C4)O)C)O)C","InChI=1S/C26H43NO5/c1-15(4-7-23(30)27-14-24(31)32)18-5-6-19-17-13-22(29)21-12-16(28)8-10-26(21,3)20(17)9-11-25(18,19)2/h15-22,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)","SPOIYSFQOFYOFZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)O","InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)","TUNFSRHWOTWDNC-UHFFFAOYSA-N"
"CC(CCC(O)=O)O[C@@H]1OC(C)[C@@H](CC1O)OC(=O)CCC(=O)NCCC1=CC=C(O)C=C1","InChI=1S/C23H33NO9/c1-14(3-9-21(28)29)31-23-18(26)13-19(15(2)32-23)33-22(30)10-8-20(27)24-12-11-16-4-6-17(25)7-5-16/h4-7,14-15,18-19,23,25-26H,3,8-13H2,1-2H3,(H,24,27)(H,28,29)/t14?,15?,18?,19-,23-/m1/s1","VQYVTRPNVGUOGV-WLAKMJJWSA-N"
"CC(CCC(O)=O)O[C@@H]1OC(C)[C@@H](CC1O)OC(=O)CCC(=O)NC[C@H](O)C1=CC=C(O)C=C1","InChI=1S/C23H33NO10/c1-13(3-9-21(29)30)32-23-17(26)11-19(14(2)33-23)34-22(31)10-8-20(28)24-12-18(27)15-4-6-16(25)7-5-15/h4-7,13-14,17-19,23,25-27H,3,8-12H2,1-2H3,(H,24,28)(H,29,30)/t13?,14?,17?,18-,19+,23+/m0/s1","YHQWACJRIRKIAL-QYURMBASSA-N"
"CC(C[C@H](O)CCCC[C@@H](O)CC(O)=O)O[C@@H]1OC(C)[C@H](O)CC1O","InChI=1S/C17H32O8/c1-10(24-17-15(21)9-14(20)11(2)25-17)7-12(18)5-3-4-6-13(19)8-16(22)23/h10-15,17-21H,3-9H2,1-2H3,(H,22,23)/t10?,11?,12-,13-,14-,15?,17-/m1/s1","KOPWGKUEIMDQOP-YSEGPLCXSA-N"
"C[C@H](CCCCC(O)=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O","InChI=1S/C13H24O6/c1-8(5-3-4-6-12(16)17)18-13-11(15)7-10(14)9(2)19-13/h8-11,13-15H,3-7H2,1-2H3,(H,16,17)/t8-,9+,10-,11-,13-/m1/s1","KBTQMAFDKPKMEJ-UYNYGYNWSA-N"
"C[C@H](CC\C=C\C(O)=O)O[C@@H]1O[C@@H](C)[C@H](O)C[C@H]1O","InChI=1S/C13H22O6/c1-8(5-3-4-6-12(16)17)18-13-11(15)7-10(14)9(2)19-13/h4,6,8-11,13-15H,3,5,7H2,1-2H3,(H,16,17)/b6-4+/t8-,9+,10-,11-,13-/m1/s1","GGHOMCWJOMBZEK-LHYQPRBASA-N"
"CC(CCCCCC\C=C\C(O)=O)OC1OC(C)C(O)CC1O","InChI=1S/C17H30O6/c1-12(9-7-5-3-4-6-8-10-16(20)21)22-17-15(19)11-14(18)13(2)23-17/h8,10,12-15,17-19H,3-7,9,11H2,1-2H3,(H,20,21)/b10-8+","NEVPBIQTDNVVMK-CSKARUKUSA-N"
"C[C@H](CCCC(C)C(O)=O)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C","InChI=1S/C27H42O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h16-18,21-24H,5-15H2,1-4H3,(H,29,30)/t17-,18?,21+,22-,23+,24+,26+,27-/m1/s1","PSXQJZDFWDKBIP-NNWQCNCGSA-N"
"C[C@H](CCCC(C)C(O)=O)[C@H]1CC[C@H]2C3=CC[C@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C","InChI=1S/C27H42O3/c1-17(6-5-7-18(2)25(29)30)22-10-11-23-21-9-8-19-16-20(28)12-14-26(19,3)24(21)13-15-27(22,23)4/h9,17-19,22-24H,5-8,10-16H2,1-4H3,(H,29,30)/t17-,18?,19+,22-,23+,24+,26+,27-/m1/s1","SQTAVUCHOVVOFD-GAMFLDECSA-N"
"NC1=C2N=CN([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)C2=NC=N1","InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1","OIRDTQYFTABQOQ-KQYNXXCUSA-N"
"OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C(O)N=CN=C12","InChI=1S/C10H12N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)/t4-,6-,7-,10-/m1/s1","UGQMRVRMYYASKQ-KQYNXXCUSA-N"
"Cc1ccc(cc1)/C=C/C(=O)O","InChI=1S/C10H10O2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-6+","RURHILYUWQEGOS-VOTSOKGWSA-N"
"CC(=O)Oc1ccccc1C(=O)O","InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)","BSYNRYMUTXBXSQ-UHFFFAOYSA-N"
"O[C@@H]1C=CC(=C[C@H]1OC(=C)C(O)=O)C(O)=O","InChI=1S/C10H10O6/c1-5(9(12)13)16-8-4-6(10(14)15)2-3-7(8)11/h2-4,7-8,11H,1H2,(H,12,13)(H,14,15)/t7-,8-/m1/s1","WTFXTQVDAKGDEY-HTQZYQBOSA-N"
"NC1=CC=CC=C1C(O)=O","InChI=1S/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10)","RWZYAGGXGHYGMB-UHFFFAOYSA-N"
"OC(=O)CC1=CC(O)=CC=C1O","InChI=1S/C8H8O4/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)","IGMNYECMUMZDDF-UHFFFAOYSA-N"
"OC(=O)C1=CC=C(O)C=C1","InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)","FJKROLUGYXJWQN-UHFFFAOYSA-N"
"OC1=CC=CC=C1O","InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H","YCIMNLLNPGFGHC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OCC(O)COP([O-])(=O)OCC[N+](C)(C)C","InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3","ASWBNKHCZGQVJV-UHFFFAOYSA-N"
"CN1C=NC2=C1C(=O)NC(=O)N2C","InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)","YAPQBXQYLJRXSA-UHFFFAOYSA-N"
"CC(C)(CO)C(O)C(=O)NCCC(O)=O","InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)","GHOKWGTUZJEAQD-UHFFFAOYSA-N"
"OC1=CC(O)=C2C(OC(=C(O)C2=O)C2=CC=C(O)C(O)=C2)=C1","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"O=C1NC2=C(NC=N2)C(=O)N1","InChI=1S/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)","LRFVTYWOQMYALW-UHFFFAOYSA-N"
"OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1C=NC2=C1NC(=O)NC2=O","InChI=1S/C10H12N4O6/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19)/t3-,5-,6-,9-/m1/s1","UBORTCNDUKBEOP-UUOKFMHZSA-N"
"NC1=C2N=CN([C@H]3O[C@@H]4CO[P@](O)(=O)O[C@@H]4[C@@H]3O)C2=NC=N1","InChI=1S/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/t4-,6+,7+,10+/m1/s1","IVOMOUWHDPKRLL-ASCDQALMSA-N"
"OC(=O)c1ccccc1","InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)","WPYMKLBDIGXBTP-UHFFFAOYSA-N"
"Cc1cccc(c1)C(=O)NCC(O)=O","InChI=1S/C10H11NO3/c1-7-3-2-4-8(5-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)","YKAKNMHEIJUKEX-UHFFFAOYSA-N"
"OC(=O)CNC(=O)c1ccccc1","InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)","QIAFMBKCNZACKA-UHFFFAOYSA-N"
"Cc1cc2nc3c(nc(=O)[nH]c3=O)n(C[C@H](O)[C@H](O)[C@H](O)CO)c2cc1C","InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m0/s1","AUNGANRZJHBGPY-SCRDCRAPSA-N"
"C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)NC(=N3)N","InChI=1S/C19H19N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)/t12-/m0/s1","OVBPIULPVIDEAO-LBPRGKRZSA-N"
"CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C(=O)O)/C)/C","InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+","SHGAZHPCJJPHSC-YCNIQYBTSA-N"
"c12c([nH]c(n1)O)nc(nc2O)O","InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)","LEHOTFFKMJEONL-UHFFFAOYSA-N"
"[H]C(=O)\C=C(C)\C=C\C=C(C)\C=C\C1=C(C)CCCC1(C)C","InChI=1S/C20H28O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,15H,7,10,14H2,1-5H3/b9-6+,12-11+,16-8+,17-13+","NCYCYZXNIZJOKI-OVSJKPMPSA-N"
"CCCCC\C=C/C\C=C/C\C=C/CCCCC(O)=O","InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-","VZCCETWTMQHEPK-QNEBEIHSSA-N"
"N[C@@H](CSSC[C@H](N)C(O)=O)C(O)=O","InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m0/s1","LEVWYRKDKASIDU-IMJSIDKUSA-N"
"CC(=O)N[C@@H](C=O)[C@H](O)[C@@H](O)[C@@H](O)CO","InChI=1S/C8H15NO6/c1-4(12)9-5(2-10)7(14)8(15)6(13)3-11/h2,5-8,11,13-15H,3H2,1H3,(H,9,12)/t5-,6-,7-,8-/m0/s1","MBLBDJOUHNCFQT-XAMCCFCMSA-N"
"C(CSC[C@@H](C(=O)O)N)[C@@H](C(=O)O)N","InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1","ILRYLPWNYFXEMH-WHFBIAKZSA-N"
"CCCCCCCCCCCCC/C=C/[C@H]([C@H](CO)N)O","InChI=1S/C18H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h14-15,17-18,20-21H,2-13,16,19H2,1H3/b15-14+/t17-,18+/m0/s1","WWUZIQQURGPMPG-KRWOKUGFSA-N"
"CC1=C(C(=O)C(=C(C1=O)OC)OC)C/C=C(\C)/CCC=C(C)C","InChI=1S/C19H26O4/c1-12(2)8-7-9-13(3)10-11-15-14(4)16(20)18(22-5)19(23-6)17(15)21/h8,10H,7,9,11H2,1-6H3/b13-10+","SQQWBSBBCSFQGC-JLHYYAGUSA-N"
"OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O","InChI=1S/C12H22O11/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1","HDTRYLNUVZCQOY-LIZSDCNHSA-N"
"Oc1ccc(cc1)-c1cc(=O)c2c(O)cc(O)cc2o1","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H","KZNIFHPLKGYRTM-UHFFFAOYSA-N"
"CC(C)CC(O)=O","InChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)","GWYFCOCPABKNJV-UHFFFAOYSA-N"
"OC(=O)CCCCCCC(O)=O","InChI=1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12)","TYFQFVWCELRYAO-UHFFFAOYSA-N"
"CC(C)CCC(O)=O","InChI=1S/C6H12O2/c1-5(2)3-4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)","FGKJLKRYENPLQH-UHFFFAOYSA-N"
"OC(=O)Cc1ccccc1O","InChI=1S/C8H8O3/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4,9H,5H2,(H,10,11)","CCVYRRGZDBSHFU-UHFFFAOYSA-N"
"OC(=O)Cc1cccc(O)c1","InChI=1S/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)","FVMDYYGIDFPZAX-UHFFFAOYSA-N"
"CC(CCC(O)=O)CC(O)=O","InChI=1S/C7H12O4/c1-5(4-7(10)11)2-3-6(8)9/h5H,2-4H2,1H3,(H,8,9)(H,10,11)","SYEOWUNSTUDKGM-UHFFFAOYSA-N"
"OC(NC(=O)c1ccccc1)C(O)=O","InChI=1S/C9H9NO4/c11-7(10-8(12)9(13)14)6-4-2-1-3-5-6/h1-5,8,12H,(H,10,11)(H,13,14)","GCWCVCCEIQXUQU-UHFFFAOYSA-N"
"CC(=O)N[C@@H](CCCN)C(O)=O","InChI=1S/C7H14N2O3/c1-5(10)9-6(7(11)12)3-2-4-8/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1","JRLGPAXAGHMNOL-LURJTMIESA-N"
"OC(=O)CCCCC(S)CCS","InChI=1S/C8H16O2S2/c9-8(10)4-2-1-3-7(12)5-6-11/h7,11-12H,1-6H2,(H,9,10)","IZFHEQBZOYJLPK-UHFFFAOYSA-N"
"Cn1cnc2[nH]c(=O)[nH]c(=O)c12","InChI=1S/C6H6N4O2/c1-10-2-7-4-3(10)5(11)9-6(12)8-4/h2H,1H3,(H2,8,9,11,12)","PFWLFWPASULGAN-UHFFFAOYSA-N"
"CC(C)C[C@H](N)C(=O)NCC(=O)NCC(O)=O","InChI=1S/C10H19N3O4/c1-6(2)3-7(11)10(17)13-4-8(14)12-5-9(15)16/h6-7H,3-5,11H2,1-2H3,(H,12,14)(H,13,17)(H,15,16)/t7-/m0/s1","VWHGTYCRDRBSFI-ZETCQYMHSA-N"
"C[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(O)=O","InChI=1S/C12H16N2O3/c1-8(13)11(15)14-10(12(16)17)7-9-5-3-2-4-6-9/h2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17)/t8-,10-/m0/s1","OMNVYXHOSHNURL-WPRPVWTQSA-N"
"OC(=O)CC1=CNC2=C1C=CC=C2","InChI=1S/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)","SEOVTRFCIGRIMH-UHFFFAOYSA-N"
"O=C(O)\C=C\c1cc(O)c(O)cc1","InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+","QAIPRVGONGVQAS-DUXPYHPUSA-N"
"c1cc(ccc1/C=C/C(=O)O)O","InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+","NGSWKAQJJWESNS-ZZXKWVIFSA-N"
"c1ccc(c(c1)C(=O)O)O","InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)","YGSDEFSMJLZEOE-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1","OVSQVDMCBVZWGM-QSOFNFLRSA-N"
"OC[C@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O","InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1","JPUKWEQWGBDDQB-QSOFNFLRSA-N"
"COC1=CC(=CC(=C1O)OC)/C=C/C(=O)O","InChI=1S/C11H12O5/c1-15-8-5-7(3-4-10(12)13)6-9(16-2)11(8)14/h3-6,14H,1-2H3,(H,12,13)/b4-3+","PCMORTLOPMLEFB-ONEGZZNKSA-N"
"C1[C@H]([C@@H]([C@@H](C=C1C(=O)O)O)O)O","InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s1","JXOHGGNKMLTUBP-HSUXUTPPSA-N"
"Oc1ccc(cc1)C\3=C\Oc2cc(O)cc(O)c2C/3=O","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H","TZBJGXHYKVUXJN-UHFFFAOYSA-N"
"CCOC(=O)C1=CC(=C(C=C1)O)OC","InChI=1S/C10H12O4/c1-3-14-10(12)7-4-5-8(11)9(6-7)13-2/h4-6,11H,3H2,1-2H3","MWAYRGBWOVHDDZ-UHFFFAOYSA-N"
"Oc1ccc(cc1O)[C@H]3Oc2cc(O)cc(O)c2C[C@@H]3O","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1","PFTAWBLQPZVEMU-DZGCQCFKSA-N"
"C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O","InChI=1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21-/m1/s1","WMBWREPUVVBILR-WIYYLYMNSA-N"
"O=C\1c3c(O/C=C/1c2ccc(O)cc2)cc(O)cc3","InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H","ZQSIJRDFPHDXIC-UHFFFAOYSA-N"
"O=C(O)Cc1cc(OC)c(O)cc1","InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12)","QRMZSPFSDQBLIX-UHFFFAOYSA-N"
"O=C(O)\C=C\c1ccccc1","InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+","WBYWAXJHAXSJNI-VOTSOKGWSA-N"
"C[n+]1c2ccccc2nc3c1cccc3[O-]","InChI=1S/C13H10N2O/c1-15-10-6-3-2-5-9(10)14-13-11(15)7-4-8-12(13)16/h2-8H,1H3","YNCMLFHHXWETLD-UHFFFAOYSA-N"
"c1ccc2c(c1)nc3ccc(cc3n2)O","InChI=1S/C12H8N2O/c15-8-5-6-11-12(7-8)14-10-4-2-1-3-9(10)13-11/h1-7,15H","RETSEGNZNUBJRB-UHFFFAOYSA-N"
"c1ccc2c(c1)nc3cccc(c3n2)O","InChI=1S/C12H8N2O/c15-11-7-3-6-10-12(11)14-9-5-2-1-4-8(9)13-10/h1-7,15H","SVRNCBGWUMMBQB-UHFFFAOYSA-N"
"c1cc(c2c(c1)nc3c(cccc3n2)C(=O)O)C(=O)O","InChI=1S/C14H8N2O4/c17-13(18)7-3-1-5-9-11(7)16-10-6-2-4-8(14(19)20)12(10)15-9/h1-6H,(H,17,18)(H,19,20)","MJALVONLCNWZHK-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)NC3=C(C(=O)C=CC3=N2)C(=O)O","InChI=1S/C13H8N2O3/c16-10-6-5-9-12(11(10)13(17)18)15-8-4-2-1-3-7(8)14-9/h1-6,15H,(H,17,18)","GVQIFYBFFGQRGS-UHFFFAOYSA-N"
"c1ccc2c(c1)nc3cccc(c3n2)C(=O)O","InChI=1S/C13H8N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7H,(H,16,17)","JGCSKOVQDXEQHI-UHFFFAOYSA-N"
"c1ccc2c(c1)nc3ccccc3n2","InChI=1S/C12H8N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8H","PCNDJXKNXGMECE-UHFFFAOYSA-N"
"O=C(OC)c1ccccc1C(=O)OC","InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3","NIQCNGHVCWTJSM-UHFFFAOYSA-N"
"CC(C)OC(=O)c1ccccc1C(=O)OC(C)C","InChI=1S/C14H18O4/c1-9(2)17-13(15)11-7-5-6-8-12(11)14(16)18-10(3)4/h5-10H,1-4H3","QWDBCIAVABMJPP-UHFFFAOYSA-N"
"CCCOC(=O)c1ccccc1C(=O)OCCC","InChI=1S/C14H18O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3","MQHNKCZKNAJROC-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC","InChI=1S/C24H38O4/c1-3-5-7-9-11-15-19-27-23(25)21-17-13-14-18-22(21)24(26)28-20-16-12-10-8-6-4-2/h13-14,17-18H,3-12,15-16,19-20H2,1-2H3","MQIUGAXCHLFZKX-UHFFFAOYSA-N"
"CCCCOC(=O)c1ccccc1C(=O)OCCCC","InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3","DOIRQSBPFJWKBE-UHFFFAOYSA-N"
"CCOC(=O)c1ccccc1C(=O)OCC","InChI=1S/C12H14O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h5-8H,3-4H2,1-2H3","FLKPEMZONWLCSK-UHFFFAOYSA-N"
"CCCC(=O)NC1CCOC1=O","InChI=1S/C8H13NO3/c1-2-3-7(10)9-6-4-5-12-8(6)11/h6H,2-5H2,1H3,(H,9,10)","VFFNZZXXTGXBOG-UHFFFAOYSA-N"
"CCCCCC(=O)NC1CCOC1=O","InChI=1S/C10H17NO3/c1-2-3-4-5-9(12)11-8-6-7-14-10(8)13/h8H,2-7H2,1H3,(H,11,12)","ZJFKKPDLNLCPNP-UHFFFAOYSA-N"
"CCCCCCCC(=O)NC1CCOC1=O","InChI=1S/C12H21NO3/c1-2-3-4-5-6-7-11(14)13-10-8-9-16-12(10)15/h10H,2-9H2,1H3,(H,13,14)","JKEJEOJPJVRHMQ-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)NC1CCOC1=O","InChI=1S/C14H25NO3/c1-2-3-4-5-6-7-8-9-13(16)15-12-10-11-18-14(12)17/h12H,2-11H2,1H3,(H,15,16)","TZWZKDULKILUPV-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)NC1CCOC1=O","InChI=1S/C16H29NO3/c1-2-3-4-5-6-7-8-9-10-11-15(18)17-14-12-13-20-16(14)19/h14H,2-13H2,1H3,(H,17,18)","WILLZMOKUUPJSL-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)NC1CCOC1=O","InChI=1S/C18H33NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(20)19-16-14-15-22-18(16)21/h16H,2-15H2,1H3,(H,19,20)","ZQAYHOXXVBVXPZ-UHFFFAOYSA-N"
"CC(=O)CC(=O)NC1CCOC1=O","InChI=1S/C8H11NO4/c1-5(10)4-7(11)9-6-2-3-13-8(6)12/h6H,2-4H2,1H3,(H,9,11)","FIHPLICEAUNEFV-UHFFFAOYSA-N"
"CCCC(=O)CC(=O)NC1CCOC1=O","InChI=1S/C10H15NO4/c1-2-3-7(12)6-9(13)11-8-4-5-15-10(8)14/h8H,2-6H2,1H3,(H,11,13)","YRYOXRMDHALAFL-UHFFFAOYSA-N"
"CCCCCC(=O)CC(=O)NC1CCOC1=O","InChI=1S/C12H19NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h10H,2-8H2,1H3,(H,13,15)","FXCMGCFNLNFLSH-UHFFFAOYSA-N"
"CCCCCCCC(=O)CC(=O)NC1CCOC1=O","InChI=1S/C14H23NO4/c1-2-3-4-5-6-7-11(16)10-13(17)15-12-8-9-19-14(12)18/h12H,2-10H2,1H3,(H,15,17)","KYGIKEQVUKTKRR-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)CC(=O)NC1CCOC1=O","InChI=1S/C16H27NO4/c1-2-3-4-5-6-7-8-9-13(18)12-15(19)17-14-10-11-21-16(14)20/h14H,2-12H2,1H3,(H,17,19)","PHSRRHGYXQCRPU-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)CC(=O)NC1CCOC1=O","InChI=1S/C18H31NO4/c1-2-3-4-5-6-7-8-9-10-11-15(20)14-17(21)19-16-12-13-23-18(16)22/h16H,2-14H2,1H3,(H,19,21)","YQFJJDSGBAAUPW-UHFFFAOYSA-N"
"CC(O)CC(=O)NC1CCOC1=O","InChI=1S/C8H13NO4/c1-5(10)4-7(11)9-6-2-3-13-8(6)12/h5-6,10H,2-4H2,1H3,(H,9,11)","FIXDIFPJOFIIEC-UHFFFAOYSA-N"
"CCCC(O)CC(=O)NC1CCOC1=O","InChI=1S/C10H17NO4/c1-2-3-7(12)6-9(13)11-8-4-5-15-10(8)14/h7-8,12H,2-6H2,1H3,(H,11,13)","CRCIHGGZGGATGM-UHFFFAOYSA-N"
"CCCCCC(O)CC(=O)NC1CCOC1=O","InChI=1S/C12H21NO4/c1-2-3-4-5-9(14)8-11(15)13-10-6-7-17-12(10)16/h9-10,14H,2-8H2,1H3,(H,13,15)","XCZVBYOXRSFQBH-UHFFFAOYSA-N"
"CCCCCCCC(O)CC(=O)NC1CCOC1=O","InChI=1S/C14H25NO4/c1-2-3-4-5-6-7-11(16)10-13(17)15-12-8-9-19-14(12)18/h11-12,16H,2-10H2,1H3,(H,15,17)","DOICJCCMIBBSOO-UHFFFAOYSA-N"
"CCCCCCCCCC(O)CC(=O)NC1CCOC1=O","InChI=1S/C16H29NO4/c1-2-3-4-5-6-7-8-9-13(18)12-15(19)17-14-10-11-21-16(14)20/h13-14,18H,2-12H2,1H3,(H,17,19)","RGTXFFYJJNWEPV-UHFFFAOYSA-N"
"CCCCCCCCCCCC(O)CC(=O)NC1CCOC1=O","InChI=1S/C18H33NO4/c1-2-3-4-5-6-7-8-9-10-11-15(20)14-17(21)19-16-12-13-23-18(16)22/h15-16,20H,2-14H2,1H3,(H,19,21)","IKQUESGRCDRZTI-UHFFFAOYSA-N"
"O=C1N[C@@H]2[C@@H](SC[C@@H]2N1)CCCCC(=O)O","InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1","YBJHBAHKTGYVGT-ZKWXMUAHSA-N"
"NCCCCNCCCN","InChI=1S/C7H19N3/c8-4-1-2-6-10-7-3-5-9/h10H,1-9H2","ATHGHQPFGPMSJY-UHFFFAOYSA-N"
"C[N+](C)(C)CC(CC(=O)[O-])O","InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3","PHIQHXFUZVPYII-UHFFFAOYSA-N"
"c1cc(cnc1)C(=O)N","InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)","DFPAKSUCGFBDDF-UHFFFAOYSA-N"
"OP(=O)(O)O","InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)","NBIIXXVUZAFLBC-UHFFFAOYSA-N"
"c1ccc(cc1)O","InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H","ISWSIDIOOBJBQZ-UHFFFAOYSA-N"
"OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@@H]1O","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1","WQZGKKKJIJFFOK-GASJEMHNSA-N"
"C([C@H]([C@H]([C@H](C=O)O)O)O)O","InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4+,5-/m0/s1","PYMYPHUHKUWMLA-LMVFSUKVSA-N"
"O[C@H]1[C@@H](O)[C@H](O[C@H](O)[C@@H]1O)CO","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6+/m1/s1","WQZGKKKJIJFFOK-PHYPRBDBSA-N"
"OC([C@H](O)[C@@H](O)[C@H](O)CO)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4?,5+,6+/m1/s1","FBPFZTCFMRRESA-NQAPHZHOSA-N"
"C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O[C@]3([C@H]([C@@H]([C@H](O3)CO)O)O)CO)O)O)O)O)O)O)O","InChI=1S/C18H32O16/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18/h5-17,19-29H,1-4H2/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16+,17-,18+/m1/s1","MUPFEKGTMRGPLJ-ZQSKZDJDSA-N"
"O1[C@H](CO)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@@]3(O[C@@H]([C@@H](O)[C@@H]3O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)CO)CO","InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-15-10(25)7(3-21)33-18(15,4-22)34-17-14(29)12(27)9(24)6(2-20)31-17/h5-17,19-29H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1","QWIZNVHXZXRPDR-WSCXOGSTSA-N"
"O(C[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O)[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)CO","InChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1","DLRVVLDZNNYCBX-LIZSDCNHSA-N"
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"CCCCC1=NC(Cl)=C(CO)N1Cc1ccc(-c2ccccc2C2=NNN=N2)cc1","InChI=1S/C22H23ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28)","PSIFNNKUMBGKDQ-UHFFFAOYSA-N"
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"CC(C)NC(=O)NS(=O)(=O)c1cnccc1Nc1cccc(C)c1","InChI=1S/C16H20N4O3S/c1-11(2)18-16(21)20-24(22,23)15-10-17-8-7-14(15)19-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,19)(H2,18,20,21)","NGBFQHCMQULJNZ-UHFFFAOYSA-N"
"O=P(OC(CCl)CCl)(OC(CCl)CCl)OC(CCl)CCl","InChI=1S/C9H15Cl6O4P/c10-1-7(2-11)17-20(16,18-8(3-12)4-13)19-9(5-14)6-15/h7-9H,1-6H2","ASLWPAWFJZFCKF-UHFFFAOYSA-N"
"CC(C)C1=CC2=C(SC3=CC=CC=C3C2=O)C=C1","InChI=1S/C16H14OS/c1-10(2)11-7-8-15-13(9-11)16(17)12-5-3-4-6-14(12)18-15/h3-10H,1-2H3","KTALPKYXQZGAEG-UHFFFAOYSA-N"
"SC1=NC2=CC=CC=C2N1","InChI=1S/C7H6N2S/c10-7-8-5-3-1-2-4-6(5)9-7/h1-4H,(H2,8,9,10)","YHMYGUUIMTVXNW-UHFFFAOYSA-N"
"SC1=NC2=CC=CC=C2S1","InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)","YXIWHUQXZSMYRE-UHFFFAOYSA-N"
"CCCCNC(=O)OC#CCI","InChI=1S/C8H12INO2/c1-2-3-6-10-8(11)12-7-4-5-9/h2-3,5-6H2,1H3,(H,10,11)","DNKGZSOYWMQDTK-UHFFFAOYSA-N"
"COC1=CC=C(\C=C\C(O)=O)C=C1","InChI=1S/C10H10O3/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-4+","AFDXODALSZRGIH-QPJJXVBHSA-N"
"CC1=CC(=O)OC2=CC=CC=C12","InChI=1S/C10H8O2/c1-7-6-10(11)12-9-5-3-2-4-8(7)9/h2-6H,1H3","PSGQCCSGKGJLRL-UHFFFAOYSA-N"
"CCOC1=CC=C2N=C(S)SC2=C1","InChI=1S/C9H9NOS2/c1-2-11-6-3-4-7-8(5-6)13-9(12)10-7/h3-5H,2H2,1H3,(H,10,12)","HOASVNMVYBSLSU-UHFFFAOYSA-N"
"OC1=CC=C2C=CC=CC2=C1N=NC1=CC=C(C=C1)S(O)(=O)=O","InChI=1S/C16H12N2O4S/c19-15-10-5-11-3-1-2-4-14(11)16(15)18-17-12-6-8-13(9-7-12)23(20,21)22/h1-10,19H,(H,20,21,22)","RDUJRVXKAIVTDH-UHFFFAOYSA-N"
"CCCCOC(=O)C1=CC=CC=C1C(=O)OCCCC","InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3","DOIRQSBPFJWKBE-UHFFFAOYSA-N"
"OC(=O)C1=CC=CC=C1C(=O)OCC1=CC=CC=C1","InChI=1S/C15H12O4/c16-14(17)12-8-4-5-9-13(12)15(18)19-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)","XIKIUQUXDNHBFR-UHFFFAOYSA-N"
"CCOC(=O)C1=CC=CC=C1C(O)=O","InChI=1S/C10H10O4/c1-2-14-10(13)8-6-4-3-5-7(8)9(11)12/h3-6H,2H2,1H3,(H,11,12)","YWWHKOHZGJFMIE-UHFFFAOYSA-N"
"CC(C)COC(=O)C1=CC=CC=C1C(O)=O","InChI=1S/C12H14O4/c1-8(2)7-16-12(15)10-6-4-3-5-9(10)11(13)14/h3-6,8H,7H2,1-2H3,(H,13,14)","RZJSUWQGFCHNFS-UHFFFAOYSA-N"
"CCNS(=O)(=O)C1=C(C)C=CC=C1","InChI=1S/C9H13NO2S/c1-3-10-13(11,12)9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3","NATWUQFQFMZVMT-UHFFFAOYSA-N"
"OS(=O)(=O)C1=CC=C2N=C(NC2=C1)C1=CC=CC=C1","InChI=1S/C13H10N2O3S/c16-19(17,18)10-6-7-11-12(8-10)15-13(14-11)9-4-2-1-3-5-9/h1-8H,(H,14,15)(H,16,17,18)","UVCJGUGAGLDPAA-UHFFFAOYSA-N"
"CC(C)(C1=CC(Br)=C(O)C(Br)=C1)C1=CC(Br)=C(O)C(Br)=C1","InChI=1S/C15H12Br4O2/c1-15(2,7-3-9(16)13(20)10(17)4-7)8-5-11(18)14(21)12(19)6-8/h3-6,20-21H,1-2H3","VEORPZCZECFIRK-UHFFFAOYSA-N"
"OC1=C(Cl)C(Cl)=C(Cl)C(Cl)=C1C(=O)NC1=CC=CC=C1","InChI=1S/C13H7Cl4NO2/c14-8-7(12(19)11(17)10(16)9(8)15)13(20)18-6-4-2-1-3-5-6/h1-5,19H,(H,18,20)","BDOBMVIEWHZYDL-UHFFFAOYSA-N"
"ClC1=CC=C(NC(=O)NC2=CC=C(Cl)C(Cl)=C2)C=C1","InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)","ICUTUKXCWQYESQ-UHFFFAOYSA-N"
"OC1=CC(Cl)=CC=C1OC1=CC=C(Cl)C=C1Cl","InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H","XEFQLINVKFYRCS-UHFFFAOYSA-N"
"NC1=CC=C(O)C=C1","InChI=1S/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H2","PLIKAWJENQZMHA-UHFFFAOYSA-N"
"CC(=O)NC1=CC=C(Br)C=C1","InChI=1S/C8H8BrNO/c1-6(11)10-8-4-2-7(9)3-5-8/h2-5H,1H3,(H,10,11)","MSLICLMCQYQNPK-UHFFFAOYSA-N"
"NC1=CC=C(Cl)C=C1","InChI=1S/C6H6ClN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2","QSNSCYSYFYORTR-UHFFFAOYSA-N"
"CC1=CC=NC=N1","InChI=1S/C5H6N2/c1-5-2-3-6-4-7-5/h2-4H,1H3","LVILGAOSPDLNRM-UHFFFAOYSA-N"
"C1=CC=C2C(C=CC3=NC4=C(C=CC5=CC=CC=C45)C=C23)=C1","InChI=1S/C21H13N/c1-3-7-17-14(5-1)11-12-20-19(17)13-16-10-9-15-6-2-4-8-18(15)21(16)22-20/h1-13H","JNCSIWAONQTVCF-UHFFFAOYSA-N"
"Oc1cc(O)c2C(=O)c3ccccc3C(=O)c2c1","InChI=1S/C14H8O4/c15-7-5-10-12(11(16)6-7)14(18)9-4-2-1-3-8(9)13(10)17/h1-6,15-16H","WPWWKBNOXTZDQJ-UHFFFAOYSA-N"
"O=C1c2ccccc2-c2cccc3cccc1c23","InChI=1S/C17H10O/c18-17-14-8-2-1-7-12(14)13-9-3-5-11-6-4-10-15(17)16(11)13/h1-10H","HUKPVYBUJRAUAG-UHFFFAOYSA-N"
"c1cnc2c(c1)cc1ccc3cccc4ccc2c1c34","InChI=1S/C19H11N/c1-3-12-6-7-14-11-15-5-2-10-20-19(15)16-9-8-13(4-1)17(12)18(14)16/h1-11H","BYFIUFNRSNKODH-UHFFFAOYSA-N"
"Oc1cccc2C(=O)c3ccccc3C(=O)c12","InChI=1S/C14H8O3/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7,15H","BTLXPCBPYBNQNR-UHFFFAOYSA-N"
"Oc1ccc2C(=O)c3ccccc3C(=O)c2c1","InChI=1S/C14H8O3/c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16/h1-7,15H","GCDBEYOJCZLKMC-UHFFFAOYSA-N"
"[O-][N+](=O)c1cc[n+]([O-])c2ccccc12","InChI=1S/C9H6N2O3/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6H","YHQDZJICGQWFHK-UHFFFAOYSA-N"
"O=c1cccc2[nH]c3ccccc3cc12","InChI=1S/C13H9NO/c15-13-7-3-6-12-10(13)8-9-4-1-2-5-11(9)14-12/h1-8,14H","DSTNUFDTTMKLQR-UHFFFAOYSA-N"
"c1ccc2nc3c(ccc4ccccc34)cc2c1","InChI=1S/C17H11N/c1-3-7-15-12(5-1)9-10-14-11-13-6-2-4-8-16(13)18-17(14)15/h1-11H","OAPPEBNXKAKQGS-UHFFFAOYSA-N"
"c1ccc2c(c1)ccc1nc3ccc4ccccc4c3cc21","InChI=1S/C21H13N/c1-3-7-16-14(5-1)9-11-20-18(16)13-19-17-8-4-2-6-15(17)10-12-21(19)22-20/h1-13H","ANUCHZVCBDOPOX-UHFFFAOYSA-N"
"c1n[nH]c2ccccc12","InChI=1S/C7H6N2/c1-2-4-7-6(3-1)5-8-9-7/h1-5H,(H,8,9)","BAXOFTOLAUCFNW-UHFFFAOYSA-N"
"Cn1c2cc(cnc2[nH]c1=N)-c1ccccc1","InChI=1S/C13H12N4/c1-17-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(17)14/h2-8H,1H3,(H2,14,15,16)","UQVKZNNCIHJZLS-UHFFFAOYSA-N"
"OC[C@@H](NC(=O)C(Cl)Cl)[C@H](O)C1=CC=C(C=C1)[N+]([O-])=O","InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1","WIIZWVCIJKGZOK-RKDXNWHRSA-N"
"CNCCC(OC1=CC=C(C=C1)C(F)(F)F)C1=CC=CC=C1","InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3","RTHCYVBBDHJXIQ-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C(CN(C)C)C1(O)CCCCC1","InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3","PNVNVHUZROJLTJ-UHFFFAOYSA-N"
"CC1=C(C=C(C=C1)N=C=O)N=C=O","InChI=1S/C9H6N2O2/c1-7-2-3-8(10-5-12)4-9(7)11-6-13/h2-4H,1H3","DVKJHBMWWAPEIU-UHFFFAOYSA-N"
"CC1=CC(=O)OC2=CC(OS(O)(=O)=O)=CC=C12","InChI=1S/C10H8O6S/c1-6-4-10(11)15-9-5-7(2-3-8(6)9)16-17(12,13)14/h2-5H,1H3,(H,12,13,14)","FUYLLJCBCKRIAL-UHFFFAOYSA-N"
"C[C@]12CC[C@H]3[C@@H](CCC4=C3C=CC(O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)=C4)[C@@H]1CCC2=O","InChI=1S/C24H30O8/c1-24-9-8-14-13-5-3-12(10-11(13)2-4-15(14)16(24)6-7-17(24)25)31-23-20(28)18(26)19(27)21(32-23)22(29)30/h3,5,10,14-16,18-21,23,26-28H,2,4,6-9H2,1H3,(H,29,30)/t14-,15-,16+,18+,19+,20-,21+,23-,24+/m1/s1","FJAZVHYPASAQKM-JBAURARKSA-N"
"CC12CCC3C(CCC4=CC(OS(O)(=O)=O)=CC=C34)C1CCC2=O","InChI=1S/C18H22O5S/c1-18-9-8-14-13-5-3-12(23-24(20,21)22)10-11(13)2-4-15(14)16(18)6-7-17(18)19/h3,5,10,14-16H,2,4,6-9H2,1H3,(H,20,21,22)","JKKFKPJIXZFSSB-UHFFFAOYSA-N"
"CC1=CC(=O)OC2=CC(O[C@@H]3O[C@@H]([C@H](O)[C@H](O)[C@H]3O)C(O)=O)=CC=C12","InChI=1S/C16H16O9/c1-6-4-10(17)24-9-5-7(2-3-8(6)9)23-16-13(20)11(18)12(19)14(25-16)15(21)22/h2-5,11-14,16,18-20H,1H3,(H,21,22)/t11-,12+,13+,14-,16+/m0/s1","ARQXEQLMMNGFDU-SQCNAZHOSA-N"
"CN1C=NC(=C1SC1=C2NC=NC2=NC=N1)[N+]([O-])=O","InChI=1S/C9H7N7O2S/c1-15-4-14-7(16(17)18)9(15)19-8-5-6(11-2-10-5)12-3-13-8/h2-4H,1H3,(H,10,11,12,13)","LMEKQMALGUDUQG-UHFFFAOYSA-N"
"OC1=CC=CC2=C(C=CC=C12)S(O)(=O)=O","InChI=1S/C10H8O4S/c11-9-5-1-4-8-7(9)3-2-6-10(8)15(12,13)14/h1-6,11H,(H,12,13,14)","YLKCHWCYYNKADS-UHFFFAOYSA-N"
"OC1=CC(O)=C(C=C1)C(=O)C1=C(O)C=C(O)C=C1","InChI=1S/C13H10O5/c14-7-1-3-9(11(16)5-7)13(18)10-4-2-8(15)6-12(10)17/h1-6,14-17H","WXNRYSGJLQFHBR-UHFFFAOYSA-N"
"OC1=CC(O)=C(C=C1)C(=O)C1=CC=CC=C1","InChI=1S/C13H10O3/c14-10-6-7-11(12(15)8-10)13(16)9-4-2-1-3-5-9/h1-8,14-15H","ZXDDPOHVAMWLBH-UHFFFAOYSA-N"
"COC1=CC=C2N=C(NC2=C1)S(=O)CC1=NC=C(C)C(OC)=C1C","InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)","SUBDBMMJDZJVOS-UHFFFAOYSA-N"
"CCCCCCCCC(=O)NCC1=CC=C(O)C(OC)=C1","InChI=1S/C17H27NO3/c1-3-4-5-6-7-8-9-17(20)18-13-14-10-11-15(19)16(12-14)21-2/h10-12,19H,3-9,13H2,1-2H3,(H,18,20)","RGOVYLWUIBMPGK-UHFFFAOYSA-N"
"COC1=CC=NC(CS(=O)C2=NC3=CC=C(OC(F)F)C=C3N2)=C1OC","InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)","IQPSEEYGBUAQFF-UHFFFAOYSA-N"
"CC(C)C1=CC2=CC[C@@H]3[C@](C)(CCC[C@@]3(C)C(O)=O)[C@H]2CC1","InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1","RSWGJHLUYNHPMX-ONCXSQPRSA-N"
"BrC1=CC2=C(NC(=O)C=C2)C=C1","InChI=1S/C9H6BrNO/c10-7-2-3-8-6(5-7)1-4-9(12)11-8/h1-5H,(H,11,12)","YLAFBGATSQRSTB-UHFFFAOYSA-N"
"Cc1ccc(c(c1)C)S(=O)(=O)O","InChI=1S/C8H10O3S/c1-6-3-4-8(7(2)5-6)12(9,10)11/h3-5H,1-2H3,(H,9,10,11)","CHZLVSBMXZSPNN-UHFFFAOYSA-N"
"CC1=CC(=O)C=C(O1)C1=CC=CC=C1","InChI=1S/C12H10O2/c1-9-7-11(13)8-12(14-9)10-5-3-2-4-6-10/h2-8H,1H3","PEYODCCEJQCEBL-UHFFFAOYSA-N"
"OC1=CC(=CC=C1)C1=CC(O)=CC=C1","InChI=1S/C12H10O2/c13-11-5-1-3-9(7-11)10-4-2-6-12(14)8-10/h1-8,13-14H","VZQSBJKDSWXLKX-UHFFFAOYSA-N"
"CCOC(=O)C1=CC=CC=C1C(=O)OCC","InChI=1S/C12H14O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h5-8H,3-4H2,1-2H3","FLKPEMZONWLCSK-UHFFFAOYSA-N"
"OC1=C(CC2=C(Cl)C(Cl)=CC(Cl)=C2O)C(Cl)=C(Cl)C=C1Cl","InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2","ACGUYXCXAPNIKK-UHFFFAOYSA-N"
"C1CC2=CC=CC=C2N1","InChI=1S/C8H9N/c1-2-4-8-7(3-1)5-6-9-8/h1-4,9H,5-6H2","LPAGFVYQRIESJQ-UHFFFAOYSA-N"
"COC(=O)C1=CN=CC=N1","InChI=1S/C6H6N2O2/c1-10-6(9)5-4-7-2-3-8-5/h2-4H,1H3","TWIIRMSFZNYMQE-UHFFFAOYSA-N"
"C1COCCN1","InChI=1S/C4H9NO/c1-3-6-4-2-5-1/h5H,1-4H2","YNAVUWVOSKDBBP-UHFFFAOYSA-N"
"N(C1=CC=CC=C1)C1=CC2=CC=CC=C2C=C1","InChI=1S/C16H13N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12,17H","KEQFTVQCIQJIQW-UHFFFAOYSA-N"
"N1N=NN=C1C1=CC=CC=C1","InChI=1S/C7H6N4/c1-2-4-6(5-3-1)7-8-10-11-9-7/h1-5H,(H,8,9,10,11)","MARUHZGHZWCEQU-UHFFFAOYSA-N"
"CCCCOC(=O)C1=CC=CC=C1C(=O)OCC1=CC=CC=C1","InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3","IRIAEXORFWYRCZ-UHFFFAOYSA-N"
"C=CCOC(=O)C1=CC=CC=C1C(=O)OCC=C","InChI=1S/C14H14O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h3-8H,1-2,9-10H2","QUDWYFHPNIMBFC-UHFFFAOYSA-N"
"C1CCNCC1","InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2","NQRYJNQNLNOLGT-UHFFFAOYSA-N"
"OC1=CC(O)=C2C(=O)C3=CC=CC=C3C(=O)C2=C1O","InChI=1S/C14H8O5/c15-8-5-9(16)14(19)11-10(8)12(17)6-3-1-2-4-7(6)13(11)18/h1-5,15-16,19H","BBNQQADTFFCFGB-UHFFFAOYSA-N"
"CS(=O)(=O)C1=CC=C(C(=O)C2C(=O)CCCC2=O)C(Cl)=C1","InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","PQTBTIFWAXVEPB-UHFFFAOYSA-N"
"C(N(CC1=CC=CC=C1)CC1=CC=CC=C1)C1=CC=CC=C1","InChI=1S/C21H21N/c1-4-10-19(11-5-1)16-22(17-20-12-6-2-7-13-20)18-21-14-8-3-9-15-21/h1-15H,16-18H2","MXHTZQSKTCCMFG-UHFFFAOYSA-N"
"OC(=O)COc1ccc(Cl)cc1Cl","InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)","OVSKIKFHRZPJSS-UHFFFAOYSA-N"
"CC(C)N1C(=O)c2ccccc2NS1(=O)=O","InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3","ZOMSMJKLGFBRBS-UHFFFAOYSA-N"
"CC(C)c1ccc(NC(=O)N(C)C)cc1","InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)","PUIYMUZLKQOUOZ-UHFFFAOYSA-N"
"CN(C)C(=O)Nc1ccc(C)c(Cl)c1","InChI=1S/C10H13ClN2O/c1-7-4-5-8(6-9(7)11)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)","JXCGFZXSOMJFOA-UHFFFAOYSA-N"
"CCCCC(Cn1cncn1)(C#N)c1ccc(Cl)cc1","InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3","HZJKXKUJVSEEFU-UHFFFAOYSA-N"
"Fc1ccc(NC(=O)c2cccnc2Oc2cccc(c2)C(F)(F)F)c(F)c1","InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)","WYEHFWKAOXOVJD-UHFFFAOYSA-N"
"C[Si](Cn1cncn1)(c1ccc(F)cc1)c1ccc(F)cc1","InChI=1S/C16H15F2N3Si/c1-22(12-21-11-19-10-20-21,15-6-2-13(17)3-7-15)16-8-4-14(18)5-9-16/h2-11H,12H2,1H3","FQKUGOMFVDPBIZ-UHFFFAOYSA-N"
"CO\N=C(/C(=O)OC)c1ccccc1CO\N=C(/C)c1cccc(c1)C(F)(F)F","InChI=1S/C20H19F3N2O4/c1-13(14-8-6-9-16(11-14)20(21,22)23)24-29-12-15-7-4-5-10-17(15)18(25-28-3)19(26)27-2/h4-11H,12H2,1-3H3/b24-13+,25-18-","ONCZDRURRATYFI-QTCHDTBASA-N"
"CCCN(CCOc1c(Cl)cc(Cl)cc1Cl)C(=O)n1ccnc1","InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3","TVLSRXXIMLFWEO-UHFFFAOYSA-N"
"COCC(=O)N(C(C)C(=O)OC)c1c(C)cccc1C","InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3","ZQEIXNIJLIKNTD-UHFFFAOYSA-N"
"CC(Oc1ccc(Cl)cc1Cl)C(O)=O","InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)","MZHCENGPTKEIGP-UHFFFAOYSA-N"
"[O-][N+](=O)NC1=NCCN1Cc1ccc(Cl)nc1","InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)","YWTYJOPNNQFBPC-UHFFFAOYSA-N"
"CC(C)N(C(=O)COc1nnc(s1)C(F)(F)F)c1ccc(F)cc1","InChI=1S/C14H13F4N3O2S/c1-8(2)21(10-5-3-9(15)4-6-10)11(22)7-23-13-20-19-12(24-13)14(16,17)18/h3-6,8H,7H2,1-2H3","IANUJLZYFUDJIH-UHFFFAOYSA-N"
"CC(C)N(C(=O)CCl)c1ccccc1","InChI=1S/C11H14ClNO/c1-9(2)13(11(14)8-12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","MFOUDYKPLGXPGO-UHFFFAOYSA-N"
"CCCN(CCC)C(=O)SCc1ccccc1","InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3","NQLVQOSNDJXLKG-UHFFFAOYSA-N"
"CCOCCN(C(=O)CCl)C(=C(C)C)c1ccccc1","InChI=1S/C16H22ClNO2/c1-4-20-11-10-18(15(19)12-17)16(13(2)3)14-8-6-5-7-9-14/h5-9H,4,10-12H2,1-3H3","CSWIKHNSBZVWNQ-UHFFFAOYSA-N"
"CCOC1Oc2ccc(OS(C)(=O)=O)cc2C1(C)C","InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3","IRCMYGHHKLLGHV-UHFFFAOYSA-N"
"CC1=NN=C(C(=O)N1N)c1ccccc1","InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3","VHCNQEUWZYOAEV-UHFFFAOYSA-N"
"NC1=C(Cl)C(=O)N(N=C1)c1ccccc1","InChI=1S/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2","WYKYKTKDBLFHCY-UHFFFAOYSA-N"
"CCNc1nc(NCC)nc(SC)n1","InChI=1S/C8H15N5S/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13)","MGLWZSOBALDPEK-UHFFFAOYSA-N"
"CC(CN1C[C@H](C)O[C@H](C)C1)Cc1ccc(cc1)C(C)(C)C","InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+","RYAUSSKQMZRMAI-ALOPSCKCSA-N"
"FC1=CC=C(C=C1)C1(CN2C=NC=N2)OC1C1=CC=CC=C1Cl","InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2","ZMYFCFLJBGAQRS-UHFFFAOYSA-N"
"CC(C)Nc1nc(N)nc(Cl)n1","InChI=1S/C6H10ClN5/c1-3(2)9-6-11-4(7)10-5(8)12-6/h3H,1-2H3,(H3,8,9,10,11,12)","DFWFIQKMSFGDCQ-UHFFFAOYSA-N"
"CCNc1nc(Cl)nc(NCC)n1","InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)","ODCWYMIRDDJXKW-UHFFFAOYSA-N"
"CCN(CC)c1nc(C)cc(OP(=S)(OC)OC)n1","InChI=1S/C11H20N3O3PS/c1-6-14(7-2)11-12-9(3)8-10(13-11)17-18(19,15-4)16-5/h8H,6-7H2,1-5H3","QHOQHJPRIBSPCY-UHFFFAOYSA-N"
"CCNc1nc(N)nc(Cl)n1","InChI=1S/C5H8ClN5/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H3,7,8,9,10,11)","IVENSCMCQBJAKW-UHFFFAOYSA-N"
"CON(C)C(=O)Nc1ccc(Cl)c(Cl)c1","InChI=1S/C9H10Cl2N2O2/c1-13(15-2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","XKJMBINCVNINCA-UHFFFAOYSA-N"
"CCNc1nc(Cl)nc(NC(C)(C)C)n1","InChI=1S/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)","FZXISNSWEXTPMF-UHFFFAOYSA-N"
"CCNc1nc(Cl)nc(NC(C)C)n1","InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)","MXWJVTOOROXGIU-UHFFFAOYSA-N"
"CCCC1COC(Cn2cncn2)(O1)c1ccc(Cl)cc1Cl","InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3","STJLVHWMYQXCPB-UHFFFAOYSA-N"
"Cc1cccc(C)c1N(Cn1cccn1)C(=O)CCl","InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3","STEPQTYSZVCJPV-UHFFFAOYSA-N"
"CN(C)C(=O)Oc1nc(nc(C)c1C)N(C)C","InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3","YFGYUFNIOHWBOB-UHFFFAOYSA-N"
"CCc1cccc(C)c1N(C(C)COC)C(=O)CCl","InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3","WVQBLGZPHOPPFO-UHFFFAOYSA-N"
"CC(C)(C)Nc1nc(N)nc(Cl)n1","InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)","LMKQNTMFZLAJDV-UHFFFAOYSA-N"
"CC(Oc1ccc(Cl)cc1C)C(O)=O","InChI=1S/C10H11ClO3/c1-6-5-8(11)3-4-9(6)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13)","WNTGYJSOUMFZEP-UHFFFAOYSA-N"
"Cc1cc(Cl)ccc1OCC(O)=O","InChI=1S/C9H9ClO3/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)","WHKUVVPPKQRRBV-UHFFFAOYSA-N"
"Oc1c(Cl)c(Cl)c(C#N)c(Cl)c1C#N","InChI=1S/C8HCl3N2O/c9-5-3(1-12)6(10)7(11)8(14)4(5)2-13/h14H","MDQKYGOECVSPIW-UHFFFAOYSA-N"
"CC(C)(C)C(O)(CCc1ccc(Cl)cc1)Cn1cncn1","InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3","PXMNMQRDXWABCY-UHFFFAOYSA-N"
"Clc1ccc(CN2CCSC2=NC#N)cn1","InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2","HOKKPVIRMVDYPB-UHFFFAOYSA-N"
"CN(C)C(=O)Nc1ccccc1","InChI=1S/C9H12N2O/c1-11(2)9(12)10-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,10,12)","XXOYNJXVWVNOOJ-UHFFFAOYSA-N"
"CN(C)C(=O)Nc1ccc(Oc2ccc(Cl)cc2)cc1","InChI=1S/C15H15ClN2O2/c1-18(2)15(19)17-12-5-9-14(10-6-12)20-13-7-3-11(16)4-8-13/h3-10H,1-2H3,(H,17,19)","IVUXTESCPZUGJC-UHFFFAOYSA-N"
"CCNc1nc(NC(C)C)nc(SC)n1","InChI=1S/C9H17N5S/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)","RQVYBGPQFYCBGX-UHFFFAOYSA-N"
"NC(=O)c1c(Cl)cccc1Cl","InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)","JHSPCUHPSIUQRB-UHFFFAOYSA-N"
"NC(=O)Nc1ccc(Cl)c(Cl)c1","InChI=1S/C7H6Cl2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12)","CYESCLHCWJKRKM-UHFFFAOYSA-N"
"Fc1ccc(Oc2ccnc3cc(Cl)cc(Cl)c23)cc1","InChI=1S/C15H8Cl2FNO/c16-9-7-12(17)15-13(8-9)19-6-5-14(15)20-11-3-1-10(18)2-4-11/h1-8H","WRPIRSINYZBGPK-UHFFFAOYSA-N"
"CC1(C)CON(Cc2ccccc2Cl)C1=O","InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3","KIEDNEWSYUYDSN-UHFFFAOYSA-N"
"CNC(=O)Oc1cc(C)c(SC)c(C)c1","InChI=1S/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)","YFBPRJGDJKVWAH-UHFFFAOYSA-N"
"CCC(CC)Nc1c(cc(C)c(C)c1[N+]([O-])=O)[N+]([O-])=O","InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3","CHIFOSRWCNZCFN-UHFFFAOYSA-N"
"Clc1ccc(cc1)-c1ccccc1NC(=O)c1cccnc1Cl","InChI=1S/C18H12Cl2N2O/c19-13-9-7-12(8-10-13)14-4-1-2-6-16(14)22-18(23)15-5-3-11-21-17(15)20/h1-11H,(H,22,23)","WYEMLYFITZORAB-UHFFFAOYSA-N"
"OC(Cc1ccccc1Cl)(Cn1cncn1)C1(Cl)CC1","InChI=1S/C14H15Cl2N3O/c15-12-4-2-1-3-11(12)7-14(20,13(16)5-6-13)8-19-10-17-9-18-19/h1-4,9-10,20H,5-8H2","HHUQPWODPBDTLI-UHFFFAOYSA-N"
"CNC1=C(C(=O)C(O1)c1ccccc1)c1cccc(c1)C(F)(F)F","InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3","NYRMIJKDBAQCHC-UHFFFAOYSA-N"
"Oc1c(Br)cc(cc1Br)C#N","InChI=1S/C7H3Br2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","UPMXNNIRAGDFEH-UHFFFAOYSA-N"
"CCNC1=NC(=O)N=C(NC(C)C)N1","InChI=1S/C8H15N5O/c1-4-9-6-11-7(10-5(2)3)13-8(14)12-6/h5H,4H2,1-3H3,(H3,9,10,11,12,13,14)","NFMIMWNQWAWNDW-UHFFFAOYSA-N"
"CC(C)(C)C(O)C(Oc1ccc(Cl)cc1)n1cncn1","InChI=1S/C14H18ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,12-13,19H,1-3H3","BAZVSMNPJJMILC-UHFFFAOYSA-N"
"CC1(C)CCC(Cc2ccc(Cl)cc2)C1(O)Cn1cncn1","InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3","XWPZUHJBOLQNMN-UHFFFAOYSA-N"
"COC(=O)C(C)N(C(=O)Cc1ccccc1)c1c(C)cccc1C","InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3","CJPQIRJHIZUAQP-UHFFFAOYSA-N"
"CC(C)OC(=O)Nc1cccc(Cl)c1","InChI=1S/C10H12ClNO2/c1-7(2)14-10(13)12-9-5-3-4-8(11)6-9/h3-7H,1-2H3,(H,12,13)","CWJSHJJYOPWUGX-UHFFFAOYSA-N"
"OC(=O)c1nc(Cl)ccc1Cl","InChI=1S/C6H3Cl2NO2/c7-3-1-2-4(8)9-5(3)6(10)11/h1-2H,(H,10,11)","HUBANNPOLNYSAD-UHFFFAOYSA-N"
"COC=C(C(=O)OC)C1=CC=CC=C1COC1=CC=CC(=N1)C(F)(F)F","InChI=1S/C18H16F3NO4/c1-24-11-14(17(23)25-2)13-7-4-3-6-12(13)10-26-16-9-5-8-15(22-16)18(19,20)21/h3-9,11H,10H2,1-2H3","IBSNKSODLGJUMQ-UHFFFAOYSA-N"
"OC(=O)C1=C(C=CC(OC2=C(Cl)C=C(Cl)C=C2)=C1)[N+]([O-])=O","InChI=1S/C13H7Cl2NO5/c14-7-1-4-12(10(15)5-7)21-8-2-3-11(16(19)20)9(6-8)13(17)18/h1-6H,(H,17,18)","IUSYSZLVZMUVDO-UHFFFAOYSA-N"
"CN=C(NCC1=CN=C(Cl)S1)N[N+]([O-])=O","InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)","PGOOBECODWQEAB-UHFFFAOYSA-N"
"COP(=S)(OC)SCN1N=Nc2ccccc2C1=O","InChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3","CJJOSEISRRTUQB-UHFFFAOYSA-N"
"CCOC(=O)c1cn2nc(OP(=S)(OCC)OCC)cc2nc1C","InChI=1S/C14H20N3O5PS/c1-5-19-14(18)11-9-17-12(15-10(11)4)8-13(16-17)22-23(24,20-6-2)21-7-3/h8-9H,5-7H2,1-4H3","JOOMJVFZQRQWKR-UHFFFAOYSA-N"
"CNC(=O)Oc1cccc2OC(C)(C)Oc12","InChI=1S/C11H13NO4/c1-11(2)15-8-6-4-5-7(9(8)16-11)14-10(13)12-3/h4-6H,1-3H3,(H,12,13)","XEGGRYVFLWGFHI-UHFFFAOYSA-N"
"CCOP(=S)(OCC)SCN1N=Nc2ccccc2C1=O","InChI=1S/C12H16N3O3PS2/c1-3-17-19(20,18-4-2)21-9-15-12(16)10-7-5-6-8-11(10)13-14-15/h5-8H,3-4,9H2,1-2H3","RQVGAIADHNPSME-UHFFFAOYSA-N"
"CCOP(=O)(OCC)O\C(=C/Cl)c1ccc(Cl)cc1Cl","InChI=1S/C12H14Cl3O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3/b12-8-","FSAVDKDHPDSCTO-WQLSENKSSA-N"
"COP(=S)(OC)Oc1ccc(SC)c(C)c1","InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3","PNVJTZOFSHSLTO-UHFFFAOYSA-N"
"COP(=S)(OC)Oc1ccc(cc1)[N+]([O-])=O","InChI=1S/C8H10NO5PS/c1-12-15(16,13-2)14-8-5-3-7(4-6-8)9(10)11/h3-6H,1-2H3","RLBIQVVOMOPOHC-UHFFFAOYSA-N"
"CCOCN(C(=O)CCl)c1c(C)cccc1CC","InChI=1S/C14H20ClNO2/c1-4-12-8-6-7-11(3)14(12)16(10-18-5-2)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3","VTNQPKFIQCLBDU-UHFFFAOYSA-N"
"CCC(=O)Nc1ccc(Cl)c(Cl)c1","InChI=1S/C9H9Cl2NO/c1-2-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)","LFULEKSKNZEWOE-UHFFFAOYSA-N"
"CC12CC1(C)C(=O)N(C2=O)c1cc(Cl)cc(Cl)c1","InChI=1S/C13H11Cl2NO2/c1-12-6-13(12,2)11(18)16(10(12)17)9-4-7(14)3-8(15)5-9/h3-5H,6H2,1-2H3","QXJKBPAVAHBARF-UHFFFAOYSA-N"
"CNC(=O)Oc1cccc2ccccc12","InChI=1S/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)","CVXBEEMKQHEXEN-UHFFFAOYSA-N"
"CN(C)C(=O)C(CCN1CCC(O)(CC1)c1ccc(Cl)cc1)(c1ccccc1)c1ccccc1","InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3","RDOIQAHITMMDAJ-UHFFFAOYSA-N"
"CC(CN1C2=C(SC3=C1C=CC=C3)C=CC=C2)N(C)C","InChI=1S/C17H20N2S/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19/h4-11,13H,12H2,1-3H3","PWWVAXIEGOYWEE-UHFFFAOYSA-N"
"NC1=C(Br)C=C(Br)C=C1CNC1CCC(O)CC1","InChI=1S/C13H18Br2N2O/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10/h5-6,10-11,17-18H,1-4,7,16H2","JBDGDEWWOUBZPM-UHFFFAOYSA-N"
"CC[C@]1(CC[C@@H](O1)[C@@]1(C)CC[C@]2(C[C@H](O)[C@@H](C)[C@H](O2)[C@H](C)[C@H](OC)[C@@H](C)C(O)=O)O1)[C@H]1O[C@@H](C[C@H]1C)[C@H]1O[C@@](O)(CO)[C@H](C)C[C@@H]1C","InChI=1S/C36H62O11/c1-10-34(31-20(3)16-26(43-31)28-19(2)15-21(4)36(41,18-37)46-28)12-11-27(44-34)33(8)13-14-35(47-33)17-25(38)22(5)30(45-35)23(6)29(42-9)24(7)32(39)40/h19-31,37-38,41H,10-18H2,1-9H3,(H,39,40)/t19-,20+,21+,22+,23+,24+,25-,26-,27+,28-,29-,30-,31-,33+,34-,35+,36-/m0/s1","GAOZTHIDHYLHMS-GDMSFIFLSA-N"
"NS(=O)(=O)c1cc(C(O)=O)c(NCc2ccco2)cc1Cl","InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)","ZZUFCTLCJUWOSV-UHFFFAOYSA-N"
"CCC1(C(=O)NCNC1=O)c1ccccc1","InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)","DQMZLTXERSFNPB-UHFFFAOYSA-N"
"Cc1cc(C)nc(NS(=O)(=O)c2ccc(N)cc2)n1","InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)","ASWVTGNCAZCNNR-UHFFFAOYSA-N"
"CN(CC1=Nc2c(N)nc(N)nc2NC1=O)c1ccc(cc1)C(=O)NC(CCC(O)=O)C(O)=O","InChI=1S/C20H22N8O6/c1-28(8-12-18(32)26-16-14(23-12)15(21)25-20(22)27-16)10-4-2-9(3-5-10)17(31)24-11(19(33)34)6-7-13(29)30/h2-5,11H,6-8H2,1H3,(H,24,31)(H,29,30)(H,33,34)(H5,21,22,25,26,27,32)","HODZDDDNGRLGSI-UHFFFAOYSA-N"
"CN1CCCC(CC1)N1N=C(Cc2ccc(Cl)cc2)c2ccccc2C1=O","InChI=1S/C22H24ClN3O/c1-25-13-4-5-18(12-14-25)26-22(27)20-7-3-2-6-19(20)21(24-26)15-16-8-10-17(23)11-9-16/h2-3,6-11,18H,4-5,12-15H2,1H3","MBUVEWMHONZEQD-UHFFFAOYSA-N"
"CNCC[C@H](Oc1cccc2ccccc12)c1cccs1","InChI=1S/C18H19NOS/c1-19-12-11-17(18-10-5-13-21-18)20-16-9-4-7-14-6-2-3-8-15(14)16/h2-10,13,17,19H,11-12H2,1H3/t17-/m0/s1","ZEUITGRIYCTCEM-KRWDZBQOSA-N"
"CC1=C(CCN2CCC(CC2)c2noc3cc(F)ccc23)C(=O)N2CCCCC2=N1","InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3","RAPZEAPATHNIPO-UHFFFAOYSA-N"
"COC1=CC=CC=C1OC1=C(OCCO)N=C(N=C1NS(=O)(=O)C1=CC=C(C=C1)C(C)(C)C)C1=NC=CC=N1","InChI=1S/C27H29N5O6S/c1-27(2,3)18-10-12-19(13-11-18)39(34,35)32-23-22(38-21-9-6-5-8-20(21)36-4)26(37-17-16-33)31-25(30-23)24-28-14-7-15-29-24/h5-15,33H,16-17H2,1-4H3,(H,30,31,32)","GJPICJJJRGTNOD-UHFFFAOYSA-N"
"ClC1=CC2=C(C=C1)N(C1CCN(CCCN3C(=O)NC4=C3C=CC=C4)CC1)C(=O)N2","InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)","FGXWKSZFVQUSTL-UHFFFAOYSA-N"
"FC(F)(F)[C@]1(OC(=O)NC2=C1C=C(Cl)C=C2)C#CC1CC1","InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1","XPOQHMRABVBWPR-ZDUSSCGKSA-N"
"COCCCC\C(=N/OCCN)C1=CC=C(C=C1)C(F)(F)F","InChI=1S/C15H21F3N2O2/c1-21-10-3-2-4-14(20-22-11-9-19)12-5-7-13(8-6-12)15(16,17)18/h5-8H,2-4,9-11,19H2,1H3/b20-14+","CJOFXWAVKWHTFT-XSFVSMFZSA-N"
"CN1CCN(CC2=CC=C(C=C2)C(=O)NC2=CC(NC3=NC(=CC=N3)C3=CN=CC=C3)=C(C)C=C2)CC1","InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)","KTUFNOKKBVMGRW-UHFFFAOYSA-N"
"NC(CC1=CC(I)=C(OC2=CC(I)=C(O)C(I)=C2)C(I)=C1)C(O)=O","InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)","XUIIKFGFIJCVMT-UHFFFAOYSA-N"
"CN1C2=C(C3=C1C=CC=C3)C(=O)C(CN1C=CN=C1C)CC2","InChI=1S/C18H19N3O/c1-12-19-9-10-21(12)11-13-7-8-16-17(18(13)22)14-5-3-4-6-15(14)20(16)2/h3-6,9-10,13H,7-8,11H2,1-2H3","FELGMEQIXOGIFQ-UHFFFAOYSA-N"
"CCC1=CC=C(CCOC2=CC=C(CC3SC(=O)NC3=O)C=C2)N=C1","InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23)","HYAFETHFCAUJAY-UHFFFAOYSA-N"
"CCCC1=NC(C)=C2N1NC(=NC2=O)C1=CC(=CC=C1OCC)S(=O)(=O)N1CCN(CC)CC1","InChI=1S/C23H32N6O4S/c1-5-8-20-24-16(4)21-23(30)25-22(26-29(20)21)18-15-17(9-10-19(18)33-7-3)34(31,32)28-13-11-27(6-2)12-14-28/h9-10,15H,5-8,11-14H2,1-4H3,(H,25,26,30)","SECKRCOLJRRGGV-UHFFFAOYSA-N"
"ClC1=CC2=C(CC(=O)N2)C=C1CCN1CCN(CC1)C1=NSC2=C1C=CC=C2","InChI=1S/C21H21ClN4OS/c22-17-13-18-15(12-20(27)23-18)11-14(17)5-6-25-7-9-26(10-8-25)21-16-3-1-2-4-19(16)28-24-21/h1-4,11,13H,5-10,12H2,(H,23,27)","MVWVFYHBGMAFLY-UHFFFAOYSA-N"
"COC(=O)C(N1CCc2sccc2C1)c1ccccc1Cl","InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3","GKTWGGQPFAXNFI-UHFFFAOYSA-N"
"CC(C)(C#N)c1cc(Cn2cncn2)cc(c1)C(C)(C)C#N","InChI=1S/C17H19N5/c1-16(2,9-18)14-5-13(8-22-12-20-11-21-22)6-15(7-14)17(3,4)10-19/h5-7,11-12H,8H2,1-4H3","YBBLVLTVTVSKRW-UHFFFAOYSA-N"
"CC1CCc2cc(F)cc3C(=O)C(=CN1c23)C(O)=O","InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19)","DPSPPJIUMHPXMA-UHFFFAOYSA-N"
"COC(=O)Nc1nc2ccc(cc2[nH]1)C(=O)c1ccccc1","InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21)","OPXLLQIJSORQAM-UHFFFAOYSA-N"
"CCCSc1ccc2nc(NC(=O)OC)[nH]c2c1","InChI=1S/C12H15N3O2S/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)","HXHWSAZORRCQMX-UHFFFAOYSA-N"
"Oc1ccc(cc1)-c1sc2cc(O)ccc2c1C(=O)c1ccc(OCCN2CCCCC2)cc1","InChI=1S/C28H27NO4S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2","GZUITABIAKMVPG-UHFFFAOYSA-N"
"COc1ccc2cc(ccc2c1)C(C)C(O)=O","InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)","CMWTZPSULFXXJA-UHFFFAOYSA-N"
"CN1N(C(=O)C=C1C)c1ccccc1","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3","VEQOALNAAJBPNY-UHFFFAOYSA-N"
"CC(C)(Oc1ccc(Cl)cc1)C(O)=O","InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)","TXCGAZHTZHNUAI-UHFFFAOYSA-N"
"CC(C)(Oc1ccc(CCNC(=O)c2ccc(Cl)cc2)cc1)C(O)=O","InChI=1S/C19H20ClNO4/c1-19(2,18(23)24)25-16-9-3-13(4-10-16)11-12-21-17(22)14-5-7-15(20)8-6-14/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)","IIBYAHWJQTYFKB-UHFFFAOYSA-N"
"Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1","InChI=1S/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H","VNFPBHJOKIVQEB-UHFFFAOYSA-N"
"CC(C)C1=C(C)N(C)N(C1=O)c1ccccc1","InChI=1S/C14H18N2O/c1-10(2)13-11(3)15(4)16(14(13)17)12-8-6-5-7-9-12/h5-10H,1-4H3","PXWLVJLKJGVOKE-UHFFFAOYSA-N"
"Fc1ccc(cc1)[C@@H]1CCNC[C@H]1COc1ccc2OCOc2c1","InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1","AHOUBRCZNHFOSL-YOEHRIQHSA-N"
"CC(C)NCC(O)COc1cccc2ccccc12","InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3","AQHHHDLHHXJYJD-UHFFFAOYSA-N"
"COc1ccc(CCN(C)CCCC(C#N)(C(C)C)c2ccc(OC)c(OC)c2)cc1OC","InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3","SGTNSNPWRIOYBX-UHFFFAOYSA-N"
"CC[C@H](C)C(=O)O[C@H]1C[C@H](O)C=C2C=C[C@H](C)[C@H](CC[C@@H](O)C[C@@H](O)CC(O)=O)[C@@H]12","InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)/t13-,14-,16+,17+,18+,19-,20-,22-/m0/s1","TUZYXOIXSAXUGO-PZAWKZKUSA-N"
"CN1c2ccc(Cl)cc2C(=NCC1=O)c1ccccc1","InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3","AAOVKJBEBIDNHE-UHFFFAOYSA-N"
"CC(C(O)=O)c1cccc(c1)C(=O)c1ccccc1","InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)","DKYWVDODHFEZIM-UHFFFAOYSA-N"
"Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1","InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)","JLKIGFTWXXRPMT-UHFFFAOYSA-N"
"ClC1=CC=CC=C1NC1=CC=CC=C1C=O","InChI=1S/C13H10ClNO/c14-11-6-2-4-8-13(11)15-12-7-3-1-5-10(12)9-16/h1-9,15H","DAAHPDZFLSFYPJ-UHFFFAOYSA-N"
"CC(C)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+]([O-])=O","InChI=1S/C11H11F3N2O3/c1-6(2)10(17)15-7-3-4-9(16(18)19)8(5-7)11(12,13)14/h3-6H,1-2H3,(H,15,17)","MKXKFYHWDHIYRV-UHFFFAOYSA-N"
"OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl","InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)","DCOPUUMXTXDBNB-UHFFFAOYSA-N"
"Cc1cccc(Nc2ccccc2C(O)=O)c1C","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","HYYBABOKPJLUIN-UHFFFAOYSA-N"
"CC(=O)N1CCN(CC1)c1ccc(OC[C@@H]2CO[C@](Cn3ccnc3)(O2)c2ccc(Cl)cc2Cl)cc1","InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m1/s1","XMAYWYJOQHXEEK-ZEQKJWHPSA-N"
"COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)CCC(O)=O","InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+","HPNSFSBZBAHARI-RUDMXATFSA-N"
"CCN(C(=O)\C=C\C)c1ccccc1C","InChI=1S/C13H17NO/c1-4-8-13(15)14(5-2)12-10-7-6-9-11(12)3/h4,6-10H,5H2,1-3H3/b8-4+","DNTGGZPQPQTDQF-XBXARRHUSA-N"
"NC(=O)N1c2ccccc2C(O)C(O)c2ccccc12","InChI=1S/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)","PRGQOPPDPVELEG-UHFFFAOYSA-N"
"OC(=O)COCCN1CCN(CC1)C(c1ccccc1)c1ccc(Cl)cc1","InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)","ZKLPARSLTMPFCP-UHFFFAOYSA-N"
"NC(=O)N1c2ccccc2CC(=O)c2ccccc12","InChI=1S/C15H12N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-8H,9H2,(H2,16,19)","CTRLABGOLIVAIY-UHFFFAOYSA-N"
"CN(C)CCOC(c1ccccc1)c1ccccc1","InChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3","ZZVUWRFHKOJYTH-UHFFFAOYSA-N"
"Cc1cc(no1)NS(=O)(=O)c2ccc(cc2)/N=C(\C)/O","InChI=1S/C12H13N3O4S/c1-8-7-12(14-19-8)15-20(17,18)11-5-3-10(4-6-11)13-9(2)16/h3-7H,1-2H3,(H,13,16)(H,14,15)","GXPIUNZCALHVBA-UHFFFAOYSA-N"
"Fc1ccc(cc1)C3(OCc2cc(C#N)ccc23)CCCN(C)C","InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3","WSEQXVZVJXJVFP-UHFFFAOYSA-N"
"CN(C)CCC=C1c2ccccc2CCc2ccccc12","InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3","KRMDCWKBEZIMAB-UHFFFAOYSA-N"
"CC(C)c1c(C(=O)Nc2ccccc2)c(c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(O)=O)-c1ccccc1","InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-,27-/m1/s1","XUKUURHRXDUEBC-KAYWLYCHSA-N"
"CC(C)NCC(O)COc1ccc(COCCOC(C)C)cc1","InChI=1S/C18H31NO4/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h5-8,14-15,17,19-20H,9-13H2,1-4H3","VHYCDWMUTMEGQY-UHFFFAOYSA-N"
"CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1","InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3","SNPPWIUOZRMYNY-UHFFFAOYSA-N"
"Clc1ccc2c(CCc3cccnc3C2=C2CCNCC2)c1","InChI=1S/C19H19ClN2/c20-16-5-6-17-15(12-16)4-3-14-2-1-9-22-19(14)18(17)13-7-10-21-11-8-13/h1-2,5-6,9,12,21H,3-4,7-8,10-11H2","JAUOIFJMECXRGI-UHFFFAOYSA-N"
"OC(Cn1cncn1)(Cn1cncn1)c1ccc(F)cc1F","InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2","RFHAOTPXVQNOHP-UHFFFAOYSA-N"
"OC1N=C(c2ccccc2Cl)c2cc(Cl)ccc2NC1=O","InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)","DIWRORZWFLOCLC-UHFFFAOYSA-N"
"Clc1ccc(COC(Cn2ccnc2)c2ccc(Cl)cc2Cl)c(Cl)c1","InChI=1S/C18H14Cl4N2O/c19-13-2-1-12(16(21)7-13)10-25-18(9-24-6-5-23-11-24)15-4-3-14(20)8-17(15)22/h1-8,11,18H,9-10H2","BYBLEWFAAKGYCD-UHFFFAOYSA-N"
"OC1N=C(c2ccccc2)c2cc(Cl)ccc2NC1=O","InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)","ADIMAYPTOBDMTL-UHFFFAOYSA-N"
"CN1c2ccc(Cl)cc2C(=NC(O)C1=O)c1ccccc1","InChI=1S/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3","SEQDDYPDSLOBDC-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C)(C)Oc1ccc(cc1)C(=O)c1ccc(Cl)cc1","InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3","YMTINGFKWWXKFG-UHFFFAOYSA-N"
"CCCCC1=NC(Cl)=C(CO)N1CC1=CC=C(C=C1)C1=C(C=CC=C1)C1=NNN=N1","InChI=1S/C22H23ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28)","PSIFNNKUMBGKDQ-UHFFFAOYSA-N"
"CN(C\C=C\C#CC(C)(C)C)Cc1cccc2ccccc12","InChI=1S/C21H25N/c1-21(2,3)15-8-5-9-16-22(4)17-19-13-10-12-18-11-6-7-14-20(18)19/h5-7,9-14H,16-17H2,1-4H3/b9-5+","DOMXUEMWDBAQBQ-WEVVVXLNSA-N"
"CN1CCN(CC1)C1=C2C=CC=CC2=Nc2ccc(Cl)cc2N1","InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,21H,8-11H2,1H3","ZUXABONWMNSFBN-UHFFFAOYSA-N"
"COc1ccc2n(C(=O)c3ccc(Cl)cc3)c(C)c(CC(O)=O)c2c1","InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)","CGIGDMFJXJATDK-UHFFFAOYSA-N"
"CC\C(=C(/c1ccccc1)c1ccc(OCCN(C)C)cc1)c1ccccc1","InChI=1S/C26H29NO/c1-4-25(21-11-7-5-8-12-21)26(22-13-9-6-10-14-22)23-15-17-24(18-16-23)28-20-19-27(2)3/h5-18H,4,19-20H2,1-3H3/b26-25-","NKANXQFJJICGDU-QPLCGJKRSA-N"
"CN1c2ncn(C)c2C(=O)N(CCCCC(C)=O)C1=O","InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3","BYPFEZZEUUWMEJ-UHFFFAOYSA-N"
"CC(O)(CS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F","InChI=1S/C18H14F4N2O4S/c1-17(26,10-29(27,28)14-6-3-12(19)4-7-14)16(25)24-13-5-2-11(9-23)15(8-13)18(20,21)22/h2-8,26H,10H2,1H3,(H,24,25)","LKJPYSCBVHEWIU-UHFFFAOYSA-N"
"CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1CCC[C@H]1C(O)=O","InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1","GBXSMTUPTTWBMN-XIRDDKMYSA-N"
"CCCCNc1ccc(cc1)C(=O)OCCN(C)C","InChI=1S/C15H24N2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3/h6-9,16H,4-5,10-12H2,1-3H3","GKCBAIGFKIBETG-UHFFFAOYSA-N"
"NC1=CC(C(O)=O)=C(O)C=C1","InChI=1S/C7H7NO3/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,9H,8H2,(H,10,11)","KBOPZPXVLCULAV-UHFFFAOYSA-N"
"COc1ccc(C(=O)c2ccccc2)c(O)c1","InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3","DXGLGDHPHMLXJC-UHFFFAOYSA-N"
"Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl","InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H","XEFQLINVKFYRCS-UHFFFAOYSA-N"
"Oc1ccc(Cl)cc1Cc1ccccc1","InChI=1S/C13H11ClO/c14-12-6-7-13(15)11(9-12)8-10-4-2-1-3-5-10/h1-7,9,15H,8H2","NCKMMSIFQUPKCK-UHFFFAOYSA-N"
"CCOC(=O)c1ccc(O)cc1","InChI=1S/C9H10O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3","NUVBSKCKDOMJSU-UHFFFAOYSA-N"
"CC(C)(c1cc(Br)c(O)c(Br)c1)c1cc(Br)c(O)c(Br)c1","InChI=1S/C15H12Br4O2/c1-15(2,7-3-9(16)13(20)10(17)4-7)8-5-11(18)14(21)12(19)6-8/h3-6,20-21H,1-2H3","VEORPZCZECFIRK-UHFFFAOYSA-N"
"CCCCOC(=O)c1ccc(O)cc1","InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3","QFOHBWFCKVYLES-UHFFFAOYSA-N"
"Oc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(Cl)c(Cl)c1","InChI=1S/C13H7Cl4NO2/c14-6-3-8(12(19)11(17)4-6)13(20)18-7-1-2-9(15)10(16)5-7/h1-5,19H,(H,18,20)","SJQBHPJLLIJASD-UHFFFAOYSA-N"
"Oc1ccc(Cl)cc1Cl","InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H","HFZWRUODUSTPEG-UHFFFAOYSA-N"
"Oc1ccc(cc1)S(=O)(=O)c1ccc(O)cc1","InChI=1S/C12H10O4S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8,13-14H","VPWNQTHUCYMVMZ-UHFFFAOYSA-N"
"CCCOC(=O)c1ccc(O)cc1","InChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3","QELSKZZBTMNZEB-UHFFFAOYSA-N"
"Oc1c(Br)cc(Cl)cc1Cc1cc(Cl)cc(Br)c1O","InChI=1S/C13H8Br2Cl2O2/c14-10-4-8(16)2-6(12(10)18)1-7-3-9(17)5-11(15)13(7)19/h2-5,18-19H,1H2","TYBHZVUFOINFDV-UHFFFAOYSA-N"
"Oc1ccc(Br)cc1","InChI=1S/C6H5BrO/c7-5-1-3-6(8)4-2-5/h1-4,8H","GZFGOTFRPZRKDS-UHFFFAOYSA-N"
"CC(=O)Nc1ccc(N)cc1","InChI=1S/C8H10N2O/c1-6(11)10-8-4-2-7(9)3-5-8/h2-5H,9H2,1H3,(H,10,11)","CHMBIJAOCISYEW-UHFFFAOYSA-N"
"Nc1ccc(c(N)c1)S(O)(=O)=O","InChI=1S/C6H8N2O3S/c7-4-1-2-6(5(8)3-4)12(9,10)11/h1-3H,7-8H2,(H,9,10,11)","JVMSQRAXNZPDHF-UHFFFAOYSA-N"
"CS(=O)(=O)c1ccc(C(=O)C2C(=O)CCCC2=O)c(Cl)c1","InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","PQTBTIFWAXVEPB-UHFFFAOYSA-N"
"NC(=O)c1ccc(N)cc1","InChI=1S/C7H8N2O/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H2,9,10)","QIKYZXDTTPVVAC-UHFFFAOYSA-N"
"CN1N(C(=O)C(N)=C1C)c1ccccc1","InChI=1S/C11H13N3O/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,12H2,1-2H3","RLFWWDJHLFCNIJ-UHFFFAOYSA-N"
"CC(=O)Nc1c(I)c(NC(C)=O)c(I)c(C(O)=O)c1I","InChI=1S/C11H9I3N2O4/c1-3(17)15-9-6(12)5(11(19)20)7(13)10(8(9)14)16-4(2)18/h1-2H3,(H,15,17)(H,16,18)(H,19,20)","YVPYQUNUQOZFHG-UHFFFAOYSA-N"
"CN1c2ncn(C)c2C(=O)N(C)C1=O","InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3","RYYVLZVUVIJVGH-UHFFFAOYSA-N"
"CC(=O)Nc1ccc(O)cc1","InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)","RZVAJINKPMORJF-UHFFFAOYSA-N"
"O=C1NS(=O)(=O)c2ccccc12","InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)","CVHZOJJKTDOEJC-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc2ccc(cc2c1)S(O)(=O)=O","InChI=1S/C10H8O6S2/c11-17(12,13)9-3-1-7-2-4-10(18(14,15)16)6-8(7)5-9/h1-6H,(H,11,12,13)(H,14,15,16)","VILFVXYKHXVYAB-UHFFFAOYSA-N"
"O=NN1CCOCC1","InChI=1S/C4H8N2O2/c7-5-6-1-3-8-4-2-6/h1-4H2","ZKXDGKXYMTYWTB-UHFFFAOYSA-N"
"CN1C(CCC1=O)c1cccnc1","InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3","UIKROCXWUNQSPJ-UHFFFAOYSA-N"
"Nc1nc(N)nc(N)n1","InChI=1S/C3H6N6/c4-1-7-2(5)9-3(6)8-1/h(H6,4,5,6,7,8,9)","JDSHMPZPIAZGSV-UHFFFAOYSA-N"
"S=C1NCCN1","InChI=1S/C3H6N2S/c6-3-4-1-2-5-3/h1-2H2,(H2,4,5,6)","PDQAZBWRQCGBEV-UHFFFAOYSA-N"
"NC(=N)NC(N)=O","InChI=1S/C2H6N4O/c3-1(4)6-2(5)7/h(H6,3,4,5,6,7)","SQSPRWMERUQXNE-UHFFFAOYSA-N"
"O=C1NC2=C(S1)C=CC=C2","InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)","YEDUAINPPJYDJZ-UHFFFAOYSA-N"
"CC12C=CC3=C4CCC(=O)C=C4CCC3C1CCC2O","InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h8-10,15-17,20H,2-7H2,1H3","MEHHPFQKXOUFFV-UHFFFAOYSA-N"
"CC12CCC3C(CC(=C)C4=CC(=O)C=CC34C)C1CCC2=O","InChI=1S/C20H24O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h6,8,11,14-16H,1,4-5,7,9-10H2,2-3H3","BFYIZQONLCFLEV-UHFFFAOYSA-N"
"CC12CCC3C(CCC4=CC(=O)CCC34)C1CCC2(O)C#C","InChI=1S/C20H26O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,12,15-18,22H,4-11H2,2H3","VIKNJXKGJWUCNN-UHFFFAOYSA-N"
"CC(=O)C1CCC2C3CCC4=CC(=O)CCC4(C)C3CCC12C","InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3","RJKFOVLPORLFTN-UHFFFAOYSA-N"
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"[H]C([H])(C([H])([H])S(O)(=O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8H5F13O3S/c9-3(10,1-2-25(22,23)24)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1-2H2,(H,22,23,24)","VIONGDJUYAYOPU-UHFFFAOYSA-N"
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"CCCCCC(=O)/C=C/C=C\C/C=C\C/C=C\CCCC(=O)O","InChI=1S/C20H30O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h4-5,8-11,14,17H,2-3,6-7,12-13,15-16,18H2,1H3,(H,22,23)/b5-4-,10-8-,11-9-,17-14+","YGJTUEISKATQSM-USWFWKISSA-N"
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"C(CCCCCC)CCCC=CCC=CCCC(OCC(COP(OCCN)(O)=O)OC(=O)CCC=CCC=CCC=CCC=CCC=CCCC)=O","InChI=1S/C43H72NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h7,9,13,15,19-20,23-26,29-32,41H,3-6,8,10-12,14,16-18,21-22,27-28,33-40,44H2,1-2H3,(H,47,48)/b9-7-,15-13-,20-19-,25-23-,26-24-,31-29-,32-30-","NZDVQHVTTWTVMW-DFEPEIOWSA-N"
"C(CC)=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OC(COP(O)(=O)OCCN)COC(CCC=CCC=CCCCCCCCCCC)=O","InChI=1S/C45H74NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-45(48)54-43(42-53-55(49,50)52-40-39-46)41-51-44(47)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,25-28,31-34,43H,3-4,6,8-10,12,14-16,18,20,23-24,29-30,35-42,46H2,1-2H3,(H,49,50)/b7-5-,13-11-,19-17-,22-21-,27-25-,28-26-,33-31-,34-32-","UWCJYOTVTHYMRF-XPMHQQHXSA-N"
"O(C(CCC=CCC=CCC=CCCCCCCC)=O)CC(OC(CCC=CCC=CCCCCCCCCCC)=O)COP(O)(=O)OCCN","InChI=1S/C41H72NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h15,17,21-24,27-30,39H,3-14,16,18-20,25-26,31-38,42H2,1-2H3,(H,45,46)/b17-15-,23-21-,24-22-,29-27-,30-28-","HIQJFUWUAGQURV-FOPRJHBCSA-N"
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"OP(=O)(OCCN)OCC(COC(=O)CCCCCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCCCCCCCCCC","InChI=1S/C42H80NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43)51-42(45)35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h23,25,29,31,40H,3-22,24,26-28,30,32-39,43H2,1-2H3,(H,46,47)/b25-23-,31-29-","GTOGJRHPAQPWSR-WGPKDLKGSA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(=O)OC(COP(OCCN)(O)=O)COC(CCCCCCCCCCCCCCCCCC)=O","InChI=1S/C44H80NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45)40-50-43(46)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13,15,19,21,25,27,31,33,42H,3-12,14,16-18,20,22-24,26,28-30,32,34-41,45H2,1-2H3,(H,48,49)/b15-13-,21-19-,27-25-,33-31-","GGEYNVXDNWJXIN-SLLFMANOSA-N"
"C(CCCCCCCCCCCC)CCCCCC(OCC(COP(OCCN)(O)=O)OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)=O","InChI=1S/C46H80NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-23-25-27-29-31-33-35-37-39-46(49)55-44(43-54-56(50,51)53-41-40-47)42-52-45(48)38-36-34-32-30-28-26-24-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22-23,27,29,33,35,44H,3-4,6,8-10,12,14-16,18,20-21,24-26,28,30-32,34,36-43,47H2,1-2H3,(H,50,51)/b7-5-,13-11-,19-17-,23-22-,29-27-,35-33-","PITVJCPCBXGCHJ-MXQGKLILSA-N"
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"C(COP(OCCN)(O)=O)(COC(CCCCCCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCCCCCCCCC","InChI=1S/C45H84NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-44(47)51-41-43(42-53-55(49,50)52-40-39-46)54-45(48)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h20,22,26,28,32,34,43H,3-19,21,23-25,27,29-31,33,35-42,46H2,1-2H3,(H,49,50)/b22-20-,28-26-,34-32-","FJLSFWWSNVGVIN-KWKIUDPJSA-N"
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"NCCOP(O)(=O)OCC(COC=CCCCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCC=CCC=CCCCCCC","InChI=1S/C43H78NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h13,15,19,21,24,26,30,32,35,38,42H,3-12,14,16-18,20,22-23,25,27-29,31,33-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b15-13-,21-19-,26-24-,32-30-,38-35+","RZZGAMUARHRLJN-ZOWVHDLQSA-N"
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"C(CCCCCCCCCCC)CCCCC=COCC(COP(OCCN)(O)=O)OC(CCC=CCC=CCC=CCC=CCCCCCCCC)=O","InChI=1S/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h17,19,22-23,26,28,32,34,37,40,44H,3-16,18,20-21,24-25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b19-17-,23-22-,28-26-,34-32-,40-37+","GZMXKUALKXYCMM-XSEHFSNESA-N"
"C(CCCCCCCCCCC)CCCCC=COCC(COP(OCCN)(O)=O)OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O","InChI=1S/C45H78NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22-23,26,28,32,34,37,40,44H,3-4,6,8-10,12,14-16,18,20-21,24-25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b7-5-,13-11-,19-17-,23-22-,28-26-,34-32-,40-37+","FIJFPUAJUDAZEY-NUANVQICSA-N"
"C(OP(OCC(COC=CCC=CCCCCCCCCCCCCC)OC(CCC=CCCCCCCCCCCCCC)=O)(O)=O)CN","InChI=1S/C41H78NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-46-38-40(39-48-50(44,45)47-37-35-42)49-41(43)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h27-30,33,36,40H,3-26,31-32,34-35,37-39,42H2,1-2H3,(H,44,45)/b29-27-,30-28-,36-33+","IEKMVBFEEDNXGT-WECHNZQXSA-N"
"NCCOP(OCC(OC(=O)CCC=CCC=CCC=CCC=CCCCCCC)COC=CCC=CCCCCCCCCCCCCC)(O)=O","InChI=1S/C43H76NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h13,15,19,21,24,26,29-32,35,38,42H,3-12,14,16-18,20,22-23,25,27-28,33-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b15-13-,21-19-,26-24-,31-29-,32-30-,38-35+","YJPYELPDWSEQHM-KTUZNUCGSA-N"
"O(C(COC=CCC=CCCCCCCCCCCCCC)COP(O)(=O)OCCN)C(=O)CCC=CCC=CCC=CCC=CCCCCCCCC","InChI=1S/C45H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h17,19,22-23,26,28,31-34,37,40,44H,3-16,18,20-21,24-25,27,29-30,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b19-17-,23-22-,28-26-,33-31-,34-32-,40-37+","LLGDMLIODPBDGJ-IVEVXDSTSA-N"
"O(C(COC=CCC=CCCCCCCCCCCCCC)COP(O)(=O)OCCN)C(=O)CCC=CCC=CCC=CCC=CCC=CCCCCC","InChI=1S/C45H78NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,26,28,31-34,37,40,44H,3-10,12,14-16,18,20-21,24-25,27,29-30,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b13-11-,19-17-,23-22-,28-26-,33-31-,34-32-,40-37+","BGXUVAFAQIKOQM-OYRSOWGGSA-N"
"C(=CCCC(OC(COC=CCC=CCCCCCCCCCCCCC)COP(O)(=O)OCCN)=O)CC=CCC=CCC=CCC=CCC=CCC","InChI=1S/C45H76NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22-23,26,28,31-34,37,40,44H,3-4,6,8-10,12,14-16,18,20-21,24-25,27,29-30,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b7-5-,13-11-,19-17-,23-22-,28-26-,33-31-,34-32-,40-37+","MEWSEYMCACAAEE-YLACOYRISA-N"
"C(=CCCC(=O)OC(COP(O)(=O)OCCN)COC=CCC=CCC=CCCCCCCCCCC)CC=CCC=CCC=CCC=CCC=CCC","InChI=1S/C45H74NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22-23,25-28,31-34,37,40,44H,3-4,6,8-10,12,14-16,18,20-21,24,29-30,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b7-5-,13-11-,19-17-,23-22-,27-25-,28-26-,33-31-,34-32-,40-37+","CQUWHUPPHYSSCA-QOAWOPSMSA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(=O)OC(COC=CCCCCCCCCCCCCCCCCCC)COP(OCCN)(O)=O","InChI=1S/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40-50-42-44(43-52-54(48,49)51-41-39-46)53-45(47)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16,20,22,26,28,32,34,37,40,44H,3-13,15,17-19,21,23-25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b16-14-,22-20-,28-26-,34-32-,40-37+","PZJZEOZHLWBYFI-MHNSSQRMSA-N"
"O(CC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(OCCN)(O)=O)C=CCCCCCCCCCCCCCCCCCC","InChI=1S/C47H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-47(49)55-46(45-54-56(50,51)53-43-41-48)44-52-42-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23-24,28,30,34,36,39,42,46H,3-4,6,8-10,12,14-16,18,20-22,25-27,29,31-33,35,37-38,40-41,43-45,48H2,1-2H3,(H,50,51)/b7-5-,13-11-,19-17-,24-23-,30-28-,36-34-,42-39+","GWWKPJFGKBNJDJ-DYEXTAMESA-N"
"C(OP(O)(=O)OCCN)C(COCCCCCCCCCCCCCCCC)OC(CCC=CCC=CCC=CCC=CCCCCCC)=O","InChI=1S/C41H76NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42)38-46-36-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h13,15,19-20,22,24,28,30,40H,3-12,14,16-18,21,23,25-27,29,31-39,42H2,1-2H3,(H,44,45)/b15-13-,20-19-,24-22-,30-28-","MAYZJBKZHVGHAB-HNBVIXCXSA-N"
"C(OP(O)(=O)OCCN)C(COCCCCCCCCCCCCCCCCCC)OC(CCC=CCC=CCCCCCCCCCC)=O","InChI=1S/C41H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-46-38-40(39-48-50(44,45)47-37-35-42)49-41(43)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h22,24,28,30,40H,3-21,23,25-27,29,31-39,42H2,1-2H3,(H,44,45)/b24-22-,30-28-","RFXWTAVLHHOPPS-JSCMVKKRSA-N"
"C(CCCCCCCCCCCCCCOCC(COP(OCCN)(O)=O)OC(CCC=CCC=CCCCCCCCCCC)=O)CCCCC","InChI=1S/C43H84NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-38-48-40-42(41-50-52(46,47)49-39-37-44)51-43(45)36-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h24,26,30,32,42H,3-23,25,27-29,31,33-41,44H2,1-2H3,(H,46,47)/b26-24-,32-30-","LJTFYNCGYVJVFV-QIPJBBGZSA-N"
"C(CCC(=O)OC(COP(OCCN)(O)=O)COCCCCCCCCCCCCCCCCCC)=CCC=CCC=CCC=CCCCCCC","InChI=1S/C43H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h13,15,19,21,24,26,30,32,42H,3-12,14,16-18,20,22-23,25,27-29,31,33-41,44H2,1-2H3,(H,46,47)/b15-13-,21-19-,26-24-,32-30-","DTYWTGFWGGLGBS-NZPWPDRSSA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(=O)OC(COP(OCCN)(O)=O)COCCCCCCCCCCCCCCCCCCCC","InChI=1S/C45H84NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40-50-42-44(43-52-54(48,49)51-41-39-46)53-45(47)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16,20,22,26,28,32,34,44H,3-13,15,17-19,21,23-25,27,29-31,33,35-43,46H2,1-2H3,(H,48,49)/b16-14-,22-20-,28-26-,34-32-","BLFJXWVGBRMOTJ-CDNBUOKMSA-N"
"P(OCC(COCCCCCCCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)(OCCN)(O)=O","InChI=1S/C47H84NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-47(49)55-46(45-54-56(50,51)53-43-41-48)44-52-42-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23-24,28,30,34,36,46H,3-4,6,8-10,12,14-16,18,20-22,25-27,29,31-33,35,37-45,48H2,1-2H3,(H,50,51)/b7-5-,13-11-,19-17-,24-23-,30-28-,36-34-","CQIPPLYYEQYRAX-JQIYMLLDSA-N"
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"CCCCCCCCCC=CCC=CCC=CCCC(=O)OC(CO)COP(O)(=O)OCCN","InChI=1S/C25H46NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)33-24(22-27)23-32-34(29,30)31-21-20-26/h10-11,13-14,16-17,24,27H,2-9,12,15,18-23,26H2,1H3,(H,29,30)/b11-10-,14-13-,17-16-","BGJVXSMYONPLDN-NWFXIAEYSA-N"
"CCCCCCC=CCC=CCC=CCC=CCCC(=O)OC(CO)COP(O)(=O)OCCN","InChI=1S/C25H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)33-24(22-27)23-32-34(29,30)31-21-20-26/h7-8,10-11,13-14,16-17,24,27H,2-6,9,12,15,18-23,26H2,1H3,(H,29,30)/b8-7-,11-10-,14-13-,17-16-","SOFGMCJQWLTKCE-ZKWNWVNESA-N"
"CCCC=CCC=CCC=CCC=CCC=CCCC(=O)OC(CO)COP(O)(=O)OCCN","InChI=1S/C25H42NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-25(28)33-24(22-27)23-32-34(29,30)31-21-20-26/h4-5,7-8,10-11,13-14,16-17,24,27H,2-3,6,9,12,15,18-23,26H2,1H3,(H,29,30)/b5-4-,8-7-,11-10-,14-13-,17-16-","UNILCTDPRMGSDM-JEBPEJKESA-N"
"CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)OC(CO)COP(O)(=O)OCCN","InChI=1S/C27H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-27(30)35-26(24-29)25-34-36(31,32)33-23-22-28/h3-4,6-7,9-10,12-13,15-16,18-19,26,29H,2,5,8,11,14,17,20-25,28H2,1H3,(H,31,32)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-","TWBVHOYVCUOMJY-KUBAVDMBSA-N"
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"P(OCC(CO)O)(O)(=O)OCC(OC(=O)CCC=CCC=CCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC","InChI=1S/C40H75O10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(44)50-38(36-49-51(45,46)48-34-37(42)33-41)35-47-39(43)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h20,22,26,28,37-38,41-42H,3-19,21,23-25,27,29-36H2,1-2H3,(H,45,46)/b22-20-,28-26-","SHHLVVJXLWXVNI-BAOXYHDDSA-N"
"C(CCCC(=O)OCC(COP(OCC(O)CO)(O)=O)OC(=O)CCC=CCC=CCCCCCCCCCCCC)CCCCCCCCCCC","InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-42(46)52-40(38-51-53(47,48)50-36-39(44)35-43)37-49-41(45)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h22,24,28,30,39-40,43-44H,3-21,23,25-27,29,31-38H2,1-2H3,(H,47,48)/b24-22-,30-28-","BWROGLIMDHGHPP-JSCMVKKRSA-N"
"C(CCCCCC)CCCCCCCCCCC(=O)OCC(COP(OCC(O)CO)(O)=O)OC(=O)CCC=CCC=CCCCCCCCCCC","InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h22,24,28,30,39-40,43-44H,3-21,23,25-27,29,31-38H2,1-2H3,(H,47,48)/b24-22-,30-28-","AOWDUWHTDPWHIC-JSCMVKKRSA-N"
"C(C(OC(=O)CCC=CCCCCCCCCCCCCC)COP(OCC(O)CO)(O)=O)OC(CCC=CCCCCCCCCCCCCC)=O","InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h27-30,39-40,43-44H,3-26,31-38H2,1-2H3,(H,47,48)/b29-27-,30-28-","VCGWKVSKEWOYEM-ZUELCTOOSA-N"
"O=C(CCC=CCCCCCCCCCCCCC)OCC(COP(OCC(O)CO)(O)=O)OC(=O)CCC=CCC=CCCCCCCCCCC","InChI=1S/C42H77O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h22,24,27-30,39-40,43-44H,3-21,23,25-26,31-38H2,1-2H3,(H,47,48)/b24-22-,29-27-,30-28-","YNBZQPMSTPSIJD-XBCPOCNBSA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(OC(COC(=O)CCC=CCCCCCCCCCCCCC)COP(O)(=O)OCC(O)CO)=O","InChI=1S/C44H77O10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-44(48)54-42(40-53-55(49,50)52-38-41(46)37-45)39-51-43(47)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h13,15,19-20,24,26,29-32,41-42,45-46H,3-12,14,16-18,21-23,25,27-28,33-40H2,1-2H3,(H,49,50)/b15-13-,20-19-,26-24-,31-29-,32-30-","ITIOHRDVKOPUBF-MOYSMJPMSA-N"
"C(CCCCCCCC)CCCCC=CCCC(=O)OCC(OC(CCC=CCC=CCC=CCC=CCC=CCCC)=O)COP(O)(=O)OCC(O)CO","InChI=1S/C44H75O10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-44(48)54-42(40-53-55(49,50)52-38-41(46)37-45)39-51-43(47)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h7,9,13,15,19-20,24,26,29-32,41-42,45-46H,3-6,8,10-12,14,16-18,21-23,25,27-28,33-40H2,1-2H3,(H,49,50)/b9-7-,15-13-,20-19-,26-24-,31-29-,32-30-","QBXWEUHSBYVVIQ-XKMJRSRDSA-N"
"C(CC=CCC=CCCC(OC(COP(OCC(CO)O)(O)=O)COC(=O)CCC=CCCCCCCCCCCCCC)=O)=CCC=CCC=CCCCCC","InChI=1S/C46H79O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-46(50)56-44(42-55-57(51,52)54-40-43(48)39-47)41-53-45(49)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,26,28,31-34,43-44,47-48H,3-10,12,14-16,18,20,23-25,27,29-30,35-42H2,1-2H3,(H,51,52)/b13-11-,19-17-,22-21-,28-26-,33-31-,34-32-","SDJOKCPHTLSGSK-RRIMUHHXSA-N"
"C(CC=CCC=CCC=CCC=CCC=CCC=CCC)C(OC(COP(OCC(CO)O)(O)=O)COC(=O)CCC=CCCCCCCCCCCCCC)=O","InChI=1S/C46H77O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-46(50)56-44(42-55-57(51,52)54-40-43(48)39-47)41-53-45(49)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,26,28,31-34,43-44,47-48H,3-4,6,8-10,12,14-16,18,20,23-25,27,29-30,35-42H2,1-2H3,(H,51,52)/b7-5-,13-11-,19-17-,22-21-,28-26-,33-31-,34-32-","VGGGUMPTGJTNFQ-QRPORDCISA-N"
"C(CCCCCC)CCCC=CCC=CCCC(=O)OCC(COP(OCC(O)CO)(O)=O)OC(=O)CCC=CCC=CCCCCCCCCCC","InChI=1S/C42H75O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h21-24,27-30,39-40,43-44H,3-20,25-26,31-38H2,1-2H3,(H,47,48)/b23-21-,24-22-,29-27-,30-28-","WZACVMOHPZANSW-WRGXGLASSA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(OC(COP(O)(=O)OCC(O)CO)COC(=O)CCC=CCC=CCCCCCCCCCC)=O","InChI=1S/C44H75O10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-44(48)54-42(40-53-55(49,50)52-38-41(46)37-45)39-51-43(47)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h13,15,19-20,23-26,29-32,41-42,45-46H,3-12,14,16-18,21-22,27-28,33-40H2,1-2H3,(H,49,50)/b15-13-,20-19-,25-23-,26-24-,31-29-,32-30-","YOXNNFKWZGKUBQ-IPVVXUKZSA-N"
"C(=CCC=CCCC(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(OCC(CO)O)(O)=O)=O)CCCCCCCCCC","InChI=1S/C46H75O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-46(50)56-44(42-55-57(51,52)54-40-43(48)39-47)41-53-45(49)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,25-28,31-34,43-44,47-48H,3-4,6,8-10,12,14-16,18,20,23-24,29-30,35-42H2,1-2H3,(H,51,52)/b7-5-,13-11-,19-17-,22-21-,27-25-,28-26-,33-31-,34-32-","QVDNNCVPBKNHNS-XPMHQQHXSA-N"
"OCC(COP(OCC(COC(=O)CCC=CCC=CCC=CCCCCCCCCC)OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)(O)=O)O","InChI=1S/C48H77O10P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-48(52)58-46(44-57-59(53,54)56-42-45(50)41-49)43-55-47(51)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19-20,22-24,27-30,33-36,45-46,49-50H,3-4,6,8-10,12,14-16,18,21,25-26,31-32,37-44H2,1-2H3,(H,53,54)/b7-5-,13-11-,19-17-,23-20-,24-22-,29-27-,30-28-,35-33-,36-34-","QVNMBAKBHHJIRP-GKYWKYGOSA-N"
"OCC(COP(OCC(COC(CCC=CCC=CCC=CCC=CCCCCCC)=O)OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)(O)=O)O","InChI=1S/C48H75O10P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-48(52)58-46(44-57-59(53,54)56-42-45(50)41-49)43-55-47(51)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19-20,22-24,27-30,33-36,45-46,49-50H,3-4,6,8-10,12,15,18,21,25-26,31-32,37-44H2,1-2H3,(H,53,54)/b7-5-,13-11-,16-14-,19-17-,23-20-,24-22-,29-27-,30-28-,35-33-,36-34-","WAHLPBOVXFIGAP-YARNEYDXSA-N"
"O=C(CCC=CCC=CCC=CCC=CCCCCCCCC)OC(COP(O)(=O)OCC(O)CO)COC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O","InChI=1S/C50H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-49(53)57-45-48(46-59-61(55,56)58-44-47(52)43-51)60-50(54)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,23-26,29-32,35-38,47-48,51-52H,3-4,6,8-10,12,14-16,21-22,27-28,33-34,39-46H2,1-2H3,(H,55,56)/b7-5-,13-11-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-","NKQMVGLKBUHTCY-JKIJTENUSA-N"
"C(C=CCC=CCC=CCC=CCC=CCCC(=O)OC(COP(O)(=O)OCC(O)CO)COC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)CCCC","InChI=1S/C50H77O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-49(53)57-45-48(46-59-61(55,56)58-44-47(52)43-51)60-50(54)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-32,35-38,47-48,51-52H,3-4,6,8-10,15-16,21-22,27-28,33-34,39-46H2,1-2H3,(H,55,56)/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-","XHLZURIDNJOINR-WBRRUXEESA-N"
"C(C=CCC=CCC=CCC=CCC=CCC)C=CCCC(=O)OC(COP(O)(=O)OCC(O)CO)COC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O","InChI=1S/C50H75O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-49(53)57-45-48(46-59-61(55,56)58-44-47(52)43-51)60-50(54)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5-8,11-14,17-20,23-26,29-32,35-38,47-48,51-52H,3-4,9-10,15-16,21-22,27-28,33-34,39-46H2,1-2H3,(H,55,56)/b7-5-,8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-","XACKZSRNTPEYBU-GZSOIYOPSA-N"
"C(CCC(=O)OCC(OC(=O)CCC=CCCCCCCCCCCCCC)COP(OC(C1O)C(C(C(C1O)O)O)O)(O)=O)CCCCCCCCCCCC","InChI=1S/C43H81O13P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(45)55-35(34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50)33-53-36(44)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h26,28,35,38-43,46-50H,3-25,27,29-34H2,1-2H3,(H,51,52)/b28-26-/t35?,38-,39-,40+,41-,42-,43-/m1/s1","IBBOEPTXNHPBRH-AFOMSZMQSA-N"
"C(CCCCC=CCC=CCCC(OC(COP(OC(C1O)C(C(C(C1O)O)O)O)(O)=O)COC(=O)CCCCCCCCCCCCCCC)=O)CCCCC","InChI=1S/C43H79O13P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(45)55-35(34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50)33-53-36(44)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h20,22,26,28,35,38-43,46-50H,3-19,21,23-25,27,29-34H2,1-2H3,(H,51,52)/b22-20-,28-26-/t35?,38-,39-,40+,41-,42-,43-/m1/s1","UKUWCMCEVNAMQA-DNPFOPPISA-N"
"C(CCCCCCCCCCCC)CCC(=O)OCC(OC(CCC=CCC=CCC=CCCCCCCCCC)=O)COP(O)(=O)OC(C(O)1)C(O)C(O)C(O)C(O)1","InChI=1S/C45H81O13P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(47)57-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)35-55-38(46)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h18-19,22,24,28,30,37,40-45,48-52H,3-17,20-21,23,25-27,29,31-36H2,1-2H3,(H,53,54)/b19-18-,24-22-,30-28-/t37?,40-,41-,42+,43-,44-,45-/m1/s1","TYVNWAWTRSCTFD-PSOMHJJNSA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(O)(=O)OC(C(O)1)C(O)C(O)C(O)C(O)1","InChI=1S/C45H79O13P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(47)57-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)35-55-38(46)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h13,15,18-19,22,24,28,30,37,40-45,48-52H,3-12,14,16-17,20-21,23,25-27,29,31-36H2,1-2H3,(H,53,54)/b15-13-,19-18-,24-22-,30-28-/t37?,40-,41-,42+,43-,44-,45-/m1/s1","QAOYQEIOBPZFPB-VHZSRAIHSA-N"
"C(CCCCCCCCCCCC)CCC(=O)OCC(OC(CCC=CCC=CCC=CCC=CCC=CCCC)=O)COP(O)(=O)OC(C(O)1)C(O)C(O)C(O)C(O)1","InChI=1S/C45H77O13P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-39(47)57-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)35-55-38(46)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h7,9,13,15,18-19,22,24,28,30,37,40-45,48-52H,3-6,8,10-12,14,16-17,20-21,23,25-27,29,31-36H2,1-2H3,(H,53,54)/b9-7-,15-13-,19-18-,24-22-,30-28-/t37?,40-,41-,42+,43-,44-,45-/m1/s1","CTYGZBOFLKSVSJ-AYZKUARYSA-N"
"C(CC=CCC=CCC=CCC=CCC=CCC)=CCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(OC(C(O)1)C(O)C(C(O)C(O)1)O)(O)=O","InChI=1S/C47H79O13P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-41(49)59-39(38-58-61(55,56)60-47-45(53)43(51)42(50)44(52)46(47)54)37-57-40(48)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,24,26,30,32,39,42-47,50-54H,3-4,6,8-10,12,14-16,19,22-23,25,27-29,31,33-38H2,1-2H3,(H,55,56)/b7-5-,13-11-,18-17-,21-20-,26-24-,32-30-/t39?,42-,43-,44+,45-,46-,47-/m1/s1","FPHAZHKZJQOPBU-BXVYXOBNSA-N"
"C(CC(=O)OCC(OC(CCC=CCC=CCCCCCCCCCC)=O)COP(OC(C1O)C(C(C(C1O)O)O)O)(O)=O)C=CCCCCCCCCCCC","InChI=1S/C43H77O13P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-37(45)55-35(34-54-57(51,52)56-43-41(49)39(47)38(46)40(48)42(43)50)33-53-36(44)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h20,22,25-28,35,38-43,46-50H,3-19,21,23-24,29-34H2,1-2H3,(H,51,52)/b22-20-,27-25-,28-26-/t35?,38-,39-,40+,41-,42-,43-/m1/s1","JHVZQBRAEVIBML-DVHZKANPSA-N"
"C(CCCCCCCCCC(=O)OCC(COP(OC(C(O)1)C(O)C(C(O)C(O)1)O)(O)=O)OC(CCC=CCC=CCC=CCC=CCCCCCC)=O)CCCCCC","InChI=1S/C46H81O13P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-40(48)58-38(37-57-60(54,55)59-46-44(52)42(50)41(49)43(51)45(46)53)36-56-39(47)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h13,15,19-20,23,25,29,31,38,41-46,49-53H,3-12,14,16-18,21-22,24,26-28,30,32-37H2,1-2H3,(H,54,55)/b15-13-,20-19-,25-23-,31-29-/t38?,41-,42-,43+,44-,45-,46-/m1/s1","DFLHJZQZIPIWSG-VAUUZOHPSA-N"
"C(CCCCCC=CCC=CCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCC)COP(O)(=O)OC(C(O)1)C(O)C(O)C(O)C(O)1)CCCC","InChI=1S/C45H83O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)55-35-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)57-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h22,24,28,30,37,40-45,48-52H,3-21,23,25-27,29,31-36H2,1-2H3,(H,53,54)/b24-22-,30-28-/t37?,40-,41-,42+,43-,44-,45-/m1/s1","DJIHJMQVAWUMQB-GRNFJTJUSA-N"
"C(CCCCCCCC(=O)OCC(COP(OC(C(O)1)C(O)C(C(O)C(O)1)O)(O)=O)OC(CCC=CCC=CCC=CCCCCCCCCC)=O)CCCCCCCCC","InChI=1S/C47H85O13P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(49)59-39(38-58-61(55,56)60-47-45(53)43(51)42(50)44(52)46(47)54)37-57-40(48)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,24,26,30,32,39,42-47,50-54H,3-18,21-23,25,27-29,31,33-38H2,1-2H3,(H,55,56)/b20-19-,26-24-,32-30-/t39?,42-,43-,44+,45-,46-,47-/m1/s1","IVPVQEZYLVFIGH-FLPISHNPSA-N"
"C(CCCC=CCC=CCC=CCC=CCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCC)COP(OC(C(O)1)C(O)C(C(O)C(O)1)O)(O)=O)CC","InChI=1S/C47H83O13P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(49)59-39(38-58-61(55,56)60-47-45(53)43(51)42(50)44(52)46(47)54)37-57-40(48)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h13,15,19-20,24,26,30,32,39,42-47,50-54H,3-12,14,16-18,21-23,25,27-29,31,33-38H2,1-2H3,(H,55,56)/b15-13-,20-19-,26-24-,32-30-/t39?,42-,43-,44+,45-,46-,47-/m1/s1","QTBZDDLLDFZGQX-KVUJAYRISA-N"
"C(C=CCC=CCC=CCC=CCCC)C=CCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCC)COP(OC(C(O)1)C(O)C(C(O)C(O)1)O)(O)=O","InChI=1S/C47H81O13P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-41(49)59-39(38-58-61(55,56)60-47-45(53)43(51)42(50)44(52)46(47)54)37-57-40(48)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h7,9,13,15,19-20,24,26,30,32,39,42-47,50-54H,3-6,8,10-12,14,16-18,21-23,25,27-29,31,33-38H2,1-2H3,(H,55,56)/b9-7-,15-13-,20-19-,26-24-,32-30-/t39?,42-,43-,44+,45-,46-,47-/m1/s1","CZXYESCYMAKGKD-BRWUPIELSA-N"
"O(P(OCC(OC(CCC=CCC=CCC=CCC=CCCCCCCCC)=O)COC(=O)CCCCCCCCCCCCCCCCC)(O)=O)C(C1O)C(C(C(C1O)O)O)O","InChI=1S/C49H87O13P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-43(51)61-41(40-60-63(57,58)62-49-47(55)45(53)44(52)46(54)48(49)56)39-59-42(50)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h17,19,21-22,26,28,32,34,41,44-49,52-56H,3-16,18,20,23-25,27,29-31,33,35-40H2,1-2H3,(H,57,58)/b19-17-,22-21-,28-26-,34-32-/t41?,44-,45-,46+,47-,48-,49-/m1/s1","LBMMQTGWTSTFIZ-WJEBLFDXSA-N"
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"O(P(OCC(OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)COC(=O)CCCCCCCCCCCCCCCCC)(O)=O)C(C1O)C(C(C(C1O)O)O)O","InChI=1S/C49H83O13P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-43(51)61-41(40-60-63(57,58)62-49-47(55)45(53)44(52)46(54)48(49)56)39-59-42(50)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,26,28,32,34,41,44-49,52-56H,3-4,6,8-10,12,14-16,18,20,23-25,27,29-31,33,35-40H2,1-2H3,(H,57,58)/b7-5-,13-11-,19-17-,22-21-,28-26-,34-32-/t41?,44-,45-,46+,47-,48-,49-/m1/s1","DJVOKHFQPGWUPK-CONVNOKZSA-N"
"C(CCCCCCCC)CCCCC=CCCC(=O)OCC(OC(CCC=CCC=CCCCCCCCCCC)=O)COP(OC(C(O)1)C(O)C(O)C(O)C(O)1)(O)=O","InChI=1S/C45H81O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(46)55-35-37(36-56-59(53,54)58-45-43(51)41(49)40(48)42(50)44(45)52)57-39(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h22,24,27-30,37,40-45,48-52H,3-21,23,25-26,31-36H2,1-2H3,(H,53,54)/b24-22-,29-27-,30-28-/t37?,40-,41-,42+,43-,44-,45-/m1/s1","YWXCZYNZOLHDAW-RFSLHEDBSA-N"
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"OC(C(O)1)C(C(O)C(O)C(OP(O)(=O)OCC(COC(CCC=CCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)1)O","InChI=1S/C49H81O13P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-43(51)61-41(40-60-63(57,58)62-49-47(55)45(53)44(52)46(54)48(49)56)39-59-42(50)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,26,28,31-34,41,44-49,52-56H,3-4,6,8-10,12,14-16,18,20,23-25,27,29-30,35-40H2,1-2H3,(H,57,58)/b7-5-,13-11-,19-17-,22-21-,28-26-,33-31-,34-32-/t41?,44-,45-,46+,47-,48-,49-/m1/s1","HJWMMUBGTHVMFN-VPCUEIIDSA-N"
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"O(P(OCC(OC(CCC=CCC=CCC=CCC=CCCCCCC)=O)COC(CCCCCCCCCCCCCCCCCCC)=O)(O)=O)C(C1O)C(C(C(C1O)O)O)O","InChI=1S/C49H87O13P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-42(50)59-39-41(40-60-63(57,58)62-49-47(55)45(53)44(52)46(54)48(49)56)61-43(51)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h14,16,20,22,26,28,32,34,41,44-49,52-56H,3-13,15,17-19,21,23-25,27,29-31,33,35-40H2,1-2H3,(H,57,58)/b16-14-,22-20-,28-26-,34-32-/t41?,44-,45-,46+,47-,48-,49-/m1/s1","NBBYCIYUCRZFFV-LLKVLBNOSA-N"
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"O(P(O)(=O)OCC(CO)OC(=O)CCC=CCCCCCCCCCCCCC)C(C1O)C(C(C(C1O)O)O)O","InChI=1S/C27H51O12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(29)38-20(18-28)19-37-40(35,36)39-27-25(33)23(31)22(30)24(32)26(27)34/h14-15,20,22-28,30-34H,2-13,16-19H2,1H3,(H,35,36)/b15-14-/t20?,22-,23-,24+,25-,26-,27-/m1/s1","OVHGUPNHWUHPOM-DBFVMBBUSA-N"
"C(N)(C(O)=O)COP(OCC(COC(CCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCC=CCCCCCC)(O)=O","InChI=1S/C42H74NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-41(45)53-38(36-51-54(48,49)52-37-39(43)42(46)47)35-50-40(44)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h13,15,18-19,22,24,28,30,38-39H,3-12,14,16-17,20-21,23,25-27,29,31-37,43H2,1-2H3,(H,46,47)(H,48,49)/b15-13-,19-18-,24-22-,30-28-","SPHVTAIQBHDJQC-WRDNLCFKSA-N"
"C(CC)=CCC=CCC=CCC=CCC=CCC=CCCC(OC(COC(CCCCCCCCCCCCCCC)=O)COP(OCC(C(O)=O)N)(O)=O)=O","InChI=1S/C44H74NO10P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20-21,24,26,30,32,40-41H,3-4,6,8-10,12,14-16,19,22-23,25,27-29,31,33-39,45H2,1-2H3,(H,48,49)(H,50,51)/b7-5-,13-11-,18-17-,21-20-,26-24-,32-30-","PWBBJQOVCTWPIM-LGFBOSHVSA-N"
"C(N)(C(O)=O)COP(OCC(COC(CCCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCC=CCCCCCC)(O)=O","InChI=1S/C43H76NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-42(46)54-39(37-52-55(49,50)53-38-40(44)43(47)48)36-51-41(45)34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h13,15,19-20,23,25,29,31,39-40H,3-12,14,16-18,21-22,24,26-28,30,32-38,44H2,1-2H3,(H,47,48)(H,49,50)/b15-13-,20-19-,25-23-,31-29-","BPPNSMDUPJTVAF-VTJLAKARSA-N"
"C(CCCCCC)CCCCCCCCCCC(OCC(COP(OCC(N)C(O)=O)(O)=O)OC(CCC=CCCCCCCCCCCCCC)=O)=O","InChI=1S/C42H80NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h28,30,38-39H,3-27,29,31-37,43H2,1-2H3,(H,46,47)(H,48,49)/b30-28-","GPSKZJNTROFFOC-HYOGKJQXSA-N"
"C(CCCCCC)CCCCCCCCCCC(OCC(COP(OCC(N)C(O)=O)(O)=O)OC(=O)CCC=CCC=CCCCCCCCCCC)=O","InChI=1S/C42H78NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-40(44)50-35-38(36-51-54(48,49)52-37-39(43)42(46)47)53-41(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h22,24,28,30,38-39H,3-21,23,25-27,29,31-37,43H2,1-2H3,(H,46,47)(H,48,49)/b24-22-,30-28-","VMDCGUSYZOIAGZ-JSCMVKKRSA-N"
"C(CCCCC)CCCC=CCC=CCC=CCCC(OC(COC(CCCCCCCCCCCCCCCCC)=O)COP(OCC(C(O)=O)N)(O)=O)=O","InChI=1S/C44H80NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h19-20,24,26,30,32,40-41H,3-18,21-23,25,27-29,31,33-39,45H2,1-2H3,(H,48,49)(H,50,51)/b20-19-,26-24-,32-30-","JRRYKGRILWVSHS-JCXYTCFZSA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(OC(COC(CCCCCCCCCCCCCCCCC)=O)COP(OCC(C(O)=O)N)(O)=O)=O","InChI=1S/C44H78NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h13,15,19-20,24,26,30,32,40-41H,3-12,14,16-18,21-23,25,27-29,31,33-39,45H2,1-2H3,(H,48,49)(H,50,51)/b15-13-,20-19-,26-24-,32-30-","AENVCOSUVDLDFA-NQWSYULSSA-N"
"C(CCCCCCC)CCCCCCCCCC(=O)OCC(OC(CCC=CCC=CCC=CCC=CCC=CCCC)=O)COP(OCC(C(O)=O)N)(O)=O","InChI=1S/C44H76NO10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(47)55-40(38-53-56(50,51)54-39-41(45)44(48)49)37-52-42(46)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h7,9,13,15,19-20,24,26,30,32,40-41H,3-6,8,10-12,14,16-18,21-23,25,27-29,31,33-39,45H2,1-2H3,(H,48,49)(H,50,51)/b9-7-,15-13-,20-19-,26-24-,32-30-","OYCMFOXJRHYXHL-HDSNJYMDSA-N"
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"O(C(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)C(COP(OCCN)(O)=O)COC(CCC=CCC=CCC=CCC=CCC=CCCCCC)=O","InChI=1S/C49H76NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-48(51)55-45-47(46-57-59(53,54)56-44-43-50)58-49(52)42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,23-26,29-32,35-38,47H,3-5,7,9-10,15-16,21-22,27-28,33-34,39-46,50H2,1-2H3,(H,53,54)/b8-6-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,37-35-,38-36-","IWZCRDQSSLJDNV-CYFORYSFSA-N"
"C(C(COC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)OC(CCC=CCC=CCC=CCC=CCC=CCC=CCCCC)=O)OP(O)(=O)OCCN","InChI=1S/C51H78NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-51(54)60-49(48-59-61(55,56)58-46-45-52)47-57-50(53)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h6,8-9,11-12,14-15,17-18,20-21,23,25-28,31-34,37-40,49H,3-5,7,10,13,16,19,22,24,29-30,35-36,41-48,52H2,1-2H3,(H,55,56)/b8-6-,11-9-,14-12-,17-15-,20-18-,23-21-,27-25-,28-26-,33-31-,34-32-,39-37-,40-38-","RYRYLVYZMTURGB-RIJNFFOPSA-N"
"C(C=CCC=CCCC(=O)OCC(COP(O)(=O)OCCN)OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)C=CCC=CCCCCCCCCCC","InChI=1S/C51H82NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-27-29-31-33-35-37-39-41-43-50(53)57-47-49(48-59-61(55,56)58-46-45-52)60-51(54)44-42-40-38-36-34-32-30-28-25-22-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,20-21,23,25-28,31-34,37-40,49H,3-5,7,9-11,13,15-17,19,22,24,29-30,35-36,41-48,52H2,1-2H3,(H,55,56)/b8-6-,14-12-,20-18-,23-21-,27-26-,28-25-,33-31-,34-32-,39-37-,40-38-","OYZJPILFCCHSQR-UNVMLCDQSA-N"
"C(CCCCCCCCCCCCC(=O)OC(COP(O)(=O)OCCN)COC=CCCCCCCCCCCCCCC)CCCCCC","InChI=1S/C41H82NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42)38-46-36-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h33,36,40H,3-32,34-35,37-39,42H2,1-2H3,(H,44,45)/b36-33+","LGFRBARRRZCSBV-PKUSAGTQSA-N"
"C(=COCC(OC(CCC=CCC=CCCCCCCCCCCCC)=O)COP(O)(=O)OCCN)CCCCCCCCCCCCCC","InChI=1S/C41H78NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42)38-46-36-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h22,24,28,30,33,36,40H,3-21,23,25-27,29,31-32,34-35,37-39,42H2,1-2H3,(H,44,45)/b24-22-,30-28-,36-33+","NDDBMPXGHSKRHS-CZAAGYDRSA-N"
"NCCOP(O)(=O)OCC(COC=CCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC","InChI=1S/C43H74NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24,26,30,32,35,38,42H,3-4,6,8-10,12,14-16,18,20,23,25,27-29,31,33-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b7-5-,13-11-,19-17-,22-21-,26-24-,32-30-,38-35+","WVGALBKSWOUIEZ-ULUZTLKMSA-N"
"NCCOP(O)(=O)OCC(COC=CCCCCCCCCCCCCCC)OC(CCC=CCC=CCC=CCC=CCCCCCCCCCC)=O","InChI=1S/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-18-16-14-12-10-8-6-4-2/h20-21,23-24,26,28,32,34,37,40,44H,3-19,22,25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b21-20-,24-23-,28-26-,34-32-,40-37+","CXLQRZCNUQQELB-FGJYPOMBSA-N"
"NCCOP(O)(=O)OCC(COC=CCCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCC=CCC=CCCCCCC","InChI=1S/C42H76NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-35-42(44)50-41(40-49-51(45,46)48-38-36-43)39-47-37-34-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h13,15,19-20,23,25,29,31,34,37,41H,3-12,14,16-18,21-22,24,26-28,30,32-33,35-36,38-40,43H2,1-2H3,(H,45,46)/b15-13-,20-19-,25-23-,31-29-,37-34+","QTIWXGKYYKPQFH-FKQGHMTJSA-N"
"NCCOP(O)(=O)OCC(COC=CCCCCCCCCCCCCCCC)OC(CCC=CCC=CCC=CCC=CCCCCCCCC)=O","InChI=1S/C44H80NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-25-27-29-31-33-35-37-44(46)52-43(42-51-53(47,48)50-40-38-45)41-49-39-36-34-32-30-28-26-24-18-16-14-12-10-8-6-4-2/h17,19,21-22,25,27,31,33,36,39,43H,3-16,18,20,23-24,26,28-30,32,34-35,37-38,40-42,45H2,1-2H3,(H,47,48)/b19-17-,22-21-,27-25-,33-31-,39-36+","HYJDBLFZSYMOCC-ORTLTHOASA-N"
"NCCOP(OCC(OC(CCCCCCCCCCCCCCC)=O)COC=CCCCCCCCCCCCCCCCC)(O)=O","InChI=1S/C39H78NO7P/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-34-44-36-38(37-46-48(42,43)45-35-33-40)47-39(41)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h31,34,38H,3-30,32-33,35-37,40H2,1-2H3,(H,42,43)/b34-31+","HEASGCOZOMIKFU-WUVHBKSUSA-N"
"C(CCCCCCCCCC(OC(COC=CCCCCCCCCCCCCCCCC)COP(OCCN)(O)=O)=O)CCCCCCCCC","InChI=1S/C43H86NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h35,38,42H,3-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b38-35+","ALJUYAAJNSNTHU-OBEQGSJMSA-N"
"NCCOP(O)(=O)OCC(COC=CCCCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCCCCCCCCCCCC","InChI=1S/C43H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h24,26,30,32,35,38,42H,3-23,25,27-29,31,33-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b26-24-,32-30-,38-35+","PWKATOOFMDDUBO-SGMJUNKUSA-N"
"NCCOP(O)(=O)OCC(COC=CCCCCCCCCCCCCCCCC)OC(=O)CCC=CCC=CCC=CCCCCCCCCC","InChI=1S/C43H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h19,21,24,26,30,32,35,38,42H,3-18,20,22-23,25,27-29,31,33-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b21-19-,26-24-,32-30-,38-35+","IAZMKBZMIIUNID-DXSDZVOISA-N"
"C(CCCCCCCCCCC)CCCCC=COCC(COP(OCCN)(O)=O)OC(CCC=CCCCCCCCCCCCCCCCCC)=O","InChI=1S/C45H88NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h32,34,37,40,44H,3-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b34-32-,40-37+","MIKCEBQQTIVKSQ-LITAQCTLSA-N"
"C(CCCCCCCCCCC)CCCCC=COCC(COP(OCCN)(O)=O)OC(CCC=CCC=CCC=CCCCCCCCCCCC)=O","InChI=1S/C45H84NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h22-23,26,28,32,34,37,40,44H,3-21,24-25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b23-22-,28-26-,34-32-,40-37+","VBVLUHGCJVMQFI-DTZLILKHSA-N"
"C(CCCCCCCCCCCCCCC)C=COCC(OC(=O)CCC=CCC=CCC=CCC=CCCCCCCCCCC)COP(OCCN)(O)=O","InChI=1S/C47H86NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-36-38-40-47(49)55-46(45-54-56(50,51)53-43-41-48)44-52-42-39-37-35-33-31-29-27-20-18-16-14-12-10-8-6-4-2/h21-22,24-25,28,30,34,36,39,42,46H,3-20,23,26-27,29,31-33,35,37-38,40-41,43-45,48H2,1-2H3,(H,50,51)/b22-21-,25-24-,30-28-,36-34-,42-39+","LAUMCRQBKCWQHU-NKPKNEKKSA-N"
"C(CCCCCCCCCCCCCCC)C=COCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCCCCCCC)COP(OCCN)(O)=O","InChI=1S/C47H84NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-36-38-40-47(49)55-46(45-54-56(50,51)53-43-41-48)44-52-42-39-37-35-33-31-29-27-20-18-16-14-12-10-8-6-4-2/h15,17,21-22,24-25,28,30,34,36,39,42,46H,3-14,16,18-20,23,26-27,29,31-33,35,37-38,40-41,43-45,48H2,1-2H3,(H,50,51)/b17-15-,22-21-,25-24-,30-28-,36-34-,42-39+","OXSYLAKUJGJRGC-PBMCJBRHSA-N"
"C(CCCCCCCCCCCCCCC)C=COCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCCCC)COP(OCCN)(O)=O","InChI=1S/C47H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-36-38-40-47(49)55-46(45-54-56(50,51)53-43-41-48)44-52-42-39-37-35-33-31-29-27-20-18-16-14-12-10-8-6-4-2/h9,11,15,17,21-22,24-25,28,30,34,36,39,42,46H,3-8,10,12-14,16,18-20,23,26-27,29,31-33,35,37-38,40-41,43-45,48H2,1-2H3,(H,50,51)/b11-9-,17-15-,22-21-,25-24-,30-28-,36-34-,42-39+","JKMKRFYKYHILMM-ZUVFDMEGSA-N"
"NCCOP(OCC(COC=CCC=CCCCCCCCCCCCCC)OC(=O)CCC=CCCCCCCCCCCCCCCC)(O)=O","InChI=1S/C43H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h29-32,35,38,42H,3-28,33-34,36-37,39-41,44H2,1-2H3,(H,46,47)/b31-29-,32-30-,38-35+","REJQSLUNBGQJLW-KHJLVCBXSA-N"
"NCCOP(OCC(COC=CCC=CCCCCCCCCCCCCC)OC(CCC=CCC=CCCCCCCCCCCCCCC)=O)(O)=O","InChI=1S/C45H84NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h26,28,31-34,37,40,44H,3-25,27,29-30,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b28-26-,33-31-,34-32-,40-37+","AINWEGSZBADWKE-CFOOOPRVSA-N"
"C(CCCCCCCCC)CCCC=CCC=COCC(OC(CCC=CCC=CCC=CCC=CCCCCCCCCCC)=O)COP(OCCN)(O)=O","InChI=1S/C47H84NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-34-36-38-40-47(49)55-46(45-54-56(50,51)53-43-41-48)44-52-42-39-37-35-33-31-29-27-20-18-16-14-12-10-8-6-4-2/h21-22,24-25,28,30,33-36,39,42,46H,3-20,23,26-27,29,31-32,37-38,40-41,43-45,48H2,1-2H3,(H,50,51)/b22-21-,25-24-,30-28-,35-33-,36-34-,42-39+","CGXFPCHJSFOKMF-ITNHFFAISA-N"
"C(CCCCCC)=CCC=CCC=CCC=CCCC(=O)OC(COC=CCCCCCCCCCCCCCCCCC)COP(OCCN)(O)=O","InChI=1S/C44H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-44(46)52-43(42-51-53(47,48)50-40-38-45)41-49-39-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13,15,19,21,25,27,31,33,36,39,43H,3-12,14,16-18,20,22-24,26,28-30,32,34-35,37-38,40-42,45H2,1-2H3,(H,47,48)/b15-13-,21-19-,27-25-,33-31-,39-36+","OVZSKAHQJGVGGL-JYQPGMKLSA-N"
"O(CCN)P(O)(=O)OCC(OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O)COC=CCC=CCCCCCCCCCCCCCCC","InChI=1S/C47H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-47(49)55-46(45-54-56(50,51)53-43-41-48)44-52-42-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23-24,28,30,33-36,39,42,46H,3-4,6,8-10,12,14-16,18,20-22,25-27,29,31-32,37-38,40-41,43-45,48H2,1-2H3,(H,50,51)/b7-5-,13-11-,19-17-,24-23-,30-28-,35-33-,36-34-,42-39+","GKRHXMAWUOFXDX-NRAOZCPZSA-N"
"C(CCCCCCCCCCCOCC(COP(OCCN)(O)=O)OC(CCC=CCCCCCCCCCCCCC)=O)CCCC","InChI=1S/C39H78NO7P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-39(41)47-38(37-46-48(42,43)45-35-33-40)36-44-34-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h26,28,38H,3-25,27,29-37,40H2,1-2H3,(H,42,43)/b28-26-","XDIGIEOFWXOONN-SGEDCAFJSA-N"
"C(CCCCCCCCCCCCC(=O)OC(COP(O)(=O)OCCN)COCCCCCCCCCCCCCCCC)CCCCCC","InChI=1S/C41H84NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-41(43)49-40(39-48-50(44,45)47-37-35-42)38-46-36-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h40H,3-39,42H2,1-2H3,(H,44,45)","HPGJUDXZGAWGNA-UHFFFAOYSA-N"
"C(CCC(=O)OC(COP(OCCN)(O)=O)COCCCCCCCCCCCCCCCC)=CCC=CCC=CCC=CCCCCCCCC","InChI=1S/C43H80NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h17,19,21-22,24,26,30,32,42H,3-16,18,20,23,25,27-29,31,33-41,44H2,1-2H3,(H,46,47)/b19-17-,22-21-,26-24-,32-30-","LGZPAQOAFXJDTR-CBQGOMEFSA-N"
"C(CCC(=O)OC(COP(OCCN)(O)=O)COCCCCCCCCCCCCCCCC)=CCC=CCC=CCC=CCC=CCC=CCC","InChI=1S/C43H76NO7P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-43(45)51-42(41-50-52(46,47)49-39-37-44)40-48-38-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,24,26,30,32,42H,3-4,6,8-10,12,14-16,18,20,23,25,27-29,31,33-41,44H2,1-2H3,(H,46,47)/b7-5-,13-11-,19-17-,22-21-,26-24-,32-30-","JJMPYAHUHHQAJB-YKPVOZFUSA-N"
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"C(COP(OCCN)(O)=O)(COC(CCCCCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCCCCCCCCC","InChI=1S/C44H82NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45)40-50-43(46)36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h19,21,25,27,31,33,42H,3-18,20,22-24,26,28-30,32,34-41,45H2,1-2H3,(H,48,49)/b21-19-,27-25-,33-31-","WHRINFUMSAOXIM-UEZFOCAYSA-N"
"O(C(=O)CCCCCCCCCCCCCCCCCCC)CC(COP(OCCN)(O)=O)OC(CCC=CCC=CCC=CCC=CCC=CCC=CCC)=O","InChI=1S/C47H82NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-47(50)56-45(44-55-57(51,52)54-42-41-48)43-53-46(49)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22,24,28,30,34,36,45H,3-4,6,8-10,12,14-16,18,20-21,23,25-27,29,31-33,35,37-44,48H2,1-2H3,(H,51,52)/b7-5-,13-11-,19-17-,24-22-,30-28-,36-34-","WIFLVHIKWGINAQ-ZVJYVBFZSA-N"
"C(CC=CCCCCCCCCCCCCCCC)C(OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC)COP(O)(=O)OCCN)=O","InChI=1S/C47H80NO8P/c1-3-5-7-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-38-40-47(50)56-45(44-55-57(51,52)54-42-41-48)43-53-46(49)39-37-35-33-31-29-27-25-23-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22,24,28,30,33-36,45H,3-4,6,8-10,12,14-16,18,20-21,23,25-27,29,31-32,37-44,48H2,1-2H3,(H,51,52)/b7-5-,13-11-,19-17-,24-22-,30-28-,35-33-,36-34-","BOUBNNHFOXUIOH-RHMKWMONSA-N"
"C(CCCCCCCCCCC)CCCCC=COCC(COP(OCCN)(O)=O)OC(CCC=CCC=CCC=CCC=CCC=CCCCCC)=O","InChI=1S/C45H80NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,26,28,32,34,37,40,44H,3-10,12,14-16,18,20-21,24-25,27,29-31,33,35-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b13-11-,19-17-,23-22-,28-26-,34-32-,40-37+","HHQFKPJXVYWLLJ-GLZZVABPSA-N"
"C(CCCCC)CCCC=CCCC=CC(C(COP(OCC[N+1](C)(C)C)([O-1])=O)NC(=O)CCCCCCCCCCCCCCCCCCC)O","InChI=1S/C43H85N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-43(47)44-41(40-51-52(48,49)50-39-38-45(3,4)5)42(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h26,28,34,36,41-42,46H,6-25,27,29-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b28-26+,36-34+/t41-,42+/m1/s1","RIQUZAZTFMJZDT-IOZXCLFOSA-N"
"C(COP(OCCN)(O)=O)(COC(CCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCC=CCC=CCC=CCC=C","InChI=1S/C44H74NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45)40-50-43(46)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h3,7,9,13,15,18-19,21-22,25,27,31,33,42H,1,4-6,8,10-12,14,16-17,20,23-24,26,28-30,32,34-41,45H2,2H3,(H,48,49)/b9-7-,15-13-,19-18-,22-21-,27-25-,33-31-","YBNKGCKMYZMAHM-UUNLMLIBSA-N"
"C(OP(OCC(OC(CCC=CCCCCCCCCCCCCCCCCC)=O)COCCCC=CCC=CCCCCCCCCCC)(O)=O)CN","InChI=1S/C45H86NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h25,27,31-34,44H,3-24,26,28-30,35-43,46H2,1-2H3,(H,48,49)/b27-25-,33-31-,34-32-","KGHOAIAMMAXYFK-LFBDKQGTSA-N"
"C(C(N)C(C)=O)OP(O)(=O)OCC(OC(=O)CCC=CCC=CCC=CCC=CCC=CCCC)COC(CCC=CCCCCCCCCCCCCC)=O","InChI=1S/C45H76NO9P/c1-4-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-37-45(49)55-42(39-53-56(50,51)54-40-43(46)41(3)47)38-52-44(48)36-34-32-30-28-26-24-22-19-17-15-13-11-9-7-5-2/h8,10,14,16,20-21,25,27,30-33,42-43H,4-7,9,11-13,15,17-19,22-24,26,28-29,34-40,46H2,1-3H3,(H,50,51)/b10-8-,16-14-,21-20-,27-25-,32-30-,33-31-","JZGHLLUAMKCKPB-UUOYPOJJSA-N"
"C(COP(OCCN)(O)=O)(COC(CCCCCCCCCCCCCCCC)=O)OC(=O)CCC=CCC=CCC=CCC=CCC=CCCCCC","InChI=1S/C44H78NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45)40-50-43(46)36-34-32-30-28-26-24-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,25,27,31,33,42H,3-10,12,14-16,18,20,23-24,26,28-30,32,34-41,45H2,1-2H3,(H,48,49)/b13-11-,19-17-,22-21-,27-25-,33-31-","TZKBOGGOMRCSLO-RDCLIOPDSA-N"
"C(CCCCCC)CCCCCCCCCCC(OCC(COP(O)(=O)OCCN)OC(=O)CCC=CCC=CCC=CCC=CCC=CCCC)=O","InChI=1S/C43H76NO8P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-43(46)52-41(40-51-53(47,48)50-38-37-44)39-49-42(45)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h7,9,13,15,19-20,24,26,30,32,41H,3-6,8,10-12,14,16-18,21-23,25,27-29,31,33-40,44H2,1-2H3,(H,47,48)/b9-7-,15-13-,20-19-,26-24-,32-30-","XYILASVYBPMWKW-HDSNJYMDSA-N"
"O=C(OCC(OC(CCC=CCCCCCCCCCCCCCCCCC)=O)COP([O-1])(=O)OCC[N+1](C)(C)C)CCC=CCCCCCCCCCCCCC","InChI=1S/C48H92NO8P/c1-6-8-10-12-14-16-18-20-22-23-24-25-27-29-31-33-35-37-39-41-48(51)57-46(45-56-58(52,53)55-43-42-49(3,4)5)44-54-47(50)40-38-36-34-32-30-28-26-21-19-17-15-13-11-9-7-2/h34-37,46H,6-33,38-45H2,1-5H3/b36-34-,37-35-","FMJLHUOCIYITDV-IRBDSUPESA-N"
"c(ccc1C(=NN=C2C)C(=O)N2)cc1","InChI=1S/C10H9N3O/c1-7-11-10(14)9(13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,12,14)","OUSYWCQYMPDAEO-UHFFFAOYSA-N"
"c1(cc(c(O)c(c1)Br)Br)C#N","InChI=1S/C7H3Br2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","UPMXNNIRAGDFEH-UHFFFAOYSA-N"
"c1(C(C)C)ccc(N)cc1","InChI=1S/C9H13N/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,10H2,1-2H3","LRTFPLFDLJYEKT-UHFFFAOYSA-N"
"c(ccc1C(=NN=C2C)C(=O)N2N)cc1","InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3","VHCNQEUWZYOAEV-UHFFFAOYSA-N"
"O=C2N(c1c(cccc1C)CC)C(C)COC2","InChI=1S/C14H19NO2/c1-4-12-7-5-6-10(2)14(12)15-11(3)8-17-9-13(15)16/h5-7,11H,4,8-9H2,1-3H3","DVBDYPDVNRJKNJ-UHFFFAOYSA-N"
"c1(CSC(N(CC)CC)=O)c(cccc1)Cl","InChI=1S/C12H16ClNOS/c1-3-14(4-2)12(15)16-9-10-7-5-6-8-11(10)13/h5-8H,3-4,9H2,1-2H3","LLLFASISUZUJEQ-UHFFFAOYSA-N"
"C(N(CCC)C(SCc1ccccc1)=O)CC","InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3","NQLVQOSNDJXLKG-UHFFFAOYSA-N"
"c1(c(cccc1Cl)Cl)C#N","InChI=1S/C7H3Cl2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H","YOYAIZYFCNQIRF-UHFFFAOYSA-N"
"ClC1=C(C(N)=O)C(Cl)=CC=C1","InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)","JHSPCUHPSIUQRB-UHFFFAOYSA-N"
"Cl-c(ccc1C(O)(CN(N=C2)C=N2)C(C(C3)C3)C)cc1","InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3","UFNOUKDBUJZYDE-UHFFFAOYSA-N"
"c1(cc(c(O)c(c1)I)I)C#N","InChI=1S/C7H3I2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","NRXQIUSYPAHGNM-UHFFFAOYSA-N"
"ClC(=C(N)C=N1)C(=O)N1-c(ccc2)cc2","InChI=1S/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2","WYKYKTKDBLFHCY-UHFFFAOYSA-N"
"S(C)C(=NN=C1C(C)(C)C)N(N)C1=O","InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3","FOXFZRUHNHCZPX-UHFFFAOYSA-N"
"O=C(NN=C1C(C)(C)C)N(N)C1=O","InChI=1S/C7H12N4O2/c1-7(2,3)4-5(12)11(8)6(13)10-9-4/h8H2,1-3H3,(H,10,13)","AHBXXEZLRFCZSF-UHFFFAOYSA-N"
"c1c(OC(Nc2cc(ccc2)C)=O)cccc1NC(OC)=O","InChI=1S/C16H16N2O4/c1-11-5-3-6-12(9-11)18-16(20)22-14-8-4-7-13(10-14)17-15(19)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)","IDOWTHOLJBTAFI-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C2C(O2)(CN3C=NC=N3)C4=CC=C(C=C4)F)Cl","InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m1/s1","ZMYFCFLJBGAQRS-IAGOWNOFSA-N"
"Cl-c(cc(Cl)c1OCCN(C(=O)N(C=N2)C=C2)CCC)cc1Cl","InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3","TVLSRXXIMLFWEO-UHFFFAOYSA-N"
"n1(cncn1)C[Si](c1ccc(F)cc1)(C)c1ccc(cc1)F","InChI=1S/C16H15F2N3Si/c1-22(12-21-11-19-10-20-21,15-6-2-13(17)3-7-15)16-8-4-14(18)5-9-16/h2-11H,12H2,1H3","FQKUGOMFVDPBIZ-UHFFFAOYSA-N"
"CCC1=CC=CC(CC)=C1N(COC)C(=O)CS(O)(=O)=O","InChI=1S/C14H21NO5S/c1-4-11-7-6-8-12(5-2)14(11)15(10-20-3)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19)","UTCJUUGCHWHUNI-UHFFFAOYSA-N"
"CCc1cccc(CC)c1N(COC)C(=O)C(O)=O","InChI=1S/C14H19NO4/c1-4-10-7-6-8-11(5-2)12(10)15(9-19-3)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)","MHCYOELBTPOBIU-UHFFFAOYSA-N"
"c(cc(C)c1N(C(=O)C(=O)O)COCC)cc1CC","InChI=1S/C14H19NO4/c1-4-11-8-6-7-10(3)12(11)15(9-19-5-2)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)","OTKTUNJJKYTOFF-UHFFFAOYSA-N"
"S(=O)(=O)(O)CC(=O)N(-c(c(cc1)C)c(c1)CC)COCC","InChI=1S/C14H21NO5S/c1-4-12-8-6-7-11(3)14(12)15(10-20-5-2)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19)","HXAIQOCRALNGKB-UHFFFAOYSA-N"
"c1(c(cc(C)cc1)C)\N=C\N(\C=N\c1c(cc(C)cc1)C)C","InChI=1S/C19H23N3/c1-14-6-8-18(16(3)10-14)20-12-22(5)13-21-19-9-7-15(2)11-17(19)4/h6-13H,1-5H3","QXAITBQSYVNQDR-UHFFFAOYSA-N"
"CCNC(=O)NC(=O)/C(=N/OC)/C#N","InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)/b11-5+","XERJKGMBORTKEO-VZUCSPMQSA-N"
"FC1=CC=C(NC(=O)C2=C(OC3=CC=CC(=C3)C(F)(F)F)N=CC=C2)C(F)=C1","InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)","WYEHFWKAOXOVJD-UHFFFAOYSA-N"
"S(=O)(=O)(C)O-c(ccc1O2)cc1C(C2OCC)(C)C","InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3","IRCMYGHHKLLGHV-UHFFFAOYSA-N"
"CS(=O)(=O)Oc1cc2c(cc1)OC(=O)C2(C)C","InChI=1S/C11H12O5S/c1-11(2)8-6-7(16-17(3,13)14)4-5-9(8)15-10(11)12/h4-6H,1-3H3","CXWYCAYNZXSHTF-UHFFFAOYSA-N"
"n1cc(C(F)(F)F)cc(Cl)c1Nc1c([N+]([O-])=O)c(Cl)c(C(F)(F)F)cc1[N+]([O-])=O","InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)","UZCGKGPEKUCDTF-UHFFFAOYSA-N"
"CCN(CC)C(=O)C(C)OC1=CC=CC2=CC=CC=C21","InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3","WXZVAROIGSFCFJ-UHFFFAOYSA-N"
"CC(C(=O)OCCON=C(C)C)OC1=CC=C(C=C1)OC2=CN=C3C=C(C=CC3=N2)Cl","InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3","FROBCXTULYFHEJ-UHFFFAOYSA-N"
"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)C(F)(F)F","InChI=1S/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3","ZSDSQXJSNMTJDA-UHFFFAOYSA-N"
"COC(C1=C(S(=O)(N)=O)C=CC=C1)=O","InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)","VSOOBQALJVLTBH-UHFFFAOYSA-N"
"c1(c(cccc1)C(OC)=O)S(NC(Nc1nc(nc(n1)C)OC)=O)(=O)=O","InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)","RSMUVYRMZCOLBH-UHFFFAOYSA-N"
"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)c2ncccc2C(=O)N(C)C","InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)","RTCOGUMHFFWOJV-UHFFFAOYSA-N"
"CCS(=O)(=O)c1cccnc1S(=O)(=O)NC(=O)Nc1nc(OC)cc(OC)n1","InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)","MEFOUWRMVYJCQC-UHFFFAOYSA-N"
"c1(nc(NC(C)C)nc(n1)OC)NC(C)C","InChI=1S/C10H19N5O/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)","ISEUFVQQFVOBCY-UHFFFAOYSA-N"
"c1(nc(NC(C)C)nc(n1)SC)NC(C)C","InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)","AAEVYOVXGOFMJO-UHFFFAOYSA-N"
"c1(c(c(c(Cl)c(n1)F)N)Cl)OCC(O)=O","InChI=1S/C7H5Cl2FN2O3/c8-3-5(11)4(9)7(12-6(3)10)15-1-2(13)14/h1H2,(H2,11,12)(H,13,14)","MEFQWPUMEMWTJP-UHFFFAOYSA-N"
"CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)COC","InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3","ZQEIXNIJLIKNTD-UHFFFAOYSA-N"
"CCNC(=O)C(C)OC(=O)NC1=CC=CC=C1","InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)","AMRQXHFXNZFDCH-UHFFFAOYSA-N"
"NC1=NC2=C(C=CC=C2)N1","InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)","JWYUFVNJZUSCSM-UHFFFAOYSA-N"
"N1(C(C(C)(C)CO1)=O)Cc1c(cccc1)Cl","InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3","KIEDNEWSYUYDSN-UHFFFAOYSA-N"
"c1c(OC(Nc2ccccc2)=O)cccc1NC(OCC)=O","InChI=1S/C16H16N2O4/c1-2-21-15(19)18-13-9-6-10-14(11-13)22-16(20)17-12-7-4-3-5-8-12/h3-11H,2H2,1H3,(H,17,20)(H,18,19)","WZJZMXBKUWKXTQ-UHFFFAOYSA-N"
"CC1CN(CC(O1)C)CC(C)CC2=CC=C(C=C2)C(C)(C)C","InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3/t15?,16-,17+","RYAUSSKQMZRMAI-ALOPSCKCSA-N"
"CC(C(=O)O)OC1=CC=C(C=C1)OC2=NC=C(C=C2)C(F)(F)F","InChI=1S/C15H12F3NO4/c1-9(14(20)21)22-11-3-5-12(6-4-11)23-13-7-2-10(8-19-13)15(16,17)18/h2-9H,1H3,(H,20,21)","YUVKUEAFAVKILW-UHFFFAOYSA-N"
"c1ccccc1Nc1nc(C2CC2)cc(C)n1","InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)","HAORKNGNJCEJBX-UHFFFAOYSA-N"
"C(C1)C1C(O)=C(C(=O)CC2C(=O)O)C(=O)C2","InChI=1S/C11H12O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h5-6,14H,1-4H2,(H,15,16)/b10-9-","DFFWZNDCNBOKDI-KTKRTIGZSA-N"
"CCOC(=O)C1CC(=O)C(=C(C2CC2)O)C(=O)C1","InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3/b12-11-","RVKCCVTVZORVGD-QXMHVHEDSA-N"
"Cc1ccccc1OCc1ccccc1\C(=N/OC)C(=O)OC","InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3/b19-17+","ZOTBXTZVPHCKPN-HTXNQAPBSA-N"
"c1(S(NC(OC)=O)(=O)=O)ccc(N)cc1","InChI=1S/C8H10N2O4S/c1-14-8(11)10-15(12,13)7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11)","VGPYEHKOIGNJKV-UHFFFAOYSA-N"
"COc1nc(NCC)nc(NC(C)C)n1","InChI=1S/C9H17N5O/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)","PXWUKZGIHQRDHL-UHFFFAOYSA-N"
"c1(cc(c(Cl)cc1)Cl)NC(N(OC)C)=O","InChI=1S/C9H10Cl2N2O2/c1-13(15-2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","XKJMBINCVNINCA-UHFFFAOYSA-N"
"C(N(C)C)(Nc1ccc(Cl)cc1)=O","InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)","BMLIZLVNXIYGCK-UHFFFAOYSA-N"
"C1(Oc2c(cccc2O1)c1c(c[nH]c1)C#N)(F)F","InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H","MUJOIMFVNIBMKC-UHFFFAOYSA-N"
"CC(C)(C1=CC=C(O)C=C1)C2=CC=C(O)C=C2","InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3","IISBACLAFKSPIT-UHFFFAOYSA-N"
"c12c(nn[nH]1)cccc2","InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)","QRUDEWIWKLJBPS-UHFFFAOYSA-N"
"CC(C)NCC(O)COc1ccc(cc1)CC(N)=O","InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)","METKIMKYRPQLGS-UHFFFAOYSA-N"
"CC(C)NCC(C1=CC=C(C=C1)NS(=O)(=O)C)O","InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3","ZBMZVLHSJCTVON-UHFFFAOYSA-N"
"CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O","InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3","AQHHHDLHHXJYJD-UHFFFAOYSA-N"
"NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC=N2","InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)","SEEPANYCNGTZFQ-UHFFFAOYSA-N"
"c1(S(Nc2nc(cc(n2)C)C)(=O)=O)ccc(N)cc1","InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)","ASWVTGNCAZCNNR-UHFFFAOYSA-N"
"c1(NS(c2ccc(N)cc2)(=O)=O)cc(nc(n1)OC)OC","InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)","ZZORFUFYDOWNEF-UHFFFAOYSA-N"
"c1(S(Nc2nccs2)(=O)=O)ccc(N)cc1","InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)","JNMRHUJNCSQMMB-UHFFFAOYSA-N"
"CCC1C(C=C(C=CC(=O)C(CC(C(C(C(CC(=O)O1)O)C)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)C)COC4C(C(C(C(O4)C)O)OC)OC","InChI=1S/C46H77NO17/c1-13-33-30(22-58-45-42(57-12)41(56-11)37(52)26(5)60-45)18-23(2)14-15-31(49)24(3)19-29(16-17-48)39(25(4)32(50)20-34(51)62-33)64-44-38(53)36(47(9)10)40(27(6)61-44)63-35-21-46(8,55)43(54)28(7)59-35/h14-15,17-18,24-30,32-33,35-45,50,52-55H,13,16,19-22H2,1-12H3/b15-14+,23-18+/t24-,25+,26-,27-,28+,29+,30-,32-,33-,35+,36-,37-,38-,39-,40-,41-,42-,43+,44+,45-,46-/m1/s1","WBPYTXDJUQJLPQ-VMXQISHHSA-N"
"CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)C(C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3O)N(C)C)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O","InChI=1S/C38H72N2O12/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28/h20-33,35,41-43,45-46H,15-19H2,1-14H3/t20-,21-,22?,23-,24-,25+,26+,27-,28+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1","MQTOSJVFKKJCRP-OHJWJPDZSA-N"
"CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@@H](OC3OC(C)CC(C3O)N(C)C)[C@@](C)(C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O)OC","InChI=1S/C38H69NO13/c1-15-26-38(10,45)31(42)21(4)28(40)19(2)17-37(9,47-14)33(52-35-29(41)25(39(11)12)16-20(3)48-35)22(5)30(23(6)34(44)50-26)51-27-18-36(8,46-13)32(43)24(7)49-27/h19-27,29-33,35,41-43,45H,15-18H2,1-14H3/t19-,20?,21+,22+,23-,24?,25?,26-,27?,29?,30+,31-,32?,33-,35?,36?,37-,38-/m1/s1","AGOYDEPGAOXOCK-AVDMLEEESA-N"
"N1(c2c(cccc2)C=Cc2c1cccc2)C(N)=O","InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)","FFGPTBGBLSHEPO-UHFFFAOYSA-N"
"c1(ccccc1)C2(C(=O)NCNC2=O)CC","InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)","DQMZLTXERSFNPB-UHFFFAOYSA-N"
"CC1=NC=C(N1CCO)[N+]([O-])=O","InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3","VAOCPAMSLUNLGC-UHFFFAOYSA-N"
"c1(Cc2c(nc(N)nc2)N)cc(c(OC)c(c1)OC)OC","InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)","IEDVJHCEMCRBQM-UHFFFAOYSA-N"
"c1c(c(ccc1)Nc1c(cccc1Cl)Cl)CC(=O)O","InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)","DCOPUUMXTXDBNB-UHFFFAOYSA-N"
"CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)O","InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)","CMWTZPSULFXXJA-UHFFFAOYSA-N"
"c1([C@@H](C(O)=O)C)ccc(CC(C)C)cc1","InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1","HEFNNWSXXWATRW-JTQLQIEISA-N"
"CC(C)(OC1=CC=C(Cl)C=C1)C(O)=O","InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)","TXCGAZHTZHNUAI-UHFFFAOYSA-N"
"CC(C1=CC=CC(=C1)C(=O)C2=CC=CC=C2)C(=O)O","InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)","DKYWVDODHFEZIM-UHFFFAOYSA-N"
"COC1=CC2=C(C=C1)N(C(=O)C3=CC=C(Cl)C=C3)C(C)=C2CC(O)=O","InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)","CGIGDMFJXJATDK-UHFFFAOYSA-N"
"c1(c(cccc1)C(O)=O)Nc1c(c(ccc1)C)C","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","HYYBABOKPJLUIN-UHFFFAOYSA-N"
"c1(C(NCCc2ccc(OC(C(O)=O)(C)C)cc2)=O)ccc(Cl)cc1","InChI=1S/C19H20ClNO4/c1-19(2,18(23)24)25-16-9-3-13(4-10-16)11-12-21-17(22)14-5-7-15(20)8-6-14/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)","IIBYAHWJQTYFKB-UHFFFAOYSA-N"
"CCCC1COC(O1)(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl","InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3","STJLVHWMYQXCPB-UHFFFAOYSA-N"
"c1(C(N(CC)CC)=O)cc(C)ccc1","InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3","MMOXZBCLCQITDF-UHFFFAOYSA-N"
"c1(C(c2ccccc2)=O)c(cc(OC)cc1)O","InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3","DXGLGDHPHMLXJC-UHFFFAOYSA-N"
"OCC(O)CNC(=O)c1c(I)c(N(CC(O)CO)C(C)=O)c(I)c(c1I)C(=O)NCC(O)CO","InChI=1S/C19H26I3N3O9/c1-8(29)25(4-11(32)7-28)17-15(21)12(18(33)23-2-9(30)5-26)14(20)13(16(17)22)19(34)24-3-10(31)6-27/h9-11,26-28,30-32H,2-7H2,1H3,(H,23,33)(H,24,34)","NTHXOOBQLCIOLC-UHFFFAOYSA-N"
"CCN1C=C(C(O)=O)C(=O)C2=CC(F)=C(C=C12)N3CCNCC3","InChI=1S/C16H18FN3O3/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20/h7-9,18H,2-6H2,1H3,(H,22,23)","OGJPXUAPXNRGGI-UHFFFAOYSA-N"
"c1(S(Nc2ccccn2)(=O)=O)ccc(N)cc1","InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)","GECHUMIMRBOMGK-UHFFFAOYSA-N"
"CC(=O)NC=2C(=O)N(c1ccccc1)N(C)C=2C","InChI=1S/C13H15N3O2/c1-9-12(14-10(2)17)13(18)16(15(9)3)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,17)","OIAGWXKSCXPNNZ-UHFFFAOYSA-N"
"CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(NC(C)=O)=C1I","InChI=1S/C11H9I3N2O4/c1-3(17)15-9-6(12)5(11(19)20)7(13)10(8(9)14)16-4(2)18/h1-2H3,(H,15,17)(H,16,18)(H,19,20)","YVPYQUNUQOZFHG-UHFFFAOYSA-N"
"Ic1c(c(I)c(c(I)c1N(C)C(=O)CO)C(=O)NCC(O)CO)C(=O)NCC(O)CO","InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31)","NJKDOADNQSYQEV-UHFFFAOYSA-N"
"CC(O)C(=O)NC1=C(I)C(C(=O)NC(CO)CO)=C(I)C(C(=O)NC(CO)CO)=C1I","InChI=1S/C17H22I3N3O8/c1-6(28)15(29)23-14-12(19)9(16(30)21-7(2-24)3-25)11(18)10(13(14)20)17(31)22-8(4-26)5-27/h6-8,24-28H,2-5H2,1H3,(H,21,30)(H,22,31)(H,23,29)","XQZXYNRDCRIARQ-UHFFFAOYSA-N"
"CN(CC(CO)O)C(=O)C1=C(C(=C(C(=C1I)C(=O)NCC(CO)O)I)NC(=O)COC)I","InChI=1S/C18H24I3N3O8/c1-24(4-9(28)6-26)18(31)12-13(19)11(17(30)22-3-8(27)5-25)14(20)16(15(12)21)23-10(29)7-32-2/h8-9,25-28H,3-7H2,1-2H3,(H,22,30)(H,23,29)","DGAIEPBNLOQYER-UHFFFAOYSA-N"
"C(C)(=O)Nc1ccc(cc1)S(=O)(=O)Nc1nc(cc(n1)OC)OC","InChI=1S/C14H16N4O5S/c1-9(19)15-10-4-6-11(7-5-10)24(20,21)18-14-16-12(22-2)8-13(17-14)23-3/h4-8H,1-3H3,(H,15,19)(H,16,17,18)","DQWIIKBKAIPUPY-UHFFFAOYSA-N"
"O=S(=O)(c1ccc(cc1)NC(=O)C)Nc1nc(cc(n1)C)C","InChI=1S/C14H16N4O3S/c1-9-8-10(2)16-14(15-9)18-22(20,21)13-6-4-12(5-7-13)17-11(3)19/h4-8H,1-3H3,(H,17,19)(H,15,16,18)","LJKAKWDUZRJNPJ-UHFFFAOYSA-N"
"c1nc(NS(c2ccc(cc2)NC(C)=O)(=O)=O)ncc1","InChI=1S/C12H12N4O3S/c1-9(17)15-10-3-5-11(6-4-10)20(18,19)16-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,17)(H,13,14,16)","NJIZUWGMNCUKGU-UHFFFAOYSA-N"
"c1(ccc(NC(=O)C)cc1)S(=O)(NC2=NC=CS2)=O","InChI=1S/C11H11N3O3S2/c1-8(15)13-9-2-4-10(5-3-9)19(16,17)14-11-12-6-7-18-11/h2-7H,1H3,(H,12,14)(H,13,15)","KXNXWINFSDKMHD-UHFFFAOYSA-N"
"CC1=CSC(=C1N(C(C)COC)C(=O)CCl)C","InChI=1S/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3","JLYFCTQDENRSOL-UHFFFAOYSA-N"
"c1ccccc1CN(C(=O)C(C)(C)C)C(C)C","InChI=1S/C15H23NO/c1-12(2)16(14(17)15(3,4)5)11-13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3","RJKCKKDSSSRYCB-UHFFFAOYSA-N"
"OC1=C([N+]([O-])=O)C=C([N+]([O-])=O)C=C1C(C)CC","InChI=1S/C10H12N2O5/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17/h4-6,13H,3H2,1-2H3","OWZPCEFYPSAJFR-UHFFFAOYSA-N"
"C1(C(C(CCC1)=O)C(c1c(cc(cc1)S(=O)(=O)C)[N+](=O)[O-])=O)=O","InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","KPUREKXXPHOJQT-UHFFFAOYSA-N"
"S(C=C1C)C(C)=C1N(C(=O)C(=O)O)C(COC)C","InChI=1S/C12H17NO4S/c1-7-6-18-9(3)10(7)13(8(2)5-17-4)11(14)12(15)16/h6,8H,5H2,1-4H3,(H,15,16)","HOYCASTVMCEOTP-UHFFFAOYSA-N"
"S(C=C1C)C(C)=C1N(C(=O)CS(=O)(=O)O)C(COC)C","InChI=1S/C12H19NO5S2/c1-8-6-19-10(3)12(8)13(9(2)5-18-4)11(14)7-20(15,16)17/h6,9H,5,7H2,1-4H3,(H,15,16,17)","YMYKMSAZEZQEER-UHFFFAOYSA-N"
"c1(c(cc(Cl)cc1)C)OCC(O)=O","InChI=1S/C9H9ClO3/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)","WHKUVVPPKQRRBV-UHFFFAOYSA-N"
"c1(nc(nc(n1)Cl)NCC)NCC","InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)","ODCWYMIRDDJXKW-UHFFFAOYSA-N"
"CC1=CC=CC(CC)=C1N(C(C)COC)C(C(O)=O)=O","InChI=1S/C15H21NO4/c1-5-12-8-6-7-10(2)13(12)16(11(3)9-20-4)14(17)15(18)19/h6-8,11H,5,9H2,1-4H3,(H,18,19)","LNOOSYCKMKZOJB-UHFFFAOYSA-N"
"O=C1C(\Br)=C(/NC(=O)N1C(CC)C)C","InChI=1S/C9H13BrN2O2/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14/h5H,4H2,1-3H3,(H,11,14)","CTSLUCNDVMMDHG-UHFFFAOYSA-N"
"ClC1=C(OCC(O)=O)C=CC(Cl)=C1","InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)","OVSKIKFHRZPJSS-UHFFFAOYSA-N"
"CCC1=CC=CC(=C1N(C(C)COC)C(=O)CCl)C","InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3","WVQBLGZPHOPPFO-UHFFFAOYSA-N"
"N(c1c(cccc1C)C)(Cn1cccn1)C(CCl)=O","InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3","STEPQTYSZVCJPV-UHFFFAOYSA-N"
"CC(OC1=C(Cl)C=C(Cl)C=C1)C(O)=O","InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)","MZHCENGPTKEIGP-UHFFFAOYSA-N"
"c1(c(ccc(c1)NC(N(C)C)=O)C)Cl","InChI=1S/C10H13ClN2O/c1-7-4-5-8(6-9(7)11)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)","JXCGFZXSOMJFOA-UHFFFAOYSA-N"
"c1(c(c(ccc1Cl)Cl)OC)C(O)=O","InChI=1S/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)","IWEDIXLBFLAXBO-UHFFFAOYSA-N"
"C(C1)C1N(C=C(C-2=O)C(=O)O)-c(cc(c3F)N(CCN4)CC4)c2c3","InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)","MYSWGUAQZAJSOK-UHFFFAOYSA-N"
"n(c(nc1NC(C)C)O)c(n1)N","InChI=1S/C6H11N5O/c1-3(2)8-5-9-4(7)10-6(12)11-5/h3H,1-2H3,(H4,7,8,9,10,11,12)","GCKLGRUZDXSATG-UHFFFAOYSA-N"
"c1(nc(nc(n1)O)NCC)NC(C)C","InChI=1S/C8H15N5O/c1-4-9-6-11-7(10-5(2)3)13-8(14)12-6/h5H,4H2,1-3H3,(H3,9,10,11,12,13,14)","NFMIMWNQWAWNDW-UHFFFAOYSA-N"
"c1(n(sc(c1)Cl)C)=O","InChI=1S/C4H4ClNOS/c1-6-4(7)2-3(5)8-6/h2H,1H3","DHNRXBZYEKSXIM-UHFFFAOYSA-N"
"c1(nc(nc(n1)Cl)NCC)NC(C)(C)C","InChI=1S/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)","FZXISNSWEXTPMF-UHFFFAOYSA-N"
"N(C(=O)N)c1ccc(cc1)C(C)C","InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)","ABBKOIZWGCVCKE-UHFFFAOYSA-N"
"c1(ccc(C(C)C)cc1)NC(N(C)C)=O","InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)","PUIYMUZLKQOUOZ-UHFFFAOYSA-N"
"c1(nc(nc(n1)Cl)N)NCC","InChI=1S/C5H8ClN5/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H3,7,8,9,10,11)","IVENSCMCQBJAKW-UHFFFAOYSA-N"
"c1(nc(nc(n1)Cl)NCC)NC(C)C","InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)","MXWJVTOOROXGIU-UHFFFAOYSA-N"
"c1(cc(c(Cl)cc1)Cl)NC(N)=O","InChI=1S/C7H6Cl2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12)","CYESCLHCWJKRKM-UHFFFAOYSA-N"
"O=C1CCCC(=O)C1C(=O)c1ccc(S(=O)(=O)C)cc1Cl","InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","PQTBTIFWAXVEPB-UHFFFAOYSA-N"
"c1(c(ccc(c1)NC(N(C)C)=O)Cl)Cl","InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","XMTQQYYKAHVGBJ-UHFFFAOYSA-N"
"O(c1nc(nc(c1)C)C(C)C)P(OCC)(OCC)=S","InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3","FHIVAFMUCKRCQO-UHFFFAOYSA-N"
"c1(cc(c(Cl)cc1)Cl)NC(NC)=O","InChI=1S/C8H8Cl2N2O/c1-11-8(13)12-5-2-3-6(9)7(10)4-5/h2-4H,1H3,(H2,11,12,13)","IDQHRQQSSQDLTR-UHFFFAOYSA-N"
"S(Nc1ccccc1)(N(C)C)(=O)=O","InChI=1S/C8H12N2O2S/c1-10(2)13(11,12)9-8-6-4-3-5-7-8/h3-7,9H,1-2H3","QCDQDISRALTLNQ-UHFFFAOYSA-N"
"c1(S(Nc2cc(C)on2)(=O)=O)ccc(N)cc1","InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)","JLKIGFTWXXRPMT-UHFFFAOYSA-N"
"c1(ccc(cc1)NC(C)=O)S(Nc1cc(C)on1)(=O)=O","InChI=1S/C12H13N3O4S/c1-8-7-12(14-19-8)15-20(17,18)11-5-3-10(4-6-11)13-9(2)16/h3-7H,1-2H3,(H,13,16)(H,14,15)","GXPIUNZCALHVBA-UHFFFAOYSA-N"
"n1(c(ccs1)=O)CCCCCCCC","InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3","JPMIIZHYYWMHDT-UHFFFAOYSA-N"
"c12c(cccc2)s[nH]c1=O","InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)","DMSMPAJRVJJAGA-UHFFFAOYSA-N"
"c1(nc(NC(C)(C)C)nc(n1)SC)NC1CC1","InChI=1S/C11H19N5S/c1-11(2,3)16-9-13-8(12-7-5-6-7)14-10(15-9)17-4/h7H,5-6H2,1-4H3,(H2,12,13,14,15,16)","HDHLIWCXDDZUFH-UHFFFAOYSA-N"
"c12c(n(c(=O)n(c1=O)C)C)ncn2C","InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3","RYYVLZVUVIJVGH-UHFFFAOYSA-N"
"N(C(=O)Nc1ccc(cc1)C(C)C)C","InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)","DOULWWSSZVEPIN-UHFFFAOYSA-N"
"N(C(OCC#CI)=O)CCCC","InChI=1S/C8H12INO2/c1-2-3-6-10-8(11)12-7-4-5-9/h2-3,6-7H2,1H3,(H,10,11)","WYVVKGNFXHOCQV-UHFFFAOYSA-N"
"c1(nc(nc(n1)SC)NCC)NC(C)(C)C","InChI=1S/C10H19N5S/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15)","IROINLKCQGIITA-UHFFFAOYSA-N"
"CC1=C(C=CC(=C1)Cl)OC(C)C(=O)O","InChI=1S/C10H11ClO3/c1-6-5-8(11)3-4-9(6)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13)","WNTGYJSOUMFZEP-UHFFFAOYSA-N"
"c1(nc(nc(n1)Cl)N)NC(C)C","InChI=1S/C6H10ClN5/c1-3(2)9-6-11-4(7)10-5(8)12-6/h3H,1-2H3,(H3,8,9,10,11,12)","DFWFIQKMSFGDCQ-UHFFFAOYSA-N"
"c1(Oc2ccccc2)cc(ccc1)CO","InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2","KGANAERDZBAECK-UHFFFAOYSA-N"
"c1(cc(ccc1)C(O)=O)Oc1ccccc1","InChI=1S/C13H10O3/c14-13(15)10-5-4-8-12(9-10)16-11-6-2-1-3-7-11/h1-9H,(H,14,15)","NXTDJHZGHOFSQG-UHFFFAOYSA-N"
"CC(C)(C)C(CCC1=CC=C(C=C1)Cl)(CN2C=NC=N2)O","InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3","PXMNMQRDXWABCY-UHFFFAOYSA-N"
"OC(CN1C=NC=N1)(CN2C=NC=N2)C3=C(F)C=C(F)C=C3","InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2","RFHAOTPXVQNOHP-UHFFFAOYSA-N"
"ClC1=C(C=CC=C1)C(N2C=CN=C2)(C3=CC=CC=C3)C4=CC=CC=C4","InChI=1S/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H","VNFPBHJOKIVQEB-UHFFFAOYSA-N"
"C(=NC)Nc1c(cc(cc1)C)C","InChI=1S/C10H14N2/c1-8-4-5-10(9(2)6-8)12-7-11-3/h4-7H,1-3H3,(H,11,12)","JIIOLEGNERQDIP-UHFFFAOYSA-N"
"CNCCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F","InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3","RTHCYVBBDHJXIQ-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl","InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3","YMTINGFKWWXKFG-UHFFFAOYSA-N"
"c1cc(C(=O)c2ccc(cc2)OC(C(=O)O)(C)C)ccc1Cl","InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)","MQOBSOSZFYZQOK-UHFFFAOYSA-N"
"CN1N(C(=O)C=C1C)C2=CC=CC=C2","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3","VEQOALNAAJBPNY-UHFFFAOYSA-N"
"O=S(=O)(Nc1ccc(C)cc1)N(C)C","InChI=1S/C9H14N2O2S/c1-8-4-6-9(7-5-8)10-14(12,13)11(2)3/h4-7,10H,1-3H3","UDCDOJQOXWCCSD-UHFFFAOYSA-N"
"S(=O)(=O)(N)N(C)C","InChI=1S/C2H8N2O2S/c1-4(2)7(3,5)6/h1-2H3,(H2,3,5,6)","QMHAHUAQAJVBIW-UHFFFAOYSA-N"
"CC(=O)NC1=C(I)C(C(O)=O)=C(I)C(C(=O)NCCO)=C1I","InChI=1S/C12H11I3N2O5/c1-4(19)17-10-8(14)5(11(20)16-2-3-18)7(13)6(9(10)15)12(21)22/h18H,2-3H2,1H3,(H,16,20)(H,17,19)(H,21,22)","OLAOYPRJVHUHCF-UHFFFAOYSA-N"
"O=c1c(Cl)c(Cl)sn1CCCCCCCC","InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3","PORQOHRXAJJKGK-UHFFFAOYSA-N"
"c1(nc(nc(n1)OC)NCC)NC(C)(C)C","InChI=1S/C10H19N5O/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15)","BCQMBFHBDZVHKU-UHFFFAOYSA-N"
"CCNC1=NC(O)=NC(NC(C)(C)C)=N1","InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)","OYTCZOJKXCTBHG-UHFFFAOYSA-N"
"O=S(O)(CC(N(C(C)COC)C1=C(CC)C=CC=C1C)=O)=O","InChI=1S/C15H23NO5S/c1-5-13-8-6-7-11(2)15(13)16(12(3)9-21-4)14(17)10-22(18,19)20/h6-8,12H,5,9-10H2,1-4H3,(H,18,19,20)","CIGKZVUEZXGYSV-UHFFFAOYSA-N"
"COC1=C(C(=NC=C1)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC(F)F)OC","InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)","IQPSEEYGBUAQFF-UHFFFAOYSA-N"
"CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O","InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3","PNVNVHUZROJLTJ-UHFFFAOYSA-N"
"S(c1ccc(N)cc1)(O)(=O)=O","InChI=1S/C6H7NO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H,8,9,10)","HVBSAKJJOYLTQU-UHFFFAOYSA-N"
"OS(C1=CC2=C(C=CC=C2)C=C1)(=O)=O","InChI=1S/C10H8O3S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,11,12,13)","KVBGVZZKJNLNJU-UHFFFAOYSA-N"
"O=S(O)(C1=CC(C=C(C=C2)S(=O)(O)=O)=C2C=C1)=O","InChI=1S/C10H8O6S2/c11-17(12,13)9-3-1-7-2-4-10(18(14,15)16)6-8(7)5-9/h1-6H,(H,11,12,13)(H,14,15,16)","VILFVXYKHXVYAB-UHFFFAOYSA-N"
"CCC[C@@H]1C[C@H](N(C1)C)C(=O)NC([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)O)O)O)C(C)Cl","InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)/t9?,10-,11+,12?,13+,14-,15-,16-,18-/m1/s1","KDLRVYVGXIQJDK-NOWPCOIGSA-N"
"CCC(CC)OC1C=C(CC(C1NC(=O)C)N)C(=O)OCC","InChI=1S/C16H28N2O4/c1-5-12(6-2)22-14-9-11(16(20)21-7-3)8-13(17)15(14)18-10(4)19/h9,12-15H,5-8,17H2,1-4H3,(H,18,19)/t13-,14+,15+/m0/s1","VSZGPKBBMSAYNT-RRFJBIMHSA-N"
"CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N)C(=O)O","InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19)/t11-,12+,13+/m0/s1","NENPYTRHICXVCS-YNEHKIRRSA-N"
"CC2(C)c1cc3C(=O)OCC(C)c3cc1C(C)(C)C2C","InChI=1S/C18H24O2/c1-10-9-20-16(19)13-8-15-14(7-12(10)13)17(3,4)11(2)18(15,5)6/h7-8,10-11H,9H2,1-6H3","PGMHPYRIXBRRQD-UHFFFAOYSA-N"
"CC12CCC3C(C1CCC2=O)CC(=C)C4=CC(=O)C=CC34C","InChI=1S/C20H24O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h6,8,11,14-16H,1,4-5,7,9-10H2,2-3H3/t14-,15-,16-,19+,20-/m0/s1","BFYIZQONLCFLEV-DAELLWKTSA-N"
"Fc1ccc(cc1)N(C(C)C)C(=O)CS(O)(=O)=O","InChI=1S/C11H14FNO4S/c1-8(2)13(11(14)7-18(15,16)17)10-5-3-9(12)4-6-10/h3-6,8H,7H2,1-2H3,(H,15,16,17)","SZCMHDLOUVZYST-UHFFFAOYSA-N"
"Fc1ccc(cc1)N(C(C)C)C(=O)C(O)=O","InChI=1S/C11H12FNO3/c1-7(2)13(10(14)11(15)16)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,15,16)","FFKNXXCOXIZLJD-UHFFFAOYSA-N"
"O=S(=O)(O)CC(=O)N(c1ccccc1)C(C)C","InChI=1S/C11H15NO4S/c1-9(2)12(10-6-4-3-5-7-10)11(13)8-17(14,15)16/h3-7,9H,8H2,1-2H3,(H,14,15,16)","BFSZJLBDHMMCAH-UHFFFAOYSA-N"
"CC(C)N(C(=O)C(O)=O)c1ccccc1","InChI=1S/C11H13NO3/c1-8(2)12(10(13)11(14)15)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,14,15)","HYHJOUPYTUBFIX-UHFFFAOYSA-N"
"c1(nc(nc(n1)OC)NCC)NCC","InChI=1S/C8H15N5O/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13)","HKAMKLBXTLTVCN-UHFFFAOYSA-N"
"Oc1nc(NCC)nc(NCC)n1","InChI=1S/C7H13N5O/c1-3-8-5-10-6(9-4-2)12-7(13)11-5/h3-4H2,1-2H3,(H3,8,9,10,11,12,13)","YQIXRXMOJFQVBV-UHFFFAOYSA-N"
"c1(nc(nc(n1)OC)NCC)NC(CC)C","InChI=1S/C10H19N5O/c1-5-7(3)12-9-13-8(11-6-2)14-10(15-9)16-4/h7H,5-6H2,1-4H3,(H2,11,12,13,14,15)","ZJMZZNVGNSWOOM-UHFFFAOYSA-N"
"n1c(nc(Cl)nc1NCC)NC(CC)C","InChI=1S/C9H16ClN5/c1-4-6(3)12-9-14-7(10)13-8(15-9)11-5-2/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15)","BZRUVKZGXNSXMB-UHFFFAOYSA-N"
"Nc1nc(NC(C)(C)C)nc(Cl)n1","InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)","LMKQNTMFZLAJDV-UHFFFAOYSA-N"
"Nc1nc(NC(C)(C)C)nc(O)n1","InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)","NUISVCFZNCYUIM-UHFFFAOYSA-N"
"COC1=C(OC)C=CC(C(C(C)C)(C#N)CCCN(CCC2=CC(OC)=C(OC)C=C2)C)=C1","InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3","SGTNSNPWRIOYBX-UHFFFAOYSA-N"
"CC(C)NCC(O)COc1ccc(cc1)CC(=O)O","InChI=1S/C14H21NO4/c1-10(2)15-8-12(16)9-19-13-5-3-11(4-6-13)7-14(17)18/h3-6,10,12,15-16H,7-9H2,1-2H3,(H,17,18)","PUQIRTNPJRFRCZ-UHFFFAOYSA-N"
"c1(c(nncc1N)O)Cl","InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)","FEWPCPCEGBPTAL-UHFFFAOYSA-N"
"ClCC(=O)N(CCOCC)\C(=C(\C)C)c1ccccc1","InChI=1S/C16H22ClNO2/c1-4-20-11-10-18(15(19)12-17)16(13(2)3)14-8-6-5-7-9-14/h5-9H,4,10-12H2,1-3H3","CSWIKHNSBZVWNQ-UHFFFAOYSA-N"
"c(ccc1C(C(=O)O)C(NCC2)CC2)cc1","InChI=1S/C13H17NO2/c15-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-3,6-7,11-12,14H,4-5,8-9H2,(H,15,16)","INGSNVSERUZOAK-UHFFFAOYSA-N"
"c(ccc1N(N(C=2C)C)C(=O)C2N(C)C)cc1","InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3","RMMXTBMQSGEXHJ-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2(C(C(C(O2)CCl)O)O)CCl)O)O)Cl)O","InChI=1S/C12H19Cl3O8/c13-1-4-7(17)10(20)12(3-14,22-4)23-11-9(19)8(18)6(15)5(2-16)21-11/h4-11,16-20H,1-3H2/t4-,5-,6+,7-,8+,9-,10+,11-,12+/m1/s1","BAQAVOSOZGMPRM-QBMZZYIRSA-N"
"CC(C)(C)C(=O)O/C2=C(/C(=O)N1CCOCCN12)c3c(CC)cc(C)cc3CC","InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3","MGOHCFMYLBAPRN-UHFFFAOYSA-N"
"O=C(N(C1=C(C=CC=C1C)C)CN2C=CC=N2)CS(O)(=O)=O","InChI=1S/C14H17N3O4S/c1-11-5-3-6-12(2)14(11)17(10-16-8-4-7-15-16)13(18)9-22(19,20)21/h3-8H,9-10H2,1-2H3,(H,19,20,21)","IPVCSECPEVHQOV-UHFFFAOYSA-N"
"Cc1cccc(c1N(Cn2cccn2)C(=O)C(=O)O)C","InChI=1S/C14H15N3O3/c1-10-5-3-6-11(2)12(10)17(13(18)14(19)20)9-16-8-4-7-15-16/h3-8H,9H2,1-2H3,(H,19,20)","PHMHHVKFXZNTKU-UHFFFAOYSA-N"
"Cc1cccc(C)c1N(CCOC)C(=O)CCl","InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3","SCCDDNKJYDZXMM-UHFFFAOYSA-N"
"O=C(COc1nnc(s1)C(F)(F)F)N(c2ccc(F)cc2)C(C)C","InChI=1S/C14H13F4N3O2S/c1-8(2)21(10-5-3-9(15)4-6-10)11(22)7-23-13-20-19-12(24-13)14(16,17)18/h3-6,8H,7H2,1-2H3","IANUJLZYFUDJIH-UHFFFAOYSA-N"
"O=C(O)c1cc(c(O)c(Br)c1)Br","InChI=1S/C7H4Br2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)","PHWAJJWKNLWZGJ-UHFFFAOYSA-N"
"c(ccc1N(N(C=2C)C)C(=O)C2N)cc1","InChI=1S/C11H13N3O/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,12H2,1-2H3","RLFWWDJHLFCNIJ-UHFFFAOYSA-N"
"NC(=O)N2c1ccccc1C4OC4c3ccccc23","InChI=1S/C15H12N2O2/c16-15(18)17-11-7-3-1-5-9(11)13-14(19-13)10-6-2-4-8-12(10)17/h1-8,13-14H,(H2,16,18)","ZRWWEEVEIOGMMT-UHFFFAOYSA-N"
"c1cc2Nc3ccccc3\C=C/c2cc1","InChI=1S/C14H11N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-10,15H","LCGTWRLJTMHIQZ-UHFFFAOYSA-N"
"CNCC(C1=CC=C(C=C1)OC)C2(CCCCC2)O","InChI=1S/C16H25NO2/c1-17-12-15(16(18)10-4-3-5-11-16)13-6-8-14(19-2)9-7-13/h6-9,15,17-18H,3-5,10-12H2,1-2H3","MKAFOJAJJMUXLW-UHFFFAOYSA-N"
"O=C2C(\NC=O)=C(\C)N(C)N2c1ccccc1","InChI=1S/C12H13N3O2/c1-9-11(13-8-16)12(17)15(14(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)","WSJBSKRPKADYRQ-UHFFFAOYSA-N"
"CN(C)CC(C1=CC=C(C=C1)O)C2(CCCCC2)O","InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3","KYYIDSXMWOZKMP-UHFFFAOYSA-N"
"CC1=C(N(C(CS(O)(=O)=O)=O)CCOC)C(C)=CC=C1","InChI=1S/C13H19NO5S/c1-10-5-4-6-11(2)13(10)14(7-8-19-3)12(15)9-20(16,17)18/h4-6H,7-9H2,1-3H3,(H,16,17,18)","RVSCDWJKJDBFRS-UHFFFAOYSA-N"
"Cc1cccc(C)c1N(CCOC)C(=O)C(O)=O","InChI=1S/C13H17NO4/c1-9-5-4-6-10(2)11(9)14(7-8-18-3)12(15)13(16)17/h4-6H,7-8H2,1-3H3,(H,16,17)","MHGMSAFPNAKIRZ-UHFFFAOYSA-N"
"CN(C)C(=N)NC(N)=N","InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)","XZWYZXLIPXDOLR-UHFFFAOYSA-N"
"[H][C@](N)(CSCCCC\C=C(/NC(=O)[C@@]1([H])CC1(C)C)C(O)=O)C(O)=O","InChI=1S/C16H26N2O5S/c1-16(2)8-10(16)13(19)18-12(15(22)23)6-4-3-5-7-24-9-11(17)14(20)21/h6,10-11H,3-5,7-9,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23)/b12-6-/t10-,11+/m1/s1","DHSUYTOATWAVLW-WFVMDLQDSA-N"
"FC1=CNC(=O)NC1=O","InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)","GHASVSINZRGABV-UHFFFAOYSA-N"
"COC1=CC=CC(=C1)[C@@]2(O)CCCC[C@@H]2CN(C)C","InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/t14-,16+/m1/s1","TVYLLZQTGLZFBW-ZBFHGGJFSA-N"
"CC(C)C(NC(=O)N(C)CC1=CSC(=N1)C(C)C)C(=O)N[C@H](CC(O)[C@H](CC2=CC=CC=C2)NC(=O)OCC3=CN=CS3)CC4=CC=CC=C4","InChI=1S/C37H48N6O5S2/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)/t28-,31-,32?,33?/m0/s1","NCDNCNXCDXHOMX-FDEOAKKQSA-N"
"CCCCC(=O)N(CC1=CC=C(C=C1)C2=C(C=CC=C2)C3=NN=NN3)[C@@H](C(C)C)C(O)=O","InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m0/s1","ACWBQPMHZXGDFX-QFIPXVFZSA-N"
"NS(=O)(=O)c2cc(c(NCc1ccco1)cc2Cl)C(=O)O","InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)","ZZUFCTLCJUWOSV-UHFFFAOYSA-N"
"NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](CO)[C@@H](O)C2(F)F","InChI=1S/C9H11F2N3O4/c10-9(11)6(16)4(3-15)18-7(9)14-2-1-5(12)13-8(14)17/h1-2,4,6-7,15-16H,3H2,(H2,12,13,17)/t4-,6-,7-/m1/s1","SDUQYLNIPVEERB-QPPQHZFASA-N"
"NS(=O)(=O)C1=CC2=C(NCNS2(=O)=O)C=C1Cl","InChI=1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)","JZUFKLXOESDKRF-UHFFFAOYSA-N"
"[H][C@@]12C[C@@H](C)[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3(F)[C@@]2([H])CCC4=CC(=O)C=C[C@]34C","InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1","UREBDLICKHMUKA-CXSFZGCWSA-N"
"[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])C[C@]([H])(C)C4=CC(=O)C=C[C@]34C","InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17-,19+,20-,21-,22-/m0/s1","VHRSUDSXCMQTMA-PJHHCJLFSA-N"
"CN1C2=C(C=C(Cl)C=C2)C(=NCC1=O)C3=CC=CC=C3","InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3","AAOVKJBEBIDNHE-UHFFFAOYSA-N"
"CC(C)C(CCCNC)(C#N)C1=CC(=C(C=C1)OC)OC","InChI=1S/C17H26N2O2/c1-13(2)17(12-18,9-6-10-19-3)14-7-8-15(20-4)16(11-14)21-5/h7-8,11,13,19H,6,9-10H2,1-5H3","WLOBUUJURNEQCL-UHFFFAOYSA-N"
"O=C/1NC(=O)N(\C=C\1)[C@@H]2O[C@@H]([C@@H](O)C2(F)F)CO","InChI=1S/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m1/s1","FIRDBEQIJQERSE-QPPQHZFASA-N"
"OC2(C(c1ccc(O)cc1)CNC)CCCCC2","InChI=1S/C15H23NO2/c1-16-11-14(12-5-7-13(17)8-6-12)15(18)9-3-2-4-10-15/h5-8,14,16-18H,2-4,9-11H2,1H3","MMSWXJSQCAEDLK-UHFFFAOYSA-N"
"OC2(C(c1ccc(OC)cc1)CN)CCCCC2","InChI=1S/C15H23NO2/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15/h5-8,14,17H,2-4,9-11,16H2,1H3","SUQHIQRIIBKNOR-UHFFFAOYSA-N"
"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F","InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2","ZOCSXAVNDGMNBV-UHFFFAOYSA-N"
"NC1=C(C(=NN1c1c(Cl)cc(cc1Cl)C(F)(F)F)C#N)S(=O)(=O)C(F)(F)F","InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2","LGHZJDKSVUTELU-UHFFFAOYSA-N"
"FC(F)(F)c2cc(Cl)c(n1nc(C#N)c(SC(F)(F)F)c1N)c(Cl)c2","InChI=1S/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2","FQXWEKADCSXYOC-UHFFFAOYSA-N"
"C1=C(C=C(C(=C1Cl)N2C(=C(C(=N2)C#N)C(F)(F)F)N)Cl)C(F)(F)F","InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2","JWKXVHLIRTVXLD-UHFFFAOYSA-N"
"c1cc(ccc1CC(=O)N)OCC(CN)O","InChI=1S/C11H16N2O3/c12-6-9(14)7-16-10-3-1-8(2-4-10)5-11(13)15/h1-4,9,14H,5-7,12H2,(H2,13,15)","UWMXVJVTKRSOPW-UHFFFAOYSA-N"
"Cl-c(ccc1C(=O)NCCN(CCO2)CC2)cc1","InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)","YHXISWVBGDMDLQ-UHFFFAOYSA-N"
"Cl-c(ccc1)c(Cl)c1-c(nnc2N)c(n2)N","InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)","PYZRQGJRPPTADH-UHFFFAOYSA-N"
"COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC","InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1","QEVHRUUCFGRFIF-MDEJGZGSSA-N"
"ClCCN(P(OC1)(=O)NCCCl)CC1","InChI=1S/C7H15Cl2N2O2P/c8-2-4-10-14(12)11(6-3-9)5-1-7-13-14/h1-7H2,(H,10,12)","HOMGKSMUEGBAAB-UHFFFAOYSA-N"
"c12[C@@H]([C@@H](O)c3c(N(C(N)=O)c2cccc1)cccc3)O","InChI=1S/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14-/m0/s1","PRGQOPPDPVELEG-KBPBESRZSA-N"
"ClC(NC(=O)C=1Cl)=C(Cl)C1","InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)","WCYYAQFQZQEUEN-UHFFFAOYSA-N"
"O(c1nc(nc(c1)C)C(C)C)P(OCC)(OCC)=O","InChI=1S/C12H21N2O4P/c1-6-16-19(15,17-7-2)18-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3","VBLJFQYCTRKKKF-UHFFFAOYSA-N"
"O=C/1/N=C(\N\C(=C\1)C)C(C)C","InChI=1S/C8H12N2O/c1-5(2)8-9-6(3)4-7(11)10-8/h4-5H,1-3H3,(H,9,10,11)","AJPIUNPJBFBUKK-UHFFFAOYSA-N"
"c1ccccc1N(C(=O)C(=O)N(C)C)N(C)C(=O)C","InChI=1S/C13H17N3O3/c1-10(17)15(4)16(11-8-6-5-7-9-11)13(19)12(18)14(2)3/h5-9H,1-4H3","IRTZMJWVZQYURE-UHFFFAOYSA-N"
"Cl-c(ncc1CN(CC2)C(N2)=NN(=O)=O)cc1","InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)","YWTYJOPNNQFBPC-UHFFFAOYSA-N"
"c1(c(cc(Cl)cc1)C)OCCCC(O)=O","InChI=1S/C11H13ClO3/c1-8-7-9(12)4-5-10(8)15-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14)","LLWADFLAOKUBDR-UHFFFAOYSA-N"
"n(c(c(C)c1OC(=O)N(C)C)C)c(n1)N(C)C","InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3","YFGYUFNIOHWBOB-UHFFFAOYSA-N"
"c(ccc1N-c(nc(c2)C)nc2C)cc1","InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)","ZLIBICFPKPWGIZ-UHFFFAOYSA-N"
"O=C(O)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C4HF7O2/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H,12,13)","YPJUNDFVDDCYIH-UHFFFAOYSA-N"
"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C5HF9O2/c6-2(7,1(15)16)3(8,9)4(10,11)5(12,13)14/h(H,15,16)","CXZGQIAOTKWCDB-UHFFFAOYSA-N"
"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C6HF11O2/c7-2(8,1(18)19)3(9,10)4(11,12)5(13,14)6(15,16)17/h(H,18,19)","PXUULQAPEKKVAH-UHFFFAOYSA-N"
"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22)","ZWBAMYVPMDSJGQ-UHFFFAOYSA-N"
"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h(H,24,25)","SNGREZUHAYWORS-UHFFFAOYSA-N"
"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C9HF17O2/c10-2(11,1(27)28)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)26/h(H,27,28)","UZUFPBIDKMEQEQ-UHFFFAOYSA-N"
"O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C10HF19O2/c11-2(12,1(30)31)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)29/h(H,30,31)","PCIUEQPBYFRTEM-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C11HF21O2/c12-2(13,1(33)34)3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)11(30,31)32/h(H,33,34)","SIDINRCMMRKXGQ-UHFFFAOYSA-N"
"FC(F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)NCC","InChI=1S/C10H6F17NO2S/c1-2-28-31(29,30)10(26,27)8(21,22)6(17,18)4(13,14)3(11,12)5(15,16)7(19,20)9(23,24)25/h28H,2H2,1H3","CCEKAJIANROZEO-UHFFFAOYSA-N"
"FC(F)(C(/F)=C\C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8H2F12O2/c9-2(1-3(21)22)4(10,11)5(12,13)6(14,15)7(16,17)8(18,19)20/h1H,(H,21,22)/b2-1+","BKOBFLVYTXYFQZ-OWOJBTEDSA-N"
"FC(F)(C(/F)=C/C(O)=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C10H2F16O2/c11-2(1-3(27)28)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)26/h1H,(H,27,28)/b2-1-","WHZXTVOEGZRRJM-UPHRSURJSA-N"
"O=C(O)/C(=C\OC)c3ccccc3Oc2cc(Oc1ccccc1C#N)ncn2","InChI=1S/C21H15N3O5/c1-27-12-16(21(25)26)15-7-3-5-9-18(15)29-20-10-19(23-13-24-20)28-17-8-4-2-6-14(17)11-22/h2-10,12-13H,1H3,(H,25,26)/b16-12-","IKCXDZCEWZARFL-VBKFSLOCSA-N"
"[O-][N+](=O)\C=C(/NC)NCCS(=O)Cc1oc(cc1)CN(C)C","InChI=1S/C13H22N4O4S/c1-14-13(9-17(18)19)15-6-7-22(20)10-12-5-4-11(21-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+","SKHXRNHSZTXSLP-UKTHLTGXSA-N"
"c1(oc(CSCCN\C(=C\[N+](=O)[O-])NC)cc1)CN(C)(C)=O","InChI=1S/C13H22N4O4S/c1-14-13(8-16(18)19)15-6-7-22-10-12-5-4-11(21-12)9-17(2,3)20/h4-5,8,14-15H,6-7,9-10H2,1-3H3/b13-8+","DFJVUWAHTQPQCV-MDWZMJQESA-N"
"CC(C)(C)C(=O)C(N1C=CN=C1)OC2=CC=C(C=C2)Cl","InChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3","OWEGWHBOCFMBLP-UHFFFAOYSA-N"
"c1c(S(=O)(=O)NC(Nc2nc(nc(n2)C(F)(F)F)OC)=O)c(C(F)(F)F)ccc1","InChI=1S/C13H9F6N5O4S/c1-28-11-21-8(13(17,18)19)20-9(23-11)22-10(25)24-29(26,27)7-5-3-2-4-6(7)12(14,15)16/h2-5H,1H3,(H2,20,21,22,23,24,25)","KVEQCVKVIFQSGC-UHFFFAOYSA-N"
"c1(nc(nc(n1)Cl)NC(C)C)NC(C)C","InChI=1S/C9H16ClN5/c1-5(2)11-8-13-7(10)14-9(15-8)12-6(3)4/h5-6H,1-4H3,(H2,11,12,13,14,15)","WJNRPILHGGKWCK-UHFFFAOYSA-N"
"C1([C@@](C(N=C(N1)S)=O)([C@@H](CCC)C)CC)=O","InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)","IUJDSEJGGMCXSG-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)Cl)O","InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)","ADIMAYPTOBDMTL-UHFFFAOYSA-N"
"S1(NC(C=C(O1)C)=O)(=O)=O","InChI=1S/C4H5NO4S/c1-3-2-4(6)5-10(7,8)9-3/h2H,1H3,(H,5,6)","YGCFIWIQZPHFLU-UHFFFAOYSA-N"
"c1([C@H]([C@@H](NC)C)O)ccccc1","InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10-/m0/s1","KWGRBVOPPLSCSI-WPRPVWTQSA-N"
"CCNC1=NC(=NC(=N1)Cl)NC(C)(C)C#N","InChI=1S/C9H13ClN6/c1-4-12-7-13-6(10)14-8(15-7)16-9(2,3)5-11/h4H2,1-3H3,(H2,12,13,14,15,16)","MZZBPDKVEFVLFF-UHFFFAOYSA-N"
"COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(=O)O)N","InChI=1S/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m0/s1","IAOZJIPTCAWIRG-QWRGUYRKSA-N"
"C1CN(CCN1CCOCC(=O)O)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl","InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)","ZKLPARSLTMPFCP-UHFFFAOYSA-N"
"C12(C(N(Cc3ccc(c4c(c5[nH]nnn5)cccc4)cc3)C(=N1)CCCC)=O)CCCC2","InChI=1S/C25H28N6O/c1-2-3-10-22-26-25(15-6-7-16-25)24(32)31(22)17-18-11-13-19(14-12-18)20-8-4-5-9-21(20)23-27-29-30-28-23/h4-5,8-9,11-14H,2-3,6-7,10,15-17H2,1H3,(H,27,28,29,30)","YOSHYTLCDANDAN-UHFFFAOYSA-N"
"CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)O)/C=C(\CC3=CC=CS3)/C(=O)O","InChI=1S/C23H24N2O4S/c1-2-3-6-21-24-14-19(12-18(23(28)29)13-20-5-4-11-30-20)25(21)15-16-7-9-17(10-8-16)22(26)27/h4-5,7-12,14H,2-3,6,13,15H2,1H3,(H,26,27)(H,28,29)/b18-12+","OROAFUQRIXKEMV-LDADJPATSA-N"
"O=C(Nc1nc(OC)cc(OC)n1)NS(=O)(=O)c2cc(NC=O)ccc2C(=O)N(C)C","InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)","PXDNXJSDGQBLKS-UHFFFAOYSA-N"
"c1(ccc(n2ccc(OCc3c(cccc3)N(OC)C(OC)=O)n2)cc1)Cl","InChI=1S/C19H18ClN3O4/c1-25-19(24)23(26-2)17-6-4-3-5-14(17)13-27-18-11-12-22(21-18)16-9-7-15(20)8-10-16/h3-12H,13H2,1-2H3","HZRSNVGNWUDEFX-UHFFFAOYSA-N"
"c1(cc(C(=O)NCCN(CC)CC)c(cc1N)OC)Cl","InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)","TTWJBBZEZQICBI-UHFFFAOYSA-N"
"N([C@@H](CC)CO)CCN[C@@H](CC)CO","InChI=1S/C10H24N2O2/c1-3-9(7-13)11-5-6-12-10(4-2)8-14/h9-14H,3-8H2,1-2H3/t9-,10-/m0/s1","AEUTYOVWOVBAKS-UWVGGRQHSA-N"
"C1[C@H]2[C@H]3[C@@H]([C@@]4(C(=CC(=O)C=C4)CC3)C)[C@@H](O)C[C@@]2([C@](C(CO)=O)(O)C1)C","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1","OIGNJSKKLXVSLS-VWUMJDOOSA-N"
"N(C)(CCCCCCCCCC)(C)=O","InChI=1S/C12H27NO/c1-4-5-6-7-8-9-10-11-12-13(2,3)14/h4-12H2,1-3H3","ZRKZFNZPJKEWPC-UHFFFAOYSA-N"
"CCCN(CC)CC1COC2(O1)CCC(CC2)C(C)(C)C","InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3","PUYXTUJWRLOUCW-UHFFFAOYSA-N"
"CC(C)C1=NC(=NC(=C1/C=C/[C@H](C[C@H](CC(=O)O)O)O)C2=CC=C(C=C2)F)N(C)S(=O)(=O)C","InChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m1/s1","BPRHUIZQVSMCRT-VEUZHWNKSA-N"
"c1(C(=O)C(NC(C)(C)C)C)cc(ccc1)Cl","InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3","SNPPWIUOZRMYNY-UHFFFAOYSA-N"
"c1(ccccc1c1ccc(Cn2c(nc3c2c(C(=O)O)ccc3)OCC)cc1)c1nnn[nH]1","InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)","HTQMVQVXFRQIKW-UHFFFAOYSA-N"
"n1(c(nc2c1cccc2)c1cc(c2c(n(c(CCC)n2)Cc2ccc(cc2)c2c(cccc2)C(O)=O)c1)C)C","InChI=1S/C33H30N4O2/c1-4-9-30-35-31-21(2)18-24(32-34-27-12-7-8-13-28(27)36(32)3)19-29(31)37(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(38)39/h5-8,10-19H,4,9,20H2,1-3H3,(H,38,39)","RMMXLENWKUUMAY-UHFFFAOYSA-N"
"c12c(c(c(C\C=C(\CCC(O)=O)C)c(c1C)OC)O)C(=O)OC2","InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+","HPNSFSBZBAHARI-RUDMXATFSA-N"
"c1(c(ccc(c1)NC([C@@](CS(c1ccc(F)cc1)(=O)=O)(C)O)=O)C#N)C(F)(F)F","InChI=1S/C18H14F4N2O4S/c1-17(26,10-29(27,28)14-6-3-12(19)4-7-14)16(25)24-13-5-2-11(9-23)15(8-13)18(20,21)22/h2-8,26H,10H2,1H3,(H,24,25)/t17-/m0/s1","LKJPYSCBVHEWIU-KRWDZBQOSA-N"
"c1(c(n(CC[C@H](C[C@H](CC(=O)O)O)O)c(c1C(Nc1ccccc1)=O)C(C)C)c1ccc(F)cc1)c1ccccc1","InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-,27-/m1/s1","XUKUURHRXDUEBC-KAYWLYCHSA-N"
"C1(CCCCC1)NS(O)(=O)=O","InChI=1S/C6H13NO3S/c8-11(9,10)7-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,9,10)","HCAJEUSONLESMK-UHFFFAOYSA-N"
"O([C@H]1[C@H](O[C@H]2[C@@H]([C@@H]([C@@H](O)[C@@H](O2)C)O)O)[C@H]([C@H](O)[C@H](O1)CO)O)c1cc(c(C(CCc2cc(c(OC)cc2)O)=O)c(c1)O)O","InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1","ITVGXXMINPYUHD-CUVHLRMHSA-N"
"CC(C)(C)CCN[C@@H](CC(=O)O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OC","InChI=1S/C20H30N2O5/c1-20(2,3)10-11-21-15(13-17(23)24)18(25)22-16(19(26)27-4)12-14-8-6-5-7-9-14/h5-9,15-16,21H,10-13H2,1-4H3,(H,22,25)(H,23,24)/t15-,16-/m0/s1","HLIAVLHNDJUHFG-HOTGVXAUSA-N"
"c12c(C(=O)NS1(=O)=O)cccc2","InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)","CVHZOJJKTDOEJC-UHFFFAOYSA-N"
"CN1C2CCC1C(C(C2)OC(=O)C3=CC=CC=C3)C(=O)OC","InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1","ZPUCINDJVBIVPJ-LJISPDSOSA-N"
"c1c(Cl)cccc1N1CCNCC1","InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2","VHFVKMTVMIZMIK-UHFFFAOYSA-N"
"c1c(C(F)(F)F)cccc1N1CCNCC1","InChI=1S/C11H13F3N2/c12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16/h1-3,8,15H,4-7H2","KKIMDKMETPPURN-UHFFFAOYSA-N"
"C1CN(CCN1)Cc1ccccc1","InChI=1S/C11H16N2/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13/h1-5,12H,6-10H2","IQXXEPZFOOTTBA-UHFFFAOYSA-N"
"C1(\c2c(CCc3c1cccc3)cccc2)=C\CCN(C)C","InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3","KRMDCWKBEZIMAB-UHFFFAOYSA-N"
"c1(ccccc1)CC(N)C","InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3","KWTSXDURSIMDCE-UHFFFAOYSA-N"
"CN1C2CCC1C(C(C2)OC(=O)C3=CC=CC=C3)C(=O)O","InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)","GVGYEFKIHJTNQZ-UHFFFAOYSA-N"
"O(c1ccc3c(c1)[C@@]24[C@@H]([C@H](N(CC2)C)C3)CCCC4)C","InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15-,17+,18+/m1/s1","MKXZASYAUGDDCJ-NJAFHUGGSA-N"
"C/C=C/1\C(CC(N1C)C)(C2=CC=CC=C2)C3=CC=CC=C3","InChI=1S/C20H23N/c1-4-19-20(15-16(2)21(19)3,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h4-14,16H,15H2,1-3H3/b19-4+","AJRJPORIQGYFMT-RMOCHZDMSA-N"
"CNC1(CCCCC1=O)C2=CC=CC=C2Cl","InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3","YQEZLKZALYSWHR-UHFFFAOYSA-N"
"CCC(=O)C(CC(C)N(C)C)(c1ccccc1)c2ccccc2","InChI=1S/C21H27NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3","USSIQXCVUWKGNF-UHFFFAOYSA-N"
"c1cccc(c1)C[C@H](C)NC","InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m0/s1","MYWUZJCMWCOHBA-VIFPVBQESA-N"
"c12[C@]34[C@@]5([C@H]([N@](CC6CC6)CC4)Cc2ccc(c1O[C@H]3C(=O)CC5)O)O","InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1","DQCKKXVULJGBQN-XFWGSAIBSA-N"
"C1(=Nc2c(Nc3c1cccc3)ccc(c2)Cl)N1CCN(CC1)C","InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3","QZUDBNBUXVUHMW-UHFFFAOYSA-N"
"c1c(c(ccc1)O[C@@H](c1ccccc1)CCNC)C","InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1","VHGCDTVCOLNTBX-QGZVFWFLSA-N"
"O=S(=O)(O)CCCNC(=O)C","InChI=1S/C5H11NO4S/c1-5(7)6-3-2-4-11(8,9)10/h2-4H2,1H3,(H,6,7)(H,8,9,10)","AFCGFAGUEYAMAO-UHFFFAOYSA-N"
"OCc1cc(ccc1O)C(O)CNC(C)(C)C","InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3","NDAUXUAQIAJITI-UHFFFAOYSA-N"
"CCN1CCCC1CNC(=O)C2=CC(=C(C=C2OC)N)S(=O)(=O)CC","InChI=1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)","NTJOBXMMWNYJFB-UHFFFAOYSA-N"
"C1CN(CC2=C1SC=C2)C(C3=CC=CC=C3Cl)C(=O)O","InChI=1S/C15H14ClNO2S/c16-12-4-2-1-3-11(12)14(15(18)19)17-7-5-13-10(9-17)6-8-20-13/h1-4,6,8,14H,5,7,9H2,(H,18,19)","DCASRSISIKYPDD-UHFFFAOYSA-N"
"CS(=O)(=O)Nc1cc2c(c(oc2cc1)CCCC)C(c1ccc(cc1)OCCCN(CCCC)CCCC)=O","InChI=1S/C31H44N2O5S/c1-5-8-12-29-30(27-23-25(32-39(4,35)36)15-18-28(27)38-29)31(34)24-13-16-26(17-14-24)37-22-11-21-33(19-9-6-2)20-10-7-3/h13-18,23,32H,5-12,19-22H2,1-4H3","ZQTNQVWKHCQYLQ-UHFFFAOYSA-N"
"c1([C@H]2CN3CCSC3=N2)ccccc1","InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2/t10-/m1/s1","HLFSDGLLUJUHTE-SNVBAGLBSA-N"
"CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)O)O)O)O","InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)/t13-,14-,16+,17+,18+,19-,20-,22-/m0/s1","TUZYXOIXSAXUGO-PZAWKZKUSA-N"
"CC(CN1C2=CC=CC=C2CCC3=CC=CC=C31)CN(C)C","InChI=1S/C20H26N2/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22/h4-11,16H,12-15H2,1-3H3","ZSCDBOWYZJWBIY-UHFFFAOYSA-N"
"FC=1\C(=N/C(=O)N(C=1)[C@@H]2O[C@@H]([C@@H](OC(=O)C)[C@H]2OC(=O)C)C)\N","InChI=1S/C13H16FN3O6/c1-5-9(22-6(2)18)10(23-7(3)19)12(21-5)17-4-8(14)11(15)16-13(17)20/h4-5,9-10,12H,1-3H3,(H2,15,16,20)/t5-,9-,10-,12-/m1/s1","NWJBWNIUGNXJGO-RPULLILYSA-N"
"Ic1c(c(I)c(c(I)c1NC(=O)C(CO)CO)C(=O)N(CC(O)CO)C)C(=O)N(CC(O)CO)C","InChI=1S/C20H28I3N3O9/c1-25(3-10(31)7-29)19(34)12-14(21)13(20(35)26(2)4-11(32)8-30)16(23)17(15(12)22)24-18(33)9(5-27)6-28/h9-11,27-32H,3-8H2,1-2H3,(H,24,33)","YLPBXIKWXNRACS-UHFFFAOYSA-N"
"O=C5O[C@@]4([C@@]3([C@H]([C@@H]2[C@H](SC(=O)C)C/C1=C/C(=O)CC[C@]1(C)[C@H]2CC3)CC4)C)CC5","InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1","LXMSZDCAJNLERA-ZHYRCANASA-N"
"Fc1cc(c(F)cc1F)C[C@@H](N)CC(=O)N3Cc2nnc(n2CC3)C(F)(F)F","InChI=1S/C16H15F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1","MFFMDFFZMYYVKS-SECBINFHSA-N"
"FC(F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)NCC(O)=O","InChI=1S/C10H4F17NO4S/c11-3(12,5(15,16)7(19,20)9(23,24)25)4(13,14)6(17,18)8(21,22)10(26,27)33(31,32)28-1-2(29)30/h28H,1H2,(H,29,30)","AYLOUUCBACYHAB-UHFFFAOYSA-N"
"FC(F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)N(C)CC(O)=O","InChI=1S/C11H6F17NO4S/c1-29(2-3(30)31)34(32,33)11(27,28)9(22,23)7(18,19)5(14,15)4(12,13)6(16,17)8(20,21)10(24,25)26/h2H2,1H3,(H,30,31)","QNDHIRFIMVNHBN-UHFFFAOYSA-N"
"FC(F)(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)N(CC(O)=O)CC","InChI=1S/C12H8F17NO4S/c1-2-30(3-4(31)32)35(33,34)12(28,29)10(23,24)8(19,20)6(15,16)5(13,14)7(17,18)9(21,22)11(25,26)27/h2-3H2,1H3,(H,31,32)","CKRXVVGETMYFIO-UHFFFAOYSA-N"
"FC(F)(CCOP(=O)(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C16H9F26O4P/c17-5(18,7(21,22)9(25,26)11(29,30)13(33,34)15(37,38)39)1-3-45-47(43,44)46-4-2-6(19,20)8(23,24)10(27,28)12(31,32)14(35,36)16(40,41)42/h1-4H2,(H,43,44)","ZDYYWMSLMLTXDM-UHFFFAOYSA-N"
"FC(F)(CCOP(=O)(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C20H9F34O4P/c21-5(22,7(25,26)9(29,30)11(33,34)13(37,38)15(41,42)17(45,46)19(49,50)51)1-3-57-59(55,56)58-4-2-6(23,24)8(27,28)10(31,32)12(35,36)14(39,40)16(43,44)18(47,48)20(52,53)54/h1-4H2,(H,55,56)","AFWOYEYXUDHGHF-UHFFFAOYSA-N"
"O=P(O)(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)O","InChI=1S/C8H6F13O4P/c9-3(10,1-2-25-26(22,23)24)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1-2H2,(H2,22,23,24)","FZTRDYSPWWJCOF-UHFFFAOYSA-N"
"O=P(O)(OCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)O","InChI=1S/C10H6F17O4P/c11-3(12,1-2-31-32(28,29)30)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2,(H2,28,29,30)","MIABSAQIFYEDJP-UHFFFAOYSA-N"
"Clc1cc(c(F)c(Cl)c1F)NC(=O)NC(=O)c2c(F)cccc2F","InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)","CJDWRQLODFKPEL-UHFFFAOYSA-N"
"Clc1ncc(s1)CN/C(=N/C)N[N+]([O-])=O","InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)","PGOOBECODWQEAB-UHFFFAOYSA-N"
"Clc4ccc(Oc1ccc(c(Cl)c1)C2(OCC(O2)C)Cn3ncnc3)cc4","InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3","BQYJATMQXGBDHF-UHFFFAOYSA-N"
"O=C(c1cc(cc(c1)C)C)N(NC(=O)c2cccc(OC)c2C)C(C)(C)C","InChI=1S/C22H28N2O3/c1-14-11-15(2)13-17(12-14)21(26)24(22(4,5)6)23-20(25)18-9-8-10-19(27-7)16(18)3/h8-13H,1-7H3,(H,23,25)","QCAWEPFNJXQPAN-UHFFFAOYSA-N"
"CC(C)OC(=O)NC(C(=O)N[C@@H](C)c1ccc(C)cc1)C(C)C","InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14-,16?/m0/s1","NWUWYYSKZYIQAE-LBAUFKAWSA-N"
"O=C(Oc1cc(c(SC)c(c1)C)C)NC","InChI=1S/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)","YFBPRJGDJKVWAH-UHFFFAOYSA-N"
"c1ccc(c(c1)c2ccc(cc2)Cl)NC(=O)c3cccnc3Cl","InChI=1S/C18H12Cl2N2O/c19-13-9-7-12(8-10-13)14-4-1-2-6-16(14)22-18(23)15-5-3-11-21-17(15)20/h1-11H,(H,22,23)","WYEMLYFITZORAB-UHFFFAOYSA-N"
"O=C(O)c1c(ncc(c1)COC)/C2=N/C(C(=O)N2)(C(C)C)C","InChI=1S/C15H19N3O4/c1-8(2)15(3)14(21)17-12(18-15)11-10(13(19)20)5-9(6-16-11)7-22-4/h5-6,8H,7H2,1-4H3,(H,19,20)(H,17,18,21)","NUPJIGQFXCQJBK-UHFFFAOYSA-N"
"O=C(OCC)NCCOc2ccc(Oc1ccccc1)cc2","InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)","HJUFTIJOISQSKQ-UHFFFAOYSA-N"
"Clc1ncc(s1)CN2\C(=N\[N+]([O-])=O)N(C)COC2","InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8+","NWWZPOKUUAIXIW-DHZHZOJOSA-N"
"C/C(=N\OC(=O)NC)SC","InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)/b7-4+","UHXUZOCRWCRNSJ-QPJJXVBHSA-N"
"O=C(NCC#N)c1cnccc1C(F)(F)F","InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)","RLQJEEJISHYWON-UHFFFAOYSA-N"
"COC1=C(C=C(C=C1)/C(=C/C(=O)N2CCOCC2)/C3=CC=C(C=C3)Cl)OC","InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3/b18-14+","QNBTYORWCCMPQP-NBVRZTHBSA-N"
"N(C(OCCC)=O)CCCN(C)C","InChI=1S/C9H20N2O2/c1-4-8-13-9(12)10-6-5-7-11(2)3/h4-8H2,1-3H3,(H,10,12)","WZZLDXDUQPOXNW-UHFFFAOYSA-N"
"ClC1=C(OCC(O)=O)N=C(Cl)C(Cl)=C1","InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)","REEQLXCGVXDJSQ-UHFFFAOYSA-N"
"O=C2N(/N=C/c1cccnc1)C\C(=N/N2)C","InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+","QHMTXANCGGJZRX-WUXMJOGZSA-N"
"O=C1\C3=C(/NC(=O)N1C2CCCCC2)CCC3","InChI=1S/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)","ZTMKADLOSYKWCA-UHFFFAOYSA-N"
"Clc1c(OP(=S)(OCC)OCC)nc(Cl)c(Cl)c1","InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3","SBPBAQFWLVIOKP-UHFFFAOYSA-N"
"Clc1c(OP(=S)(OC)OC)nc(Cl)c(Cl)c1","InChI=1S/C7H7Cl3NO3PS/c1-12-15(16,13-2)14-7-5(9)3-4(8)6(10)11-7/h3H,1-2H3","HRBKVYFZANMGRE-UHFFFAOYSA-N"
"O=C(c1cc(cc(c1)C)C)N(NC(=O)c2ccc(cc2)CC)C(C)(C)C","InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)","QYPNKSZPJQQLRK-UHFFFAOYSA-N"
"O=C(Oc1cc(c(c(c1)C)S(=O)C)C)NC","InChI=1S/C11H15NO3S/c1-7-5-9(15-11(13)12-3)6-8(2)10(7)16(4)14/h5-6H,1-4H3,(H,12,13)","FNCMBMZOZQAWJA-UHFFFAOYSA-N"
"Clc1ncc(cc1)CN2C(=N\C#N)\SCC2","InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2","HOKKPVIRMVDYPB-UHFFFAOYSA-N"
"Clc1ncc(cc1)CN2C(=N/C(=O)N)/SCC2","InChI=1S/C10H11ClN4OS/c11-8-2-1-7(5-13-8)6-15-3-4-17-10(15)14-9(12)16/h1-2,5H,3-4,6H2,(H2,12,16)/b14-10-","LEZHOZPJYAQQNU-UVTDQMKNSA-N"
"Clc2ncc(CN1CCNC1=O)cc2","InChI=1S/C9H10ClN3O/c10-8-2-1-7(5-12-8)6-13-4-3-11-9(13)14/h1-2,5H,3-4,6H2,(H,11,14)","ADWTYURAFSWNSU-UHFFFAOYSA-N"
"Clc1ccc(cc1)C(C#N)(CCCC)Cn2ncnc2","InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3","HZJKXKUJVSEEFU-UHFFFAOYSA-N"
"c1cc(ccc1CC(CN2CCCCC2)C)C(C)(C)C","InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3","MGNFYQILYYYUBS-UHFFFAOYSA-N"
"Clc1ncc(cc1)CN(\C(=N\C#N)C)C","InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3","WCXDHFDTOYPNIE-UHFFFAOYSA-N"
"Clc2ccc(NC(=O)Nc1ccc(Cl)cc1)cc2Cl","InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)","ICUTUKXCWQYESQ-UHFFFAOYSA-N"
"CC1C(NC(=O)C(NC(=O)C(C(NC(=O)C(NC(=O)C(NC(=O)C(=C)N(C(=O)CCC(NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)CCCN=C(N)N)C=CC(=CC(C)C(CC2=CC=CC=C2)OC)C","InChI=1S/C49H74N10O12/c1-26(2)23-37-46(66)58-40(48(69)70)30(6)42(62)55-35(17-14-22-52-49(50)51)45(65)54-34(19-18-27(3)24-28(4)38(71-10)25-33-15-12-11-13-16-33)29(5)41(61)56-36(47(67)68)20-21-39(60)59(9)32(8)44(64)53-31(7)43(63)57-37/h11-13,15-16,18-19,24,26,28-31,34-38,40H,8,14,17,20-23,25H2,1-7,9-10H3,(H,53,64)(H,54,65)(H,55,62)(H,56,61)(H,57,63)(H,58,66)(H,67,68)(H,69,70)(H4,50,51,52)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1","ZYZCGGRZINLQBL-GWRQVWKTSA-N"
"CC(C)(C)C1=NNC(=NC1=O)SC","InChI=1S/C8H13N3OS/c1-8(2,3)5-6(12)9-7(13-4)11-10-5/h1-4H3,(H,9,11,12)","MIWRSUQXSCLDNV-UHFFFAOYSA-N"
"n(c(nc1NC(C)C)O)c(n1)NC(C)C","InChI=1S/C9H17N5O/c1-5(2)10-7-12-8(11-6(3)4)14-9(15)13-7/h5-6H,1-4H3,(H3,10,11,12,13,14,15)","RUOTUMSRCIMLJK-UHFFFAOYSA-N"
"c1(Oc2c(cc(Cl)cc2)Cl)c(cc(Cl)cc1)O","InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H","XEFQLINVKFYRCS-UHFFFAOYSA-N"
"C(\c1ccccc1)(c1ccccc1)=C(/C(OC[C@@H](CCCC)CC)=O)C#N","InChI=1S/C24H27NO2/c1-3-5-12-19(4-2)18-27-24(26)22(17-25)23(20-13-8-6-9-14-20)21-15-10-7-11-16-21/h6-11,13-16,19H,3-5,12,18H2,1-2H3/t19-/m1/s1","FMJSMJQBSVNSBF-LJQANCHMSA-N"
"n1(C2CCCCC2)c(n(c(N(C)C)nc1=O)C)=O","InChI=1S/C12H20N4O2/c1-14(2)10-13-11(17)16(12(18)15(10)3)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3","CAWXEEYDBZRFPE-UHFFFAOYSA-N"
"c12c(cccc1)N=C(NC(OC)=O)N2","InChI=1S/C9H9N3O2/c1-14-9(13)12-8-10-6-4-2-3-5-7(6)11-8/h2-5H,1H3,(H2,10,11,12,13)","TWFZGCMQGLPBSX-UHFFFAOYSA-N"
"N(c1ccccc1)(S(N(C)C)(=O)=O)SC(F)(Cl)Cl","InChI=1S/C9H11Cl2FN2O2S2/c1-13(2)18(15,16)14(17-9(10,11)12)8-6-4-3-5-7-8/h3-7H,1-2H3","WURGXGVFSMYFCG-UHFFFAOYSA-N"
"CC1=C(NC([H])=O)C=CC(C)=C1","InChI=1S/C9H11NO/c1-7-3-4-9(10-6-11)8(2)5-7/h3-6H,1-2H3,(H,10,11)","JOFDPSBOUCXJCC-UHFFFAOYSA-N"
"NCCC(Oc1ccc(cc1)C(F)(F)F)c2ccccc2","InChI=1S/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2","WIQRCHMSJFFONW-UHFFFAOYSA-N"
"n1nc2c(cccc2[nH]1)C","InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","CMGDVUCDZOBDNL-UHFFFAOYSA-N"
"Clc1nc(n(c1CO)Cc4ccc(c2ccccc2c3[nH]nnn3)cc4)CCCC","InChI=1S/C22H23ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28)","PSIFNNKUMBGKDQ-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C2=CC=C(C=C2)C(=O)O)C3=NNN=N3","InChI=1S/C14H10N4O2/c19-14(20)10-7-5-9(6-8-10)11-3-1-2-4-12(11)13-15-17-18-16-13/h1-8H,(H,19,20)(H,15,16,17,18)","USAWIVMZUYOXCF-UHFFFAOYSA-N"
"CN1C2=CC=CC=C2N=N1","InChI=1S/C7H7N3/c1-10-7-5-3-2-4-6(7)8-9-10/h2-5H,1H3","HXQHRUJXQJEGER-UHFFFAOYSA-N"
"CC1CC(C2C(CC(C(O2)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C(CC(=O)C(C=C(C1)C)CC=C)O)C)C(=CC4CCC(C(C4)OC)O)C)O)C)OC)OC","InChI=1S/C44H69NO12/c1-10-13-31-19-25(2)18-26(3)20-37(54-8)40-38(55-9)22-28(5)44(52,57-40)41(49)42(50)45-17-12-11-14-32(45)43(51)56-39(29(6)34(47)24-35(31)48)27(4)21-30-15-16-33(46)36(23-30)53-7/h10,19,21,26,28-34,36-40,46-47,52H,1,11-18,20,22-24H2,2-9H3/b25-19-,27-21+/t26-,28+,29+,30-,31+,32-,33+,34-,36+,37-,38-,39+,40+,44+/m0/s1","QJJXYPPXXYFBGM-LJIGMGMYSA-N"
"OC(=O)c1ccc(cc1)n2nc(nc2c3ccccc3O)c4ccccc4O","InChI=1S/C21H15N3O4/c25-17-7-3-1-5-15(17)19-22-20(16-6-2-4-8-18(16)26)24(23-19)14-11-9-13(10-12-14)21(27)28/h1-12,25-26H,(H,27,28)","BOFQWVMAQOTZIW-UHFFFAOYSA-N"
"O=C(OCC(OCn1c2N\C(=N/C(=O)c2nc1)N)CO)[C@@H](N)C(C)C","InChI=1S/C14H22N6O5/c1-7(2)9(15)13(23)24-4-8(3-21)25-6-20-5-17-10-11(20)18-14(16)19-12(10)22/h5,7-9,21H,3-4,6,15H2,1-2H3,(H3,16,18,19,22)/t8?,9-/m0/s1","WPVFJKSGQUFQAP-GKAPJAKFSA-N"
"O=C(Oc1cc(ccc1)[C@@H](N(C)C)C)N(CC)C","InChI=1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1","XSVMFMHYUFZWBK-NSHDSACASA-N"
"FC=1\C(=N/C(=O)N(C=1)[C@@H]2O[C@@H]([C@@H](O)[C@H]2O)C)\NC(=O)OCCCCC","InChI=1S/C15H22FN3O6/c1-3-4-5-6-24-15(23)18-12-9(16)7-19(14(22)17-12)13-11(21)10(20)8(2)25-13/h7-8,10-11,13,20-21H,3-6H2,1-2H3,(H,17,18,22,23)/t8-,10-,11-,13-/m1/s1","GAGWJHPBXLXJQN-UORFTKCHSA-N"
"O=C(NNCc1c(O)c(O)c(O)cc1)C(N)CO","InChI=1S/C10H15N3O5/c11-6(4-14)10(18)13-12-3-5-1-2-7(15)9(17)8(5)16/h1-2,6,12,14-17H,3-4,11H2,(H,13,18)","BNQDCRGUHNALGH-UHFFFAOYSA-N"
"c1nc(nn1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)C(=O)N","InChI=1S/C8H12N4O5/c9-6(16)7-10-2-12(11-7)8-5(15)4(14)3(1-13)17-8/h2-5,8,13-15H,1H2,(H2,9,16)/t3-,4-,5-,8-/m1/s1","IWUCXVSUMQZMFG-AFCXAGJDSA-N"
"C1=CC=C2C(=C1)N=NN2O","InChI=1S/C6H5N3O/c10-9-6-4-2-1-3-5(6)7-8-9/h1-4,10H","ASOKPJOREAFHNY-UHFFFAOYSA-N"
"O=C(OCN1C(=O)CN(C1=O)CC#C)C2C(\C=C(/C)C)C2(C)C","InChI=1S/C17H22N2O4/c1-6-7-18-9-13(20)19(16(18)22)10-23-15(21)14-12(8-11(2)3)17(14,4)5/h1,8,12,14H,7,9-10H2,2-5H3","VPRAQYXPZIFIOH-UHFFFAOYSA-N"
"CO[C@@H](Cc1ccccc1)[C@@H](C)/C=C(C)/C=C/[C@@H]2NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]2C)C(O)=O)C(O)=O","InChI=1S/C49H74N10O12/c1-26(2)23-37-46(66)58-40(48(69)70)30(6)42(62)55-35(17-14-22-52-49(50)51)45(65)54-34(19-18-27(3)24-28(4)38(71-10)25-33-15-12-11-13-16-33)29(5)41(61)56-36(47(67)68)20-21-39(60)59(9)32(8)44(64)53-31(7)43(63)57-37/h11-13,15-16,18-19,24,26,28-31,34-38,40H,8,14,17,20-23,25H2,1-7,9-10H3,(H,53,64)(H,54,65)(H,55,62)(H,56,61)(H,57,63)(H,58,66)(H,67,68)(H,69,70)(H4,50,51,52)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1","ZYZCGGRZINLQBL-GWRQVWKTSA-N"
"C#CCN(C)Cc1ccccc1","InChI=1S/C11H13N/c1-3-9-12(2)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3","DPWPWRLQFGFJFI-UHFFFAOYSA-N"
"CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2","InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3","IJHNSHDBIRRJRN-UHFFFAOYSA-N"
"O(c1ccc(cc1)CN(c2ncccc2)CCN(C)C)C","InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3","YECBIJXISLIIDS-UHFFFAOYSA-N"
"N(CCCN)CCCN(C)C","InChI=1S/C8H21N3/c1-11(2)8-4-7-10-6-3-5-9/h10H,3-9H2,1-2H3","OMKZWUPRGQMQJC-UHFFFAOYSA-N"
"n1cc(ccc1)[C@H]2N(C)CCC2","InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1","SNICXCGAKADSCV-JTQLQIEISA-N"
"O(c1cc(NC(C)CCCN)c2ncccc2c1)C","InChI=1S/C15H21N3O/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14/h4,6,8-11,18H,3,5,7,16H2,1-2H3","INDBQLZJXZLFIT-UHFFFAOYSA-N"
"O(c1c(cccc1C)C)CC(N)C","InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3","VLPIATFUUWWMKC-UHFFFAOYSA-N"
"O=S(=O)(c1nnc(s1)NC(=O)C)N","InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)","BZKPWHYZMXOIDC-UHFFFAOYSA-N"
"CC(C)(C)C(C(=O)NC(CC1=CC=CC=C1)C(CN(CC2=CC=C(C=C2)C3=CC=CC=N3)NC(=O)C(C(C)(C)C)NC(=O)OC)O)NC(=O)OC","InChI=1S/C38H52N6O7/c1-37(2,3)31(41-35(48)50-7)33(46)40-29(22-25-14-10-9-11-15-25)30(45)24-44(43-34(47)32(38(4,5)6)42-36(49)51-8)23-26-17-19-27(20-18-26)28-16-12-13-21-39-28/h9-21,29-32,45H,22-24H2,1-8H3,(H,40,46)(H,41,48)(H,42,49)(H,43,47)/t29-,30-,31+,32+/m0/s1","AXRYRYVKAWYZBR-GASGPIRDSA-N"
"O(c1ccc(cc1)COCCOC(C)C)CC(O)CNC(C)C","InChI=1S/C18H31NO4/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h5-8,14-15,17,19-20H,9-13H2,1-4H3","VHYCDWMUTMEGQY-UHFFFAOYSA-N"
"CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=CC=C3)N)SC1)C(=O)O","InChI=1S/C16H17N3O4S/c1-8-7-24-15-11(14(21)19(15)12(8)16(22)23)18-13(20)10(17)9-5-3-2-4-6-9/h2-6,10-11,15H,7,17H2,1H3,(H,18,20)(H,22,23)","ZAIPMKNFIOOWCQ-UHFFFAOYSA-N"
"CCN(CC)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C(=O)C","InChI=1S/C20H33N3O4/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26)","JOATXPAWOHTVSZ-UHFFFAOYSA-N"
"CC(C)CN(CC(C(CC1=CC=CC=C1)NC(=O)OC2COC3C2CCO3)O)S(=O)(=O)C4=CC=C(C=C4)N","InChI=1S/C27H37N3O7S/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32)/t22-,23-,24+,25-,26+/m0/s1","CJBJHOAVZSMMDJ-HEXNFIEUSA-N"
"CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC","InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3","HSUGRBWQSSZJOP-UHFFFAOYSA-N"
"CC(C1=CC=CC=C1)(C2=CC=CC=N2)OCCN(C)C","InChI=1S/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3","HCFDWZZGGLSKEP-UHFFFAOYSA-N"
"CC(C)(C1=CC=C(C=C1)C(CCCN2CCC(CC2)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)O)C(=O)O","InChI=1S/C32H39NO4/c1-31(2,30(35)36)25-17-15-24(16-18-25)29(34)14-9-21-33-22-19-28(20-23-33)32(37,26-10-5-3-6-11-26)27-12-7-4-8-13-27/h3-8,10-13,15-18,28-29,34,37H,9,14,19-23H2,1-2H3,(H,35,36)","RWTNPBWLLIMQHL-UHFFFAOYSA-N"
"C1CCNC(C1)CNC(=O)C2=C(C=CC(=C2)OCC(F)(F)F)OCC(F)(F)F","InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)","DJBNUMBKLMJRSA-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F","InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)","LPEPZBJOKDYZAD-UHFFFAOYSA-N"
"CN1CCN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3","InChI=1S/C16H15ClN2/c1-19-10-9-18-16(12-5-3-2-4-6-12)14-11-13(17)7-8-15(14)19/h2-8,11H,9-10H2,1H3","YLCXGBZIZBEVPZ-UHFFFAOYSA-N"
"CN1CCC2=CC3=C(C(=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OC)OCO3","InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3","AKNNEGZIBPJZJG-UHFFFAOYSA-N"
"CCN(CC)CC#CCOC(=O)C(C1CCCCC1)(C2=CC=CC=C2)O","InChI=1S/C22H31NO3/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3","XIQVNETUBQGFHX-UHFFFAOYSA-N"
"CCCC(C(=O)OCC)NC(C)C(=O)N1C2CCCCC2CC1C(=O)O","InChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)","IPVQLZZIHOAWMC-UHFFFAOYSA-N"
"CCN1CCCC1CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N)OC","InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)","BGRJTUBHPOOWDU-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)C1=C(C=CC(=C1)S(=O)(=O)C)OC","InChI=1S/C15H24N2O4S/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18)","JTVPZMFULRWINT-UHFFFAOYSA-N"
"C1CN(CC2=C1SC=C2)CC3=CC=CC=C3Cl","InChI=1S/C14H14ClNS/c15-13-4-2-1-3-11(13)9-16-7-5-14-12(10-16)6-8-17-14/h1-4,6,8H,5,7,9-10H2","PHWBOXQYWZNQIN-UHFFFAOYSA-N"
"OC(C(=O)OC1CC2CCC(C1)[N+]21CCCC1)(C1=CC=CC=C1)C1=CC=CC=C1","InChI=1S/C25H30NO3/c27-24(25(28,19-9-3-1-4-10-19)20-11-5-2-6-12-20)29-23-17-21-13-14-22(18-23)26(21)15-7-8-16-26/h1-6,9-12,21-23,28H,7-8,13-18H2/q+1","OYYDSUSKLWTMMQ-UHFFFAOYSA-N"
"CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C","InChI=1S/C16H24N2/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15/h8-9H,6-7,10H2,1-5H3,(H,17,18)","HUCJFAOMUPXHDK-UHFFFAOYSA-N"
"Clc2cc(ccc2Oc1cc(C(=O)O)c([N+]([O-])=O)cc1)C(F)(F)F","InChI=1S/C14H7ClF3NO5/c15-10-5-7(14(16,17)18)1-4-12(10)24-8-2-3-11(19(22)23)9(6-8)13(20)21/h1-6H,(H,20,21)","NUFNQYOELLVIPL-UHFFFAOYSA-N"
"O=C(OCC)CCN(SN(C(=O)O\N=C(/SC)C)C)Cc1ccccc1","InChI=1S/C17H25N3O4S2/c1-5-23-16(21)11-12-20(13-15-9-7-6-8-10-15)26-19(3)17(22)24-18-14(2)25-4/h6-10H,5,11-13H2,1-4H3/b18-14-","GMAUQNJOSOMMHI-JXAWBTAJSA-N"
"S(c1nc(nc(n1)NC(C)C)NCC)C","InChI=1S/C9H17N5S/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)","RQVYBGPQFYCBGX-UHFFFAOYSA-N"
"O=C(N(c1c(cccc1C)C)C(C(=O)OC)C)Cc2ccccc2","InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3","CJPQIRJHIZUAQP-UHFFFAOYSA-N"
"C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])O/N=C/C2=CC(=C(C(=C2)Br)O)Br","InChI=1S/C13H7Br2N3O6/c14-9-3-7(4-10(15)13(9)19)6-16-24-12-2-1-8(17(20)21)5-11(12)18(22)23/h1-6,19H/b16-6+","XTFNPKDYCLFGPV-OMCISZLKSA-N"
"c12c(OC(NC)=O)cccc1cccc2","InChI=1S/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)","CVXBEEMKQHEXEN-UHFFFAOYSA-N"
"N1(C([C@@H]2CC=CC[C@@H]2C1=O)=O)SC(Cl)(Cl)Cl","InChI=1S/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2/t5-,6+","LDVVMCZRFWMZSG-OLQVQODUSA-N"
"CC2(C)CC1=C(C(=CC=C1)OC(NC)=O)O2","InChI=1S/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)","DUEPRVBVGDRKAG-UHFFFAOYSA-N"
"CCOP(=O)(OCC)O/C(=C\Cl)/C1=C(C=C(C=C1)Cl)Cl","InChI=1S/C12H14Cl3O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3/b12-8-","FSAVDKDHPDSCTO-WQLSENKSSA-N"
"Clc1cc(C#N)cc(Cl)c1O","InChI=1S/C7H3Cl2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","YRSSHOVRSMQULE-UHFFFAOYSA-N"
"CCC/C(=N\OCC)/C1=C(CC(CC1=O)C2CCCSC2)O","InChI=1S/C17H27NO3S/c1-3-6-14(18-21-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-22-11-12/h12-13,19H,3-11H2,1-2H3/b18-14+","GGWHBJGBERXSLL-NBVRZTHBSA-N"
"O=P(O\C=C(/Cl)Cl)(OC)OC","InChI=1S/C4H7Cl2O4P/c1-8-11(7,9-2)10-3-4(5)6/h3H,1-2H3","OEBRKCOSUFCWJD-UHFFFAOYSA-N"
"O=C2OC(C(=O)N2Nc1ccccc1)(c4ccc(Oc3ccccc3)cc4)C","InChI=1S/C22H18N2O4/c1-22(16-12-14-19(15-13-16)27-18-10-6-3-7-11-18)20(25)24(21(26)28-22)23-17-8-4-2-5-9-17/h2-15,23H,1H3","PCCSBWNGDMYFCW-UHFFFAOYSA-N"
"O=P(SC(CC)C)(OCC)N1C(=O)SCC1","InChI=1S/C9H18NO3PS2/c1-4-8(3)16-14(12,13-5-2)10-6-7-15-9(10)11/h8H,4-7H2,1-3H3","DUFVKSUJRWYZQP-UHFFFAOYSA-N"
"Clc1ccc(NC(=O)CC)cc1Cl","InChI=1S/C9H9Cl2NO/c1-2-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)","LFULEKSKNZEWOE-UHFFFAOYSA-N"
"FC(F)c2nc(c(C/1=N/CCS\1)c(c2C(=O)OC)CC(C)C)C(F)(F)F","InChI=1S/C16H17F5N2O2S/c1-7(2)6-8-9(15(24)25-3)11(13(17)18)23-12(16(19,20)21)10(8)14-22-4-5-26-14/h7,13H,4-6H2,1-3H3","YIJZJEYQBAAWRJ-UHFFFAOYSA-N"
"Clc1c(c(c(Cl)c(Cl)c1Cl)C(=O)O)C(=O)O","InChI=1S/C8H2Cl4O4/c9-3-1(7(13)14)2(8(15)16)4(10)6(12)5(3)11/h(H,13,14)(H,15,16)","WZHHYIOUKQNLQM-UHFFFAOYSA-N"
"CC(C)OC(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1","InChI=1S/C18H24FN3O3S/c1-9(2)15(22-18(24)25-10(3)4)16(23)20-11(5)17-21-13-7-6-12(19)8-14(13)26-17/h6-11,15H,1-5H3,(H,20,23)(H,22,24)/t11-,15+/m1/s1","USRKFGIXLGKMKU-ABAIWWIYSA-N"
"O=C2N(Nc1ccccc1)C(\SC)=N/[C@]2(c3ccccc3)C","InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1","LMVPQMGRYSRMIW-KRWDZBQOSA-N"
"O=C(Nc1ccc(O)c(Cl)c1Cl)C2(C)CCCCC2","InChI=1S/C14H17Cl2NO2/c1-14(7-3-2-4-8-14)13(19)17-9-5-6-10(18)12(16)11(9)15/h5-6,18H,2-4,7-8H2,1H3,(H,17,19)","VDLGAVXLJYLFDH-UHFFFAOYSA-N"
"Clc4ccccc4Oc3ncnc(Oc2ccccc2C(=N\OC)/C=1OCCON=1)c3F","InChI=1S/C21H16ClFN4O5/c1-28-26-18(21-27-30-11-10-29-21)13-6-2-4-8-15(13)31-19-17(23)20(25-12-24-19)32-16-9-5-3-7-14(16)22/h2-9,12H,10-11H2,1H3/b26-18+","UFEODZBUAFNAEU-NLRVBDNBSA-N"
"Clc1ncc(cc1)CN2\C(=N/CC2)N","InChI=1S/C9H11ClN4/c10-8-2-1-7(5-13-8)6-14-4-3-12-9(14)11/h1-2,5H,3-4,6H2,(H2,11,12)","UEQZFAGVRGWPDK-UHFFFAOYSA-N"
"O=C2N(c1cc(Cl)cc(Cl)c1)C(=O)CN2C(=O)NC(C)C","InChI=1S/C13H13Cl2N3O3/c1-7(2)16-12(20)17-6-11(19)18(13(17)21)10-4-8(14)3-9(15)5-10/h3-5,7H,6H2,1-2H3,(H,16,20)","ONUFESLQCSAYKA-UHFFFAOYSA-N"
"Clc1ccc(cc1)C(OCC#C)C(=O)NCCc2ccc(OCC#C)c(OC)c2","InChI=1S/C23H22ClNO4/c1-4-14-28-20-11-6-17(16-21(20)27-3)12-13-25-23(26)22(29-15-5-2)18-7-9-19(24)10-8-18/h1-2,6-11,16,22H,12-15H2,3H3,(H,25,26)","KWLVWJPJKJMCSH-UHFFFAOYSA-N"
"n1c(C#CC)cc(nc1Nc2ccccc2)C","InChI=1S/C14H13N3/c1-3-7-13-10-11(2)15-14(17-13)16-12-8-5-4-6-9-12/h4-6,8-10H,1-2H3,(H,15,16,17)","CIFWZNRJIBNXRE-UHFFFAOYSA-N"
"Brc2ccc(OC)c(C(=O)c1c(cc(OC)c(OC)c1OC)C)c2C","InChI=1S/C19H21BrO5/c1-10-9-14(23-4)18(24-5)19(25-6)15(10)17(21)16-11(2)12(20)7-8-13(16)22-3/h7-9H,1-6H3","AMSPWOYQQAWRRM-UHFFFAOYSA-N"
"Clc1ccc(cc1)CN(C(=O)Nc2ccccc2)C3CCCC3","InChI=1S/C19H21ClN2O/c20-16-12-10-15(11-13-16)14-22(18-8-4-5-9-18)19(23)21-17-6-2-1-3-7-17/h1-3,6-7,10-13,18H,4-5,8-9,14H2,(H,21,23)","OGYFATSSENRIKG-UHFFFAOYSA-N"
"Oc1cc4c(cc1)C3CCC2(C(CCC2(C#C)O)C3CC4)C","InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3","BFPYWIDHMRZLRN-UHFFFAOYSA-N"
"Oc1ccc(Cl)cc1","InChI=1S/C6H5ClO/c7-5-1-3-6(8)4-2-5/h1-4,8H","WXNZTHHGJRFXKQ-UHFFFAOYSA-N"
"Ic1cc(cc(I)c1OCCN(CC)CC)C(=O)c2c3ccccc3oc2CCCC","InChI=1S/C25H29I2NO3/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3","IYIKLHRQXLHMJQ-UHFFFAOYSA-N"
"O=C(c1c(OC)cc(OC)cc1OC)CCCN2CCCC2","InChI=1S/C17H25NO4/c1-20-13-11-15(21-2)17(16(12-13)22-3)14(19)7-6-10-18-8-4-5-9-18/h11-12H,4-10H2,1-3H3","OWYLAEYXIQKAOL-UHFFFAOYSA-N"
"O=C2N1/C(=C(/Cl)CS[C@@H]1[C@@H]2NC(=O)[C@@H](c3ccccc3)N)C(=O)O","InChI=1S/C15H14ClN3O4S/c16-8-6-24-14-10(13(21)19(14)11(8)15(22)23)18-12(20)9(17)7-4-2-1-3-5-7/h1-5,9-10,14H,6,17H2,(H,18,20)(H,22,23)/t9-,10-,14-/m1/s1","QYIYFLOTGYLRGG-GPCCPHFNSA-N"
"c1cc(ccc1[C@H]([C@@H](CO)NC(=O)C(Cl)Cl)O)[N+](=O)[O-]","InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m1/s1","WIIZWVCIJKGZOK-RKDXNWHRSA-N"
"O=C(O)C(C)(C)CCCOc1cc(ccc1C)C","InChI=1S/C15H22O3/c1-11-6-7-12(2)13(10-11)18-9-5-8-15(3,4)14(16)17/h6-7,10H,5,8-9H2,1-4H3,(H,16,17)","HEMJJKBWTPKOJG-UHFFFAOYSA-N"
"OC(CNC(C)(C)C)COc1cccc2c1C[C@H](O)[C@H](O)C2","InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/t12?,14-,15+/m1/s1","VWPOSFSPZNDTMJ-UCWKZMIHSA-N"
"Fc4cc1c2N(/C=C(\C1=O)C(=O)O)C(COc2c4N3CCN(C)CC3)C","InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)","GSDSWSVVBLHKDQ-UHFFFAOYSA-N"
"Cl/C(Cl)=C/C3C(C(=O)OCc2cccc(Oc1ccccc1)c2)C3(C)C","InChI=1S/C21H20Cl2O3/c1-21(2)17(12-18(22)23)19(21)20(24)25-13-14-7-6-10-16(11-14)26-15-8-4-3-5-9-15/h3-12,17,19H,13H2,1-2H3","RLLPVAHGXHCWKJ-UHFFFAOYSA-N"
"O=C(O)\C2=C\N(c1nc(ncc1C2=O)N3CCNCC3)CC","InChI=1S/C14H17N5O3/c1-2-18-8-10(13(21)22)11(20)9-7-16-14(17-12(9)18)19-5-3-15-4-6-19/h7-8,15H,2-6H2,1H3,(H,21,22)","JOHZPMXAZQZXHR-UHFFFAOYSA-N"
"O=C1N(CC(=O)N)CCC1","InChI=1S/C6H10N2O2/c7-5(9)4-8-3-1-2-6(8)10/h1-4H2,(H2,7,9)","GMZVRMREEHBGGF-UHFFFAOYSA-N"
"O=CC[C@@H]4[C@H](OC2OC(C(OC1OC(C)C(O)C(O)(C)C1)C(N(C)C)C2O)C)[C@@H](OC)[C@H](O)CC(=O)O[C@H](C)C\C=C\C=C\[C@H](OC3OC(C)C(N(C)C)CC3)[C@H](C)C4","InChI=1S/C43H74N2O14/c1-24-21-29(19-20-46)39(59-42-37(49)36(45(9)10)38(27(4)56-42)58-35-23-43(6,51)41(50)28(5)55-35)40(52-11)31(47)22-33(48)53-25(2)15-13-12-14-16-32(24)57-34-18-17-30(44(7)8)26(3)54-34/h12-14,16,20,24-32,34-42,47,49-51H,15,17-19,21-23H2,1-11H3/b13-12+,16-14+/t24-,25-,26?,27?,28?,29+,30?,31-,32+,34?,35?,36?,37?,38?,39+,40+,41?,42?,43?/m1/s1","ACTOXUHEUCPTEW-JMRHEKERSA-N"
"Fc1c(nc2c(c1)C(=O)C(\C(=O)O)=C/N2CC)N3CCNCC3","InChI=1S/C15H17FN4O3/c1-2-19-8-10(15(22)23)12(21)9-7-11(16)14(18-13(9)19)20-5-3-17-4-6-20/h7-8,17H,2-6H2,1H3,(H,22,23)","IDYZIJYBMGIQMJ-UHFFFAOYSA-N"
"CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)C3=CC=C(O)C=C3)C(=O)N2[C@H]1C(O)=O","InChI=1S/C16H19N3O5S/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24)/t9-,10-,11+,14-/m1/s1","LSQZJLSUYDQPKJ-NJBDSQKTSA-N"
"Clc1ccc(cc1)C(c2ccccc2)N3CCN(CC3)Cc4cccc(c4)C","InChI=1S/C25H27ClN2/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23/h2-13,18,25H,14-17,19H2,1H3","OCJYIGYOJCODJL-UHFFFAOYSA-N"
"O=C3[C@]2(CC[C@@H]1[C@@]4(C(=C/C[C@H]1[C@@H]2CC3)\C[C@@H](O)CC4)C)C","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3/t13-,14-,15-,16-,18-,19-/m0/s1","FMGSKLZLMKYGDP-USOAJAOKSA-N"
"c1(\[N+](=N\c2ccccc2)[O-])ccccc1","InChI=1S/C12H10N2O/c15-14(12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10H","GAUZCKBSTZFWCT-UHFFFAOYSA-N"
"CC(=O)CC(C1=CC=C(C=C1)Cl)C2=C(C3=CC=CC=C3OC2=O)O","InChI=1S/C19H15ClO4/c1-11(21)10-15(12-6-8-13(20)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,22H,10H2,1H3","DEKWZWCFHUABHE-UHFFFAOYSA-N"
"CC(=O)CC(C1=CC=CO1)C2=C(C3=CC=CC=C3OC2=O)O","InChI=1S/C17H14O5/c1-10(18)9-12(13-7-4-8-21-13)15-16(19)11-5-2-3-6-14(11)22-17(15)20/h2-8,12,19H,9H2,1H3","JFIXKFSJCQNGEK-UHFFFAOYSA-N"
"c1(Nc2ccccc2)ccccc1","InChI=1S/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H","DMBHHRLKUKUOEG-UHFFFAOYSA-N"
"O=C(OCCCC)C(Oc2ccc(Oc1ncc(cc1)C(F)(F)F)cc2)C","InChI=1S/C19H20F3NO4/c1-3-4-11-25-18(24)13(2)26-15-6-8-16(9-7-15)27-17-10-5-14(12-23-17)19(20,21)22/h5-10,12-13H,3-4,11H2,1-2H3","VAIZTNZGPYBOGF-UHFFFAOYSA-N"
"O=C(O)C3(O)c1ccccc1c2c3cccc2","InChI=1S/C14H10O3/c15-13(16)14(17)11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8,17H,(H,15,16)","GXAMYUGOODKVRM-UHFFFAOYSA-N"
"O=C1SC(=N/N1CSP(=S)(OC)OC)\OC","InChI=1S/C6H11N2O4PS3/c1-10-5-7-8(6(9)16-5)4-15-13(14,11-2)12-3/h4H2,1-3H3","MEBQXILRKZHVCX-UHFFFAOYSA-N"
"O=C(O)c1ccccc1C(=O)Nc3cccc2ccccc23","InChI=1S/C18H13NO3/c20-17(14-9-3-4-10-15(14)18(21)22)19-16-11-5-7-12-6-1-2-8-13(12)16/h1-11H,(H,19,20)(H,21,22)","JXTHEWSKYLZVJC-UHFFFAOYSA-N"
"c1(Oc2ccc([N+](=O)[O-])cc2)c(cc(Cl)cc1)Cl","InChI=1S/C12H7Cl2NO3/c13-8-1-6-12(11(14)7-8)18-10-4-2-9(3-5-10)15(16)17/h1-7H","XITQUSLLOSKDTB-UHFFFAOYSA-N"
"[O-][N+](=O)c1cc(cc([N+]([O-])=O)c1N(CCC)CCC)S(=O)(=O)N","InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)","UNAHYJYOSSSJHH-UHFFFAOYSA-N"
"O=C2OCCN2N(C(=O)COC)c1c(cccc1C)C","InChI=1S/C14H18N2O4/c1-10-5-4-6-11(2)13(10)16(12(17)9-19-3)15-7-8-20-14(15)18/h4-6H,7-9H2,1-3H3","UWVQIROCRJWDKL-UHFFFAOYSA-N"
"COP(=S)(OC)SCN1C(=O)C2=CC=CC=C2C1=O","InChI=1S/C11H12NO4PS2/c1-15-17(18,16-2)19-7-12-10(13)8-5-3-4-6-9(8)11(12)14/h3-6H,7H2,1-2H3","LMNZTLDVJIUSHT-UHFFFAOYSA-N"
"Clc1cc(cc(Cl)c1)N2C(=O)C3(CC3(C2=O)C)C","InChI=1S/C13H11Cl2NO2/c1-12-6-13(12,2)11(18)16(10(12)17)9-4-7(14)3-8(15)5-9/h3-5H,6H2,1-2H3","QXJKBPAVAHBARF-UHFFFAOYSA-N"
"O=C\1c3c(OC(/O)=C/1C(c2ccccc2)CC(=O)C)cccc3","InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,22H,11H2,1H3","QTXVAVXCBMYBJW-UHFFFAOYSA-N"
"O=C2c1nccnc1N(C(=O)N2C)C","InChI=1S/C8H8N4O2/c1-11-6-5(9-3-4-10-6)7(13)12(2)8(11)14/h3-4H,1-2H3","LMXZVISHHDYBFW-UHFFFAOYSA-N"
"O=P(O)(O)CO[C@H](C)Cn1c2ncnc(c2nc1)N","InChI=1S/C9H14N5O4P/c1-6(18-5-19(15,16)17)2-14-4-13-7-8(10)11-3-12-9(7)14/h3-4,6H,2,5H2,1H3,(H2,10,11,12)(H2,15,16,17)/t6-/m1/s1","SGOIRFVFHAKUTI-ZCFIWIBFSA-N"
"FC=1\C(=N/C(=O)N(C=1)[C@H]2O[C@H](SC2)CO)\N","InChI=1S/C8H10FN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)/t5-,6+/m0/s1","XQSPYNMVSIKCOC-NTSWFWBYSA-N"
"Clc1ccc(c(Cl)c1)C(CCC)Cn2ncnc2","InChI=1S/C13H15Cl2N3/c1-2-3-10(7-18-9-16-8-17-18)12-5-4-11(14)6-13(12)15/h4-6,8-10H,2-3,7H2,1H3","WKBPZYKAUNRMKP-UHFFFAOYSA-N"
"[O-][N+](=O)NC(=N/C)\NCC1CCOC1","InChI=1S/C7H14N4O3/c1-8-7(10-11(12)13)9-4-6-2-3-14-5-6/h6H,2-5H2,1H3,(H2,8,9,10)","YKBZOVFACRVRJN-UHFFFAOYSA-N"
"[O-][N+](=O)c1cc(cc(c1O)C(C)(C)C)[N+]([O-])=O","InChI=1S/C10H12N2O5/c1-10(2,3)7-4-6(11(14)15)5-8(9(7)13)12(16)17/h4-5,13H,1-3H3","IIPZYDQGBIWLBU-UHFFFAOYSA-N"
"O=C(Nc1ccccc1)N(C)C","InChI=1S/C9H12N2O/c1-11(2)9(12)10-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,10,12)","XXOYNJXVWVNOOJ-UHFFFAOYSA-N"
"S=P(Sc1ccccc1)(OCC)CC","InChI=1S/C10H15OPS2/c1-3-11-12(13,4-2)14-10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3","KVGLBTYUCJYMND-UHFFFAOYSA-N"
"O=C(N(c1c(cccc1C)C)C(C(=O)OC)C)c2occc2","InChI=1S/C17H19NO4/c1-11-7-5-8-12(2)15(11)18(13(3)17(20)21-4)16(19)14-9-6-10-22-14/h5-10,13H,1-4H3","CIEXPHRYOLIQQD-UHFFFAOYSA-N"
"COP(=O)(OC)OC1=C(Cl)C2C=CCC12","InChI=1S/C9H12ClO4P/c1-12-15(11,13-2)14-9-7-5-3-4-6(7)8(9)10/h3-4,6-7H,5H2,1-2H3","GBAWQJNHVWMTLU-UHFFFAOYSA-N"
"S=P(Oc1ccc(cc1)[N+]([O-])=O)(OCC)OCC","InChI=1S/C10H14NO5PS/c1-3-14-17(18,15-4-2)16-10-7-5-9(6-8-10)11(12)13/h5-8H,3-4H2,1-2H3","LCCNCVORNKJIRZ-UHFFFAOYSA-N"
"[O-][N+](=O)c1c(c(cc([N+]([O-])=O)c1NC(CC)CC)C)C","InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3","CHIFOSRWCNZCFN-UHFFFAOYSA-N"
"ClCC(=O)N(c1c(cccc1CC)CC)CCOCCC","InChI=1S/C17H26ClNO2/c1-4-11-21-12-10-19(16(20)13-18)17-14(5-2)8-7-9-15(17)6-3/h7-9H,4-6,10-13H2,1-3H3","YLPGTOIOYRQOHV-UHFFFAOYSA-N"
"O=C(c1ccccc1Cl)NC(=O)Nc2ccc(OC(F)(F)F)cc2","InChI=1S/C15H10ClF3N2O3/c16-12-4-2-1-3-11(12)13(22)21-14(23)20-9-5-7-10(8-6-9)24-15(17,18)19/h1-8H,(H2,20,21,22,23)","XAIPTRIXGHTTNT-UHFFFAOYSA-N"
"O=C2OC(C(=O)N2c1cc(Cl)cc(Cl)c1)(\C=C)C","InChI=1S/C12H9Cl2NO3/c1-3-12(2)10(16)15(11(17)18-12)9-5-7(13)4-8(14)6-9/h3-6H,1H2,2H3","FSCWZHGZWWDELK-UHFFFAOYSA-N"
"[O-][N+](=O)c1cc([N+]([O-])=O)cc(c1O)C","InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3","ZXVONLUNISGICL-UHFFFAOYSA-N"
"Clc1ccc(cc1)C(=O)n3c2ccc(OC)cc2c(c3C)CC(=O)OCC(=O)O","InChI=1S/C21H18ClNO6/c1-12-16(10-20(26)29-11-19(24)25)17-9-15(28-2)7-8-18(17)23(12)21(27)13-3-5-14(22)6-4-13/h3-9H,10-11H2,1-2H3,(H,24,25)","FSQKKOOTNAMONP-UHFFFAOYSA-N"
"COCCCOC1=C(OC)C=CC(C[C@@H](C[C@H](N)[C@@H](O)C[C@@H](C(C)C)C(=O)NCC(C)(C)C(N)=O)C(C)C)=C1","InChI=1S/C30H53N3O6/c1-19(2)22(14-21-10-11-26(38-8)27(15-21)39-13-9-12-37-7)16-24(31)25(34)17-23(20(3)4)28(35)33-18-30(5,6)29(32)36/h10-11,15,19-20,22-25,34H,9,12-14,16-18,31H2,1-8H3,(H2,32,36)(H,33,35)/t22-,23-,24-,25-/m0/s1","UXOWGYHJODZGMF-QORCZRPOSA-N"
"C1C2CC3CC1CC(C2)(C3)N","InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2","DKNWSYNQZKUICI-UHFFFAOYSA-N"
"O=C(Nc1c(cccc1C)C)C2N(C)CCCC2","InChI=1S/C15H22N2O/c1-11-7-6-8-12(2)14(11)16-15(18)13-9-4-5-10-17(13)3/h6-8,13H,4-5,9-10H2,1-3H3,(H,16,18)","INWLQCZOYSRPNW-UHFFFAOYSA-N"
"CC1=CC(OCC2CNC(=O)O2)=CC(C)=C1","InChI=1S/C12H15NO3/c1-8-3-9(2)5-10(4-8)15-7-11-6-13-12(14)16-11/h3-5,11H,6-7H2,1-2H3,(H,13,14)","IMWZZHHPURKASS-UHFFFAOYSA-N"
"O(c1ccccc1OC\C=C)CC(O)CNC(C)C","InChI=1S/C15H23NO3/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3/h4-8,12-13,16-17H,1,9-11H2,2-3H3","CEMAWMOMDPGJMB-UHFFFAOYSA-N"
"S=C(Oc2ccc1c(cccc1)c2)N(c3cc(ccc3)C)C","InChI=1S/C19H17NOS/c1-14-6-5-9-17(12-14)20(2)19(22)21-18-11-10-15-7-3-4-8-16(15)13-18/h3-13H,1-2H3","FUSNMLFNXJSCDI-UHFFFAOYSA-N"
"O=S(=O)(N)Cc2noc1ccccc12","InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)","UBQNRHZMVUUOMG-UHFFFAOYSA-N"
"O=S(=O)(N)c1c(Cl)ccc(c1)C2(O)c3ccccc3C(=O)N2","InChI=1S/C14H11ClN2O4S/c15-11-6-5-8(7-12(11)22(16,20)21)14(19)10-4-2-1-3-9(10)13(18)17-14/h1-7,19H,(H,17,18)(H2,16,20,21)","JIVPVXMEBJLZRO-UHFFFAOYSA-N"
"O=C3/N=C\Nc1c3ncn1[C@@H]2O[C@@H](CC2)CO","InChI=1S/C10H12N4O3/c15-3-6-1-2-7(17-6)14-5-13-8-9(14)11-4-12-10(8)16/h4-7,15H,1-3H2,(H,11,12,16)/t6-,7+/m0/s1","BXZVVICBKDXVGW-NKWVEPMBSA-N"
"O=C(O)C[C@H](O)C[C@H](O)/C=C/c2c(c1ccccc1n2C(C)C)c3ccc(F)cc3","InChI=1S/C24H26FNO4/c1-15(2)26-21-6-4-3-5-20(21)24(16-7-9-17(25)10-8-16)22(26)12-11-18(27)13-19(28)14-23(29)30/h3-12,15,18-19,27-28H,13-14H2,1-2H3,(H,29,30)/b12-11+/t18-,19-/m1/s1","FJLGEFLZQAZZCD-MCBHFWOFSA-N"
"Cc1c(ccnc1CS(=O)c2[nH]c3ccccc3n2)OCC(F)(F)F","InChI=1S/C16H14F3N3O2S/c1-10-13(20-7-6-14(10)24-9-16(17,18)19)8-25(23)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22)","MJIHNNLFOKEZEW-UHFFFAOYSA-N"
"Clc3ccccc3C/2=N/C(O)C(=O)Nc1c\2cc(Cl)cc1","InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)","DIWRORZWFLOCLC-UHFFFAOYSA-N"
"O=C(O[C@@H]1[C@H]3C(=C/[C@H](C)C1)\C=C/[C@@H]([C@@H]3CC[C@H]2OC(=O)C[C@H](O)C2)C)[C@@H](C)CC","InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1","PCZOHLXUXFIOCF-BXMDZJJMSA-N"
"CC1C=CC=CCCC=CC=CC=CC=CC(CC2C(C(CC(O2)(CC(C(CCC(CC(CC(CC(=O)OC(C(C1O)C)C)O)O)O)O)O)O)O)C(=O)O)OC3C(C(C(C(O3)C)O)N)O","InChI=1S/C47H75NO17/c1-27-17-15-13-11-9-7-5-6-8-10-12-14-16-18-34(64-46-44(58)41(48)43(57)30(4)63-46)24-38-40(45(59)60)37(54)26-47(61,65-38)25-36(53)35(52)20-19-31(49)21-32(50)22-33(51)23-39(55)62-29(3)28(2)42(27)56/h5-6,8,10-18,27-38,40-44,46,49-54,56-58,61H,7,9,19-26,48H2,1-4H3,(H,59,60)/b6-5+,10-8+,13-11+,14-12+,17-15+,18-16+/t27-,28-,29-,30+,31+,32+,33+,34-,35+,36+,37-,38-,40+,41-,42+,43+,44-,46-,47+/m0/s1","VQOXZBDYSJBXMA-NQTDYLQESA-N"
"O=C(Nc1ccccc1C)C(NCCC)C","InChI=1S/C13H20N2O/c1-4-9-14-11(3)13(16)15-12-8-6-5-7-10(12)2/h5-8,11,14H,4,9H2,1-3H3,(H,15,16)","MVFGUOIZUNYYSO-UHFFFAOYSA-N"
"O=C(c1nnn(c1)Cc2c(F)cccc2F)N","InChI=1S/C10H8F2N4O/c11-7-2-1-3-8(12)6(7)4-16-5-9(10(13)17)14-15-16/h1-3,5H,4H2,(H2,13,17)","POGQSBRIGCQNEG-UHFFFAOYSA-N"
"O=C(O[C@@H]1[C@H]3C(=C/[C@H](C)C1)\C=C/[C@@H]([C@@H]3CC[C@H]2OC(=O)C[C@H](O)C2)C)C(C)(C)CC","InChI=1S/C25H38O5/c1-6-25(4,5)24(28)30-21-12-15(2)11-17-8-7-16(3)20(23(17)21)10-9-19-13-18(26)14-22(27)29-19/h7-8,11,15-16,18-21,23,26H,6,9-10,12-14H2,1-5H3/t15-,16-,18+,19+,20-,21-,23-/m0/s1","RYMZZMVNJRMUDD-HGQWONQESA-N"
"O=S(=O)(c2c(Nc1cc(ccc1)C)ccnc2)NC(=O)NC(C)C","InChI=1S/C16H20N4O3S/c1-11(2)18-16(21)20-24(22,23)15-10-17-8-7-14(15)19-13-6-4-5-12(3)9-13/h4-11H,1-3H3,(H,17,19)(H2,18,20,21)","NGBFQHCMQULJNZ-UHFFFAOYSA-N"
"N#C[C@H]4N(C(=O)CNC13CC2CC(C1)CC(O)(C2)C3)CCC4","InChI=1S/C17H25N3O2/c18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16/h12-14,19,22H,1-8,10-11H2/t12?,13?,14-,16?,17?/m0/s1","SYOKIDBDQMKNDQ-XWTIBIIYSA-N"
"O=C(N)C1NCCC1","InChI=1S/C5H10N2O/c6-5(8)4-2-1-3-7-4/h4,7H,1-3H2,(H2,6,8)","VLJNHYLEOZPXFW-UHFFFAOYSA-N"
"NC(C)C13CC2CC(CC(C1)C2)C3","InChI=1S/C12H21N/c1-8(13)12-5-9-2-10(6-12)4-11(3-9)7-12/h8-11H,2-7,13H2,1H3","UBCHPRBFMUDMNC-UHFFFAOYSA-N"
"N(CCCC)(CCCC)CCCC","InChI=1S/C12H27N/c1-4-7-10-13(11-8-5-2)12-9-6-3/h4-12H2,1-3H3","IMFACGCPASFAPR-UHFFFAOYSA-N"
"NC(C)CCCCC","InChI=1S/C7H17N/c1-3-4-5-6-7(2)8/h7H,3-6,8H2,1-2H3","VSRBKQFNFZQRBM-UHFFFAOYSA-N"
"O=P(OCC)(OCC)OCC","InChI=1S/C6H15O4P/c1-4-8-11(7,9-5-2)10-6-3/h4-6H2,1-3H3","DQWPFSLDHJDLRL-UHFFFAOYSA-N"
"O=C(N)C1CCNCC1","InChI=1S/C6H12N2O/c7-6(9)5-1-3-8-4-2-5/h5,8H,1-4H2,(H2,7,9)","DPBWFNDFMCCGGJ-UHFFFAOYSA-N"
"O=C(OC(=O)OC(C)(C)C)OC(C)(C)C","InChI=1S/C10H18O5/c1-9(2,3)14-7(11)13-8(12)15-10(4,5)6/h1-6H3","DYHSDKLCOJIUFX-UHFFFAOYSA-N"
"O=C(Nc1nc(OC)cc(OC)n1)NS(=O)(=O)N(C)S(=O)(=O)C","InChI=1S/C9H15N5O7S2/c1-14(22(4,16)17)23(18,19)13-9(15)12-8-10-6(20-2)5-7(11-8)21-3/h5H,1-4H3,(H2,10,11,12,13,15)","CTTHWASMBLQOFR-UHFFFAOYSA-N"
"O=C2O\C(=N/N2c1c(Cl)cc(NC(=O)N(C)C)cc1)C(C)(C)C","InChI=1S/C15H19ClN4O3/c1-15(2,3)12-18-20(14(22)23-12)11-7-6-9(8-10(11)16)17-13(21)19(4)5/h6-8H,1-5H3,(H,17,21)","DHWRNDJOGMTCPB-UHFFFAOYSA-N"
"O=C3\C4=C(/C(=O)N3c2c(F)cc1OCC(=O)N(c1c2)CC#C)CCCC4","InChI=1S/C19H15FN2O4/c1-2-7-21-15-9-14(13(20)8-16(15)26-10-17(21)23)22-18(24)11-5-3-4-6-12(11)19(22)25/h1,8-9H,3-7,10H2","FOUWCSDKDDHKQP-UHFFFAOYSA-N"
"C1(C(OCC)=O)=NOC(C1)(c1ccccc1)c1ccccc1","InChI=1S/C18H17NO3/c1-2-21-17(20)16-13-18(22-19-16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3","MWKVXOJATACCCH-UHFFFAOYSA-N"
"Clc1cc(Cl)c(cc1)N2/N=C(/C(=O)OCC)CC2(C(=O)OCC)C","InChI=1S/C16H18Cl2N2O4/c1-4-23-14(21)12-9-16(3,15(22)24-5-2)20(19-12)13-7-6-10(17)8-11(13)18/h6-8H,4-5,9H2,1-3H3","OPGCOAPTHCZZIW-UHFFFAOYSA-N"
"O=C(Nc1nc(cc(OC)n1)OC)NS(=O)(=O)c2cc(CNS(C)(=O)=O)ccc2C(=O)OC","InChI=1S/C17H21N5O9S2/c1-29-13-8-14(30-2)20-16(19-13)21-17(24)22-33(27,28)12-7-10(9-18-32(4,25)26)5-6-11(12)15(23)31-3/h5-8,18H,9H2,1-4H3,(H2,19,20,21,22,24)","NIFKBBMCXCMCAO-UHFFFAOYSA-N"
"Clc1ccc(cc1)CC2C(O)(C(CC2)(C)C)Cn3ncnc3","InChI=1S/C17H22ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,11-12,14,22H,7-10H2,1-2H3","XWPZUHJBOLQNMN-UHFFFAOYSA-N"
"Clc1c(ccc(Cl)c1NS(=O)(=O)c2nc3nc(OC)cc(OC)n3n2)C","InChI=1S/C14H13Cl2N5O4S/c1-7-4-5-8(15)12(11(7)16)20-26(22,23)14-18-13-17-9(24-2)6-10(25-3)21(13)19-14/h4-6,20H,1-3H3","VGHPMIFEKOFHHQ-UHFFFAOYSA-N"
"Clc1ccc(NC(=O)N(OC)C)cc1","InChI=1S/C9H11ClN2O2/c1-12(14-2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)","LKJPSUCKSLORMF-UHFFFAOYSA-N"
"Clc2cc(ccc2Oc1ccc([N+]([O-])=O)c(OCC)c1)C(F)(F)F","InChI=1S/C15H11ClF3NO4/c1-2-23-14-8-10(4-5-12(14)20(21)22)24-13-6-3-9(7-11(13)16)15(17,18)19/h3-8H,2H2,1H3","OQMBBFQZGJFLBU-UHFFFAOYSA-N"
"Clc1cc(C(=O)NC(C#C)(C)C)cc(Cl)c1","InChI=1S/C12H11Cl2NO/c1-4-12(2,3)15-11(16)8-5-9(13)7-10(14)6-8/h1,5-7H,2-3H3,(H,15,16)","PHNUZKMIPFFYSO-UHFFFAOYSA-N"
"Clc1ccccc1CC(O)(C2(Cl)CC2)Cn3ncnc3","InChI=1S/C14H15Cl2N3O/c15-12-4-2-1-3-11(12)7-14(20,13(16)5-6-13)8-19-10-17-9-18-19/h1-4,9-10,20H,5-8H2","HHUQPWODPBDTLI-UHFFFAOYSA-N"
"O=C(c1ccc(c(c1Cl)COCC(F)(F)F)S(=O)(=O)C)C2C(=O)CCCC2=O","InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3","IUQAXCIUEPFPSF-UHFFFAOYSA-N"
"CC/C(=N\OC\C=C\Cl)/C=1C(=O)CC(CC=1O)C2CCOCC2","InChI=1S/C17H24ClNO4/c1-2-14(19-23-7-3-6-18)17-15(20)10-13(11-16(17)21)12-4-8-22-9-5-12/h3,6,12-13,20H,2,4-5,7-11H2,1H3/b6-3+,19-14+","IOYNQIMAUDJVEI-BMVIKAAMSA-N"
"O=C1N/C(=C(/Cl)C(=O)N1C(C)(C)C)C","InChI=1S/C9H13ClN2O2/c1-5-6(10)7(13)12(8(14)11-5)9(2,3)4/h1-4H3,(H,11,14)","NBQCNZYJJMBDKY-UHFFFAOYSA-N"
"c1(c2cscn2)[nH]c2ccccc2n1","InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)","WJCNZQLZVWNLKY-UHFFFAOYSA-N"
"c1(C(F)(F)F)cc(ccc1)\C(=N\OCc1c(cccc1)\C(C(=O)OC)=N\OC)C","InChI=1S/C20H19F3N2O4/c1-13(14-8-6-9-16(11-14)20(21,22)23)24-29-12-15-7-4-5-10-17(15)18(25-28-3)19(26)27-2/h4-11H,12H2,1-3H3/b24-13+,25-18-","ONCZDRURRATYFI-QTCHDTBASA-N"
"O=C(OC)c1cccc(c1S(=O)(=O)NC(=O)Nc2nc(nc(OCC(F)(F)F)n2)N(C)C)C","InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)","IMEVJVISCHQJRM-UHFFFAOYSA-N"
"n1nn(c2ccccc12)COC","InChI=1S/C8H9N3O/c1-12-6-11-8-5-3-2-4-7(8)9-10-11/h2-5H,6H2,1H3","QEIXBXXKTUNWDK-UHFFFAOYSA-N"
"c1cc2c(cc1C(=O)O)nn[nH]2","InChI=1S/C7H5N3O2/c11-7(12)4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,11,12)(H,8,9,10)","GUOVBFFLXKJFEE-UHFFFAOYSA-N"
"c1cnn[nH]1","InChI=1S/C2H3N3/c1-2-4-5-3-1/h1-2H,(H,3,4,5)","QWENRTYMTSOGBR-UHFFFAOYSA-N"
"Oc1cnn[nH]1","InChI=1S/C2H3N3O/c6-2-1-3-5-4-2/h1H,(H2,3,4,5,6)","QEASJVYPHMYPJM-UHFFFAOYSA-N"
"O=C(N(CC)C(C(=O)N(C)C)CC)/C=C/C","InChI=1S/C12H22N2O2/c1-6-9-11(15)14(8-3)10(7-2)12(16)13(4)5/h6,9-10H,7-8H2,1-5H3/b9-6+","LSAMUAYPDHUBQD-RMKNXTFCSA-N"
"S=C2Sc1ccccc1N2","InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)","YXIWHUQXZSMYRE-UHFFFAOYSA-N"
"O=C4\C=C2/[C@]([C@H]1[C@@H](O)C[C@@]3([C@@H](C(=O)CO)CC[C@H]3[C@@H]1CC2)C)(C)CC4","InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1","OMFXVFTZEKFJBZ-HJTSIMOOSA-N"
"O=C(CO)[C@@]3(O)CC[C@H]2[C@@H]4CC\C1=C\C(=O)CC[C@]1(C)[C@H]4C(=O)C[C@@]23C","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1","MFYSYFVPBJMHGN-ZPOLXVRWSA-N"
"O=C(N(c1ccccc1C)CC)C=CC","InChI=1S/C13H17NO/c1-4-8-13(15)14(5-2)12-10-7-6-9-11(12)3/h4,6-10H,5H2,1-3H3","DNTGGZPQPQTDQF-UHFFFAOYSA-N"
"Clc1cc(ccc1OC)NC(=O)N(C)C","InChI=1S/C10H13ClN2O2/c1-13(2)10(14)12-7-4-5-9(15-3)8(11)6-7/h4-6H,1-3H3,(H,12,14)","DSRNRYQBBJQVCW-UHFFFAOYSA-N"
"[H][C@@]12CC3=C(C(O)=CC=C3N(C)C)C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2","InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,17-,23-/m0/s1","DYKFCLLONBREIL-KVUCHLLUSA-N"
"CCOC1=C(C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(O)=O)C2=CC=CC=C2C=C1","InChI=1S/C21H22N2O5S/c1-4-28-13-10-9-11-7-5-6-8-12(11)14(13)17(24)22-15-18(25)23-16(20(26)27)21(2,3)29-19(15)23/h5-10,15-16,19H,4H2,1-3H3,(H,22,24)(H,26,27)/t15-,16+,19-/m1/s1","GPXLMGHLHQJAGZ-JTDSTZFVSA-N"
"CC1=C(C(=O)N[C@H]2[C@H]3SC(C)(C)[C@@H](N3C2=O)C(O)=O)C(=NO1)C1=CC=CC=C1","InChI=1S/C19H19N3O5S/c1-9-11(12(21-27-9)10-7-5-4-6-8-10)15(23)20-13-16(24)22-14(18(25)26)19(2,3)28-17(13)22/h4-8,13-14,17H,1-3H3,(H,20,23)(H,25,26)/t13-,14+,17-/m1/s1","UWYHMGVUTGAWSP-JKIFEVAISA-N"
"O=C(SCCCCCCCC)Oc2cc(Cl)nnc2c1ccccc1","InChI=1S/C19H23ClN2O2S/c1-2-3-4-5-6-10-13-25-19(23)24-16-14-17(20)21-22-18(16)15-11-8-7-9-12-15/h7-9,11-12,14H,2-6,10,13H2,1H3","JTZCTMAVMHRNTR-UHFFFAOYSA-N"
"O=S(=O)(Nc2c(Cl)cc(Cl)c(N1/N=C(\N(C1=O)C(F)F)C)c2)C","InChI=1S/C11H10Cl2F2N4O3S/c1-5-16-19(11(20)18(5)10(14)15)9-4-8(17-23(2,21)22)6(12)3-7(9)13/h3-4,10,17H,1-2H3","OORLZFUTLGXMEF-UHFFFAOYSA-N"
"CC(C)(C)NCC(O)COC1=NSN=C1N1CCOCC1","InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3","BLJRIMJGRPQVNF-UHFFFAOYSA-N"
"Cc1cccc(c1N([C@@H](C)C(=O)O)C(=O)COC)C","InChI=1S/C14H19NO4/c1-9-6-5-7-10(2)13(9)15(11(3)14(17)18)12(16)8-19-4/h5-7,11H,8H2,1-4H3,(H,17,18)/t11-/m0/s1","ZRIKZVLHMGYCIR-NSHDSACASA-N"
"Clc2ncc(CN1COCN(C)C1=N)s2","InChI=1S/C8H11ClN4OS/c1-12-4-14-5-13(8(12)10)3-6-2-11-7(9)15-6/h2,10H,3-5H2,1H3","JDTUGRDKAOPKRI-UHFFFAOYSA-N"
"C[C@]1(c2cccc(c2C(=O)C3=C([C@]4([C@@H](C[C@@H]31)[C@@H](C(=C(C4=O)C(=O)N)O)N(C)C)O)O)O)O","InChI=1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25,27-28,31-32H,7H2,1-3H3,(H2,23,30)/t9-,10-,15-,21+,22-/m0/s1","OFVLGDICTFRJMM-WESIUVDSSA-N"
"O=C2N1/C(=C(\CS[C@@H]1[C@@H]2NC(=O)C(=N\OC(C(=O)O)(C)C)/c3nc(sc3)N)C[n+]4ccccc4)C([O-])=O","InChI=1S/C22H22N6O7S2/c1-22(2,20(33)34)35-26-13(12-10-37-21(23)24-12)16(29)25-14-17(30)28-15(19(31)32)11(9-36-18(14)28)8-27-6-4-3-5-7-27/h3-7,10,14,18H,8-9H2,1-2H3,(H4-,23,24,25,29,31,32,33,34)/b26-13-/t14-,18-/m1/s1","ORFOPKXBNMVMKC-DWVKKRMSSA-N"
"C[C@H]1COc2c3n1cc(c(=O)c3cc(c2N4CCN(CC4)C)F)C(=O)O","InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1","GSDSWSVVBLHKDQ-JTQLQIEISA-N"
"O=C(OCC(=O)[C@]3(O)[C@]2(C[C@H](O)[C@]4(F)[C@@]1(/C(=C\C(=O)CC1)CC[C@H]4[C@@H]2CC3)C)C)C","InChI=1S/C23H31FO6/c1-13(25)30-12-19(28)22(29)9-7-16-17-5-4-14-10-15(26)6-8-20(14,2)23(17,24)18(27)11-21(16,22)3/h10,16-18,27,29H,4-9,11-12H2,1-3H3/t16-,17-,18-,20-,21-,22-,23-/m0/s1","SYWHXTATXSMDSB-GSLJADNHSA-N"
"Oc2cc(\C=C\c1ccc(O)cc1)cc(O)c2","InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+","LUKBXSAWLPMMSZ-OWOJBTEDSA-N"
"O=C(CO)[C@]3(O)[C@]2(C[C@H](O)[C@]4(F)[C@@]/1(\C(=C/C(=O)\C=C\1)CC[C@H]4[C@@H]2C[C@@H]3C)C)C","InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,17-,19-,20-,21-,22-/m0/s1","UREBDLICKHMUKA-DVTGEIKXSA-N"
"O=C(CO)[C@@]3(O)CC[C@H]2[C@@H]4CC\C1=C\C(=O)\C=C/[C@]1(C)[C@H]4C(=O)C[C@@]23C","InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1","XOFYZVNMUHMLCC-ZPOLXVRWSA-N"
"O=C(OCC(=O)[C@]3(O)[C@]2(C[C@H](O)[C@]4(F)[C@@]/1(\C(=C/C(=O)\C=C\1)CC[C@H]4[C@@H]2C[C@@H]3C)C)C)C","InChI=1S/C24H31FO6/c1-13-9-18-17-6-5-15-10-16(27)7-8-21(15,3)23(17,25)19(28)11-22(18,4)24(13,30)20(29)12-31-14(2)26/h7-8,10,13,17-19,28,30H,5-6,9,11-12H2,1-4H3/t13-,17-,18-,19-,21-,22-,23-,24-/m0/s1","AKUJBENLRBOFTD-QZIXMDIESA-N"
"CO[C@@H](Cc1ccccc1)[C@@H](C)\C=C(C)\C=C\[C@@H]2NC(=O)[C@H](C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]2C)C(O)=O)C(O)=O","InChI=1S/C46H67N7O12/c1-24(2)21-35-44(60)52-38(46(63)64)28(6)40(56)47-29(7)41(57)49-33(18-17-25(3)22-26(4)36(65-11)23-32-15-13-12-14-16-32)27(5)39(55)50-34(45(61)62)19-20-37(54)53(10)31(9)43(59)48-30(8)42(58)51-35/h12-18,22,24,26-30,33-36,38H,9,19-21,23H2,1-8,10-11H3,(H,47,56)(H,48,59)(H,49,57)(H,50,55)(H,51,58)(H,52,60)(H,61,62)(H,63,64)/b18-17+,25-22+/t26-,27-,28-,29-,30+,33-,34+,35-,36-,38+/m0/s1","DIAQQISRBBDJIM-DRSCAGMXSA-N"
"COC(Cc1ccccc1)C(C)/C=C(C)/C=C/C2NC(=O)C(Cc3ccccc3)NC(=O)C(C)C(NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(=C)N(C)C(=O)CCC(NC(=O)C2C)C(O)=O)C(O)=O","InChI=1S/C52H71N7O12/c1-29(2)25-40-50(66)58-44(52(69)70)33(6)46(62)56-41(27-36-17-13-11-14-18-36)49(65)54-38(22-21-30(3)26-31(4)42(71-10)28-37-19-15-12-16-20-37)32(5)45(61)55-39(51(67)68)23-24-43(60)59(9)35(8)48(64)53-34(7)47(63)57-40/h11-22,26,29,31-34,38-42,44H,8,23-25,27-28H2,1-7,9-10H3,(H,53,64)(H,54,65)(H,55,61)(H,56,62)(H,57,63)(H,58,66)(H,67,68)(H,69,70)/b22-21+,30-26+","FEVBMCJUKWWWBT-BNIOFCGNSA-N"
"COC(Cc1ccccc1)C(C)\C=C(C)\C=C/C2NC(=O)C(Cc3ccc(O)cc3)NC(=O)C(C)C(NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(=C)N(C)C(=O)CCC(NC(=O)C2C)C(O)=O)C(O)=O","InChI=1S/C52H71N7O13/c1-28(2)24-40-50(67)58-44(52(70)71)32(6)46(63)56-41(26-36-17-19-37(60)20-18-36)49(66)54-38(21-16-29(3)25-30(4)42(72-10)27-35-14-12-11-13-15-35)31(5)45(62)55-39(51(68)69)22-23-43(61)59(9)34(8)48(65)53-33(7)47(64)57-40/h11-21,25,28,30-33,38-42,44,60H,8,22-24,26-27H2,1-7,9-10H3,(H,53,65)(H,54,66)(H,55,62)(H,56,63)(H,57,64)(H,58,67)(H,68,69)(H,70,71)/b21-16-,29-25+","SIGQAYSWORHPPH-GFXLLRAPSA-N"
"CO[C@@H](Cc1ccccc1)[C@@H](C)/C=C(C)/C=C/[C@@H]2NC(=O)[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]2C)C(O)=O)C(O)=O","InChI=1S/C54H72N8O12/c1-29(2)24-42-52(69)61-46(54(72)73)33(6)48(65)59-43(27-37-28-55-40-19-15-14-18-38(37)40)51(68)57-39(21-20-30(3)25-31(4)44(74-10)26-36-16-12-11-13-17-36)32(5)47(64)58-41(53(70)71)22-23-45(63)62(9)35(8)50(67)56-34(7)49(66)60-42/h11-21,25,28-29,31-34,39,41-44,46,55H,8,22-24,26-27H2,1-7,9-10H3,(H,56,67)(H,57,68)(H,58,64)(H,59,65)(H,60,66)(H,61,69)(H,70,71)(H,72,73)/b21-20+,30-25+/t31-,32-,33-,34+,39-,41+,42-,43-,44-,46+/m0/s1","CJIASZBWXIFQMU-LNXRSHCCSA-N"
"O=C2N[C@@H](\C=C\C(=C\[C@H](C)[C@@H](OC)Cc1ccccc1)C)[C@@H](C(=O)N[C@@H](C(=O)O)CCC(=O)N(/C(=C)C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)O)[C@@H](C(=O)N[C@H]2CCC/N=C(\N)N)C)CCC/N=C(\N)N)C)C)C","InChI=1S/C49H75N13O12/c1-26(24-27(2)37(74-8)25-32-14-10-9-11-15-32)18-19-33-28(3)40(64)60-36(46(70)71)20-21-38(63)62(7)31(6)43(67)56-30(5)42(66)59-35(17-13-23-55-49(52)53)45(69)61-39(47(72)73)29(4)41(65)58-34(44(68)57-33)16-12-22-54-48(50)51/h9-11,14-15,18-19,24,27-30,33-37,39H,6,12-13,16-17,20-23,25H2,1-5,7-8H3,(H,56,67)(H,57,68)(H,58,65)(H,59,66)(H,60,64)(H,61,69)(H,70,71)(H,72,73)(H4,50,51,54)(H4,52,53,55)/b19-18+,26-24+/t27-,28-,29-,30+,33-,34-,35+,36+,37-,39+/m0/s1","JIGDOBKZMULDHS-CJYJKAEFSA-N"
"CO[C@@H](Cc1ccccc1)[C@@H](C)\C=C(C)\C=C\[C@@H]2NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]2C)C(O)=O)C(O)=O","InChI=1S/C49H75N13O12/c1-26(24-27(2)37(74-8)25-32-14-10-9-11-15-32)18-19-33-28(3)40(64)60-36(46(70)71)20-21-38(63)62(7)31(6)43(67)56-30(5)42(66)59-35(17-13-23-55-49(52)53)45(69)61-39(47(72)73)29(4)41(65)58-34(44(68)57-33)16-12-22-54-48(50)51/h9-11,14-15,18-19,24,27-30,33-37,39H,6,12-13,16-17,20-23,25H2,1-5,7-8H3,(H,56,67)(H,57,68)(H,58,65)(H,59,66)(H,60,64)(H,61,69)(H,70,71)(H,72,73)(H4,50,51,54)(H4,52,53,55)/b19-18+,26-24+/t27-,28-,29-,30+,33-,34-,35-,36+,37-,39+/m0/s1","JIGDOBKZMULDHS-UUHBQKJESA-N"
"CO[C@@H](Cc1ccccc1)[C@@H](C)\C=C(C)\C=C\[C@@H]2NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc3ccc(O)cc3)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]2C)C(O)=O)C(O)=O","InChI=1S/C52H72N10O13/c1-28(25-29(2)41(75-8)27-34-13-10-9-11-14-34)16-21-37-30(3)44(65)59-39(50(71)72)22-23-42(64)62(7)33(6)47(68)56-32(5)46(67)60-40(26-35-17-19-36(63)20-18-35)49(70)61-43(51(73)74)31(4)45(66)58-38(48(69)57-37)15-12-24-55-52(53)54/h9-11,13-14,16-21,25,29-32,37-41,43,63H,6,12,15,22-24,26-27H2,1-5,7-8H3,(H,56,68)(H,57,69)(H,58,66)(H,59,65)(H,60,67)(H,61,70)(H,71,72)(H,73,74)(H4,53,54,55)/b21-16+,28-25+/t29-,30-,31-,32+,37-,38-,39+,40-,41-,43+/m0/s1","OWHASZQTEFAUJC-GJRPNUFSSA-N"
"NC(=N)NCCC[C@@H]2NC(=O)[C@@H](C)[C@@H](NC(=O)C(=C\C)\N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@H](/C=C/C(/C)=C/[C@H](C)[C@H](Cc1ccccc1)OC)NC2=O)C(=O)O)C(O)=O","InChI=1S/C41H60N8O10/c1-8-31-38(54)48-34(40(57)58)26(5)36(52)46-29(15-12-20-44-41(42)43)37(53)45-28(25(4)35(51)47-30(39(55)56)18-19-33(50)49(31)6)17-16-23(2)21-24(3)32(59-7)22-27-13-10-9-11-14-27/h8-11,13-14,16-17,21,24-26,28-30,32,34H,12,15,18-20,22H2,1-7H3,(H,45,53)(H,46,52)(H,47,51)(H,48,54)(H,55,56)(H,57,58)(H4,42,43,44)/b17-16+,23-21+,31-8-/t24-,25-,26-,28-,29-,30+,32-,34+/m0/s1","IXBQSRWSVIBXNC-HSKGSTCASA-N"
"O=C(/N=C(\N)N)N","InChI=1S/C2H6N4O/c3-1(4)6-2(5)7/h(H6,3,4,5,6,7)","SQSPRWMERUQXNE-UHFFFAOYSA-N"
"O=C4\C=C2/[C@]([C@H]1CC[C@@]3([C@@H](C(=O)C)CC[C@H]3[C@@H]1CC2)C)(C)CC4","InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1","RJKFOVLPORLFTN-LEKSSAKUSA-N"
"C1=C2C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)NC=N2","InChI=1S/C7H6ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-3H,(H,10,11)(H2,9,12,13)","JBMKAUGHUNFTOL-UHFFFAOYSA-N"
"C1=C(C(=CC(=C1Cl)S(=O)(=O)N)S(=O)(=O)N)N","InChI=1S/C6H8ClN3O4S2/c7-3-1-4(8)6(16(10,13)14)2-5(3)15(9,11)12/h1-2H,8H2,(H2,9,11,12)(H2,10,13,14)","IHJCXVZDYSXXFT-UHFFFAOYSA-N"
"C1=CC(=CC=C1S(=O)(=O)N)Cl","InChI=1S/C6H6ClNO2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,(H2,8,9,10)","HHHDJHHNEURCNV-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)S(=O)(=O)N)Cl","InChI=1S/C6H6ClNO2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,(H2,8,9,10)","JCCBZCMSYUSCFM-UHFFFAOYSA-N"
"CC(=O)N1CCN(CC1)C2=CC=C(C=C2)OC[C@H]3CO[C@](O3)(CN4C=CN=C4)C5=C(C=C(C=C5)Cl)Cl","InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m0/s1","XMAYWYJOQHXEEK-OZXSUGGESA-N"
"C[C@]1([C@H](CC[C@]2([C@H]1CC[C@@]3([C@@H]2C(=O)C=C4[C@]3(CC[C@@]5([C@H]4C[C@](CC5)(C(=O)O)C)C)C)C)C)O)C","InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26+,27-,28-,29+,30+/m0/s1","MPDGHEJMBKOTSU-YKLVYJNSSA-N"
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"C1=CC(=CC=C1C2=COC3=CC(=CC(=C3C2=O)O)O)O","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H","TZBJGXHYKVUXJN-UHFFFAOYSA-N"
"C[N+](CC#C)(CC1=CC=CC=C1)[O-]","InChI=1S/C11H13NO/c1-3-9-12(2,13)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3","NZCJCBZLNHDNCR-UHFFFAOYSA-N"
"C1CCC(CC1)C(=O)N2CC3C4=CC=CC=C4CCN3C(=O)C2","InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2","FSVJFNAIGNNGKK-UHFFFAOYSA-N"
"CCCCOC1=CC=C(C=C1)OCCCN2CCOCC2","InChI=1S/C17H27NO3/c1-2-3-12-20-16-5-7-17(8-6-16)21-13-4-9-18-10-14-19-15-11-18/h5-8H,2-4,9-15H2,1H3","DQKXQSGTHWVTAD-UHFFFAOYSA-N"
"CN1CCN2C(C1)C3=CC=CC=C3CC4=CC=CC=C42","InChI=1S/C18H20N2/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19/h2-9,18H,10-13H2,1H3","UEQUQVLFIPOEMF-UHFFFAOYSA-N"
"C[C@H](Cc1ccccc1)N(C)CC#C","InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1","MEZLKOACVSPNER-GFCCVEGCSA-N"
"CC1=CC=CC=C1C(C2=CC=CC=C2)OCCN(C)C","InChI=1S/C18H23NO/c1-15-9-7-8-12-17(15)18(20-14-13-19(2)3)16-10-5-4-6-11-16/h4-12,18H,13-14H2,1-3H3","QVYRGXJJSLMXQH-UHFFFAOYSA-N"
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"C[N+]1(CCN2c3ccccc3Cc4ccccc4C2C1)[O-]","InChI=1S/C18H20N2O/c1-20(21)11-10-19-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(19)13-20/h2-9,18H,10-13H2,1H3","VVDXWJOYXVNLLQ-UHFFFAOYSA-N"
"CC[N+](CC)(CC(=O)NC1=C(C=CC=C1C)C)[O-]","InChI=1S/C14H22N2O2/c1-5-16(18,6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)","YDVXPJXUHRROBA-UHFFFAOYSA-N"
"c1cc(cnc1)C2CCCN2","InChI=1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2","MYKUKUCHPMASKF-UHFFFAOYSA-N"
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"C[C@]12CCC3=C4CCC(=O)C=C4CC[C@H]3[C@@H]1CC[C@]2(CC#N)O","InChI=1S/C20H25NO2/c1-19-8-6-16-15-5-3-14(22)12-13(15)2-4-17(16)18(19)7-9-20(19,23)10-11-21/h12,17-18,23H,2-10H2,1H3/t17-,18+,19+,20-/m1/s1","AZFLJNIPTRTECV-FUMNGEBKSA-N"
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"CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)NC(=O)S3","InChI=1S/C19H20N2O3S/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23)","HYAFETHFCAUJAY-UHFFFAOYSA-N"
"CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N=[N+]=[N-]","InChI=1S/C10H13N5O4/c1-5-3-15(10(18)12-9(5)17)8-2-6(13-14-11)7(4-16)19-8/h3,6-8,16H,2,4H2,1H3,(H,12,17,18)/t6-,7+,8+/m0/s1","HBOMLICNUCNMMY-XLPZGREQSA-N"
"C1=NC2=C(N1CCC(CO)CO)N=C(NC2=O)N","InChI=1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)12-5-15(8)2-1-6(3-16)4-17/h5-6,16-17H,1-4H2,(H3,11,13,14,18)","JNTOCHDNEULJHD-UHFFFAOYSA-N"
"CC([C@H]1CC[C@@H](CC1)C(=O)N[C@@H](C(=O)O)CC2=CC=CC=C2)C","InChI=1S/C19H27NO3/c1-13(2)15-8-10-16(11-9-15)18(21)20-17(19(22)23)12-14-6-4-3-5-7-14/h3-7,13,15-17H,8-12H2,1-2H3,(H,20,21)(H,22,23)/t15-,16-,17-/m1/s1","OELFLUMRDSZNSF-BRWVUGGUSA-N"
"CCC1(CCCCN(C1)C)C2=CC(=CC=C2)O","InChI=1S/C15H23NO/c1-3-15(9-4-5-10-16(2)12-15)13-7-6-8-14(17)11-13/h6-8,11,17H,3-5,9-10,12H2,1-2H3","JLICHNCFTLFZJN-UHFFFAOYSA-N"
"CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC(=C(C=C2)N3CCOCC3)F","InChI=1S/C16H20FN3O4/c1-11(21)18-9-13-10-20(16(22)24-13)12-2-3-15(14(17)8-12)19-4-6-23-7-5-19/h2-3,8,13H,4-7,9-10H2,1H3,(H,18,21)/t13-/m0/s1","TYZROVQLWOKYKF-ZDUSSCGKSA-N"
"C1CC1C#C[C@]2(C3=C(C=CC(=C3)Cl)NC(=O)O2)C(F)(F)F","InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1","XPOQHMRABVBWPR-ZDUSSCGKSA-N"
"COC1=C(C=C2C(=C1)C(=NC(=N2)N3CCN(CC3)C(=O)C4COC5=CC=CC=C5O4)N)OC","InChI=1S/C23H25N5O5/c1-30-18-11-14-15(12-19(18)31-2)25-23(26-21(14)24)28-9-7-27(8-10-28)22(29)20-13-32-16-5-3-4-6-17(16)33-20/h3-6,11-12,20H,7-10,13H2,1-2H3,(H2,24,25,26)","RUZYUOTYCVRMRZ-UHFFFAOYSA-N"
"CCCCOC1=NC2=CC=CC=C2C(=C1)C(=O)NCCN(CC)CC","InChI=1S/C20H29N3O2/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h8-11,15H,4-7,12-14H2,1-3H3,(H,21,24)","PUFQVTATUTYEAL-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C","InChI=1S/C24H28O2/c1-15-13-20-21(24(5,6)12-11-23(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)22(25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,25,26)","NAVMQTYZDKMPEU-UHFFFAOYSA-N"
"CC(COC1=CC=CC=C1CC2=CC=CC=C2)N3CCCCC3","InChI=1S/C21H27NO/c1-18(22-14-8-3-9-15-22)17-23-21-13-7-6-12-20(21)16-19-10-4-2-5-11-19/h2,4-7,10-13,18H,3,8-9,14-17H2,1H3","JTUQXGZRVLWBCR-UHFFFAOYSA-N"
"Brc1cc(Cl)cc(c1O)Cc2cc(Cl)cc(Br)c2O","InChI=1S/C13H8Br2Cl2O2/c14-10-4-8(16)2-6(12(10)18)1-7-3-9(17)5-11(15)13(7)19/h2-5,18-19H,1H2","TYBHZVUFOINFDV-UHFFFAOYSA-N"
"C1=CC(=C(C=C1CCN)O)O","InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2","VYFYYTLLBUKUHU-UHFFFAOYSA-N"
"C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N","InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1","OIRDTQYFTABQOQ-KQYNXXCUSA-N"
"CCCCN1CCCCC1/C(=N/C2=C(C=CC=C2C)C)/O","InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)","LEBVLXFERQHONN-UHFFFAOYSA-N"
"C1CN(CCN1CC(CO)O)C2=CC=CC=C2","InChI=1S/C13H20N2O2/c16-11-13(17)10-14-6-8-15(9-7-14)12-4-2-1-3-5-12/h1-5,13,16-17H,6-11H2","PTVWPYVOOKLBCG-UHFFFAOYSA-N"
"CCC1=C2C(=CC=C1)C3=C(N2)C(OCC3)(CC)CC(=O)O","InChI=1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)","NNYBQONXHNTVIJ-UHFFFAOYSA-N"
"[O-][N+](C)(C)C[C@H]2CCCC[C@]2(O)c1cc(OC)ccc1","InChI=1S/C16H25NO3/c1-17(2,19)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)20-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/t14-,16+/m1/s1","HBXKSXMNNGHBEA-ZBFHGGJFSA-N"
"C1CC[C@@](CC1)(C(=O)O)CC(=O)O","InChI=1S/C9H14O4/c10-7(11)6-9(8(12)13)4-2-1-3-5-9/h1-6H2,(H,10,11)(H,12,13)","SDAXMMUAZRUWNL-UHFFFAOYSA-N"
"CNCCCC12CCC(C3=CC=CC=C31)C4=CC=CC=C24","InChI=1S/C20H23N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-5,7-10,15,21H,6,11-14H2,1H3","QSLMDECMDJKHMQ-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2(C(=O)NC(=O)N2)C3=CC=CC=C3","InChI=1S/C15H12N2O2/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19)","CXOFVDLJLONNDW-UHFFFAOYSA-N"
"C1=CC(=C(C=C1[N+](=O)[O-])Cl)NC(=O)C2=C(C=CC(=C2)Cl)O","InChI=1S/C13H8Cl2N2O4/c14-7-1-4-12(18)9(5-7)13(19)16-11-3-2-8(17(20)21)6-10(11)15/h1-6,18H,(H,16,19)","RJMUSRYZPJIFPJ-UHFFFAOYSA-N"
"CCCCOC1=CC=C(C=C1)CC(=O)NO","InChI=1S/C12H17NO3/c1-2-3-8-16-11-6-4-10(5-7-11)9-12(14)13-15/h4-7,15H,2-3,8-9H2,1H3,(H,13,14)","MXJWRABVEGLYDG-UHFFFAOYSA-N"
"CN(C)CC/C=C\1/C2=CC=CC=C2COC3=C1C=C(C=C3)CC(=O)O","InChI=1S/C21H23NO3/c1-22(2)11-5-8-18-17-7-4-3-6-16(17)14-25-20-10-9-15(12-19(18)20)13-21(23)24/h3-4,6-10,12H,5,11,13-14H2,1-2H3,(H,23,24)/b18-8-","JBIMVDZLSHOPLA-LSCVHKIXSA-N"
"CNC[C@@H](C1=CC(=C(C=C1)O)O)O","InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1","UCTWMZQNUQWSLP-VIFPVBQESA-N"
"CCCC(C)(COC(=O)N)COC(=O)NC(C)C","InChI=1S/C12H24N2O4/c1-5-6-12(4,7-17-10(13)15)8-18-11(16)14-9(2)3/h9H,5-8H2,1-4H3,(H2,13,15)(H,14,16)","OFZCIYFFPZCNJE-UHFFFAOYSA-N"
"O=C(OCC)C2(c1ccccc1)[C@@H](\C=C/CC2)N(C)C","InChI=1S/C17H23NO2/c1-4-20-16(19)17(14-10-6-5-7-11-14)13-9-8-12-15(17)18(2)3/h5-8,10-12,15H,4,9,13H2,1-3H3/t15-,17?/m1/s1","WDEFBBTXULIOBB-LDCVWXEPSA-N"
"CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CCCCC3","InChI=1S/C16H17ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h5,7-9H,2-4,6,10H2,1H3","IQWYAQCHYZHJOS-UHFFFAOYSA-N"
"CCOC(=O)C1(CCN(CC1)C)C2=CC=CC=C2","InChI=1S/C15H21NO2/c1-3-18-14(17)15(9-11-16(2)12-10-15)13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3","XADCESSVHJOZHK-UHFFFAOYSA-N"
"CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3C(=O)CC4","InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-12,17H,4-5,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1","LLPOLZWFYMWNKH-CMKMFDCUSA-N"
"CN1CC[C@]23[C@@H]4[C@H]1CC5=C2C(=C(C=C5)OC)O[C@H]3[C@H](CC4)O","InChI=1S/C18H23NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3,6,11-13,17,20H,4-5,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1","RBOXVHNMENFORY-DNJOTXNNSA-N"
"CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)C(CO)C3=CC=CC=C3","InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16?","RKUNBYITZUJHSG-SPUOUPEWSA-N"
"C[C@@H]([C@H](C1=CC=CC=C1)O)N","InChI=1S/C9H13NO/c1-7(10)9(11)8-5-3-2-4-6-8/h2-7,9,11H,10H2,1H3/t7-,9+/m0/s1","DLNKOYKMWOXYQA-IONNQARKSA-N"
"C1=NNC2=C1C(=NC=N2)O","InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)","OFCNXPDARWKPPY-UHFFFAOYSA-N"
"O=C(c1ccc(OC)cc1)NCC","InChI=1S/C10H13NO2/c1-3-11-10(12)8-4-6-9(13-2)7-5-8/h4-7H,3H2,1-2H3,(H,11,12)","KIOWCVBPJXEJLN-UHFFFAOYSA-N"
"CNC[C@@H](C1=CC(=CC=C1)O)O","InChI=1S/C9H13NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7/h2-5,9-12H,6H2,1H3/t9-/m0/s1","SONNWYBIRXJNDC-VIFPVBQESA-N"
"CCC(=O)OC(CC1=CC=CC=C1)(C2=CC=CC=C2)C(C)CN(C)C","InChI=1S/C22H29NO2/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19/h6-15,18H,5,16-17H2,1-4H3","XLMALTXPSGQGBX-UHFFFAOYSA-N"
"CCOC1=C(C=CC(=C1)CC(=O)NC(CC(C)C)C2=CC=CC=C2N3CCCCC3)C(=O)O","InChI=1S/C27H36N2O4/c1-4-33-25-17-20(12-13-22(25)27(31)32)18-26(30)28-23(16-19(2)3)21-10-6-7-11-24(21)29-14-8-5-9-15-29/h6-7,10-13,17,19,23H,4-5,8-9,14-16,18H2,1-3H3,(H,28,30)(H,31,32)","FAEKWTJYAYMJKF-UHFFFAOYSA-N"
"CN(CCCNC(=O)C1CCCO1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC","InChI=1S/C19H27N5O4/c1-24(8-5-7-21-18(25)14-6-4-9-28-14)19-22-13-11-16(27-3)15(26-2)10-12(13)17(20)23-19/h10-11,14H,4-9H2,1-3H3,(H,21,25)(H2,20,22,23)","WNMJYKCGWZFFKR-UHFFFAOYSA-N"
"CC12CC3CC(C1)(CC(C3)(C2)N)C","InChI=1S/C12H21N/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9H,3-8,13H2,1-2H3","BUGYDGFZZOZRHP-UHFFFAOYSA-N"
"CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2","InChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3","ZZVUWRFHKOJYTH-UHFFFAOYSA-N"
"CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F","InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3","RAPZEAPATHNIPO-UHFFFAOYSA-N"
"O=NN(c1ccccc1)c2ccccc2","InChI=1S/C12H10N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H","UBUCNCOMADRQHX-UHFFFAOYSA-N"
"O=NN1CCNCC1","InChI=1S/C4H9N3O/c8-6-7-3-1-5-2-4-7/h5H,1-4H2","CVTIZMOISGMZRJ-UHFFFAOYSA-N"
"O=NN(c1ccccc1)C","InChI=1S/C7H8N2O/c1-9(8-10)7-5-3-2-4-6-7/h2-6H,1H3","MAXCWSIJKVASQC-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)NC(=O)S2","InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)","YEDUAINPPJYDJZ-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl","InChI=1S/C13H9ClO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H","UGVRJVHOJNYEHR-UHFFFAOYSA-N"
"C1C[N+](CCN1C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl)(CCOCC(=O)O)[O-]","InChI=1S/C21H25ClN2O4/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)23-10-12-24(27,13-11-23)14-15-28-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)","IVDOUUOLLFEMJQ-UHFFFAOYSA-N"
"C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl","InChI=1S/C17H19ClN2/c18-16-8-6-15(7-9-16)17(14-4-2-1-3-5-14)20-12-10-19-11-13-20/h1-9,17,19H,10-13H2","UZKBSZSTDQSMDR-UHFFFAOYSA-N"
"C1=CC(=CC=C1C(=O)NCCC(=O)O)Cl","InChI=1S/C10H10ClNO3/c11-8-3-1-7(2-4-8)10(15)12-6-5-9(13)14/h1-4H,5-6H2,(H,12,15)(H,13,14)","ZCGLNFAUVVHTQO-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=C(C=C2Cl)O)Cl","InChI=1S/C14H11Cl2NO3/c15-10-6-9(18)7-11(16)14(10)17-12-4-2-1-3-8(12)5-13(19)20/h1-4,6-7,17-18H,5H2,(H,19,20)","KGVXVPRLBMWZLG-UHFFFAOYSA-N"
"COC1=CC=CC(=C1)C2(CCCCC2CN)O","InChI=1S/C14H21NO2/c1-17-13-7-4-6-11(9-13)14(16)8-3-2-5-12(14)10-15/h4,6-7,9,12,16H,2-3,5,8,10,15H2,1H3","QNPPIKMBCJUUTG-UHFFFAOYSA-N"
"CC[N+]1(CCCC1CNC(=O)C2=CC(=C(C=C2OC)N)S(=O)(=O)CC)[O-]","InChI=1S/C17H27N3O5S/c1-4-20(22)8-6-7-12(20)11-19-17(21)13-9-16(26(23,24)5-2)14(18)10-15(13)25-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)","LLIKIPAUZJTRGB-UHFFFAOYSA-N"
"C1=CC(=C(C(=C1)Cl)NC2=C(C=C(C=C2)O)CC(=O)O)Cl","InChI=1S/C14H11Cl2NO3/c15-10-2-1-3-11(16)14(10)17-12-5-4-9(18)6-8(12)7-13(19)20/h1-6,17-18H,7H2,(H,19,20)","VNQURRWYKFZKJZ-UHFFFAOYSA-N"
"[O-][N+](C)(C)[C@H]3C[C@@H](C)O[C@@H](O[C@@H]2[C@@H](C)[C@H](O[C@H]1C[C@@](C)(OC)[C@@H](O)[C@H](C)O1)[C@@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](C)C[C@@]2(C)OC)[C@@H]3O","InChI=1S/C38H69NO14/c1-15-26-38(10,45)31(42)21(4)28(40)19(2)17-37(9,48-14)33(53-35-29(41)25(39(11,12)46)16-20(3)49-35)22(5)30(23(6)34(44)51-26)52-27-18-36(8,47-13)32(43)24(7)50-27/h19-27,29-33,35,41-43,45H,15-18H2,1-14H3/t19-,20-,21+,22+,23-,24+,25+,26-,27+,29-,30+,31-,32+,33-,35+,36-,37-,38-/m1/s1","KDRPFIWYMNONLJ-KCBOHYOISA-N"
"CN(C)N=O","InChI=1S/C2H6N2O/c1-4(2)3-5/h1-2H3","UMFJAHHVKNCGLG-UHFFFAOYSA-N"
"CCN(C)N=O","InChI=1S/C3H8N2O/c1-3-5(2)4-6/h3H2,1-2H3","RTDCJKARQCRONF-UHFFFAOYSA-N"
"C1CCN(C1)N=O","InChI=1S/C4H8N2O/c7-5-6-3-1-2-4-6/h1-4H2","WNYADZVDBIBLJJ-UHFFFAOYSA-N"
"O=NN(CC)CC","InChI=1S/C4H10N2O/c1-3-6(4-2)5-7/h3-4H2,1-2H3","WBNQDOYYEUMPFS-UHFFFAOYSA-N"
"O=NN1CCCCC1","InChI=1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2","UWSDONTXWQOZFN-UHFFFAOYSA-N"
"O=NN(CCC)CCC","InChI=1S/C6H14N2O/c1-3-5-8(7-9)6-4-2/h3-6H2,1-2H3","YLKFDHTUAUWZPQ-UHFFFAOYSA-N"
"O=S(=O)(c1ccc(cc1)C)N(N=O)C","InChI=1S/C8H10N2O3S/c1-7-3-5-8(6-4-7)14(12,13)10(2)9-11/h3-6H,1-2H3","FFKZOUIEAHOBHW-UHFFFAOYSA-N"
"O=NN(CCCC)CCCC","InChI=1S/C8H18N2O/c1-3-5-7-10(9-11)8-6-4-2/h3-8H2,1-2H3","YGJHZCLPZAZIHH-UHFFFAOYSA-N"
"CC(CC1=CC=CC=C1)[N+](C)(CC#C)[O-]","InChI=1S/C13H17NO/c1-4-10-14(3,15)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3","IVFPCTFUZXEDKP-UHFFFAOYSA-N"
"O=C(O)\C(=N\OC)c2ccccc2COc1ccccc1C","InChI=1S/C17H17NO4/c1-12-7-3-6-10-15(12)22-11-13-8-4-5-9-14(13)16(17(19)20)18-21-2/h3-10H,11H2,1-2H3,(H,19,20)/b18-16+","LXOPDEDFRXZTNO-FBMGVBCBSA-N"
"CC(CC1=CC(=CC=C1)C(F)(F)F)N","InChI=1S/C10H12F3N/c1-7(14)5-8-3-2-4-9(6-8)10(11,12)13/h2-4,6-7H,5,14H2,1H3","MLBHFBKZUPLWBD-UHFFFAOYSA-N"
"c1ccc(c(c1)N2CCNCC2)Cl","InChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8H2","PWZDJIUQHUGFRJ-UHFFFAOYSA-N"
"CCNCC(=O)NC1=C(C=CC=C1C)C","InChI=1S/C12H18N2O/c1-4-13-8-11(15)14-12-9(2)6-5-7-10(12)3/h5-7,13H,4,8H2,1-3H3,(H,14,15)","WRMRXPASUROZGT-UHFFFAOYSA-N"
"CCN(C(C)Cc1cccc(c1)C(F)(F)F)N=O","InChI=1S/C12H15F3N2O/c1-3-17(16-18)9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9H,3,7H2,1-2H3","JVGWNJLSTCQSCZ-UHFFFAOYSA-N"
"CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl","InChI=1S/C18H21ClN2/c1-20-11-13-21(14-12-20)18(15-5-3-2-4-6-15)16-7-9-17(19)10-8-16/h2-10,18H,11-14H2,1H3","WFNAKBGANONZEQ-UHFFFAOYSA-N"
"CN(C)c1ccc(cc1)Cl","InChI=1S/C8H10ClN/c1-10(2)8-5-3-7(9)4-6-8/h3-6H,1-2H3","IONGEXNDPXANJD-UHFFFAOYSA-N"
"CNC1=CC=C(C=C1)Cl","InChI=1S/C7H8ClN/c1-9-7-4-2-6(8)3-5-7/h2-5,9H,1H3","XCEYKKJMLOFDSS-UHFFFAOYSA-N"
"Cc2nc(NC(=O)NS(=O)(=O)c1cc(I)ccc1C(=O)OC)nc(OC)n2","InChI=1S/C14H14IN5O6S/c1-7-16-12(19-14(17-7)26-3)18-13(22)20-27(23,24)10-6-8(15)4-5-9(10)11(21)25-2/h4-6H,1-3H3,(H2,16,17,18,19,20,22)","VWGAYSCWLXQJBQ-UHFFFAOYSA-N"
"O=C(c1c(onc1)C2CC2)c3ccc(cc3S(=O)(=O)C)C(F)(F)F","InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3","OYIKARCXOQLFHF-UHFFFAOYSA-N"
"CCCN1C(=O)C2=C(C=CC(=C2)I)N=C1OCCC","InChI=1S/C14H17IN2O2/c1-3-7-17-13(18)11-9-10(15)5-6-12(11)16-14(17)19-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3","FLVBXVXXXMLMOX-UHFFFAOYSA-N"
"CC(CN1C2=CC=CC=C2CCC3=CC=CC=C31)C[N+](C)(C)[O-]","InChI=1S/C20H26N2O/c1-16(15-22(2,3)23)14-21-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)21/h4-11,16H,12-15H2,1-3H3","UNOPAPJVNIQNJP-UHFFFAOYSA-N"
"CC(C(=O)O)OC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl","InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)","GOCUAJYOYBLQRH-UHFFFAOYSA-N"
"CNCC1CCCCC1(c2cccc(c2)OC)O","InChI=1S/C15H23NO2/c1-16-11-13-6-3-4-9-15(13,17)12-7-5-8-14(10-12)18-2/h5,7-8,10,13,16-17H,3-4,6,9,11H2,1-2H3","VUMQHLSPUAFKKK-UHFFFAOYSA-N"
"C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCC(=O)C3=CC=C(C=C3)F","InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2","LNEPOXFFQSENCJ-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(CCCCCCCCCC(=O)O)cc1","InChI=1S/C16H24O5S/c17-16(18)9-7-5-3-1-2-4-6-8-14-10-12-15(13-11-14)22(19,20)21/h10-13H,1-9H2,(H,17,18)(H,19,20,21)","VCKAUONIDRWIGP-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(CCCCCCCC(=O)O)cc1","InChI=1S/C14H20O5S/c15-14(16)7-5-3-1-2-4-6-12-8-10-13(11-9-12)20(17,18)19/h8-11H,1-7H2,(H,15,16)(H,17,18,19)","KCKCVKAROJRVBA-UHFFFAOYSA-N"
"C1=C(C(=C(C(=C1Cl)Cl)Cl)O)Cl","InChI=1S/C6H2Cl4O/c7-2-1-3(8)6(11)5(10)4(2)9/h1,11H","VGVRPFIJEJYOFN-UHFFFAOYSA-N"
"CC(=O)OC1=CC=CC=C1C(=O)O","InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)","BSYNRYMUTXBXSQ-UHFFFAOYSA-N"
"CCCSC1=CC2=C(C=C1)N=C(N2)NC(=O)OC","InChI=1S/C12H15N3O2S/c1-3-6-18-8-4-5-9-10(7-8)14-11(13-9)15-12(16)17-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)","HXHWSAZORRCQMX-UHFFFAOYSA-N"
"CN(CC=CC1=CC=CC=C1)CC2=CC=CC3=CC=CC=C32","InChI=1S/C21H21N/c1-22(16-8-11-18-9-3-2-4-10-18)17-20-14-7-13-19-12-5-6-15-21(19)20/h2-15H,16-17H2,1H3","OZGNYLLQHRPOBR-UHFFFAOYSA-N"
"CC(C)(C)C(C(=CC1=CC=C(C=C1)Cl)N2C=NC=N2)O","InChI=1S/C15H18ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-10,14,20H,1-3H3","YNWVFADWVLCOPU-UHFFFAOYSA-N"
"CC12CCN(C1N(C3=C2C=C(C=C3)O)C)C","InChI=1S/C13H18N2O/c1-13-6-7-14(2)12(13)15(3)11-5-4-9(16)8-10(11)13/h4-5,8,12,16H,6-7H2,1-3H3","HKGWQUVGHPDEBZ-UHFFFAOYSA-N"
"C1CCNC(C1)C(C2=CC=CC=C2)C(=O)N","InChI=1S/C13H18N2O/c14-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-15-11/h1-3,6-7,11-12,15H,4-5,8-9H2,(H2,14,16)","LJLMNWPXAYKPGV-UHFFFAOYSA-N"
"C1=CC(=CC=C1C#N)C(C2=CC=C(C=C2)C#N)N3C=NC=N3","InChI=1S/C17H11N5/c18-9-13-1-5-15(6-2-13)17(22-12-20-11-21-22)16-7-3-14(10-19)4-8-16/h1-8,11-12,17H","HPJKCIUCZWXJDR-UHFFFAOYSA-N"
"CC(C)(C)C#CC=CCN(C)CC1=CC=CC2=CC=CC=C21","InChI=1S/C21H25N/c1-21(2,3)15-8-5-9-16-22(4)17-19-13-10-12-18-11-6-7-14-20(18)19/h5-7,9-14H,16-17H2,1-4H3","DOMXUEMWDBAQBQ-UHFFFAOYSA-N"
"C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC=C3","InChI=1S/C18H15OP/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H","FIQMHBFVRAXMOP-UHFFFAOYSA-N"
"CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC(=C2)N3C=C(N=C3)C)C(F)(F)F)NC4=NC=CC(=N4)C5=CN=CC=C5","InChI=1S/C28H22F3N7O/c1-17-5-6-19(10-25(17)37-27-33-9-7-24(36-27)20-4-3-8-32-14-20)26(39)35-22-11-21(28(29,30)31)12-23(13-22)38-15-18(2)34-16-38/h3-16H,1-2H3,(H,35,39)(H,33,36,37)","HHZIURLSWUIHRB-UHFFFAOYSA-N"
"CCCCP(=O)(CCCC)CCCC","InChI=1S/C12H27OP/c1-4-7-10-14(13,11-8-5-2)12-9-6-3/h4-12H2,1-3H3","MNZAKDODWSQONA-UHFFFAOYSA-N"
"CC(C)(C)C1=NC(=CC=C1)C(C)(C)C","InChI=1S/C13H21N/c1-12(2,3)10-8-7-9-11(14-10)13(4,5)6/h7-9H,1-6H3","UWKQJZCTQGMHKD-UHFFFAOYSA-N"
"CCCCNC(C)C","InChI=1S/C7H17N/c1-4-5-6-8-7(2)3/h7-8H,4-6H2,1-3H3","OKRJGUKZYSEUOY-UHFFFAOYSA-N"
"CC(C)(C)NCC(C1=CC(=C(C(=C1)Cl)N)Cl)O","InChI=1S/C12H18Cl2N2O/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7/h4-5,10,16-17H,6,15H2,1-3H3","STJMRWALKKWQGH-UHFFFAOYSA-N"
"CN1C(=O)CC(=O)N(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3","InChI=1S/C16H13ClN2O2/c1-18-13-8-7-11(17)9-14(13)19(16(21)10-15(18)20)12-5-3-2-4-6-12/h2-9H,10H2,1H3","CXOXHMZGEKVPMT-UHFFFAOYSA-N"
"c1ccc(cc1)S(=N)(=O)O","InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)","KHBQMWCZKVMBLN-UHFFFAOYSA-N"
"CCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2","InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3","IRIAEXORFWYRCZ-UHFFFAOYSA-N"
"CC1=CC(=C(C=C1)C)OCC2=CC=CC=C2C(=NOC)C(=O)NC","InChI=1S/C19H22N2O3/c1-13-9-10-14(2)17(11-13)24-12-15-7-5-6-8-16(15)18(21-23-4)19(22)20-3/h5-11H,12H2,1-4H3,(H,20,22)","WXUZAHCNPWONDH-UHFFFAOYSA-N"
"CC1=C(C=CC(=C1)OP(=S)(OC)OC)S(=O)(=O)C","InChI=1S/C10H15O5PS2/c1-8-7-9(15-16(17,13-2)14-3)5-6-10(8)18(4,11)12/h5-7H,1-4H3","ZDHYERRNXRANLI-UHFFFAOYSA-N"
"CNC1=C(C(=O)C(O1)C2=CC=CC=C2)C3=CC(=CC=C3)C(F)(F)F","InChI=1S/C18H14F3NO2/c1-22-17-14(12-8-5-9-13(10-12)18(19,20)21)15(23)16(24-17)11-6-3-2-4-7-11/h2-10,16,22H,1H3","NYRMIJKDBAQCHC-UHFFFAOYSA-N"
"C1=CC=C(C=C1)NC(=O)NC2=CC(=NC=C2)Cl","InChI=1S/C12H10ClN3O/c13-11-8-10(6-7-14-11)16-12(17)15-9-4-2-1-3-5-9/h1-8H,(H2,14,15,16,17)","GPXLRLUVLMHHIK-UHFFFAOYSA-N"
"CCC(C)(CC)C1=NOC(=C1)NC(=O)C2=C(C=CC=C2OC)OC","InChI=1S/C18H24N2O4/c1-6-18(3,7-2)14-11-15(24-20-14)19-17(21)16-12(22-4)9-8-10-13(16)23-5/h8-11H,6-7H2,1-5H3,(H,19,21)","PMHURSZHKKJGBM-UHFFFAOYSA-N"
"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)NC3=CC=C(C=C3)F)C(F)(F)F","InChI=1S/C19H12F4N2O2/c20-13-7-9-14(10-8-13)24-18(26)16-5-2-6-17(25-16)27-15-4-1-3-12(11-15)19(21,22)23/h1-11H,(H,24,26)","CWKFPEBMTGKLKX-UHFFFAOYSA-N"
"CCCC(=C1C(=O)CC(CC1=O)C2CCCSC2)NOCC(C)OC3=CC=C(C=C3)Cl","InChI=1S/C24H32ClNO4S/c1-3-5-21(26-29-14-16(2)30-20-9-7-19(25)8-10-20)24-22(27)12-18(13-23(24)28)17-6-4-11-31-15-17/h7-10,16-18,26H,3-6,11-15H2,1-2H3","NZYQPWCHQXECMD-UHFFFAOYSA-N"
"CC1=CC=CC=C1S(=O)(=O)N","InChI=1S/C7H9NO2S/c1-6-4-2-3-5-7(6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)","YCMLQMDWSXFTIF-UHFFFAOYSA-N"
"CCNC(C)CC1=CC2=C(C=C1)OCO2","InChI=1S/C12H17NO2/c1-3-13-9(2)6-10-4-5-11-12(7-10)15-8-14-11/h4-5,7,9,13H,3,6,8H2,1-2H3","PVXVWWANJIWJOO-UHFFFAOYSA-N"
"C1CN(CCN1)C2=C3C=CC=CC3=NC4=C(N2)C=C(C=C4)Cl","InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19,21H,7-10H2","HESZUPIXRNZIOI-UHFFFAOYSA-N"
"C1C(=O)NC2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3","InChI=1S/C15H11ClN2O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)","AKPLHCDWDRPJGD-UHFFFAOYSA-N"
"CCN1C=C(C(=O)C2=CC3=C(C=C21)OCO3)C(=O)O","InChI=1S/C13H11NO5/c1-2-14-5-8(13(16)17)12(15)7-3-10-11(4-9(7)14)19-6-18-10/h3-5H,2,6H2,1H3,(H,16,17)","KYGZCKSPAKDVKC-UHFFFAOYSA-N"
"CC1(C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O)O","InChI=1S/C22H24N2O9/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29/h4-6,12-14,17,25-26,28,30,32-33H,1-3H3,(H2,23,31)","OWFJMIVZYSDULZ-UHFFFAOYSA-N"
"C1CNCC(C1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4","InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2","AHOUBRCZNHFOSL-UHFFFAOYSA-N"
"CCC(=O)N(C1CCNCC1)C2=CC=CC=C2","InChI=1S/C14H20N2O/c1-2-14(17)16(12-6-4-3-5-7-12)13-8-10-15-11-9-13/h3-7,13,15H,2,8-11H2,1H3","PMCBDBWCQQBSRJ-UHFFFAOYSA-N"
"CC(CC1=CC2=C(C=C1)OCO2)NC","InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3","SHXWCVYOXRDMCX-UHFFFAOYSA-N"
"CCCCC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3","InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3","VYMDGNCVAMGZFE-UHFFFAOYSA-N"
"CN=C1CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O","InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9,21H,10H2,1H3","BUCORZSTKDOEKQ-UHFFFAOYSA-N"
"CC1=CC=C(C=C1)S(=O)(=O)N","InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)","LMYRWZFENFIFIT-UHFFFAOYSA-N"
"CN1C2CCC1C(C(C2)O)C(=O)OC","InChI=1S/C10H17NO3/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2/h6-9,12H,3-5H2,1-2H3","QIQNNBXHAYSQRY-UHFFFAOYSA-N"
"C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F","InChI=1S/C20H17F2N3O3/c21-12-1-3-13(4-2-12)25-11-15(20(27)28)19(26)14-9-16(22)18(10-17(14)25)24-7-5-23-6-8-24/h1-4,9-11,23H,5-8H2,(H,27,28)","XBHBWNFJWIASRO-UHFFFAOYSA-N"
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"CN1C2=C(C(=O)N(C1=O)C)NC=N2","InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)","ZFXYFBGIUFBOJW-UHFFFAOYSA-N"
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"CS(=O)(=O)C1=CC=C(C=C1)C(C(CO)NC(=O)C(Cl)Cl)O","InChI=1S/C12H15Cl2NO5S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-16)15-12(18)11(13)14/h2-5,9-11,16-17H,6H2,1H3,(H,15,18)","OTVAEFIXJLOWRX-UHFFFAOYSA-N"
"CC1(OC2COC3(C(C2O1)OC(O3)(C)C)COS(=O)(=O)N)C","InChI=1S/C12H21NO8S/c1-10(2)18-7-5-16-12(6-17-22(13,14)15)9(8(7)19-10)20-11(3,4)21-12/h7-9H,5-6H2,1-4H3,(H2,13,14,15)","KJADKKWYZYXHBB-UHFFFAOYSA-N"
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"CCC(=O)N(C1CCN(CC1)CCC2=CC=CC=C2)C3=CC=CC=C3","InChI=1S/C22H28N2O/c1-2-22(25)24(20-11-7-4-8-12-20)21-14-17-23(18-15-21)16-13-19-9-5-3-6-10-19/h3-12,21H,2,13-18H2,1H3","PJMPHNIQZUBGLI-UHFFFAOYSA-N"
"CS(=O)(=O)C1=CC=C(C=C1)C(C(CF)NC(=O)C(Cl)Cl)O","InChI=1S/C12H14Cl2FNO4S/c1-21(19,20)8-4-2-7(3-5-8)10(17)9(6-15)16-12(18)11(13)14/h2-5,9-11,17H,6H2,1H3,(H,16,18)","AYIRNRDRBQJXIF-UHFFFAOYSA-N"
"CC1CCC2=C3N1C=C(C(=O)C3=CC(=C2)F)C(=O)O","InChI=1S/C14H12FNO3/c1-7-2-3-8-4-9(15)5-10-12(8)16(7)6-11(13(10)17)14(18)19/h4-7H,2-3H2,1H3,(H,18,19)","DPSPPJIUMHPXMA-UHFFFAOYSA-N"
"CN1CCN(CC1)C(=O)OC2C3=NC=CN=C3C(=O)N2C4=NC=C(C=C4)Cl","InChI=1S/C17H17ClN6O3/c1-22-6-8-23(9-7-22)17(26)27-16-14-13(19-4-5-20-14)15(25)24(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3","GBBSUAFBMRNDJC-UHFFFAOYSA-N"
"C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N","InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2","MQJKPEGWNLWLTK-UHFFFAOYSA-N"
"COC1=C(C=C(C=C1)CC2=CN=C(N=C2N)N)OC","InChI=1S/C13H16N4O2/c1-18-10-4-3-8(6-11(10)19-2)5-9-7-16-13(15)17-12(9)14/h3-4,6-7H,5H2,1-2H3,(H4,14,15,16,17)","LDBTVAXGKYIFHO-UHFFFAOYSA-N"
"CCCS(=O)(=O)C1=CC2=C(C=C1)N=C(N2)NC(=O)OC","InChI=1S/C12H15N3O4S/c1-3-6-20(17,18)8-4-5-9-10(7-8)14-11(13-9)15-12(16)19-2/h4-5,7H,3,6H2,1-2H3,(H2,13,14,15,16)","CLSJYOLYMZNKJB-UHFFFAOYSA-N"
"C1=CC(=C(C=C1Cl)CC2=C(C=CC(=C2)Cl)O)O","InChI=1S/C13H10Cl2O2/c14-10-1-3-12(16)8(6-10)5-9-7-11(15)2-4-13(9)17/h1-4,6-7,16-17H,5H2","MDNWOSOZYLHTCG-UHFFFAOYSA-N"
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"CCOC1=CC2=C(C=C1)NC(C=C2C)(C)C","InChI=1S/C14H19NO/c1-5-16-11-6-7-13-12(8-11)10(2)9-14(3,4)15-13/h6-9,15H,5H2,1-4H3","DECIPOUIJURFOJ-UHFFFAOYSA-N"
"CCOP(=S)(OCC)SCN1C(=O)C2=CC=CC=C2N=N1","InChI=1S/C12H16N3O3PS2/c1-3-17-19(20,18-4-2)21-9-15-12(16)10-7-5-6-8-11(10)13-14-15/h5-8H,3-4,9H2,1-2H3","RQVGAIADHNPSME-UHFFFAOYSA-N"
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"COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=C(C=C3)F","InChI=1S/C16H12FN3O3/c1-23-16(22)20-15-18-12-7-4-10(8-13(12)19-15)14(21)9-2-5-11(17)6-3-9/h2-8H,1H3,(H2,18,19,20,22)","CPEUVMUXAHMANV-UHFFFAOYSA-N"
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"CC1=C(N2C(C(C2=O)NC(=O)C(C3=CC=C(C=C3)O)N)SC1)C(=O)O","InChI=1S/C16H17N3O5S/c1-7-6-25-15-11(14(22)19(15)12(7)16(23)24)18-13(21)10(17)8-2-4-9(20)5-3-8/h2-5,10-11,15,20H,6,17H2,1H3,(H,18,21)(H,23,24)","BOEGTKLJZSQCCD-UHFFFAOYSA-N"
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"CC1=C(C(=NO1)C2=C(C=CC=C2Cl)Cl)C(=O)NC3C4N(C3=O)C(C(S4)(C)C)C(=O)O","InChI=1S/C19H17Cl2N3O5S/c1-7-10(12(23-29-7)11-8(20)5-4-6-9(11)21)15(25)22-13-16(26)24-14(18(27)28)19(2,3)30-17(13)24/h4-6,13-14,17H,1-3H3,(H,22,25)(H,27,28)","YFAGHNZHGGCZAX-UHFFFAOYSA-N"
"CCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F","InChI=1S/C19H22FN3O3/c1-2-21-5-7-22(8-6-21)17-10-16-13(9-15(17)20)18(24)14(19(25)26)11-23(16)12-3-4-12/h9-12H,2-8H2,1H3,(H,25,26)","SPFYMRJSYKOXGV-UHFFFAOYSA-N"
"COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)C3=CC=CC=C3","InChI=1S/C16H13N3O3/c1-22-16(21)19-15-17-12-8-7-11(9-13(12)18-15)14(20)10-5-3-2-4-6-10/h2-9H,1H3,(H2,17,18,19,21)","OPXLLQIJSORQAM-UHFFFAOYSA-N"
"CN(C)CCCN1C2=CC=CC=C2CCC3=C1C=C(C=C3)Cl","InChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3","GDLIGKIOYRNHDA-UHFFFAOYSA-N"
"COC(=O)C1=CC=CC=C1C(=O)OC","InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3","NIQCNGHVCWTJSM-UHFFFAOYSA-N"
"C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2C(=O)OC3=CC=CC=C3","InChI=1S/C20H14O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h1-14H","DWNAQMUDCDVSLT-UHFFFAOYSA-N"
"CN(C)CCC=C1C2=CC=CC=C2COC3=CC=CC=C31","InChI=1S/C19H21NO/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3","ODQWQRRAPPTVAG-UHFFFAOYSA-N"
"CC1C2C(C3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O","InChI=1S/C22H24N2O8/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29/h4-7,10,14-15,17,25-27,30,32H,1-3H3,(H2,23,31)","SGKRLCUYIXIAHR-UHFFFAOYSA-N"
"C1CN(CC=C1N2C3=CC=CC=C3NC2=O)CCCC(=O)C4=CC=C(C=C4)F","InChI=1S/C22H22FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-11H,3,6,12-15H2,(H,24,28)","RMEDXOLNCUSCGS-UHFFFAOYSA-N"
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"CC1CC2=CC=CC=C2N1NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N","InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)","NDDAHWYSQHTHNT-UHFFFAOYSA-N"
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"CC1=C(C(=C(C=C1)Cl)NC2=CC=CC=C2C(=O)O)Cl","InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)","SBDNJUWAMKYJOX-UHFFFAOYSA-N"
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"CNCCC=C1C2=CC=CC=C2CCC3=CC=CC=C31","InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-11,20H,6,12-14H2,1H3","PHVGLTMQBUFIQQ-UHFFFAOYSA-N"
"CC1C=CC=C(C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)OC(C4=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C5=C2N6C=CC(=CC6=N5)C)O)C","InChI=1S/C43H51N3O11/c1-19-14-16-46-28(18-19)44-32-29-30-37(50)25(7)40-31(29)41(52)43(9,57-40)55-17-15-27(54-10)22(4)39(56-26(8)47)24(6)36(49)23(5)35(48)20(2)12-11-13-21(3)42(53)45-33(34(32)46)38(30)51/h11-18,20,22-24,27,35-36,39,48-51H,1-10H3,(H,45,53)","NZCRJKRKKOLAOJ-UHFFFAOYSA-N"
"CN1C(=CN=C1COC(=O)N)[N+](=O)[O-]","InChI=1S/C6H8N4O4/c1-9-4(3-14-6(7)11)8-2-5(9)10(12)13/h2H,3H2,1H3,(H2,7,11)","PQFRTXSWDXZRRS-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C(=O)O)O","InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)","YGSDEFSMJLZEOE-UHFFFAOYSA-N"
"CC1=CC2=C(NC3=CC=CC=C3N=C2S1)N4CCN(CC4)C","InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,18H,7-10H2,1-2H3","WXPNDRBBWZMPQG-UHFFFAOYSA-N"
"CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CCCC(C2)O)O","InChI=1S/C21H34O2/c1-4-5-6-7-13-21(2,3)17-11-12-19(20(23)15-17)16-9-8-10-18(22)14-16/h11-12,15-16,18,22-23H,4-10,13-14H2,1-3H3","ZWWRREXSUJTKNN-UHFFFAOYSA-N"
"C1C(COC1(CN2C=NC=N2)C3=C(C=C(C=C3)Cl)Cl)Br","InChI=1S/C13H12BrCl2N3O/c14-9-4-13(20-5-9,6-19-8-17-7-18-19)11-2-1-10(15)3-12(11)16/h1-3,7-9H,4-6H2","HJJVPARKXDDIQD-UHFFFAOYSA-N"
"COC(=O)C1=C(C(=C(C(=C1Cl)Cl)C(=O)OC)Cl)Cl","InChI=1S/C10H6Cl4O4/c1-17-9(15)3-5(11)7(13)4(10(16)18-2)8(14)6(3)12/h1-2H3","NPOJQCVWMSKXDN-UHFFFAOYSA-N"
"CCOP(=O)(NC(C)C)OC1=CC(=C(C=C1)S(=O)(=O)C)C","InChI=1S/C13H22NO5PS/c1-6-18-20(15,14-10(2)3)19-12-7-8-13(11(4)9-12)21(5,16)17/h7-10H,6H2,1-5H3,(H,14,15)","LVNYJXIBJFXIRZ-UHFFFAOYSA-N"
"CC(C)OC1=C(C=C(C(=C1)N2C(=O)OC(=N2)C(C)(C)C)Cl)Cl","InChI=1S/C15H18Cl2N2O3/c1-8(2)21-12-7-11(9(16)6-10(12)17)19-14(20)22-13(18-19)15(3,4)5/h6-8H,1-5H3","CHNUNORXWHYHNE-UHFFFAOYSA-N"
"CC(C)(C)C(C(CC1=CC=C(C=C1)Cl)N2C=NC=N2)O","InChI=1S/C15H20ClN3O/c1-15(2,3)14(20)13(19-10-17-9-18-19)8-11-4-6-12(16)7-5-11/h4-7,9-10,13-14,20H,8H2,1-3H3","RMOGWMIKYWRTKW-UHFFFAOYSA-N"
"CC1=C(C=CC(=C1)OP(=S)(OC)OC)S(=O)C","InChI=1S/C10H15O4PS2/c1-8-7-9(5-6-10(8)17(4)11)14-15(16,12-2)13-3/h5-7H,1-4H3","DLAPIMGBBDILHJ-UHFFFAOYSA-N"
"CN(C)C(=O)NC1=CC=CC(=C1)C(F)(F)F","InChI=1S/C10H11F3N2O/c1-15(2)9(16)14-8-5-3-4-7(6-8)10(11,12)13/h3-6H,1-2H3,(H,14,16)","RZILCCPWPBTYDO-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C(CN2C=NC=N2)(C3=CC=C(C=C3)F)O)F","InChI=1S/C16H13F2N3O/c17-13-7-5-12(6-8-13)16(22,9-21-11-19-10-20-21)14-3-1-2-4-15(14)18/h1-8,10-11,22H,9H2","JWUCHKBSVLQQCO-UHFFFAOYSA-N"
"CC(C)C1(C(=O)NC(=N1)C2=NC3=CC=CC=C3C=C2C(=O)O)C","InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)","CABMTIJINOIHOD-UHFFFAOYSA-N"
"CN1CCN2C(C1)C3=CC=CC=C3CC4=CC(=CN=C42)O","InChI=1S/C17H19N3O/c1-19-6-7-20-16(11-19)15-5-3-2-4-12(15)8-13-9-14(21)10-18-17(13)20/h2-5,9-10,16,21H,6-8,11H2,1H3","DAWYIZBOUQIVNX-UHFFFAOYSA-N"
"CCOC(=O)CC(C(=O)OCC)SP(=O)(OC)OC","InChI=1S/C10H19O7PS/c1-5-16-9(11)7-8(10(12)17-6-2)19-18(13,14-3)15-4/h8H,5-7H2,1-4H3","WSORODGWGUUOBO-UHFFFAOYSA-N"
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"CC(CC1=CC2=C(C=C1)OCO2)N","InChI=1S/C10H13NO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6,11H2,1H3","NGBBVGZWCFBOGO-UHFFFAOYSA-N"
"C1=CC=C2C=C(C=CC2=C1)OCC(=O)O","InChI=1S/C12H10O3/c13-12(14)8-15-11-6-5-9-3-1-2-4-10(9)7-11/h1-7H,8H2,(H,13,14)","RZCJYMOBWVJQGV-UHFFFAOYSA-N"
"C1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)O","InChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H","IZUPBVBPLAPZRR-UHFFFAOYSA-N"
"CN1C(=O)CN=C(C2=C1C=CC(=C2)N)C3=CC=CC=C3F","InChI=1S/C16H14FN3O/c1-20-14-7-6-10(18)8-12(14)16(19-9-15(20)21)11-4-2-3-5-13(11)17/h2-8H,9,18H2,1H3","LTCDLGUFORGHGY-UHFFFAOYSA-N"
"CC1=CN=C2C(=C1)C=CC(=C2C(=O)O)Cl","InChI=1S/C11H8ClNO2/c1-6-4-7-2-3-8(12)9(11(14)15)10(7)13-5-6/h2-5H,1H3,(H,14,15)","ALZOLUNSQWINIR-UHFFFAOYSA-N"
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"CC1=NNC(=O)N(N)C1=O","InChI=1S/C4H6N4O2/c1-2-3(9)8(5)4(10)7-6-2/h5H2,1H3,(H,7,10)","OBVMWVBNOLJKBG-UHFFFAOYSA-N"
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"COCC(=O)N(C(C)C(O)=O)C1=C(C=CC=C1C)C(O)=O","InChI=1S/C14H17NO6/c1-8-5-4-6-10(14(19)20)12(8)15(9(2)13(17)18)11(16)7-21-3/h4-6,9H,7H2,1-3H3,(H,17,18)(H,19,20)","WFTHOCDLKYPFJX-UHFFFAOYSA-N"
"NC(=O)C1=C(Cl)C(C(N)=O)=C(C(Cl)=C1Cl)S(O)(=O)=O","InChI=1S/C8H5Cl3N2O5S/c9-3-1(7(12)14)4(10)5(11)6(19(16,17)18)2(3)8(13)15/h(H2,12,14)(H2,13,15)(H,16,17,18)","NLCNUAPJCIAONV-UHFFFAOYSA-N"
"NC(=O)C1=C(Cl)C(C#N)=C(O)C(Cl)=C1Cl","InChI=1S/C8H3Cl3N2O2/c9-4-2(1-12)7(14)6(11)5(10)3(4)8(13)15/h14H,(H2,13,15)","WUYYRWIYXBUPBS-UHFFFAOYSA-N"
"CC1=NC(N)=NC(=C1)C1CC1","InChI=1S/C8H11N3/c1-5-4-7(6-2-3-6)11-8(9)10-5/h4,6H,2-3H2,1H3,(H2,9,10,11)","KPMMRZPKAYBHME-UHFFFAOYSA-N"
"CN1C(O)=NC(NC(C)(C)C)=NC1=O","InChI=1S/C8H14N4O2/c1-8(2,3)11-5-9-6(13)12(4)7(14)10-5/h1-4H3,(H2,9,10,11,13,14)","SKWILWLBILDCEB-UHFFFAOYSA-N"
"CC(C)(NC1=NC(N)=NC(O)=N1)C(O)=O","InChI=1S/C7H11N5O3/c1-7(2,3(13)14)12-5-9-4(8)10-6(15)11-5/h1-2H3,(H,13,14)(H4,8,9,10,11,12,15)","QKOJUBFULGSCQS-UHFFFAOYSA-N"
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"CCC1=CC(C)=CC(CC)=C1C1C(=O)N2CCOCCN2C1=O","InChI=1S/C18H24N2O3/c1-4-13-10-12(3)11-14(5-2)15(13)16-17(21)19-6-8-23-9-7-20(19)18(16)22/h10-11,16H,4-9H2,1-3H3","QHUWVQWAKAJLTJ-UHFFFAOYSA-N"
"CCC1=C(N(C(C)C(O)=O)C(=O)CS(O)(=O)=O)C(C)=CC=C1","InChI=1S/C14H19NO6S/c1-4-11-7-5-6-9(2)13(11)15(10(3)14(17)18)12(16)8-22(19,20)21/h5-7,10H,4,8H2,1-3H3,(H,17,18)(H,19,20,21)","WOXWIWNBIJDJHI-UHFFFAOYSA-N"
"CCC1=C(NC(=O)CS(O)(=O)=O)C(C)=CC=C1","InChI=1S/C11H15NO4S/c1-3-9-6-4-5-8(2)11(9)12-10(13)7-17(14,15)16/h4-6H,3,7H2,1-2H3,(H,12,13)(H,14,15,16)","QPVPJECIHVSBLZ-UHFFFAOYSA-N"
"NC1=C(C(=NN1C1=C(Cl)C=C(C=C1Cl)C(F)(F)F)C(O)=O)S(=O)C(F)(F)F","InChI=1S/C12H5Cl2F6N3O3S/c13-4-1-3(11(15,16)17)2-5(14)7(4)23-9(21)8(6(22-23)10(24)25)27(26)12(18,19)20/h1-2H,21H2,(H,24,25)","OHWPIAZSHNMBAC-UHFFFAOYSA-N"
"CCC\C(=N/OCC)C1=C(O)CC(CC1=O)C1CCCS(=O)C1","InChI=1S/C17H27NO4S/c1-3-6-14(18-22-4-2)17-15(19)9-13(10-16(17)20)12-7-5-8-23(21)11-12/h12-13,19H,3-11H2,1-2H3/b18-14+","SVKHAVSUBSUFBQ-NBVRZTHBSA-N"
"OC(=O)C1=CNN=C1C(F)F","InChI=1S/C5H4F2N2O2/c6-4(7)3-2(5(10)11)1-8-9-3/h1,4H,(H,8,9)(H,10,11)","IGQNDARULCASRN-UHFFFAOYSA-N"
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"C1=C(C=CC(=C1)S(=O)(=O)N)N","InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)","FDDDEECHVMSUSB-UHFFFAOYSA-N"
"CC1(C)C(O)OC2=CC=C(OS(C)(=O)=O)C=C12","InChI=1S/C11H14O5S/c1-11(2)8-6-7(16-17(3,13)14)4-5-9(8)15-10(11)12/h4-6,10,12H,1-3H3","KNHJTPLSWOEZHZ-UHFFFAOYSA-N"
"CC1=C(N=C(N=C1C)N(C)C)O","InChI=1S/C8H13N3O/c1-5-6(2)9-8(11(3)4)10-7(5)12/h1-4H3,(H,9,10,12)","MUEHLDAHWSCFAG-UHFFFAOYSA-N"
"CC1=CC(O)=CC(C)=C1S(C)(=O)=O","InChI=1S/C9H12O3S/c1-6-4-8(10)5-7(2)9(6)13(3,11)12/h4-5,10H,1-3H3","GRBGKIGVRUXTSK-UHFFFAOYSA-N"
"OC(=O)CN1C=NC=N1","InChI=1S/C4H5N3O2/c8-4(9)1-7-3-5-2-6-7/h2-3H,1H2,(H,8,9)","RXDBSQXFIWBJSR-UHFFFAOYSA-N"
"CCN1C(=O)NC(=O)C1(NOC)C(N)=O","InChI=1S/C7H12N4O4/c1-3-11-6(14)9-5(13)7(11,4(8)12)10-15-2/h10H,3H2,1-2H3,(H2,8,12)(H,9,13,14)","CTDZGEFRMQIFFW-UHFFFAOYSA-N"
"CN(C)C(=O)C1=CC=CN=C1S(=O)(=O)NC(=O)NC(N)=N","InChI=1S/C10H14N6O4S/c1-16(2)8(17)6-4-3-5-13-7(6)21(19,20)15-10(18)14-9(11)12/h3-5H,1-2H3,(H5,11,12,14,15,18)","JIZXOFJDALMBAQ-UHFFFAOYSA-N"
"CN(C)C(=O)C1=CC=CN=C1S(=O)(=O)NC(=O)NC(N)=O","InChI=1S/C10H13N5O5S/c1-15(2)8(16)6-4-3-5-12-7(6)21(19,20)14-10(18)13-9(11)17/h3-5H,1-2H3,(H4,11,13,14,17,18)","DGJDFJVBNQLVJW-UHFFFAOYSA-N"
"OC(=O)C1=CC=CC2=C1OC(F)(F)O2","InChI=1S/C8H4F2O4/c9-8(10)13-5-3-1-2-4(7(11)12)6(5)14-8/h1-3H,(H,11,12)","ZGAQVJDFFVTWJK-UHFFFAOYSA-N"
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"OC(=O)CCC(=O)N1CCN(CC1)c1ccccc1Cl","InChI=1S/C14H17ClN2O3/c15-11-3-1-2-4-12(11)16-7-9-17(10-8-16)13(18)5-6-14(19)20/h1-4H,5-10H2,(H,19,20)","FMKKWAHJJLLAOW-UHFFFAOYSA-N"
"OC(=O)\C=C\C(=O)N1CCN(CC1)c1ccccc1Cl","InChI=1S/C14H15ClN2O3/c15-11-3-1-2-4-12(11)16-7-9-17(10-8-16)13(18)5-6-14(19)20/h1-6H,7-10H2,(H,19,20)/b6-5+","AXXAWJZEEQXNHQ-AATRIKPKSA-N"
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"OC(=O)CC(=O)N1CCN(CC1)c1ccccc1Cl","InChI=1S/C13H15ClN2O3/c14-10-3-1-2-4-11(10)15-5-7-16(8-6-15)12(17)9-13(18)19/h1-4H,5-9H2,(H,18,19)","XHCNVUPFYLKTEJ-UHFFFAOYSA-N"
"OC(=O)CNc1ccccc1Cl","InChI=1S/C8H8ClNO2/c9-6-3-1-2-4-7(6)10-5-8(11)12/h1-4,10H,5H2,(H,11,12)","NSDVLRONTCKCPY-UHFFFAOYSA-N"
"CN(CC#C)CC1=CC=CC=C1","InChI=1S/C11H13N/c1-3-9-12(2)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3","DPWPWRLQFGFJFI-UHFFFAOYSA-N"
"C[N+]([O-])(CC#C)CC1=CC=CC=C1","InChI=1S/C11H13NO/c1-3-9-12(2,13)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3","NZCJCBZLNHDNCR-UHFFFAOYSA-N"
"O=CN(CC#C)CC1=CC=CC=C1","InChI=1S/C11H11NO/c1-2-8-12(10-13)9-11-6-4-3-5-7-11/h1,3-7,10H,8-9H2","MOSRXMRJDACECK-UHFFFAOYSA-N"
"C#CCNCC1=CC=CC=C1","InChI=1S/C10H11N/c1-2-8-11-9-10-6-4-3-5-7-10/h1,3-7,11H,8-9H2","LDYBFSGEBHSTOQ-UHFFFAOYSA-N"
"CN(C)CCC(c1ccccc1)c1ccccn1","InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3","IJHNSHDBIRRJRN-UHFFFAOYSA-N"
"C[N+](C)([O-])CCC(C1=CC=CC=C1)C1=NC=CC=C1","InChI=1S/C16H20N2O/c1-18(2,19)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3","OBBDJQMNZLQVAZ-UHFFFAOYSA-N"
"COC1=CC2=CC=CN=C2C(NC(C)CCCN)=C1","InChI=1S/C15H21N3O/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14/h4,6,8-11,18H,3,5,7,16H2,1-2H3","INDBQLZJXZLFIT-UHFFFAOYSA-N"
"COC1=CC2=CC=CN=C2C(NC(C)CCC(O)=O)=C1","InChI=1S/C15H18N2O3/c1-10(5-6-14(18)19)17-13-9-12(20-2)8-11-4-3-7-16-15(11)13/h3-4,7-10,17H,5-6H2,1-2H3,(H,18,19)","KIMKJIXTIWKABF-UHFFFAOYSA-N"
"COC1=CC2=CC=CN=C2C(NC(C)C(O)=O)=C1","InChI=1S/C13H14N2O3/c1-8(13(16)17)15-11-7-10(18-2)6-9-4-3-5-14-12(9)11/h3-8,15H,1-2H3,(H,16,17)","KCYRVQQKJYMPAM-UHFFFAOYSA-N"
"COC1=CC2=CC=CN=C2C(N)=C1","InChI=1S/C10H10N2O/c1-13-8-5-7-3-2-4-12-10(7)9(11)6-8/h2-6H,11H2,1H3","YGGTVPCTAKYCSQ-UHFFFAOYSA-N"
"COC1=CC2=CC=CN=C2C(NC(C)CCCNC(C)=O)=C1","InChI=1S/C17H23N3O2/c1-12(6-4-8-18-13(2)21)20-16-11-15(22-3)10-14-7-5-9-19-17(14)16/h5,7,9-12,20H,4,6,8H2,1-3H3,(H,18,21)","YVURERLGLAYCCQ-UHFFFAOYSA-N"
"COC1=CC2=CC=CN=C2C(=C1)N(C=O)C(C)CCC(O)=O","InChI=1S/C16H18N2O4/c1-11(5-6-15(20)21)18(10-19)14-9-13(22-2)8-12-4-3-7-17-16(12)14/h3-4,7-11H,5-6H2,1-2H3,(H,20,21)","HWLCTPIUUFQVEK-UHFFFAOYSA-N"
"COc1ccc(CN(CCN(C)C)c2ccccn2)cc1","InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3","YECBIJXISLIIDS-UHFFFAOYSA-N"
"COc1ccc(CN(CCN(C)(C)=O)c2ccccn2)cc1","InChI=1S/C17H23N3O2/c1-20(2,21)13-12-19(17-6-4-5-11-18-17)14-15-7-9-16(22-3)10-8-15/h4-11H,12-14H2,1-3H3","IQDUZGGMNVZTAI-UHFFFAOYSA-N"
"CNCCN(Cc1ccc(OC)cc1)c1ccccn1","InChI=1S/C16H21N3O/c1-17-11-12-19(16-5-3-4-10-18-16)13-14-6-8-15(20-2)9-7-14/h3-10,17H,11-13H2,1-2H3","LWKSMQXIHQRJJJ-UHFFFAOYSA-N"
"CN(C)CCN(Cc1ccc(O)cc1)c1ccccn1","InChI=1S/C16H21N3O/c1-18(2)11-12-19(16-5-3-4-10-17-16)13-14-6-8-15(20)9-7-14/h3-10,20H,11-13H2,1-2H3","FCFBHFOEKQWQBR-UHFFFAOYSA-N"
"COc1ccc(CN(CC(O)=O)c2ccccn2)cc1","InChI=1S/C15H16N2O3/c1-20-13-7-5-12(6-8-13)10-17(11-15(18)19)14-4-2-3-9-16-14/h2-9H,10-11H2,1H3,(H,18,19)","PPJDHLMQESOTEN-UHFFFAOYSA-N"
"COc1ccc(CN(CCN(C)C=O)c2ccccn2)cc1","InChI=1S/C17H21N3O2/c1-19(14-21)11-12-20(17-5-3-4-10-18-17)13-15-6-8-16(22-2)9-7-15/h3-10,14H,11-13H2,1-2H3","AGBYYCMLOLWSPS-UHFFFAOYSA-N"
"CN(C)CCNc1ccccn1","InChI=1S/C9H15N3/c1-12(2)8-7-11-9-5-3-4-6-10-9/h3-6H,7-8H2,1-2H3,(H,10,11)","PBPMFHCGVZTYHV-UHFFFAOYSA-N"
"CCCNCC1COC2(CCC(CC2)C(C)(C)C)O1","InChI=1S/C16H31NO2/c1-5-10-17-11-14-12-18-16(19-14)8-6-13(7-9-16)15(2,3)4/h13-14,17H,5-12H2,1-4H3","YYICKHZBDGQJBW-UHFFFAOYSA-N"
"CCNCC1COC2(CCC(CC2)C(C)(C)C)O1","InChI=1S/C15H29NO2/c1-5-16-10-13-11-17-15(18-13)8-6-12(7-9-15)14(2,3)4/h12-13,16H,5-11H2,1-4H3","AUYSPPNVFQBFHX-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C(C[N+](C)(C)[O-])C1(O)CCCCC1","InChI=1S/C17H27NO3/c1-18(2,20)13-16(17(19)11-5-4-6-12-17)14-7-9-15(21-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3","LASJEFFANGIOGZ-UHFFFAOYSA-N"
"CC(=O)CN(CCOC1=C(Cl)C=C(Cl)C=C1Cl)C=O","InChI=1S/C12H12Cl3NO3/c1-8(18)6-16(7-17)2-3-19-12-10(14)4-9(13)5-11(12)15/h4-5,7H,2-3,6H2,1H3","KOOVZZFZNASYFB-UHFFFAOYSA-N"
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"CC(O)CN(CCOC1=C(Cl)C=C(Cl)C=C1Cl)C(=O)N1C=CN=C1","InChI=1S/C15H16Cl3N3O3/c1-10(22)8-20(15(23)21-3-2-19-9-21)4-5-24-14-12(17)6-11(16)7-13(14)18/h2-3,6-7,9-10,22H,4-5,8H2,1H3","YXJSNOWMOJFNPG-UHFFFAOYSA-N"
"CCCN(CCOC1=C(Cl)C=C(Cl)C=C1Cl)C(N)=O","InChI=1S/C12H15Cl3N2O2/c1-2-3-17(12(16)18)4-5-19-11-9(14)6-8(13)7-10(11)15/h6-7H,2-5H2,1H3,(H2,16,18)","MPNJTIZLDHWBFX-UHFFFAOYSA-N"
"CC(O)CNCCOC1=C(Cl)C=C(Cl)C=C1Cl","InChI=1S/C11H14Cl3NO2/c1-7(16)6-15-2-3-17-11-9(13)4-8(12)5-10(11)14/h4-5,7,15-16H,2-3,6H2,1H3","CCROUVCATXGAFZ-UHFFFAOYSA-N"
"CCCN(CCOC1=C(Cl)C=C(Cl)C=C1Cl)C(=O)SCC(N)C(O)=O","InChI=1S/C15H19Cl3N2O4S/c1-2-3-20(15(23)25-8-12(19)14(21)22)4-5-24-13-10(17)6-9(16)7-11(13)18/h6-7,12H,2-5,8,19H2,1H3,(H,21,22)","HUHAANSJHKXOQG-UHFFFAOYSA-N"
"NCCOC1=C(Cl)C=C(Cl)C=C1Cl","InChI=1S/C8H8Cl3NO/c9-5-3-6(10)8(7(11)4-5)13-2-1-12/h3-4H,1-2,12H2","SUSCJRQKCYABMX-UHFFFAOYSA-N"
"CCCN(CCOC1=C(Cl)C=C(Cl)C=C1Cl)C(=O)N(CO)C=N","InChI=1S/C14H18Cl3N3O3/c1-2-3-19(14(22)20(8-18)9-21)4-5-23-13-11(16)6-10(15)7-12(13)17/h6-8,18,21H,2-5,9H2,1H3","LRLDLEGEIWYGJQ-UHFFFAOYSA-N"
"CCCN(CCOC1=C(Cl)C(OC2O[C@H](COS(O)(=O)=O)[C@@H](O)[C@H](O)[C@H]2O)=C(Cl)C=C1Cl)C(=O)N1C=CN=C1","InChI=1S/C21H26Cl3N3O11S/c1-2-4-26(21(31)27-5-3-25-10-27)6-7-35-18-11(22)8-12(23)19(14(18)24)38-20-17(30)16(29)15(28)13(37-20)9-36-39(32,33)34/h3,5,8,10,13,15-17,20,28-30H,2,4,6-7,9H2,1H3,(H,32,33,34)/t13-,15-,16+,17-,20?/m1/s1","UNCSXZRCRHPBJA-PQCYZMNFSA-N"
"CCCN(CCOC1=C(Cl)C=C(Cl)C(OS(O)(=O)=O)=C1Cl)C(=O)N1C=CN=C1","InChI=1S/C15H16Cl3N3O6S/c1-2-4-20(15(22)21-5-3-19-9-21)6-7-26-13-10(16)8-11(17)14(12(13)18)27-28(23,24)25/h3,5,8-9H,2,4,6-7H2,1H3,(H,23,24,25)","AGQNYUSTLRWZPV-UHFFFAOYSA-N"
"CCCN(CCOC1=C(Cl)C=C(Cl)C=C1Cl)C=O","InChI=1S/C12H14Cl3NO2/c1-2-3-16(8-17)4-5-18-12-10(14)6-9(13)7-11(12)15/h6-8H,2-5H2,1H3","UYGPHUXNXJCWGM-UHFFFAOYSA-N"
"CCCN(CCOC1=C(Cl)C=C(Cl)C(OC2O[C@H](COS(O)(=O)=O)[C@@H](O)[C@H](O)[C@H]2O)=C1Cl)C(=O)N1C=CN=C1","InChI=1S/C21H26Cl3N3O11S/c1-2-4-26(21(31)27-5-3-25-10-27)6-7-35-18-11(22)8-12(23)19(14(18)24)38-20-17(30)16(29)15(28)13(37-20)9-36-39(32,33)34/h3,5,8,10,13,15-17,20,28-30H,2,4,6-7,9H2,1H3,(H,32,33,34)/t13-,15-,16+,17-,20?/m1/s1","UNCSXZRCRHPBJA-PQCYZMNFSA-N"
"CCCN(CCOC1=C(Cl)C=C(O)C(SCC(N)C(O)=O)=C1Cl)C(=O)N1C=CN=C1","InChI=1S/C18H22Cl2N4O5S/c1-2-4-23(18(28)24-5-3-22-10-24)6-7-29-15-11(19)8-13(25)16(14(15)20)30-9-12(21)17(26)27/h3,5,8,10,12,25H,2,4,6-7,9,21H2,1H3,(H,26,27)","IENWMYMSXABSSK-UHFFFAOYSA-N"
"[H]N([H])[C@@H](CCC(=O)N([H])[C@@H](CSC(=O)NCCOC1=C(Cl)C=C(Cl)C=C1Cl)C(=O)N([H])CC(O)=O)C(O)=O","InChI=1S/C19H23Cl3N4O8S/c20-9-5-10(21)16(11(22)6-9)34-4-3-24-19(33)35-8-13(17(30)25-7-15(28)29)26-14(27)2-1-12(23)18(31)32/h5-6,12-13H,1-4,7-8,23H2,(H,24,33)(H,25,30)(H,26,27)(H,28,29)(H,31,32)/t12-,13-/m0/s1","HZMMMVGQXDUITB-STQMWFEESA-N"
"OCC(C1CC1)C(O)(CN1C=NC=N1)C1=CC=C(Cl)C=C1","InChI=1S/C15H18ClN3O2/c16-13-5-3-12(4-6-13)15(21,8-19-10-17-9-18-19)14(7-20)11-1-2-11/h3-6,9-11,14,20-21H,1-2,7-8H2","IVFRBVSPAOYOOK-UHFFFAOYSA-N"
"CC(C1CC1)C(O)(CN1N=CN=C1O)C1=CC=C(Cl)C=C1","InChI=1S/C15H18ClN3O2/c1-10(11-2-3-11)15(21,8-19-14(20)17-9-18-19)12-4-6-13(16)7-5-12/h4-7,9-11,21H,2-3,8H2,1H3,(H,17,18,20)","PCNSTTQWJVIKMC-UHFFFAOYSA-N"
"CC(C1CC1)C(O)(CN1C=NC(O)=N1)C1=CC=C(Cl)C=C1","InChI=1S/C15H18ClN3O2/c1-10(11-2-3-11)15(21,8-19-9-17-14(20)18-19)12-4-6-13(16)7-5-12/h4-7,9-11,21H,2-3,8H2,1H3,(H,18,20)","KDVNSJWEDNCKDY-UHFFFAOYSA-N"
"FC1=CC=C(C=C1)[C@]1(CN2C=NC=N2)O[C@H]1C1=CC=CC=C1Cl","InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2/t16-,17-/m0/s1","ZMYFCFLJBGAQRS-IRXDYDNUSA-N"
"OC1=NN(C[C@]2(O[C@H]2C2=CC=CC=C2Cl)C2=CC=C(F)C=C2)C=N1","InChI=1S/C17H13ClFN3O2/c18-14-4-2-1-3-13(14)15-17(24-15,9-22-10-20-16(23)21-22)11-5-7-12(19)8-6-11/h1-8,10,15H,9H2,(H,21,23)/t15-,17-/m0/s1","ZSDOCYUTMYKRND-RDJZCZTQSA-N"
"N[C@@H](CS[C@@](CN1C=NC=N1)(C(=O)C1=CC=CC=C1Cl)C1=CC=C(F)C=C1)C(O)=O","InChI=1S/C20H18ClFN4O3S/c21-16-4-2-1-3-15(16)18(27)20(10-26-12-24-11-25-26,30-9-17(23)19(28)29)13-5-7-14(22)8-6-13/h1-8,11-12,17H,9-10,23H2,(H,28,29)/t17-,20+/m0/s1","TZYAOSFLCQVQJN-FXAWDEMLSA-N"
"N[C@@H](CS[C@@](CN1C=NC=N1)([C@H](O)C1=CC=CC=C1Cl)C1=CC=C(F)C=C1)C(O)=O","InChI=1S/C20H20ClFN4O3S/c21-16-4-2-1-3-15(16)18(27)20(10-26-12-24-11-25-26,30-9-17(23)19(28)29)13-5-7-14(22)8-6-13/h1-8,11-12,17-18,27H,9-10,23H2,(H,28,29)/t17-,18+,20+/m0/s1","HPPQENYNPCPJDE-NLWGTHIKSA-N"
"N[C@@H](CS[C@@](C(O)N1C=NC=N1)([C@H](O)C1=CC=CC=C1Cl)C1=CC=C(F)C=C1)C(O)=O","InChI=1S/C20H20ClFN4O4S/c21-15-4-2-1-3-14(15)17(27)20(31-9-16(23)18(28)29,12-5-7-13(22)8-6-12)19(30)26-11-24-10-25-26/h1-8,10-11,16-17,19,27,30H,9,23H2,(H,28,29)/t16-,17+,19?,20+/m0/s1","FFDPUOKMKYPWSA-UQHKUSSPSA-N"
"OS(=O)(=O)OC(N1C=NC=N1)[C@]1(O[C@H]1C1=CC=CC=C1Cl)C1=CC=C(F)C=C1","InChI=1S/C17H13ClFN3O5S/c18-14-4-2-1-3-13(14)15-17(26-15,11-5-7-12(19)8-6-11)16(27-28(23,24)25)22-10-20-9-21-22/h1-10,15-16H,(H,23,24,25)/t15-,16?,17-/m0/s1","LRHLUQVZYPONJN-QRFGZVGRSA-N"
"[H]N([H])[C@@H](CCC(=O)N([H])[C@@H](CS[C@@](CN1C=NC=N1)([C@H](O)C1=CC=CC=C1Cl)C1=CC=C(F)C=C1)C(=O)N([H])CC(O)=O)C(O)=O","InChI=1S/C27H30ClFN6O7S/c28-19-4-2-1-3-18(19)24(39)27(13-35-15-31-14-33-35,16-5-7-17(29)8-6-16)43-12-21(25(40)32-11-23(37)38)34-22(36)10-9-20(30)26(41)42/h1-8,14-15,20-21,24,39H,9-13,30H2,(H,32,40)(H,34,36)(H,37,38)(H,41,42)/t20-,21-,24+,27+/m0/s1","CQVYQYUSHAXATN-DWBNTRNDSA-N"
"OCCCC1COC(CN2C=NC=N2)(O1)C1=C(Cl)C=C(Cl)C=C1","InChI=1S/C15H17Cl2N3O3/c16-11-3-4-13(14(17)6-11)15(8-20-10-18-9-19-20)22-7-12(23-15)2-1-5-21/h3-4,6,9-10,12,21H,1-2,5,7-8H2","GZZNFYOGUUPAEU-UHFFFAOYSA-N"
"CC(O)CC1COC(CN2C=NC=N2)(O1)C1=C(Cl)C=C(Cl)C=C1","InChI=1S/C15H17Cl2N3O3/c1-10(21)4-12-6-22-15(23-12,7-20-9-18-8-19-20)13-3-2-11(16)5-14(13)17/h2-3,5,8-10,12,21H,4,6-7H2,1H3","ACQHZORIRZCPLG-UHFFFAOYSA-N"
"OC(CN1C=NC=N1)C1=C(Cl)C=C(Cl)C=C1","InChI=1S/C10H9Cl2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6,10,16H,4H2","XCWJBJOPHSVLGU-UHFFFAOYSA-N"
"ClC1=CC(Cl)=C(C=C1)C(=O)CN1C=NC=N1","InChI=1S/C10H7Cl2N3O/c11-7-1-2-8(9(12)3-7)10(16)4-15-6-13-5-14-15/h1-3,5-6H,4H2","XOHMICFWUQPTNP-UHFFFAOYSA-N"
"CC(C)(CO)C(O)(CCC1=CC=C(Cl)C=C1)CN1C=NC=N1","InChI=1S/C16H22ClN3O2/c1-15(2,10-21)16(22,9-20-12-18-11-19-20)8-7-13-3-5-14(17)6-4-13/h3-6,11-12,21-22H,7-10H2,1-2H3","OIKHXEKXIIAQKY-UHFFFAOYSA-N"
"CC(C)(C)C(CCC1=CC=C(Cl)C=C1)(CN1C=NC=N1)OP(O)(O)=O","InChI=1S/C16H23ClN3O4P/c1-15(2,3)16(24-25(21,22)23,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12H,8-10H2,1-3H3,(H2,21,22,23)","NMJXDYGJGLTLDI-UHFFFAOYSA-N"
"CC(C)(CO)C(CCC1=CC=C(Cl)C=C1)(CN1C=NC=N1)OP(O)(O)=O","InChI=1S/C16H23ClN3O5P/c1-15(2,10-21)16(25-26(22,23)24,9-20-12-18-11-19-20)8-7-13-3-5-14(17)6-4-13/h3-6,11-12,21H,7-10H2,1-2H3,(H2,22,23,24)","RSIWUZQNFRIBIY-UHFFFAOYSA-N"
"CC(C)(C)C(O)(CCC1=CC=C(Cl)C=C1)CN1C=NC(O)=N1","InChI=1S/C16H22ClN3O2/c1-15(2,3)16(22,10-20-11-18-14(21)19-20)9-8-12-4-6-13(17)7-5-12/h4-7,11,22H,8-10H2,1-3H3,(H,19,21)","PEKHDQCGVPPILP-UHFFFAOYSA-N"
"CC(C)(C)C(O)(CC(O)C1=CC=C(Cl)C=C1)CN1C=NC=N1","InChI=1S/C16H22ClN3O2/c1-15(2,3)16(22,9-20-11-18-10-19-20)8-14(21)12-4-6-13(17)7-5-12/h4-7,10-11,14,21-22H,8-9H2,1-3H3","SCQIVKOIYXXGEW-UHFFFAOYSA-N"
"[H][C@]1(COC2=CC=C(C=C2)N2CCN(CC2)C(C)=O)CO[C@@](CN2C=CN=C2)(O1)C1=CC=C(Cl)C=C1Cl","InChI=1S/C26H28Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-9,14,18,23H,10-13,15-17H2,1H3/t23-,26-/m0/s1","XMAYWYJOQHXEEK-OZXSUGGESA-N"
"[H][C@]1(COC2=CC=C(C=C2)N2CCN(CC2)C(C)=O)CO[C@@](CNC(=O)CNC=O)(O1)C1=CC=C(Cl)C=C1Cl","InChI=1S/C26H30Cl2N4O6/c1-18(34)31-8-10-32(11-9-31)20-3-5-21(6-4-20)36-14-22-15-37-26(38-22,16-30-25(35)13-29-17-33)23-7-2-19(27)12-24(23)28/h2-7,12,17,22H,8-11,13-16H2,1H3,(H,29,33)(H,30,35)/t22-,26-/m0/s1","XRVDJJPAVOFCOR-NVQXNPDNSA-N"
"O=C(NC1=NC2=CC=CC=C2N1)OCC","InChI=1S/C10H11N3O2/c1-2-15-10(14)13-9-11-7-5-3-4-6-8(7)12-9/h3-6H,2H2,1H3,(H2,11,12,13,14)","OKOVSTKGUBOSTB-UHFFFAOYSA-N"
"CC(NCC(O)COC1=CC=C(CCO)C=C1)C","InChI=1S/C14H23NO3/c1-11(2)15-9-13(17)10-18-14-5-3-12(4-6-14)7-8-16/h3-6,11,13,15-17H,7-10H2,1-2H3","CUKXSBOAIJILRY-UHFFFAOYSA-N"
"OC1=CC=C(CCNC(C2=CC=C(Cl)C=C2)=O)C=C1","InChI=1S/C15H14ClNO2/c16-13-5-3-12(4-6-13)15(19)17-10-9-11-1-7-14(18)8-2-11/h1-8,18H,9-10H2,(H,17,19)","ZTLWJYCDAXUIBK-UHFFFAOYSA-N"
"CC(C(OC)=O)(OC1=CC=C(CCNC(C2=CC=C(Cl)C=C2)=O)C=C1)C","InChI=1S/C20H22ClNO4/c1-20(2,19(24)25-3)26-17-10-4-14(5-11-17)12-13-22-18(23)15-6-8-16(21)9-7-15/h4-11H,12-13H2,1-3H3,(H,22,23)","KDYYGGKDZBRIIX-UHFFFAOYSA-N"
"CN/C(NCCSCC1=CC=C(CNC)O1)=C\[N+]([O-])=O","InChI=1S/C12H20N4O3S/c1-13-7-10-3-4-11(19-10)9-20-6-5-15-12(14-2)8-16(17)18/h3-4,8,13-15H,5-7,9H2,1-2H3/b12-8+","WZLBVRXZNDXPPW-XYOKQWHBSA-N"
"CC1=CC(NS(=O)(C2=CC=C(NCC3=NC(C(NC(N)=N4)=O)=C4N=C3)C=C2)=O)=NO1","InChI=1S/C17H16N8O4S/c1-9-6-13(24-29-9)25-30(27,28)12-4-2-10(3-5-12)19-7-11-8-20-15-14(21-11)16(26)23-17(18)22-15/h2-6,8,19H,7H2,1H3,(H,24,25)(H3,18,20,22,23,26)","LVUVWJASQQPDSL-UHFFFAOYSA-N"
"CC1=CC(NS(=O)(C2=CC=C(NCC3=NC(C(NC(O)=N4)=O)=C4N=C3)C=C2)=O)=NO1","InChI=1S/C17H15N7O5S/c1-9-6-13(23-29-9)24-30(27,28)12-4-2-10(3-5-12)18-7-11-8-19-15-14(20-11)16(25)22-17(26)21-15/h2-6,8,18H,7H2,1H3,(H,23,24)(H2,19,21,22,25,26)","ZTEDFROSGMEYCI-UHFFFAOYSA-N"
"O=C(CCC(NC(C1=C(C=CC=C1)NC2=CC=CC(C)=C2C)=O)C(O)=O)O","InChI=1S/C20H22N2O5/c1-12-6-5-9-15(13(12)2)21-16-8-4-3-7-14(16)19(25)22-17(20(26)27)10-11-18(23)24/h3-9,17,21H,10-11H2,1-2H3,(H,22,25)(H,23,24)(H,26,27)","HLEKOHRJHVCEKY-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CCC)CCCCCC","InChI=1S/C16H26O3S/c1-3-5-6-7-9-14(8-4-2)15-10-12-16(13-11-15)20(17,18)19/h10-14H,3-9H2,1-2H3,(H,17,18,19)","NANHIUZYPFDGJS-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CCC)CCCCC(=O)O","InChI=1S/C15H22O5S/c1-2-5-12(6-3-4-7-15(16)17)13-8-10-14(11-9-13)21(18,19)20/h8-12H,2-7H2,1H3,(H,16,17)(H,18,19,20)","OKAXESGQNYIPGL-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CCC(=O)O)CCC(=O)O","InChI=1S/C13H16O7S/c14-12(15)7-3-10(4-8-13(16)17)9-1-5-11(6-2-9)21(18,19)20/h1-2,5-6,10H,3-4,7-8H2,(H,14,15)(H,16,17)(H,18,19,20)","HOTNRZRMYIRTPN-UHFFFAOYSA-N"
"O=S(=O)(O)c1ccc2c(c1)C(CCC2CC)CCCC","InChI=1S/C16H24O3S/c1-3-5-6-13-8-7-12(4-2)15-10-9-14(11-16(13)15)20(17,18)19/h9-13H,3-8H2,1-2H3,(H,17,18,19)","ZANYAOJPVAPRQY-UHFFFAOYSA-N"
"O=S(=O)(O)c1ccc2c(c1)C(CCC2CCC(=O)O)CC","InChI=1S/C15H20O5S/c1-2-10-3-4-11(5-8-15(16)17)13-7-6-12(9-14(10)13)21(18,19)20/h6-7,9-11H,2-5,8H2,1H3,(H,16,17)(H,18,19,20)","OXVZPANHCLMUFY-UHFFFAOYSA-N"
"O=S(=O)(O)c1ccc2c(c1)C(CCC2C(=O)O)C(=O)O","InChI=1S/C12H12O7S/c13-11(14)8-3-4-9(12(15)16)10-5-6(20(17,18)19)1-2-7(8)10/h1-2,5,8-9H,3-4H2,(H,13,14)(H,15,16)(H,17,18,19)","OBMVBAQSIVLJJN-UHFFFAOYSA-N"
"OS(=O)(=O)OCCCCCCCCCCCC","InChI=1S/C12H26O4S/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h2-12H2,1H3,(H,13,14,15)","MOTZDAYCYVMXPC-UHFFFAOYSA-N"
"O=S(O)(=O)OCCOCCCCCCCCCCCC","InChI=1S/C14H30O5S/c1-2-3-4-5-6-7-8-9-10-11-12-18-13-14-19-20(15,16)17/h2-14H2,1H3,(H,15,16,17)","QTDIEDOANJISNP-UHFFFAOYSA-N"
"O=S(=O)(O)C(CCCCCCC)CCCCCC","InChI=1S/C14H30O3S/c1-3-5-7-9-11-13-14(18(15,16)17)12-10-8-6-4-2/h14H,3-13H2,1-2H3,(H,15,16,17)","MZBFYGYTZIZFQC-UHFFFAOYSA-N"
"O=C(O)COc1ccc(cc1)CCCCCCCCC","InChI=1S/C17H26O3/c1-2-3-4-5-6-7-8-9-15-10-12-16(13-11-15)20-14-17(18)19/h10-13H,2-9,14H2,1H3,(H,18,19)","NISAHDHKGPWBEM-UHFFFAOYSA-N"
"Oc1ccc(cc1)CCCCCCCC","InChI=1S/C14H22O/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12,15H,2-8H2,1H3","NTDQQZYCCIDJRK-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CCCC)CCCCCC","InChI=1S/C17H28O3S/c1-3-5-7-8-10-15(9-6-4-2)16-11-13-17(14-12-16)21(18,19)20/h11-15H,3-10H2,1-2H3,(H,18,19,20)","FERBTPHUEYEGDN-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CC)CCCCC(=O)O","InChI=1S/C14H20O5S/c1-2-11(5-3-4-6-14(15)16)12-7-9-13(10-8-12)20(17,18)19/h7-11H,2-6H2,1H3,(H,15,16)(H,17,18,19)","KNDYNZDDQSJMQR-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CCCC)CCCCC(=O)O","InChI=1S/C16H24O5S/c1-2-3-6-13(7-4-5-8-16(17)18)14-9-11-15(12-10-14)22(19,20)21/h9-13H,2-8H2,1H3,(H,17,18)(H,19,20,21)","PLMAIIGPUFQJCH-UHFFFAOYSA-N"
"C1=CC2=NNN=C2C(=C1)C(=O)O","InChI=1S/C7H5N3O2/c11-7(12)4-2-1-3-5-6(4)9-10-8-5/h1-3H,(H,11,12)(H,8,9,10)","KFJDQPJLANOOOB-UHFFFAOYSA-N"
"CC1=C2C(=CC=C1)NN=N2","InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","CMGDVUCDZOBDNL-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1C)N=NN2","InChI=1S/C8H9N3/c1-5-3-7-8(4-6(5)2)10-11-9-7/h3-4H,1-2H3,(H,9,10,11)","MVPKIPGHRNIOPT-UHFFFAOYSA-N"
"C1=CC2=C(C=C1C(=O)O)N=NN2","InChI=1S/C7H5N3O2/c11-7(12)4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,11,12)(H,8,9,10)","GUOVBFFLXKJFEE-UHFFFAOYSA-N"
"OC1=CN=NN1","InChI=1S/C2H3N3O/c6-2-1-3-5-4-2/h1H,(H2,3,4,5,6)","QEASJVYPHMYPJM-UHFFFAOYSA-N"
"C1=CC(=C(C=C1NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C(F)(F)F)Cl","InChI=1S/C15H8Cl2F6N2O/c16-11-3-1-7(5-9(11)14(18,19)20)24-13(26)25-8-2-4-12(17)10(6-8)15(21,22)23/h1-6H,(H2,24,25,26)","ABOVRDBEJDIBMZ-UHFFFAOYSA-N"
"C1=C(C(=C(C(=C1Cl)Cl)CC2=C(C(=CC(=C2Cl)Cl)Cl)O)O)Cl","InChI=1S/C13H6Cl6O2/c14-6-2-8(16)12(20)4(10(6)18)1-5-11(19)7(15)3-9(17)13(5)21/h2-3,20-21H,1H2","ACGUYXCXAPNIKK-UHFFFAOYSA-N"
"C1=CC(=C(C(=C1)F)C(=O)NC(=O)NC2=CC(=C(C=C2Cl)OC(C(C(F)(F)F)F)(F)F)Cl)F","InChI=1S/C17H8Cl2F8N2O3/c18-6-5-11(32-17(26,27)14(22)16(23,24)25)7(19)4-10(6)28-15(31)29-13(30)12-8(20)2-1-3-9(12)21/h1-5,14H,(H2,28,29,30,31)","PWPJGUXAGUPAHP-UHFFFAOYSA-N"
"C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)O","InChI=1S/C13H11ClO/c14-12-6-7-13(15)11(9-12)8-10-4-2-1-3-5-10/h1-7,9,15H,8H2","NCKMMSIFQUPKCK-UHFFFAOYSA-N"
"CC(C)(C)C1=CC=C(C=C1)CCOC2=NC=NC3=CC=CC=C32","InChI=1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3","DMYHGDXADUDKCQ-UHFFFAOYSA-N"
"C1CN(CCN1C/C=C/C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F","InChI=1S/C26H26F2N2/c27-24-12-8-22(9-13-24)26(23-10-14-25(28)15-11-23)30-19-17-29(18-20-30)16-4-7-21-5-2-1-3-6-21/h1-15,26H,16-20H2/b7-4+","SMANXXCATUTDDT-QPJJXVBHSA-N"
"Cc1cccc(c1N)C","InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3","UFFBMTHBGFGIHF-UHFFFAOYSA-N"
"Cc1ccc2c(c1)[nH]nn2","InChI=1S/C7H7N3/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","LRUDIIUSNGCQKF-UHFFFAOYSA-N"
"c1ccc(cc1)C(=O)c2ccc(cc2O)O","InChI=1S/C13H10O3/c14-10-6-7-11(12(15)8-10)13(16)9-4-2-1-3-5-9/h1-8,14-15H","ZXDDPOHVAMWLBH-UHFFFAOYSA-N"
"c1cc(c(cc1O)O)C(=O)c2ccc(cc2O)O","InChI=1S/C13H10O5/c14-7-1-3-9(11(16)5-7)13(18)10-4-2-8(15)6-12(10)17/h1-6,14-17H","WXNRYSGJLQFHBR-UHFFFAOYSA-N"
"COc1ccc(c(c1)O)C(=O)c2ccccc2","InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3","DXGLGDHPHMLXJC-UHFFFAOYSA-N"
"COc1cc(c(cc1S(=O)(=O)O)C(=O)c2ccccc2)O","InChI=1S/C14H12O6S/c1-20-12-8-11(15)10(7-13(12)21(17,18)19)14(16)9-5-3-2-4-6-9/h2-8,15H,1H3,(H,17,18,19)","CXVGEDCSTKKODG-UHFFFAOYSA-N"
"COc1ccc(c(c1)O)C(=O)c2ccccc2O","InChI=1S/C14H12O4/c1-18-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8,15-16H,1H3","MEZZCSHVIGVWFI-UHFFFAOYSA-N"
"c1ccc2c(c1)[nH]nn2","InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)","QRUDEWIWKLJBPS-UHFFFAOYSA-N"
"CC(C)NCC(COc1ccc(cc1)COCCOC(C)C)O","InChI=1S/C18H31NO4/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h5-8,14-15,17,19-20H,9-13H2,1-4H3","VHYCDWMUTMEGQY-UHFFFAOYSA-N"
"CC[N+](CC)(Cc1ccccc1)CC(=O)Nc2c(cccc2C)C","InChI=1S/C21H28N2O/c1-5-23(6-2,15-19-13-8-7-9-14-19)16-20(24)22-21-17(3)11-10-12-18(21)4/h7-14H,5-6,15-16H2,1-4H3/p+1","ZFQMTVNLDNXRNQ-UHFFFAOYSA-O"
"CCN(CC)C(=O)c1cccc(c1)C","InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3","MMOXZBCLCQITDF-UHFFFAOYSA-N"
"C1CCC(CC1)(CC(=O)O)CN","InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)","UGJMXCAKCUNAIE-UHFFFAOYSA-N"
"C(=NC(=O)N)(N)N","InChI=1S/C2H6N4O/c3-1(4)6-2(5)7/h(H6,3,4,5,6,7)","SQSPRWMERUQXNE-UHFFFAOYSA-N"
"c1c2c(cc(c1Cl)S(=O)(=O)N)S(=O)(=O)NCN2","InChI=1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)","JZUFKLXOESDKRF-UHFFFAOYSA-N"
"CCN(CC)C/C(=N\c1c(cccc1C)C)/O","InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)","NNJVILVZKWQKPM-UHFFFAOYSA-N"
"CC(C)NCC(COc1ccc(cc1)CCOC)O","InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3","IUBSYMUCCVWXPE-UHFFFAOYSA-N"
"c1ccc(cc1)c2[nH]c3cc(ccc3n2)S(=O)(=O)O","InChI=1S/C13H10N2O3S/c16-19(17,18)10-6-7-11-12(8-10)15-13(14-11)9-4-2-1-3-5-9/h1-8H,(H,14,15)(H,16,17,18)","UVCJGUGAGLDPAA-UHFFFAOYSA-N"
"CC(C)NCC(c1ccc(cc1)NS(=O)(=O)C)O","InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3","ZBMZVLHSJCTVON-UHFFFAOYSA-N"
"C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CCl)O)O)CCl)O)O)Cl)O","InChI=1S/C12H19Cl3O8/c13-1-4-7(17)10(20)12(3-14,22-4)23-11-9(19)8(18)6(15)5(2-16)21-11/h4-11,16-20H,1-3H2/t4-,5-,6+,7-,8+,9-,10+,11-,12+/m1/s1","BAQAVOSOZGMPRM-QBMZZYIRSA-N"
"CN(C)CC1CCCCC1(c2cccc(c2)OC)O","InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3","TVYLLZQTGLZFBW-UHFFFAOYSA-N"
"CN(C)CC(c1ccc(cc1)O)C2(CCCCC2)O","InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3","KYYIDSXMWOZKMP-UHFFFAOYSA-N"
"CCN(CC)Cc1ccccc1","InChI=1S/C11H17N/c1-3-12(4-2)10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3","ZWRDBWDXRLPESY-UHFFFAOYSA-N"
"CCNCC(=O)Nc1c(cccc1C)C","InChI=1S/C12H18N2O/c1-4-13-8-11(15)14-12-9(2)6-5-7-10(12)3/h5-7,13H,4,8H2,1-3H3,(H,14,15)","WRMRXPASUROZGT-UHFFFAOYSA-N"
"CC[N+](CC)(CC(O)=O)CC1=CC=CC=C1","InChI=1S/C13H19NO2/c1-3-14(4-2,11-13(15)16)10-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3/p+1","FCPJMWRSLGIKTQ-UHFFFAOYSA-O"
"[O-1][N+1](=O)c(c4)c(c1)c(c3c4)c(c2cc3)c(ccc2)c1","InChI=1S/C16H9NO2/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H","ALRLPDGCPYIVHP-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(O)c1","InChI=1S/C6H4N2O5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H","UFBJCMHMOXMLKC-UHFFFAOYSA-N"
"Oc(c1)cc(Cl)c(Cl)c1","InChI=1S/C6H4Cl2O/c7-5-2-1-4(9)3-6(5)8/h1-3,9H","WDNBURPWRNALGP-UHFFFAOYSA-N"
"Oc(c1)c(Cl)ccc(Cl)1","InChI=1S/C6H4Cl2O/c7-4-1-2-5(8)6(9)3-4/h1-3,9H","RANCECPPZPIPNO-UHFFFAOYSA-N"
"Clc(c1)c(O)c(Cl)cc1","InChI=1S/C6H4Cl2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H","HOLHYSJJBXSLMV-UHFFFAOYSA-N"
"Oc(c1)c(Cl)c(Cl)cc1","InChI=1S/C6H4Cl2O/c7-4-2-1-3-5(9)6(4)8/h1-3,9H","UMPSXRYVXUPCOS-UHFFFAOYSA-N"
"Oc(c1)c(Cl)cc(Cl)c1","InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H","HFZWRUODUSTPEG-UHFFFAOYSA-N"
"Oc(c1)cc(Cl)cc(Cl)1","InChI=1S/C6H4Cl2O/c7-4-1-5(8)3-6(9)2-4/h1-3,9H","VPOMSPZBQMDLTM-UHFFFAOYSA-N"
"Oc(c1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C6H3Cl3O/c7-3-1-5(9)6(10)2-4(3)8/h1-2,10H","LHJGJYXLEPZJPM-UHFFFAOYSA-N"
"Clc(c1)cc(Cl)c(O)c(Cl)1","InChI=1S/C6H3Cl3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H","LINPIYWFGCPVIE-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(O)ccc1","InChI=1S/C6H5NO3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H","IQUPABOKLQSFBK-UHFFFAOYSA-N"
"Cc(c1)c(O)c(C)cc1","InChI=1S/C8H10O/c1-6-4-3-5-7(2)8(6)9/h3-5,9H,1-2H3","NXXYKOUNUYWIHA-UHFFFAOYSA-N"
"Oc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C6H5NO3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H","RTZZCYNQPHTPPL-UHFFFAOYSA-N"
"Oc(c1)cc(C)c(C)c1","InChI=1S/C8H10O/c1-6-3-4-8(9)5-7(6)2/h3-5,9H,1-2H3","YCOXTKKNXUZSKD-UHFFFAOYSA-N"
"Cc(c1)cc(O)c(C)c1","InChI=1S/C8H10O/c1-6-3-4-7(2)8(9)5-6/h3-5,9H,1-2H3","NKTOLZVEWDHZMU-UHFFFAOYSA-N"
"Cc(c1)c(C)c(O)cc1","InChI=1S/C8H10O/c1-6-4-3-5-8(9)7(6)2/h3-5,9H,1-2H3","QWBBPBRQALCEIZ-UHFFFAOYSA-N"
"Cc(c1)cc(O)cc(C)1","InChI=1S/C8H10O/c1-6-3-7(2)5-8(9)4-6/h3-5,9H,1-2H3","TUAMRELNJMMDMT-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(O)c1","InChI=1S/C8H10O/c1-6-3-4-8(9)7(2)5-6/h3-5,9H,1-2H3","KUFFULVDNCHOFZ-UHFFFAOYSA-N"
"Cc(c1)c(O)ccc1","InChI=1S/C7H8O/c1-6-4-2-3-5-7(6)8/h2-5,8H,1H3","QWVGKYWNOKOFNN-UHFFFAOYSA-N"
"Cc(c1)cc(O)cc1","InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3","RLSSMJSEOOYNOY-UHFFFAOYSA-N"
"Cc(c1)ccc(O)c1","InChI=1S/C7H8O/c1-6-2-4-7(8)5-3-6/h2-5,8H,1H3","IWDCLRJOBJJRNH-UHFFFAOYSA-N"
"Oc(c1)c(Cl)ccc1","InChI=1S/C6H5ClO/c7-5-3-1-2-4-6(5)8/h1-4,8H","ISPYQTSUDJAMAB-UHFFFAOYSA-N"
"Oc(c1)cc(Cl)cc1","InChI=1S/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H","HORNXRXVQWOLPJ-UHFFFAOYSA-N"
"Oc(c1)ccc(Cl)c1","InChI=1S/C6H5ClO/c7-5-1-3-6(8)4-2-5/h1-4,8H","WXNZTHHGJRFXKQ-UHFFFAOYSA-N"
"Oc(c1)cc(O)cc1","InChI=1S/C6H6O2/c7-5-2-1-3-6(8)4-5/h1-4,7-8H","GHMLBKRAJCXXBS-UHFFFAOYSA-N"
"Oc(c1)c(O)ccc1","InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H","YCIMNLLNPGFGHC-UHFFFAOYSA-N"
"CC(=C(N)1)N(C)N(c(c2)cccc2)C(=O)1","InChI=1S/C11H13N3O/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,12H2,1-2H3","RLFWWDJHLFCNIJ-UHFFFAOYSA-N"
"C(C1=4)C(O)CCC(C)1C(C(CC4)3[H])(CCC(C)(C32[H])C(CC2)C(C)CCC(C(C)C)CC)[H]","InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1","KZJWDPNRJALLNS-VJSFXXLFSA-N"
"Clc(c1)c(Cl)ccc1","InChI=1S/C6H4Cl2/c7-5-3-1-2-4-6(5)8/h1-4H","RFFLAFLAYFXFSW-UHFFFAOYSA-N"
"Clc(c1)cc(Cl)cc1","InChI=1S/C6H4Cl2/c7-5-2-1-3-6(8)4-5/h1-4H","ZPQOPVIELGIULI-UHFFFAOYSA-N"
"Clc(c1)ccc(Cl)c1","InChI=1S/C6H4Cl2/c7-5-1-2-6(8)4-3-5/h1-4H","OCJBOOLMMGQPQU-UHFFFAOYSA-N"
"O=C(C1)CCCC1","InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2","JHIVVAPYMSGYDF-UHFFFAOYSA-N"
"OC(C1)CCCC1","InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2","HPXRVTGHNJAIIH-UHFFFAOYSA-N"
"CC(C1)C(=O)CCC1","InChI=1S/C7H12O/c1-6-4-2-3-5-7(6)8/h6H,2-5H2,1H3","LFSAPCRASZRSKS-UHFFFAOYSA-N"
"CC(C1)C(O)CCC1","InChI=1S/C7H14O/c1-6-4-2-3-5-7(6)8/h6-8H,2-5H2,1H3","NDVWOBYBJYUSMF-UHFFFAOYSA-N"
"COC(=O)c(c1)cccc1","InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3","QPJVMBTYPHYUOC-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cccc1","InChI=1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3","MTZQAGJQAFMTAQ-UHFFFAOYSA-N"
"CCCOC(=O)c(c1)cccc1","InChI=1S/C10H12O2/c1-2-8-12-10(11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3","UDEWPOVQBGFNGE-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)cccc1","InChI=1S/C10H12O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3","FEXQDZTYJVXMOS-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)cccc1","InChI=1S/C11H14O2/c1-9(2)8-13-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","KYZHGEFMXZOSJN-UHFFFAOYSA-N"
"CC(C)(C)OC(=O)c(c1)cccc1","InChI=1S/C11H14O2/c1-11(2,3)13-10(12)9-7-5-4-6-8-9/h4-8H,1-3H3","LYDRKKWPKKEMNZ-UHFFFAOYSA-N"
"OC(=O)c(c1)c(C)ccc1","InChI=1S/C8H8O2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3,(H,9,10)","ZWLPBLYKEWSWPD-UHFFFAOYSA-N"
"Cc(c1)cc(cc1)C(O)=O","InChI=1S/C8H8O2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3,(H,9,10)","GPSDUZXPYCFOSQ-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)C(O)=O","InChI=1S/C8H8O2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H,9,10)","LPNBBFKOUUSUDB-UHFFFAOYSA-N"
"COC(=O)c(c1)c(C)ccc1","InChI=1S/C9H10O2/c1-7-5-3-4-6-8(7)9(10)11-2/h3-6H,1-2H3","WVWZECQNFWFVFW-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(C)c1","InChI=1S/C9H10O2/c1-7-3-5-8(6-4-7)9(10)11-2/h3-6H,1-2H3","QSSJZLPUHJDYKF-UHFFFAOYSA-N"
"CCOC(=O)c(c1)c(C)ccc1","InChI=1S/C10H12O2/c1-3-12-10(11)9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3","SOUAXOGPALPTTC-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(C)c1","InChI=1S/C10H12O2/c1-3-12-10(11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3","NWPWRAWAUYIELB-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)c(C)ccc1","InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3","GKOTWEXRHKVLLK-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)ccc(C)c1","InChI=1S/C11H14O2/c1-8(2)13-11(12)10-6-4-9(3)5-7-10/h4-8H,1-3H3","ONWRVKPIVJMSHO-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)c(C)ccc1","InChI=1S/C12H16O2/c1-3-4-9-14-12(13)11-8-6-5-7-10(11)2/h5-8H,3-4,9H2,1-2H3","GALQLODNTKQGFE-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)cc(C)cc1","InChI=1S/C12H16O2/c1-3-4-8-14-12(13)11-7-5-6-10(2)9-11/h5-7,9H,3-4,8H2,1-2H3","KECCQYFSODJESB-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)ccc(C)c1","InChI=1S/C12H16O2/c1-3-4-9-14-12(13)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3","UYGHRCCJWWYXMY-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(C)ccc1","InChI=1S/C12H16O2/c1-9(2)8-14-12(13)11-7-5-4-6-10(11)3/h4-7,9H,8H2,1-3H3","WBNOXPDHXZDLCY-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(C)c1","InChI=1S/C12H16O2/c1-9(2)8-14-12(13)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3","IELVQABKIBOBRG-UHFFFAOYSA-N"
"CCCCCOC(=O)c(c1)c(C)ccc1","InChI=1S/C13H18O2/c1-3-4-7-10-15-13(14)12-9-6-5-8-11(12)2/h5-6,8-9H,3-4,7,10H2,1-2H3","YMAHRBGBVUOIMQ-UHFFFAOYSA-N"
"CCCCCOC(=O)c(c1)ccc(C)c1","InChI=1S/C13H18O2/c1-3-4-5-10-15-13(14)12-8-6-11(2)7-9-12/h6-9H,3-5,10H2,1-2H3","FXPYVDXLZGLQKU-UHFFFAOYSA-N"
"CC(C)CCOC(=O)c(c1)c(C)ccc1","InChI=1S/C13H18O2/c1-10(2)8-9-15-13(14)12-7-5-4-6-11(12)3/h4-7,10H,8-9H2,1-3H3","ZMSLAZFPMYEGIT-UHFFFAOYSA-N"
"CC(C)CCOC(=O)c(c1)ccc(C)c1","InChI=1S/C13H18O2/c1-10(2)8-9-15-13(14)12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3","WDNOGGRIGNCXKH-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(C)OC(=O)c(c1)c(C)ccc1","InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i1D3","GKOTWEXRHKVLLK-FIBGUPNXSA-N"
"[2H]C(C)(C)OC(=O)c(c1)c(C)ccc1","InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i8D","GKOTWEXRHKVLLK-BNEYPBHNSA-N"
"[2H]C([2H])([2H])C(C([2H])([2H])[2H])OC(=O)c(c1)c(C)ccc1","InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i1D3,2D3","GKOTWEXRHKVLLK-WFGJKAKNSA-N"
"[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])OC(=O)c(c1)c(C)ccc1","InChI=1S/C11H14O2/c1-8(2)13-11(12)10-7-5-4-6-9(10)3/h4-8H,1-3H3/i1D3,2D3,8D","GKOTWEXRHKVLLK-UNAVHCQLSA-N"
"COC(=O)c(c1)c(O)ccc1","InChI=1S/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H3","OSWPMRLSEDHDFF-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(O)cc1","InChI=1S/C8H8O3/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5,9H,1H3","YKUCHDXIBAQWSF-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(O)c1","InChI=1S/C8H8O3/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5,9H,1H3","LXCFILQKKLGQFO-UHFFFAOYSA-N"
"CCOC(=O)c(c1)c(O)ccc1","InChI=1S/C9H10O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6,10H,2H2,1H3","GYCKQBWUSACYIF-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(O)c1","InChI=1S/C9H10O3/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6,10H,2H2,1H3","NUVBSKCKDOMJSU-UHFFFAOYSA-N"
"CCCOC(=O)c(c1)c(O)ccc1","InChI=1S/C10H12O3/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h3-6,11H,2,7H2,1H3","LZFIOSVZIQOVFW-UHFFFAOYSA-N"
"CCCOC(=O)c(c1)ccc(O)c1","InChI=1S/C10H12O3/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6,11H,2,7H2,1H3","QELSKZZBTMNZEB-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)c(O)ccc1","InChI=1S/C10H12O3/c1-7(2)13-10(12)8-5-3-4-6-9(8)11/h3-7,11H,1-2H3","YEULQIJMIOWCHB-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)ccc(O)c1","InChI=1S/C10H12O3/c1-7(2)13-10(12)8-3-5-9(11)6-4-8/h3-7,11H,1-2H3","CMHMMKSPYOOVGI-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)c(O)ccc1","InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7,12H,2-3,8H2,1H3","YFDUWSBGVPBWKF-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)ccc(O)c1","InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3","QFOHBWFCKVYLES-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(O)ccc1","InChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8,12H,7H2,1-2H3","PTXDBYSCVQQBNF-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(O)c1","InChI=1S/C11H14O3/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8,12H,7H2,1-2H3","XPJVKCRENWUEJH-UHFFFAOYSA-N"
"CC(C)CCOC(=O)c(c1)c(O)ccc1","InChI=1S/C12H16O3/c1-9(2)7-8-15-12(14)10-5-3-4-6-11(10)13/h3-6,9,13H,7-8H2,1-2H3","PMGCQNGBLMMXEW-UHFFFAOYSA-N"
"COC(=O)c(c1)c(N)ccc1","InChI=1S/C8H9NO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,9H2,1H3","VAMXMNNIEUEQDV-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(N)c1","InChI=1S/C8H9NO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,9H2,1H3","LZXXNPOYQCLXRS-UHFFFAOYSA-N"
"CCOC(=O)c(c1)c(N)ccc1","InChI=1S/C9H11NO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2,10H2,1H3","TWLLPUMZVVGILS-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(N)c1","InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3","BLFLLBZGZJTVJG-UHFFFAOYSA-N"
"Cc(c1)c(I)ccc1","InChI=1S/C7H7I/c1-6-4-2-3-5-7(6)8/h2-5H,1H3","RINOYHWVBUKAQE-UHFFFAOYSA-N"
"Cc(c1)cc(I)cc1","InChI=1S/C7H7I/c1-6-3-2-4-7(8)5-6/h2-5H,1H3","VLCPISYURGTGLP-UHFFFAOYSA-N"
"Cc(c1)ccc(I)c1","InChI=1S/C7H7I/c1-6-2-4-7(8)5-3-6/h2-5H,1H3","UDHAWRUAECEBHC-UHFFFAOYSA-N"
"COC(=O)CNC(C)=O","InChI=1S/C5H9NO3/c1-4(7)6-3-5(8)9-2/h3H2,1-2H3,(H,6,7)","RFNODQARGNZURK-UHFFFAOYSA-N"
"COC(=O)C([H])(C)NC(C)=O","InChI=1S/C6H11NO3/c1-4(6(9)10-3)7-5(2)8/h4H,1-3H3,(H,7,8)/t4-/m1/s1","FQGVVDYNRHNTCK-SCSAIBSYSA-N"
"CCC([H])(C)C([H])(NC(C)=O)C(=O)OC","InChI=1S/C9H17NO3/c1-5-6(2)8(9(12)13-4)10-7(3)11/h6,8H,5H2,1-4H3,(H,10,11)/t6-,8-/m0/s1","JPQWQTHLAKUOOA-XPUUQOCRSA-N"
"COC(=O)C([H])(NC(C)=O)C(C)C","InChI=1S/C8H15NO3/c1-5(2)7(8(11)12-4)9-6(3)10/h5,7H,1-4H3,(H,9,10)/t7-/m0/s1","KCHNPFJMSOGXIT-ZETCQYMHSA-N"
"COC(=O)C([H])(CC(C)C)NC(C)=O","InChI=1S/C9H17NO3/c1-6(2)5-8(9(12)13-4)10-7(3)11/h6,8H,5H2,1-4H3,(H,10,11)/t8-/m1/s1","IIGAKARAJMXVOZ-MRVPVSSYSA-N"
"COC(=O)C([H])(CO)NC(C)=O","InChI=1S/C6H11NO4/c1-4(9)7-5(3-8)6(10)11-2/h5,8H,3H2,1-2H3,(H,7,9)/t5-/m1/s1","ONUNDAQVOOLWTH-RXMQYKEDSA-N"
"COC(=O)C([H])(CCSC)NC(C)=O","InChI=1S/C8H15NO3S/c1-6(10)9-7(4-5-13-3)8(11)12-2/h7H,4-5H2,1-3H3,(H,9,10)/t7-/m1/s1","YVMKSJIMTATAAS-SSDOTTSWSA-N"
"COC(=O)C([H])(NC(C)=O)Cc(c1)cccc1","InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14)/t11-/m1/s1","IKGHIFGXPVLPFD-LLVKDONJSA-N"
"CCOC(=O)CCC([H])(NC(C)=O)C(=O)OCC","InChI=1S/C11H19NO5/c1-4-16-10(14)7-6-9(12-8(3)13)11(15)17-5-2/h9H,4-7H2,1-3H3,(H,12,13)/t9-/m1/s1","FBAOQDIATMHNAD-SECBINFHSA-N"
"CCOC(=O)CC([H])(NC(C)=O)C(=O)OCC","InChI=1S/C10H17NO5/c1-4-15-9(13)6-8(11-7(3)12)10(14)16-5-2/h8H,4-6H2,1-3H3,(H,11,12)/t8-/m0/s1","XQGDGRNHLJLQOV-QMMMGPOBSA-N"
"COC(=O)CCC([H])(NC(C)=O)C(=O)OC","InChI=1S/C9H15NO5/c1-6(11)10-7(9(13)15-3)4-5-8(12)14-2/h7H,4-5H2,1-3H3,(H,10,11)/t7-/m1/s1","KAUXXCKARJMDIG-SSDOTTSWSA-N"
"COC(=O)CC([H])(NC(C)=O)C(=O)OC","InChI=1S/C8H13NO5/c1-5(10)9-6(8(12)14-3)4-7(11)13-2/h6H,4H2,1-3H3,(H,9,10)/t6-/m0/s1","VRPXVQSXUIFMKQ-LURJTMIESA-N"
"O=C(C1)NCC(=O)N1","InChI=1S/C4H6N2O2/c7-3-1-5-4(8)2-6-3/h1-2H2,(H,5,8)(H,6,7)","BXRNXXXXHLBUKK-UHFFFAOYSA-N"
"CC(N1)C(=O)NC(C)C(=O)1","InChI=1S/C6H10N2O2/c1-3-5(9)8-4(2)6(10)7-3/h3-4H,1-2H3,(H,7,10)(H,8,9)","WWISPHBAYBECQZ-UHFFFAOYSA-N"
"CC(C)C(N1)C(=O)NCC(=O)1","InChI=1S/C7H12N2O2/c1-4(2)6-7(11)8-3-5(10)9-6/h4,6H,3H2,1-2H3,(H,8,11)(H,9,10)","IULFBTHVPRNQCG-UHFFFAOYSA-N"
"CC(C)CC(N1)C(=O)NCC(=O)1","InChI=1S/C8H14N2O2/c1-5(2)3-6-8(12)9-4-7(11)10-6/h5-6H,3-4H2,1-2H3,(H,9,12)(H,10,11)","VQFHWKRNHGHZTK-UHFFFAOYSA-N"
"CC(N1)C(=O)NCC(=O)1","InChI=1S/C5H8N2O2/c1-3-5(9)6-2-4(8)7-3/h3H,2H2,1H3,(H,6,9)(H,7,8)","ICCHEGCKVBMSTF-UHFFFAOYSA-N"
"CC(C)C(N1)C(=O)NC(C)C(=O)1","InChI=1S/C8H14N2O2/c1-4(2)6-8(12)9-5(3)7(11)10-6/h4-6H,1-3H3,(H,9,12)(H,10,11)","ORLDMMKUTCCBSM-UHFFFAOYSA-N"
"COC(=O)CNC(=O)C([H])(C)NC(=O)C([H])(NC(C)=O)C(C)C","InChI=1S/C13H23N3O5/c1-7(2)11(16-9(4)17)13(20)15-8(3)12(19)14-6-10(18)21-5/h7-8,11H,6H2,1-5H3,(H,14,19)(H,15,20)(H,16,17)/t8-,11-/m0/s1","LISVXPDUUDDSQY-KWQFWETISA-N"
"COC(=O)C([H])(C)NC(=O)CNC(=O)C([H])(NC(C)=O)C(C)C","InChI=1S/C13H23N3O5/c1-7(2)11(16-9(4)17)12(19)14-6-10(18)15-8(3)13(20)21-5/h7-8,11H,6H2,1-5H3,(H,14,19)(H,15,18)(H,16,17)/t8-,11-/m0/s1","YJRCHSYSXSJNIJ-KWQFWETISA-N"
"COC(=O)CNC(=O)C([H])(CC(C)C)NC(=O)C([H])(NC(C)=O)C(C)C","InChI=1S/C16H29N3O5/c1-9(2)7-12(15(22)17-8-13(21)24-6)19-16(23)14(10(3)4)18-11(5)20/h9-10,12,14H,7-8H2,1-6H3,(H,17,22)(H,18,20)(H,19,23)/t12-,14-/m0/s1","KGIAKTQRGZGRTM-JSGCOSHPSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(CC(C)C)NC(=O)C([H])(NC(C)=O)C(C)C","InChI=1S/C17H31N3O5/c1-9(2)8-13(15(22)18-11(5)17(24)25-7)20-16(23)14(10(3)4)19-12(6)21/h9-11,13-14H,8H2,1-7H3,(H,18,22)(H,19,21)(H,20,23)/t11-,13-,14-/m0/s1","BIVNJYGJTYZEIL-UBHSHLNASA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(Cc(c1)cccc1)NC(=O)C([H])(NC(C)=O)C(C)C","InChI=1S/C20H29N3O5/c1-12(2)17(22-14(4)24)19(26)23-16(11-15-9-7-6-8-10-15)18(25)21-13(3)20(27)28-5/h6-10,12-13,16-17H,11H2,1-5H3,(H,21,25)(H,22,24)(H,23,26)/t13-,16+,17+/m0/s1","ZDXDAKFLQBLHBZ-IAOVAPTHSA-N"
"COC(=O)CNC(=O)C([H])(NC(=O)CNC(C)=O)Cc(c1)cccc1","InChI=1S/C16H21N3O5/c1-11(20)17-9-14(21)19-13(8-12-6-4-3-5-7-12)16(23)18-10-15(22)24-2/h3-7,13H,8-10H2,1-2H3,(H,17,20)(H,18,23)(H,19,21)/t13-/m1/s1","ZTAIDJDGBMPCMR-CYBMUJFWSA-N"
"COC(=O)CNC(=O)C([H])(Cc(c1)cccc1)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C17H23N3O5/c1-11(19-12(2)21)16(23)20-14(9-13-7-5-4-6-8-13)17(24)18-10-15(22)25-3/h4-8,11,14H,9-10H2,1-3H3,(H,18,24)(H,19,21)(H,20,23)/t11-,14-/m1/s1","YJHFROAAFUSFCE-BXUZGUMPSA-N"
"CC(=O)NCC(=O)NC([H])(Cc(c1)cccc1)C(=O)NC([H])(C)C(=O)OC","InChI=1S/C17H23N3O5/c1-11(17(24)25-3)19-16(23)14(9-13-7-5-4-6-8-13)20-15(22)10-18-12(2)21/h4-8,11,14H,9-10H2,1-3H3,(H,18,21)(H,19,23)(H,20,22)/t11-,14+/m0/s1","RTYWHWDOFGCNND-SMDDNHRTSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(Cc(c1)cccc1)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C18H25N3O5/c1-11(19-13(3)22)16(23)21-15(10-14-8-6-5-7-9-14)17(24)20-12(2)18(25)26-4/h5-9,11-12,15H,10H2,1-4H3,(H,19,22)(H,20,24)(H,21,23)/t11-,12-,15+/m0/s1","VYQSQZHRINOMNA-SLEUVZQESA-N"
"CCOC(=O)CNC(=O)C([H])(CCSC)NC(=O)CNC(C)=O","InChI=1S/C13H23N3O5S/c1-4-21-12(19)8-15-13(20)10(5-6-22-3)16-11(18)7-14-9(2)17/h10H,4-8H2,1-3H3,(H,14,17)(H,15,20)(H,16,18)/t10-/m1/s1","HHRQOICKOIKRLM-SNVBAGLBSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(CC(C)C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C15H27N3O5/c1-8(2)7-12(14(21)17-10(4)15(22)23-6)18-13(20)9(3)16-11(5)19/h8-10,12H,7H2,1-6H3,(H,16,19)(H,17,21)(H,18,20)/t9-,10-,12+/m0/s1","AUAGMYCQABLHDY-JBLDHEPKSA-N"
"COC(=O)CNC(=O)C([H])(CC(C)C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C14H25N3O5/c1-8(2)6-11(14(21)15-7-12(19)22-5)17-13(20)9(3)16-10(4)18/h8-9,11H,6-7H2,1-5H3,(H,15,21)(H,16,18)(H,17,20)/t9-,11+/m0/s1","YKEYCFCGBQCOIK-GXSJLCMTSA-N"
"CC(=O)NCC(=O)NC([H])(CC(C)C)C(=O)NC([H])(C)C(=O)OC","InChI=1S/C14H25N3O5/c1-8(2)6-11(17-12(19)7-15-10(4)18)13(20)16-9(3)14(21)22-5/h8-9,11H,6-7H2,1-5H3,(H,15,18)(H,16,20)(H,17,19)/t9-,11+/m0/s1","ZHBQZAHXYOMCDR-GXSJLCMTSA-N"
"COC(=O)CNC(=O)C([H])(C(C)C)NC(=O)CNC(C)=O","InChI=1S/C12H21N3O5/c1-7(2)11(12(19)14-6-10(18)20-4)15-9(17)5-13-8(3)16/h7,11H,5-6H2,1-4H3,(H,13,16)(H,14,19)(H,15,17)/t11-/m1/s1","XAHIQDXYCYBQRT-LLVKDONJSA-N"
"COC(=O)CNC(=O)C([H])(C(C)C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C13H23N3O5/c1-7(2)11(13(20)14-6-10(18)21-5)16-12(19)8(3)15-9(4)17/h7-8,11H,6H2,1-5H3,(H,14,20)(H,15,17)(H,16,19)/t8-,11+/m0/s1","UEGJWOSKZCVBFS-GZMMTYOYSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(C(C)C)NC(=O)CNC(C)=O","InChI=1S/C13H23N3O5/c1-7(2)11(16-10(18)6-14-9(4)17)12(19)15-8(3)13(20)21-5/h7-8,11H,6H2,1-5H3,(H,14,17)(H,15,19)(H,16,18)/t8-,11+/m0/s1","ODXCZVQCPDKJQW-GZMMTYOYSA-N"
"OCC=C(C)CCC=C(C)C","InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+","GLZPCOQZEFWAFX-JXMROGBWSA-N"
"OCC=C(C)CCC=C(C)C","InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7-","GLZPCOQZEFWAFX-YFHOEESVSA-N"
"O=CC=C(C)CCC=C(C)C","InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+","WTEVQBCEXWBHNA-JXMROGBWSA-N"
"O=CC=C(C)CCC=C(C)C","InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7-","WTEVQBCEXWBHNA-YFHOEESVSA-N"
"N#CC=C(C)CCC=C(C)C","InChI=1S/C10H15N/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6H2,1-3H3/b10-7+","HLCSDJLATUNSSI-JXMROGBWSA-N"
"N#CC=C(C)CCC=C(C)C","InChI=1S/C10H15N/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6H2,1-3H3/b10-7-","HLCSDJLATUNSSI-YFHOEESVSA-N"
"CC(=O)OC([H])(C1)C([H])(CCC1)C(C)(C)C","InChI=1S/C12H22O2/c1-9(13)14-11-8-6-5-7-10(11)12(2,3)4/h10-11H,5-8H2,1-4H3/t10-,11+/m0/s1","FINOAUDUYKVGDS-WDEREUQCSA-N"
"CC(=O)OC([H])(C1)C([H])(CCC1)C(C)(C)C","InChI=1S/C12H22O2/c1-9(13)14-11-8-6-5-7-10(11)12(2,3)4/h10-11H,5-8H2,1-4H3/t10-,11-/m1/s1","FINOAUDUYKVGDS-GHMZBOCLSA-N"
"CC(=O)OC([H])(C1)CCC([H])(C1)C(C)(C)C","InChI=1S/C12H22O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h10-11H,5-8H2,1-4H3/t10-,11+","MBZRJSQZCBXRGK-PHIMTYICSA-N"
"CC(=O)OC([H])(C1)CCC([H])(C1)C(C)(C)C","InChI=1S/C12H22O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h10-11H,5-8H2,1-4H3/t10-,11-","MBZRJSQZCBXRGK-XYPYZODXSA-N"
"[H]C(C2)(C1)C([H])(CCC2)CCC1","InChI=1S/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2/t9-,10-","NNBZCPXTIHJBJL-MGCOHNPYSA-N"
"[H]C(C2)(C1)C([H])(CCC2)CCC1","InChI=1S/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2","NNBZCPXTIHJBJL-UHFFFAOYSA-N"
"O=C(C1)C([H])(C2)C([H])(CCC2)CC1","InChI=1S/C10H16O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h8-9H,1-7H2/t8-,9+/m0/s1","AFEFRXAPJRCTOW-DTWKUNHWSA-N"
"C1CC[C@H]2CC(=O)CC[C@H]2C1","InChI=1S/C10H16O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-9H,1-7H2/t8-,9+/m1/s1","LGVJRKCQQHOWAU-BDAKNGLRSA-N"
"[H]C(C2)(C1)C([H])(CCC2)CC1","InChI=1S/C9H16/c1-2-5-9-7-3-6-8(9)4-1/h8-9H,1-7H2/t8-,9-/m1/s1","BNRNAKTVFSZAFA-RKDXNWHRSA-N"
"[H]C(C2)(C1)C([H])(CCC2)CC1","InChI=1S/C9H16/c1-2-5-9-7-3-6-8(9)4-1/h8-9H,1-7H2/t8-,9+","BNRNAKTVFSZAFA-DTORHVGOSA-N"
"C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O","InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1","CWVRJTMFETXNAD-JUHZACGLSA-N"
"CC(O1)C1C(=O)C(O)(C(C)3)C(O)C(C(O)4)(O2)C(C(=O)c(c5)c(c(O)cc5)4)(C(O)3)2","InChI=1S/C19H20O9/c1-6-12(21)18-13(22)8-4-3-5-9(20)10(8)14(23)19(18,28-18)16(25)17(6,26)15(24)11-7(2)27-11/h3-7,11-12,14,16,20-21,23,25-26H,1-2H3","ZGZVMKCZHDIFQA-UHFFFAOYSA-N"
"O=C(C4)OC([H])(C([H])41)c(c(=O)2)c(c(=O)c(c(O)3)c(ccc3)2)C([H])(C)O1","InChI=1S/C16H12O6/c1-6-11-13(16-9(21-6)5-10(18)22-16)14(19)7-3-2-4-8(17)12(7)15(11)20/h2-4,6,9,16-17H,5H2,1H3/t6-,9-,16+/m1/s1","XUWPJKDMEZSVTP-LTYMHZPRSA-N"
"c(c16)(cc(C=7[H])c(C(N(C7C)N)=O)c(O)6)CC([H])(O5)c(c4OC5)c(c(O)c(c43)C(=O)C(C2([H])O)=C(O3)C(OC)(CC2)[H])1","InChI=1S/C27H24N2O9/c1-9-5-10-6-11-7-14-18-19(15(11)21(31)16(10)27(34)29(9)28)23(33)20-22(32)17-12(30)3-4-13(35-2)24(17)38-26(20)25(18)37-8-36-14/h5-6,12-14,30-31,33H,3-4,7-8,28H2,1-2H3/t12-,13+,14+/m0/s1","PUQUSQASXBNKCW-BFHYXJOUSA-N"
"[H]C(O)(C(OC)7[H])C([H])(C)OC(C7([H])O)(OC([H])(C([H])(O)1)C(Oc(c25)cccc(c(O)c(c64)C(Oc(c36)ccc(c3C(=O)Oc45)C)=O)2)(OC([H])(C)C1([H])O)[H])[H]","InChI=1S/C32H32O14/c1-10-8-9-15-18-16(10)29(38)45-26-17-13(23(35)20(19(18)26)30(39)43-15)6-5-7-14(17)44-32-28(24(36)21(33)11(2)42-32)46-31-25(37)27(40-4)22(34)12(3)41-31/h5-9,11-12,21-22,24-25,27-28,31-37H,1-4H3","PONPPNYZKHNPKZ-UHFFFAOYSA-N"
"C(C=1)(OC(C2C)([H])C(C)C(OC2(O3)CCC(C)C3([H])CC(C)O)(CCC([H])(CC)C=CC=CCC(C(O)C(C)(O)C(=O)C(C(O)C(C(C(C(O)C(C1)C)C)=O)C)C)C)[H])=O","InChI=1S/C45H74O11/c1-12-34-17-15-13-14-16-27(4)42(51)44(11,53)43(52)32(9)40(50)31(8)39(49)30(7)38(48)26(3)18-21-37(47)54-41-29(6)35(20-19-34)55-45(33(41)10)23-22-25(2)36(56-45)24-28(5)46/h13-15,17-18,21,25-36,38,40-42,46,48,50-51,53H,12,16,19-20,22-24H2,1-11H3/b14-13+,17-15+,21-18+/t25-,26-,27+,28-,29+,30+,31-,32-,33-,34-,35-,36-,38+,40+,41+,42+,44+,45-/m1/s1","MNULEGDCPYONBU-MAOZEBSWSA-N"
"O=C(C(C)=O)NCC(N52)(c(c1=O)c(CC2(C(c34)(N(C)C(C5([H])C#N)([H])Cc3c(c(c(OC)c4=O)C)=O)[H])[H])c(c(c(OC)1)C)=O)[H]","InChI=1S/C29H30N4O8/c1-11-23(35)14-8-17-22-21-15(24(36)12(2)28(41-6)26(21)38)7-16(32(22)4)18(9-30)33(17)19(10-31-29(39)13(3)34)20(14)25(37)27(11)40-5/h16-19,22H,7-8,10H2,1-6H3,(H,31,39)/t16?,17-,18-,19-,22?/m0/s1","JNEGMBHBUAJRSX-KRPZRDOVSA-N"
"CC1=C(C(=O)C2=C(C1=O)C[C@@H]3CN4[C@H]([C@H]2N3C)CC5=C([C@@H]4CNC(=O)C(=O)C)C(=O)C(=C(C5=O)C)OC)OC","InChI=1S/C28H31N3O8/c1-11-22(33)15-7-14-10-31-17(21(30(14)4)20(15)25(36)27(11)39-6)8-16-19(18(31)9-29-28(37)13(3)32)24(35)26(38-5)12(2)23(16)34/h14,17-18,21H,7-10H2,1-6H3,(H,29,37)/t14-,17+,18+,21-/m1/s1","KOHPLTGVBZMVDW-BBTHKVSRSA-N"
"CN(C(=O)1)C([H])(CC(C)C)C(=O)OC(C(N(C)C([H])(CC(C)C)C(=O)OC(C(N(C)C([H])(CC(C)C)C(=O)OC1(C(C)C)[H])=O)(C(C)C)[H])=O)(C(C)C)[H]","InChI=1S/C36H63N3O9/c1-19(2)16-25-34(43)46-29(23(9)10)32(41)38(14)27(18-21(5)6)36(45)48-30(24(11)12)33(42)39(15)26(17-20(3)4)35(44)47-28(22(7)8)31(40)37(25)13/h19-30H,16-18H2,1-15H3/t25-,26-,27-,28+,29+,30+/m0/s1","WICJNWLMJRLFKQ-NHODMIADSA-N"
"c(c7)c(C12O)c(cc7O)OC(C(=O)c(c(O)3)c(cc(O)c3C(C4C(=O)c(c6)c(O)cc(c6)O)C=C(C)CC4c(c5O)ccc(O)c5)O2)1CC=C(C)C","InChI=1S/C40H36O12/c1-18(2)10-11-39-38(49)35-32(52-40(39,50)27-9-6-22(43)16-31(27)51-39)17-30(46)34(37(35)48)26-13-19(3)12-25(23-7-4-20(41)14-28(23)44)33(26)36(47)24-8-5-21(42)15-29(24)45/h4-10,13-17,25-26,33,41-46,48,50H,11-12H2,1-3H3","SUOXGDJCEWTZIZ-UHFFFAOYSA-N"
"c(c1)c(cc(o2)c1cc2c(c6)cc(c(c6O)C(C3C(=O)c(c5O)ccc(c5CC=C(C)C)O)C=C(CC(c(c(O)4)ccc(O)c4)3)C)O)O","InChI=1S/C39H36O9/c1-19(2)4-8-26-30(42)11-10-27(38(26)46)39(47)36-28(25-9-7-23(40)17-31(25)43)12-20(3)13-29(36)37-32(44)14-22(15-33(37)45)34-16-21-5-6-24(41)18-35(21)48-34/h4-7,9-11,13-18,28-29,36,40-46H,8,12H2,1-3H3","SEHVRKPXIDOTRX-UHFFFAOYSA-N"
"CC(C)=CCc(c(O)3)c(O)cc(c3)c(o1)c([H])c(c2)c(cc(O)c2)1","InChI=1S/C19H18O4/c1-11(2)3-6-15-16(21)7-13(8-17(15)22)18-9-12-4-5-14(20)10-19(12)23-18/h3-5,7-10,20-22H,6H2,1-2H3","ZTGHWUWBQNCCOH-UHFFFAOYSA-N"
"CC(C)=CCc(c(O)3)c(O1)c(c(O)c3)C(=O)C(CC=C(C)C)=C(c(c2)c(O)cc(O)c2)1","InChI=1S/C25H26O6/c1-13(2)5-8-17-20(28)12-21(29)22-23(30)18(9-6-14(3)4)24(31-25(17)22)16-10-7-15(26)11-19(16)27/h5-7,10-12,26-29H,8-9H2,1-4H3","UWQYBLOHTQWSQD-UHFFFAOYSA-N"
"c(c6)(cc(c(c6)C(C(C1(c(c5)c(O)cc(O)c5)[H])([H])C(c(c32)c(cc(c2C(C(=C(c(c4)c(O)cc(O)c4)O3)CC=C(C)C)=O)O)O)C=C(C)C1)=O)O)O","InChI=1S/C40H36O11/c1-18(2)4-8-26-38(50)36-33(48)17-32(47)35(40(36)51-39(26)25-11-7-22(43)16-31(25)46)28-13-19(3)12-27(23-9-5-20(41)14-29(23)44)34(28)37(49)24-10-6-21(42)15-30(24)45/h4-7,9-11,13-17,27-28,34,41-48H,8,12H2,1-3H3/t27-,28-,34-/m1/s1","APPXYONGBIXGRO-QPFJYYDMSA-N"
"CC(=O)OCCN(C(C)=O)C(C)=O","InChI=1S/C8H13NO4/c1-6(10)9(7(2)11)4-5-13-8(3)12/h4-5H2,1-3H3","SXAOEDBWUOCFAT-UHFFFAOYSA-N"
"O=Cc(c1)c(C)ccc1","InChI=1S/C8H8O/c1-7-4-2-3-5-8(7)6-9/h2-6H,1H3","BTFQKIATRPGRBS-UHFFFAOYSA-N"
"O=Cc(c1)cc(C)cc1","InChI=1S/C8H8O/c1-7-3-2-4-8(5-7)6-9/h2-6H,1H3","OVWYEQOVUDKZNU-UHFFFAOYSA-N"
"O=Cc(c1)ccc(C)c1","InChI=1S/C8H8O/c1-7-2-4-8(6-9)5-3-7/h2-6H,1H3","FXLOVSHXALFLKQ-UHFFFAOYSA-N"
"Cc(c1)c(Br)ccc1","InChI=1S/C7H7Br/c1-6-4-2-3-5-7(6)8/h2-5H,1H3","QSSXJPIWXQTSIX-UHFFFAOYSA-N"
"Cc(c1)cc(Br)cc1","InChI=1S/C7H7Br/c1-6-3-2-4-7(8)5-6/h2-5H,1H3","WJIFKOVZNJTSGO-UHFFFAOYSA-N"
"Cc(c1)ccc(Br)c1","InChI=1S/C7H7Br/c1-6-2-4-7(8)5-3-6/h2-5H,1H3","ZBTMRBYMKUEVEU-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)ccc(N)c1","InChI=1S/C10H13NO2/c1-7(2)13-10(12)8-3-5-9(11)6-4-8/h3-7H,11H2,1-2H3","JWCPZKNBPMSYND-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)c(N)ccc1","InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-6-4-5-7-10(9)12/h4-7H,2-3,8,12H2,1H3","HUIYGGQINIVDNW-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(N)c1","InChI=1S/C11H15NO2/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8H,7,12H2,1-2H3","PUYOAVGNCWPANW-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(N)ccc1","InChI=1S/C11H15NO2/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8H,7,12H2,1-2H3","ILCLJQFCMRCPNM-UHFFFAOYSA-N"
"CCCCCOC(=O)c(c1)c(N)ccc1","InChI=1S/C12H17NO2/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7-8H,2-3,6,9,13H2,1H3","JCKCYPSMCQDSHT-UHFFFAOYSA-N"
"Cc(c1)c(Cl)ccc1","InChI=1S/C7H7Cl/c1-6-4-2-3-5-7(6)8/h2-5H,1H3","IBSQPLPBRSHTTG-UHFFFAOYSA-N"
"Cc(c1)cc(Cl)cc1","InChI=1S/C7H7Cl/c1-6-3-2-4-7(8)5-6/h2-5H,1H3","OSOUNOBYRMOXQQ-UHFFFAOYSA-N"
"Cc(c1)ccc(Cl)c1","InChI=1S/C7H7Cl/c1-6-2-4-7(8)5-3-6/h2-5H,1H3","NPDACUSDTOMAMK-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(F)ccc1","InChI=1S/C11H13FO2/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8H,7H2,1-2H3","KQJFKNAUYPTSIY-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(Cl)ccc1","InChI=1S/C11H13ClO2/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8H,7H2,1-2H3","BESGEXPDWNNBJA-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(Br)ccc1","InChI=1S/C11H13BrO2/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8H,7H2,1-2H3","SCIFVEGBPQFBFK-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(I)ccc1","InChI=1S/C11H13IO2/c1-8(2)7-14-11(13)9-5-3-4-6-10(9)12/h3-6,8H,7H2,1-2H3","IZXVGIVNILXQPP-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(F)c1","InChI=1S/C11H13FO2/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3","IGYANOACLVBRGX-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(Cl)c1","InChI=1S/C11H13ClO2/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3","BWLDEQAGSZRTIV-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(Br)c1","InChI=1S/C11H13BrO2/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3","NQPBBLSKHPOXEU-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(I)c1","InChI=1S/C11H13IO2/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3","RIZYPRZSPFNPBR-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(O)cc1","InChI=1S/C9H10O3/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6,10H,2H2,1H3","MWSMNBYIEBRXAL-UHFFFAOYSA-N"
"CC(=O)c(c1)c(C)ccc1","InChI=1S/C9H10O/c1-7-5-3-4-6-9(7)8(2)10/h3-6H,1-2H3","YXWWHNCQZBVZPV-UHFFFAOYSA-N"
"CC(=O)c(c1)cc(C)cc1","InChI=1S/C9H10O/c1-7-4-3-5-9(6-7)8(2)10/h3-6H,1-2H3","FSPSELPMWGWDRY-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)C(C)=O","InChI=1S/C9H10O/c1-7-3-5-9(6-4-7)8(2)10/h3-6H,1-2H3","GNKZMNRKLCTJAY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(C)ccc1","InChI=1S/C7H7NO2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3","PLAZTCDQAHEYBI-UHFFFAOYSA-N"
"Cc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3","QZYHIOPPLUPUJF-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C7H7NO2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3","ZPTVNYMJQHSSEA-UHFFFAOYSA-N"
"ClCc(c1)cccc1","InChI=1S/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H2","KCXMKQUNVWSEMD-UHFFFAOYSA-N"
"COCc(c1)cccc1","InChI=1S/C8H10O/c1-9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3","GQKZBCPTCWJTAS-UHFFFAOYSA-N"
"COc(c1)c(C)ccc1","InChI=1S/C8H10O/c1-7-5-3-4-6-8(7)9-2/h3-6H,1-2H3","DTFKRVXLBCAIOZ-UHFFFAOYSA-N"
"COc(c1)cc(C)cc1","InChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3","OSIGJGFTADMDOB-UHFFFAOYSA-N"
"Cc(c1)c(C)ccc1","InChI=1S/C8H10/c1-7-5-3-4-6-8(7)2/h3-6H,1-2H3","CTQNGGLPUBDAKN-UHFFFAOYSA-N"
"Cc(c1)cc(C)cc1","InChI=1S/C8H10/c1-7-4-3-5-8(2)6-7/h3-6H,1-2H3","IVSZLXZYQVIEFR-UHFFFAOYSA-N"
"Cc(c1)ccc(C)c1","InChI=1S/C8H10/c1-7-3-5-8(2)6-4-7/h3-6H,1-2H3","URLKBWYHVLBVBO-UHFFFAOYSA-N"
"N#Cc(c1)cc(C)cc1","InChI=1S/C8H7N/c1-7-3-2-4-8(5-7)6-9/h2-5H,1H3","BOHCMQZJWOGWTA-UHFFFAOYSA-N"
"N#Cc(c1)ccc(C)c1","InChI=1S/C8H7N/c1-7-2-4-8(6-9)5-3-7/h2-5H,1H3","VCZNNAKNUVJVGX-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(N)ccc1","InChI=1S/C6H6N2O2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H,7H2","DPJCXCZTLWNFOH-UHFFFAOYSA-N"
"Nc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C6H6N2O2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H,7H2","XJCVRTZCHMZPBD-UHFFFAOYSA-N"
"Nc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C6H6N2O2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H,7H2","TYMLOMAKGOJONV-UHFFFAOYSA-N"
"Oc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C6H5NO3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H","BTJIUGUIPKRLHP-UHFFFAOYSA-N"
"COc(c1)c(ccc1)[N+1]([O-1])=O","InChI=1S/C7H7NO3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3","CFBYEGUGFPZCNF-UHFFFAOYSA-N"
"COc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C7H7NO3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5H,1H3","WGYFINWERLNPHR-UHFFFAOYSA-N"
"COc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C7H7NO3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3","BNUHAJGCKIQFGE-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(F)ccc1","InChI=1S/C6H4FNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H","PWKNBLFSJAVFAB-UHFFFAOYSA-N"
"Fc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C6H4FNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H","WMASLRCNNKMRFP-UHFFFAOYSA-N"
"Fc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C6H4FNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H","WFQDTOYDVUWQMS-UHFFFAOYSA-N"
"CCCN","InChI=1S/C3H9N/c1-2-3-4/h2-4H2,1H3","WGYKZJWCGVVSQN-UHFFFAOYSA-N"
"CC(C)N","InChI=1S/C3H9N/c1-3(2)4/h3H,4H2,1-2H3","JJWLVOIRVHMVIS-UHFFFAOYSA-N"
"NCC(C)C","InChI=1S/C4H11N/c1-4(2)3-5/h4H,3,5H2,1-2H3","KDSNLYIMUZNERS-UHFFFAOYSA-N"
"CCC(C)N","InChI=1S/C4H11N/c1-3-4(2)5/h4H,3,5H2,1-2H3","BHRZNVHARXXAHW-UHFFFAOYSA-N"
"CC(C)(C)N","InChI=1S/C4H11N/c1-4(2,3)5/h5H2,1-3H3","YBRBMKDOPFTVDT-UHFFFAOYSA-N"
"CCCCCN","InChI=1S/C5H13N/c1-2-3-4-5-6/h2-6H2,1H3","DPBLXKKOBLCELK-UHFFFAOYSA-N"
"CCCCCCN","InChI=1S/C6H15N/c1-2-3-4-5-6-7/h2-7H2,1H3","BMVXCPBXGZKUPN-UHFFFAOYSA-N"
"CCCCCCCN","InChI=1S/C7H17N/c1-2-3-4-5-6-7-8/h2-8H2,1H3","WJYIASZWHGOTOU-UHFFFAOYSA-N"
"CCCCCCCCN","InChI=1S/C8H19N/c1-2-3-4-5-6-7-8-9/h2-9H2,1H3","IOQPZZOEVPZRBK-UHFFFAOYSA-N"
"CCCCCCC(C)N","InChI=1S/C8H19N/c1-3-4-5-6-7-8(2)9/h8H,3-7,9H2,1-2H3","HBXNJMZWGSCKPW-UHFFFAOYSA-N"
"CCCCC(CC)CN","InChI=1S/C8H19N/c1-3-5-6-8(4-2)7-9/h8H,3-7,9H2,1-2H3","LTHNHFOGQMKPOV-UHFFFAOYSA-N"
"CC(C)(C)CC(C)(C)N","InChI=1S/C8H19N/c1-7(2,3)6-8(4,5)9/h6,9H2,1-5H3","QIJIUJYANDSEKG-UHFFFAOYSA-N"
"CSCCC(N1)C(=O)NCC(=O)1","InChI=1S/C7H12N2O2S/c1-12-3-2-5-7(11)8-4-6(10)9-5/h5H,2-4H2,1H3,(H,8,11)(H,9,10)","BYJGBWBCRKWFFX-UHFFFAOYSA-N"
"OCC(N1)C(=O)NC(C)C(=O)1","InChI=1S/C6H10N2O3/c1-3-5(10)8-4(2-9)6(11)7-3/h3-4,9H,2H2,1H3,(H,7,11)(H,8,10)","JJDWARJCLFFKRT-UHFFFAOYSA-N"
"OCC(N1)C(=O)NCC(=O)1","InChI=1S/C5H8N2O3/c8-2-3-5(10)6-1-4(9)7-3/h3,8H,1-2H2,(H,6,10)(H,7,9)","MOWMPSYJSYTSSM-UHFFFAOYSA-N"
"CC(C)CC(N1)C(=O)NC(C)C(=O)1","InChI=1S/C9H16N2O2/c1-5(2)4-7-9(13)10-6(3)8(12)11-7/h5-7H,4H2,1-3H3,(H,10,13)(H,11,12)","DBJPZCJQDRPOME-UHFFFAOYSA-N"
"CC(=C2)C(C1)C(C)(C)C(C2)1","InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3","GRWFGVWFFZKLTI-UHFFFAOYSA-N"
"C=C(C2)C(C1)C(C)(C)C(C2)1","InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3","WTARULDDTDQWMU-UHFFFAOYSA-N"
"CC1=CC[C@@H](CC1)C(=C)C","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3/t10-/m0/s1","XMGQYMWWDOXHJM-JTQLQIEISA-N"
"CC(C1)CC(O)C(C1)C(C)C","InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3","NOOLISFMXDJSKH-UHFFFAOYSA-N"
"CC(C2)C(C1)C(C)(C)C(C2)1","InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3","XOKSLPVRUOBDEW-UHFFFAOYSA-N"
"CC(C1)CCC(C1)C(C)C","InChI=1S/C10H20/c1-8(2)10-6-4-9(3)5-7-10/h8-10H,4-7H2,1-3H3/t9-,10-","CFJYNSNXFXLKNS-MGCOHNPYSA-N"
"CC(C)C([H])(C1)CCC([H])(C)C1","InChI=1S/C10H20/c1-8(2)10-6-4-9(3)5-7-10/h8-10H,4-7H2,1-3H3/t9-,10+","CFJYNSNXFXLKNS-AOOOYVTPSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(C(C)C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C14H25N3O5/c1-7(2)11(13(20)16-9(4)14(21)22-6)17-12(19)8(3)15-10(5)18/h7-9,11H,1-6H3,(H,15,18)(H,16,20)(H,17,19)/t8-,9-,11+/m0/s1","VDUCHUWLAWWFIX-ATZCPNFKSA-N"
"CCCC(C)=O","InChI=1S/C5H10O/c1-3-4-5(2)6/h3-4H2,1-2H3","XNLICIUVMPYHGG-UHFFFAOYSA-N"
"CC(C)C(C)=O","InChI=1S/C5H10O/c1-4(2)5(3)6/h4H,1-3H3","SYBYTAAJFKOIEJ-UHFFFAOYSA-N"
"CCCCC(C)=O","InChI=1S/C6H12O/c1-3-4-5-6(2)7/h3-5H2,1-2H3","QQZOPKMRPOGIEB-UHFFFAOYSA-N"
"CC(C)CC(C)=O","InChI=1S/C6H12O/c1-5(2)4-6(3)7/h5H,4H2,1-3H3","NTIZESTWPVYFNL-UHFFFAOYSA-N"
"CC(=O)C(C)(C)C","InChI=1S/C6H12O/c1-5(7)6(2,3)4/h1-4H3","PJGSXYOJTGTZAV-UHFFFAOYSA-N"
"CCCCCC(C)=O","InChI=1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3","CATSNJVOTSVZJV-UHFFFAOYSA-N"
"CC(C)CCC(C)=O","InChI=1S/C7H14O/c1-6(2)4-5-7(3)8/h6H,4-5H2,1-3H3","FFWSICBKRCICMR-UHFFFAOYSA-N"
"CCCCCCC(C)=O","InChI=1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3","ZPVFWPFBNIEHGJ-UHFFFAOYSA-N"
"CCCCCCCC(C)=O","InChI=1S/C9H18O/c1-3-4-5-6-7-8-9(2)10/h3-8H2,1-2H3","VKCYHJWLYTUGCC-UHFFFAOYSA-N"
"CCC(=O)CC","InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3","FDPIMTJIUBPUKL-UHFFFAOYSA-N"
"CCCC(=O)CC","InChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3","PFCHFHIRKBAQGU-UHFFFAOYSA-N"
"CCCCC(=O)CC","InChI=1S/C7H14O/c1-3-5-6-7(8)4-2/h3-6H2,1-2H3","NGAZZOYFWWSOGK-UHFFFAOYSA-N"
"CCCC(=O)CCC","InChI=1S/C7H14O/c1-3-5-7(8)6-4-2/h3-6H2,1-2H3","HCFAJYNVAYBARA-UHFFFAOYSA-N"
"CCCO","InChI=1S/C3H8O/c1-2-3-4/h4H,2-3H2,1H3","BDERNNFJNOPAEC-UHFFFAOYSA-N"
"CC(C)O","InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3","KFZMGEQAYNKOFK-UHFFFAOYSA-N"
"CCCCO","InChI=1S/C4H10O/c1-2-3-4-5/h5H,2-4H2,1H3","LRHPLDYGYMQRHN-UHFFFAOYSA-N"
"OCC(C)C","InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3","ZXEKIIBDNHEJCQ-UHFFFAOYSA-N"
"CCC(C)O","InChI=1S/C4H10O/c1-3-4(2)5/h4-5H,3H2,1-2H3","BTANRVKWQNVYAZ-UHFFFAOYSA-N"
"CC(C)(C)O","InChI=1S/C4H10O/c1-4(2,3)5/h5H,1-3H3","DKGAVHZHDRPRBM-UHFFFAOYSA-N"
"CCCCCO","InChI=1S/C5H12O/c1-2-3-4-5-6/h6H,2-5H2,1H3","AMQJEAYHLZJPGS-UHFFFAOYSA-N"
"OCCC(C)C","InChI=1S/C5H12O/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3","PHTQWCKDNZKARW-UHFFFAOYSA-N"
"CCCC(C)O","InChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3","JYVLIDXNZAXMDK-UHFFFAOYSA-N"
"CCC(C)CO","InChI=1S/C5H12O/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3","QPRQEDXDYOZYLA-UHFFFAOYSA-N"
"CCC(C)(C)O","InChI=1S/C5H12O/c1-4-5(2,3)6/h6H,4H2,1-3H3","MSXVEPNJUHWQHW-UHFFFAOYSA-N"
"CCCCCCO","InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3","ZSIAUFGUXNUGDI-UHFFFAOYSA-N"
"CCCCC(C)O","InChI=1S/C6H14O/c1-3-4-5-6(2)7/h6-7H,3-5H2,1-2H3","QNVRIHYSUZMSGM-UHFFFAOYSA-N"
"CCCCCCCO","InChI=1S/C7H16O/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3","BBMCTIGTTCKYKF-UHFFFAOYSA-N"
"CCCCCCCCO","InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3","KBPLFHHGFOOTCA-UHFFFAOYSA-N"
"CCCCCCC(C)O","InChI=1S/C8H18O/c1-3-4-5-6-7-8(2)9/h8-9H,3-7H2,1-2H3","SJWFXCIHNDVPSH-UHFFFAOYSA-N"
"NCCCO","InChI=1S/C3H9NO/c4-2-1-3-5/h5H,1-4H2","WUGQZFFCHPXWKQ-UHFFFAOYSA-N"
"NCC(C)O","InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3","HXKKHQJGJAFBHI-UHFFFAOYSA-N"
"NCCCCCO","InChI=1S/C5H13NO/c6-4-2-1-3-5-7/h7H,1-6H2","LQGKDMHENBFVRC-UHFFFAOYSA-N"
"CCCC(C1)CCCC1","InChI=1S/C9H18/c1-2-6-9-7-4-3-5-8-9/h9H,2-8H2,1H3","DEDZSLCZHWTGOR-UHFFFAOYSA-N"
"CCCCC(C1)CCCC1","InChI=1S/C10H20/c1-2-3-7-10-8-5-4-6-9-10/h10H,2-9H2,1H3","GGBJHURWWWLEQH-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=C)c(c1)cccc1","InChI=1S/C14H12/c1-12(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11H,1H2","ZMYIIHDQURVDRB-UHFFFAOYSA-N"
"C(CC(c(c4)cccc4)c(c3)cccc3)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C28H26/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27-28H,21-22H2","RYRPAXUFKAJVQC-UHFFFAOYSA-N"
"COC(=O)CNC(=O)CNC(C)=O","InChI=1S/C7H12N2O4/c1-5(10)8-3-6(11)9-4-7(12)13-2/h3-4H2,1-2H3,(H,8,10)(H,9,11)","JSBPKTULFDBSFS-UHFFFAOYSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C9H16N2O4/c1-5(10-7(3)12)8(13)11-6(2)9(14)15-4/h5-6H,1-4H3,(H,10,12)(H,11,13)/t5-,6+/m1/s1","CXWPLQYKHLCSPO-RITPCOANSA-N"
"COC(=O)CNC(=O)CNC(=O)CNC(C)=O","InChI=1S/C9H15N3O5/c1-6(13)10-3-7(14)11-4-8(15)12-5-9(16)17-2/h3-5H2,1-2H3,(H,10,13)(H,11,14)(H,12,15)","RBKYCFQDIAZTQJ-UHFFFAOYSA-N"
"COC(=O)C([H])(C)NC(=O)CNC(=O)CNC(C)=O","InChI=1S/C10H17N3O5/c1-6(10(17)18-3)13-9(16)5-12-8(15)4-11-7(2)14/h6H,4-5H2,1-3H3,(H,11,14)(H,12,15)(H,13,16)/t6-/m1/s1","JLSJNENSAQOMOY-ZCFIWIBFSA-N"
"COC(=O)CNC(=O)C([H])(C)NC(=O)CNC(C)=O","InChI=1S/C10H17N3O5/c1-6(10(17)12-5-9(16)18-3)13-8(15)4-11-7(2)14/h6H,4-5H2,1-3H3,(H,11,14)(H,12,17)(H,13,15)/t6-/m1/s1","WBVHFIJZXUJKNA-ZCFIWIBFSA-N"
"COC(=O)CNC(=O)C([H])(C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C11H19N3O5/c1-6(10(17)12-5-9(16)19-4)14-11(18)7(2)13-8(3)15/h6-7H,5H2,1-4H3,(H,12,17)(H,13,15)(H,14,18)/t6-,7+/m0/s1","AOOOWAGCBQNBPR-NKWVEPMBSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(C)NC(=O)CNC(C)=O","InChI=1S/C11H19N3O5/c1-6(13-9(16)5-12-8(3)15)10(17)14-7(2)11(18)19-4/h6-7H,5H2,1-4H3,(H,12,15)(H,13,16)(H,14,17)/t6-,7+/m1/s1","VLAFVIQYTNYXEZ-RQJHMYQMSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C12H21N3O5/c1-6(13-9(4)16)10(17)14-7(2)11(18)15-8(3)12(19)20-5/h6-8H,1-5H3,(H,13,16)(H,14,17)(H,15,18)/t6-,7-,8+/m1/s1","FKSWBCPVKXRWMC-PRJMDXOYSA-N"
"CC(C)CCOC(=O)c(c1)cccc1","InChI=1S/C12H16O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3","MLLAPOCBLWUFAP-UHFFFAOYSA-N"
"CCCNC(C)=O","InChI=1S/C5H11NO/c1-3-4-6-5(2)7/h3-4H2,1-2H3,(H,6,7)","IHPHPGLJYCDONF-UHFFFAOYSA-N"
"CC(C)NC(C)=O","InChI=1S/C5H11NO/c1-4(2)6-5(3)7/h4H,1-3H3,(H,6,7)","PDUSWJORWQPNRP-UHFFFAOYSA-N"
"CCCCNC(C)=O","InChI=1S/C6H13NO/c1-3-4-5-7-6(2)8/h3-5H2,1-2H3,(H,7,8)","GYLDXXLJMRTVSS-UHFFFAOYSA-N"
"CC(C)CNC(C)=O","InChI=1S/C6H13NO/c1-5(2)4-7-6(3)8/h5H,4H2,1-3H3,(H,7,8)","VDQMVRFHUYAKJL-UHFFFAOYSA-N"
"CCC(C)NC(C)=O","InChI=1S/C6H13NO/c1-4-5(2)7-6(3)8/h5H,4H2,1-3H3,(H,7,8)","FILVHGGOUFZULB-UHFFFAOYSA-N"
"CCCCCNC(C)=O","InChI=1S/C7H15NO/c1-3-4-5-6-8-7(2)9/h3-6H2,1-2H3,(H,8,9)","PTBCMKWBUAWWMQ-UHFFFAOYSA-N"
"CC(C)CCNC(C)=O","InChI=1S/C7H15NO/c1-6(2)4-5-8-7(3)9/h6H,4-5H2,1-3H3,(H,8,9)","XWDCLPNMPBQWCW-UHFFFAOYSA-N"
"CCCCCCNC(C)=O","InChI=1S/C8H17NO/c1-3-4-5-6-7-9-8(2)10/h3-7H2,1-2H3,(H,9,10)","SYIOXNGUUYGIIF-UHFFFAOYSA-N"
"CCC=C","InChI=1S/C4H8/c1-3-4-2/h3H,1,4H2,2H3","VXNZUUAINFGPBY-UHFFFAOYSA-N"
"CCCCC=C","InChI=1S/C6H12/c1-3-5-6-4-2/h3H,1,4-6H2,2H3","LIKMAJRDDDTEIG-UHFFFAOYSA-N"
"CCCC=C","InChI=1S/C5H10/c1-3-5-4-2/h3H,1,4-5H2,2H3","YWAKXRMUMFPDSH-UHFFFAOYSA-N"
"OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7?,8-,10+/m1/s1","DTGKSKDOIYIVQL-VWHDNNRLSA-N"
"O=C(C1)c(c2)c(ccc2)C1","InChI=1S/C9H8O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4H,5-6H2","QNXSIUBBGPHDDE-UHFFFAOYSA-N"
"O=C(C1)Cc(c2)c(ccc2)1","InChI=1S/C9H8O/c10-9-5-7-3-1-2-4-8(7)6-9/h1-4H,5-6H2","UMJJFEIKYGFCAT-UHFFFAOYSA-N"
"O=C(C1)CC([H])(C2)C([H])1CC(=O)2","InChI=1S/C8H10O2/c9-7-1-5-2-8(10)4-6(5)3-7/h5-6H,1-4H2","HAFQHNGZPQYKFF-UHFFFAOYSA-N"
"CC(=O)OC([H])(C2)C(C)(C)C([H])(OC(C)=O)C([H])=C(C)CCC([H])(O1)C(C)(C2)1","InChI=1S/C19H30O5/c1-12-7-8-16-19(6,24-16)10-9-15(22-13(2)20)18(4,5)17(11-12)23-14(3)21/h11,15-17H,7-10H2,1-6H3/b12-11-/t15-,16-,17-,19-/m0/s1","LLDZPKVTWNOHBD-NXWIZDFYSA-N"
"CC(C1)=C([H])C(O)C(C)(C)C(C2)OC(C)(C2)C(O)C1","InChI=1S/C15H26O3/c1-10-5-6-11(16)15(4)8-7-13(18-15)14(2,3)12(17)9-10/h9,11-13,16-17H,5-8H2,1-4H3/b10-9-","GMYOIOXPNNQOMS-KTKRTIGZSA-N"
"CC(=O)CC(C)=O","InChI=1S/C5H8O2/c1-4(6)3-5(2)7/h3H2,1-2H3","YRKCREAYFQTBPV-UHFFFAOYSA-N"
"CC(C)C([H])(C2)C(C31)C(C(C)=CC3)C(C)(C2)1","InChI=1S/C15H24/c1-9(2)11-7-8-15(4)12-6-5-10(3)14(15)13(11)12/h5,9,11-14H,6-8H2,1-4H3/t11-,12?,13?,14-,15-/m0/s1","VLXDPFLIRFYIME-IIZVFWCOSA-N"
"CC(=O)C=C(C)O[Co](OC(C)=CC(C)=O)OC(C)=CC(C)=O","InChI=1S/3C5H8O2.Co/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;;;+3/p-3/b2*4-3+;4-3-;","RHCQEPWEBDOALW-AMLHQIMMSA-K"
"CC(=O)C=C(C)O[Ni]OC(C)=CC(C)=O","InChI=1S/2C5H8O2.Ni/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/q;;+2/p-2/b2*4-3-;","BMGNSKKZFQMGDH-FDGPNNRMSA-L"
"CC(=O)C=C(C)O[Pd]OC(C)=CC(C)=O","InChI=1S/2C5H8O2.Pd/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/q;;+2/p-2/b2*4-3+;","JKDRQYIYVJVOPF-SYWGCQIGSA-L"
"CC(=O)C(Br)=C(C)O[Pd]OC(C)=C(Br)C(C)=O","InChI=1S/2C5H7BrO2.Pd/c2*1-3(7)5(6)4(2)8;/h2*7H,1-2H3;/q;;+2/p-2/b2*5-3+;","QYXHETFVNFTXGP-MSEGBBJSSA-L"
"CC(=O)C([N+1]([O-1])=O)=C(C)O[Cu]OC(C)=C(C(C)=O)[N+1]([O-1])=O","InChI=1S/2C5H7NO4.Cu/c2*1-3(7)5(4(2)8)6(9)10;/h2*7H,1-2H3;/q;;+2/p-2/b2*5-3+;","DRDZHSCSMNUNPW-MSEGBBJSSA-L"
"CC(=O)C=C(C)O[Pt]OC(C)=CC(C)=O","InChI=1S/2C5H8O2.Pt/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/q;;+2/p-2/b2*4-3+;","KLFRPGNCEJNEKU-SYWGCQIGSA-L"
"CC(=O)C=C(C)O[Al](OC(C)=CC(C)=O)OC(C)=CC(C)=O","InChI=1S/3C5H8O2.Al/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;;;+3/p-3/b3*4-3+;","KILURZWTCGSYRE-MUCWUPSWSA-K"
"CC(=O)C=C(C)O[Co]OC(C)=CC(C)=O","InChI=1S/2C5H8O2.Co/c2*1-4(6)3-5(2)7;/h2*3,6H,1-2H3;/q;;+2/p-2/b4-3+;4-3-;","UTYYEGLZLFAFDI-OHSCNOFNSA-L"
"Cc(c2)nc(nc(Cl)2)c(c1)cccc1","InChI=1S/C11H9ClN2/c1-8-7-10(12)14-11(13-8)9-5-3-2-4-6-9/h2-7H,1H3","MOLLLUIWZOISLC-UHFFFAOYSA-N"
"Cc(c2)nc(nc2)c(c1)cccc1","InChI=1S/C11H10N2/c1-9-7-8-12-11(13-9)10-5-3-2-4-6-10/h2-8H,1H3","XPENFJAKMNONFL-UHFFFAOYSA-N"
"Cc(n2)cc(nc2)c(c1)cccc1","InChI=1S/C11H10N2/c1-9-7-11(13-8-12-9)10-5-3-2-4-6-10/h2-8H,1H3","MTGUMZRYKWCXGO-UHFFFAOYSA-N"
"COc(n1)cc(C)nc1","InChI=1S/C6H8N2O/c1-5-3-6(9-2)8-4-7-5/h3-4H,1-2H3","GGFJPYWUQCOYLQ-UHFFFAOYSA-N"
"CCc(n1)nc(OC(C)C)cc(C)1","InChI=1S/C10H16N2O/c1-5-9-11-8(4)6-10(12-9)13-7(2)3/h6-7H,5H2,1-4H3","AAQLJELBECCXJR-UHFFFAOYSA-N"
"CCc(n1)nc(OC)cc(C)1","InChI=1S/C8H12N2O/c1-4-7-9-6(2)5-8(10-7)11-3/h5H,4H2,1-3H3","XFXYDUVPPNPVLV-UHFFFAOYSA-N"
"CCOc(c1)nc(CC)nc(C)1","InChI=1S/C9H14N2O/c1-4-8-10-7(3)6-9(11-8)12-5-2/h6H,4-5H2,1-3H3","GFBRLSQLXXVWNF-UHFFFAOYSA-N"
"COc(c1)nc(C)nc(C)1","InChI=1S/C7H10N2O/c1-5-4-7(10-3)9-6(2)8-5/h4H,1-3H3","NBLOKQVJTMLMRG-UHFFFAOYSA-N"
"CC(=C)C(C2)CC(O1)C(C)(C2)1","InChI=1S/C10H16O/c1-7(2)8-4-5-10(3)9(6-8)11-10/h8-9H,1,4-6H2,2-3H3","CCEFMUBVSUDRLG-UHFFFAOYSA-N"
"CC(C2)CC(O1)C(C2)(C(C)C)1","InChI=1S/C10H18O/c1-7(2)10-5-4-8(3)6-9(10)11-10/h7-9H,4-6H2,1-3H3","PPERHRAPFJGBED-UHFFFAOYSA-N"
"CC(C)C(C2)CC(O1)C(C)(C2)1","InChI=1S/C10H18O/c1-7(2)8-4-5-10(3)9(6-8)11-10/h7-9H,4-6H2,1-3H3","WSHVHJSDSVPPIV-UHFFFAOYSA-N"
"CC(C2)(O1)C(CCC2)1","InChI=1S/C7H12O/c1-7-5-3-2-4-6(7)8-7/h6H,2-5H2,1H3","FIEKVYPYFQSFTP-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C=CC(=O)c(c1)cccc1","InChI=1S/C16H14O2/c1-18-15-10-7-13(8-11-15)9-12-16(17)14-5-3-2-4-6-14/h2-12H,1H3/b12-9+","XUFXKBJMCRJATM-FMIVXFBMSA-N"
"COc(c2)ccc(c2)C(=O)C=Cc(c1)cccc1","InChI=1S/C16H14O2/c1-18-15-10-8-14(9-11-15)16(17)12-7-13-5-3-2-4-6-13/h2-12H,1H3/b12-7+","KJHHAPASNNVTSN-KPKJPENVSA-N"
"CCNN","InChI=1S/C2H8N2/c1-2-4-3/h4H,2-3H2,1H3","WHRIKZCFRVTHJH-UHFFFAOYSA-N"
"CCCNN","InChI=1S/C3H10N2/c1-2-3-5-4/h5H,2-4H2,1H3","UKPBXIFLSVLDPA-UHFFFAOYSA-N"
"NNC(C)C","InChI=1S/C3H10N2/c1-3(2)5-4/h3,5H,4H2,1-2H3","KJAQRHMKLVGSCG-UHFFFAOYSA-N"
"NNCC(C)C","InChI=1S/C4H12N2/c1-4(2)3-6-5/h4,6H,3,5H2,1-2H3","NGSOWKPBNFOQCR-UHFFFAOYSA-N"
"CCC(C)NN","InChI=1S/C4H12N2/c1-3-4(2)6-5/h4,6H,3,5H2,1-2H3","SFSUYFSIKDDLOL-UHFFFAOYSA-N"
"CCCCCCCNN","InChI=1S/C7H18N2/c1-2-3-4-5-6-7-9-8/h9H,2-8H2,1H3","AETGYOWKOXPRCB-UHFFFAOYSA-N"
"C=CCNN","InChI=1S/C3H8N2/c1-2-3-5-4/h2,5H,1,3-4H2","ZTILHLWDFSMCLZ-UHFFFAOYSA-N"
"CC=CCNN","InChI=1S/C4H10N2/c1-2-3-4-6-5/h2-3,6H,4-5H2,1H3/b3-2+","SHHBQSBSBLLJKJ-NSCUHMNNSA-N"
"C=CC(C)NN","InChI=1S/C4H10N2/c1-3-4(2)6-5/h3-4,6H,1,5H2,2H3","ZXMKECRNTYBFFP-UHFFFAOYSA-N"
"NNc(c1)cccc1","InChI=1S/C6H8N2/c7-8-6-4-2-1-3-5-6/h1-5,8H,7H2","HKOOXMFOFWEVGF-UHFFFAOYSA-N"
"NNCc(c1)cccc1","InChI=1S/C7H10N2/c8-9-6-7-4-2-1-3-5-7/h1-5,9H,6,8H2","NHOWLEZFTHYCTP-UHFFFAOYSA-N"
"COCCNN","InChI=1S/C3H10N2O/c1-6-3-2-5-4/h5H,2-4H2,1H3","IBELBRDFPCFICX-UHFFFAOYSA-N"
"CN(C)N","InChI=1S/C2H8N2/c1-4(2)3/h3H2,1-2H3","RHUYHJGZWVXEHW-UHFFFAOYSA-N"
"CCCN(C)N","InChI=1S/C4H12N2/c1-3-4-6(2)5/h3-5H2,1-2H3","JOFQXPUKJJQCPW-UHFFFAOYSA-N"
"CC(C)N(C)N","InChI=1S/C4H12N2/c1-4(2)6(3)5/h4H,5H2,1-3H3","XYQCAFWEBBSSKS-UHFFFAOYSA-N"
"CCN(N)CC","InChI=1S/C4H12N2/c1-3-6(5)4-2/h3-5H2,1-2H3","IFZHGQSUNAKKSN-UHFFFAOYSA-N"
"CCCCN(C)N","InChI=1S/C5H14N2/c1-3-4-5-7(2)6/h3-6H2,1-2H3","OEEGQMYUIKPQMM-UHFFFAOYSA-N"
"CC(C)CN(C)N","InChI=1S/C5H14N2/c1-5(2)4-7(3)6/h5H,4,6H2,1-3H3","DVWYNPADZDHBSJ-UHFFFAOYSA-N"
"CCCCN(N)CC","InChI=1S/C6H16N2/c1-3-5-6-8(7)4-2/h3-7H2,1-2H3","GGVXCUYZOPPOAM-UHFFFAOYSA-N"
"CCN(N)CC(C)C","InChI=1S/C6H16N2/c1-4-8(7)5-6(2)3/h6H,4-5,7H2,1-3H3","SRPRMXWUMUHGED-UHFFFAOYSA-N"
"CCC(C)N(N)CC","InChI=1S/C6H16N2/c1-4-6(3)8(7)5-2/h6H,4-5,7H2,1-3H3","JETSNSHFMGMDDQ-UHFFFAOYSA-N"
"CCCN(N)CCC","InChI=1S/C6H16N2/c1-3-5-8(7)6-4-2/h3-7H2,1-2H3","ZHHHDUSWMATTFE-UHFFFAOYSA-N"
"CC(C)N(N)C(C)C","InChI=1S/C6H16N2/c1-5(2)8(7)6(3)4/h5-6H,7H2,1-4H3","CDLZUDXUPFCTRJ-UHFFFAOYSA-N"
"CCCCN(N)CCCC","InChI=1S/C8H20N2/c1-3-5-7-10(9)8-6-4-2/h3-9H2,1-2H3","DJTIANXYHUNHQV-UHFFFAOYSA-N"
"CC(C)CN(N)CC(C)C","InChI=1S/C8H20N2/c1-7(2)5-10(9)6-8(3)4/h7-8H,5-6,9H2,1-4H3","JDAGVHRXQORNKW-UHFFFAOYSA-N"
"NN(C1)CCCC1","InChI=1S/C5H12N2/c6-7-4-2-1-3-5-7/h1-6H2","LWMPFIOTEAXAGV-UHFFFAOYSA-N"
"NN(C1)CCCCC1","InChI=1S/C6H14N2/c7-8-5-3-1-2-4-6-8/h1-7H2","UGBKOURNNQREPE-UHFFFAOYSA-N"
"C=CCN(C)N","InChI=1S/C4H10N2/c1-3-4-6(2)5/h3H,1,4-5H2,2H3","MTHGBQGOPUDWHI-UHFFFAOYSA-N"
"C#CCN(C)N","InChI=1S/C4H8N2/c1-3-4-6(2)5/h1H,4-5H2,2H3","PJDXKHMHDLLSDJ-UHFFFAOYSA-N"
"C=CCN(N)CC=C","InChI=1S/C6H12N2/c1-3-5-8(7)6-4-2/h3-4H,1-2,5-7H2","UPVLRUMEBXYJMQ-UHFFFAOYSA-N"
"CC=CCN(N)CC=CC","InChI=1S/C8H16N2/c1-3-5-7-10(9)8-6-4-2/h3-6H,7-9H2,1-2H3/b5-3+,6-4+","HCVMGJBOKUBGRJ-GGWOSOGESA-N"
"CN(N)c(c1)cccc1","InChI=1S/C7H10N2/c1-9(8)7-5-3-2-4-6-7/h2-6H,8H2,1H3","MWOODERJGVWYJE-UHFFFAOYSA-N"
"CCN(N)c(c1)cccc1","InChI=1S/C8H12N2/c1-2-10(9)8-6-4-3-5-7-8/h3-7H,2,9H2,1H3","NQSIARGGPGHMCG-UHFFFAOYSA-N"
"CCNNCC","InChI=1S/C4H12N2/c1-3-5-6-4-2/h5-6H,3-4H2,1-2H3","YCBOYOYVDOUXLH-UHFFFAOYSA-N"
"CCCNNCCC","InChI=1S/C6H16N2/c1-3-5-7-8-6-4-2/h7-8H,3-6H2,1-2H3","BOOQVRGRSDTZRZ-UHFFFAOYSA-N"
"CCCNNC(C)C","InChI=1S/C6H16N2/c1-4-5-7-8-6(2)3/h6-8H,4-5H2,1-3H3","PNBRACSSFLTMRS-UHFFFAOYSA-N"
"CC(C)NNC(C)C","InChI=1S/C6H16N2/c1-5(2)7-8-6(3)4/h5-8H,1-4H3","QWLQTDXXEZQUBB-UHFFFAOYSA-N"
"CCCCNNCC","InChI=1S/C6H16N2/c1-3-5-6-8-7-4-2/h7-8H,3-6H2,1-2H3","ALNDIBLAORBEAX-UHFFFAOYSA-N"
"CCCCNNCCCC","InChI=1S/C8H20N2/c1-3-5-7-9-10-8-6-4-2/h9-10H,3-8H2,1-2H3","FEBRIAPYLGMZSR-UHFFFAOYSA-N"
"CCC(C)NNC(C)CC","InChI=1S/C8H20N2/c1-5-7(3)9-10-8(4)6-2/h7-10H,5-6H2,1-4H3","GTTATNIRHPAPPY-UHFFFAOYSA-N"
"[H]C(C1)=NN(C(C)C)C(C)1","InChI=1S/C7H14N2/c1-6(2)9-7(3)4-5-8-9/h5-7H,4H2,1-3H3","DUOUFHCFRWDSBE-UHFFFAOYSA-N"
"CC(C)N(C1)N=C(C)C(C)1","InChI=1S/C8H16N2/c1-6(2)10-5-7(3)8(4)9-10/h6-7H,5H2,1-4H3","FLFFDGXRTTZWSA-UHFFFAOYSA-N"
"CCC(C1)=NN(C1)C(C)C","InChI=1S/C8H16N2/c1-4-8-5-6-10(9-8)7(2)3/h7H,4-6H2,1-3H3","UMSXSCVFMDGXJU-UHFFFAOYSA-N"
"CCC(C=1)CN(N1)C(C)C","InChI=1S/C8H16N2/c1-4-8-5-9-10(6-8)7(2)3/h5,7-8H,4,6H2,1-3H3","YYDARPMCZIBRBD-UHFFFAOYSA-N"
"CCCCN(N=1)C(C)CC([H])1","InChI=1S/C8H16N2/c1-3-4-7-10-8(2)5-6-9-10/h6,8H,3-5,7H2,1-2H3","IPKPLDIJSVOODS-UHFFFAOYSA-N"
"CC(C)CN(C1)N=C(C)C1","InChI=1S/C8H16N2/c1-7(2)6-10-5-4-8(3)9-10/h7H,4-6H2,1-3H3","ZEWMFEJLDHQAFQ-UHFFFAOYSA-N"
"CN(C)N=NN(C)C","InChI=1S/C4H12N4/c1-7(2)5-6-8(3)4/h1-4H3/b6-5+","PRGCYUAJTPIADR-AATRIKPKSA-N"
"CCN(CC)N=NN(C)C","InChI=1S/C6H16N4/c1-5-10(6-2)8-7-9(3)4/h5-6H2,1-4H3/b8-7+","ACWGYOPNCRGEKM-BQYQJAHWSA-N"
"CCN(CC)N=NN(CC)CC","InChI=1S/C8H20N4/c1-5-11(6-2)9-10-12(7-3)8-4/h5-8H2,1-4H3/b10-9+","DTPTYCXQWZYACS-MDZDMXLPSA-N"
"CC(C)N(C)N=NN(C)C(C)C","InChI=1S/C8H20N4/c1-7(2)11(5)9-10-12(6)8(3)4/h7-8H,1-6H3/b10-9+","LHQPFVXOECBIPT-MDZDMXLPSA-N"
"CN(C)N=NN(C(C)C)C(C)C","InChI=1S/C8H20N4/c1-7(2)12(8(3)4)10-9-11(5)6/h7-8H,1-6H3/b10-9+","JTPWWUNKACEDTB-MDZDMXLPSA-N"
"CC(C)N(C(C)C)N=NN(C(C)C)C(C)C","InChI=1S/C12H28N4/c1-9(2)15(10(3)4)13-14-16(11(5)6)12(7)8/h9-12H,1-8H3/b14-13+","ZNDMWJNPHFHXFT-BUHFOSPRSA-N"
"CCN=NC(C)NN(C)C","InChI=1S/C6H16N4/c1-5-7-8-6(2)9-10(3)4/h6,9H,5H2,1-4H3/b8-7+","BABHWMHGOCZGSO-BQYQJAHWSA-N"
"CCN=NC(C)NN(CC)CC","InChI=1S/C8H20N4/c1-5-9-10-8(4)11-12(6-2)7-3/h8,11H,5-7H2,1-4H3/b10-9+","BWOHUQVAJNGKEM-MDZDMXLPSA-N"
"CCN=NC(CCC)NN(C)C","InChI=1S/C8H20N4/c1-5-7-8(10-9-6-2)11-12(3)4/h8,11H,5-7H2,1-4H3/b10-9+","QBKJPAWZEPDHGU-MDZDMXLPSA-N"
"CCN=NC(NN(C)C)C(C)C","InChI=1S/C8H20N4/c1-6-9-10-8(7(2)3)11-12(4)5/h7-8,11H,6H2,1-5H3/b10-9+","DBYJOJHQJZEVBO-MDZDMXLPSA-N"
"CCCCN=NC(C)NN(C)C","InChI=1S/C8H20N4/c1-5-6-7-9-10-8(2)11-12(3)4/h8,11H,5-7H2,1-4H3/b10-9-","FIDAZQLHWRIURY-KTKRTIGZSA-N"
"CCN=NC(C)NN(C1)CCCC1","InChI=1S/C9H20N4/c1-3-10-11-9(2)12-13-7-5-4-6-8-13/h9,12H,3-8H2,1-2H3/b11-10+","MHEVJASIEPDIBM-ZHACJKMWSA-N"
"CCN=NC(C)NN(C(C)C)C(C)C","InChI=1S/C10H24N4/c1-7-11-12-10(6)13-14(8(2)3)9(4)5/h8-10,13H,7H2,1-6H3/b12-11+","RVDGPLNVVIDJHU-VAWYXSNFSA-N"
"CCN=NC(C(C)C)NN(CC)CC","InChI=1S/C10H24N4/c1-6-11-12-10(9(4)5)13-14(7-2)8-3/h9-10,13H,6-8H2,1-5H3/b12-11-","URZKYFUVOOYNIS-QXMHVHEDSA-N"
"CCCN=NC(CC)NN(CCC)CCC","InChI=1S/C12H28N4/c1-5-9-13-14-12(8-4)15-16(10-6-2)11-7-3/h12,15H,5-11H2,1-4H3/b14-13-","OZKYWOIOCNSWGR-YPKPFQOOSA-N"
"[O-1][N+1](=O)c(c(Br)1)c(C2)c(NC2)cc1","InChI=1S/C8H7BrN2O2/c9-6-1-2-7-5(3-4-10-7)8(6)11(12)13/h1-2,10H,3-4H2","JJQZFMFVYQSWQX-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)C=O","InChI=1S/C9H7NO/c11-6-7-5-10-9-4-2-1-3-8(7)9/h1-6,10H","OLNJUISKUQQNIM-UHFFFAOYSA-N"
"[O-1][N+1](=O)C(C=2)=Cn(c1)c(C2)cc(C)1","InChI=1S/C9H8N2O2/c1-7-4-8-2-3-9(11(12)13)6-10(8)5-7/h2-6H,1H3","MAZOIJIDRZDDKK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c([H])1)c(c2)c(ccc2)n(C)1","InChI=1S/C9H8N2O2/c1-10-6-9(11(12)13)7-4-2-3-5-8(7)10/h2-6H,1H3","SDNGVFXIFVLBAJ-UHFFFAOYSA-N"
"CC1=CC2=C(N1)C=CC(=C2)[N+](=O)[O-]","InChI=1S/C9H8N2O2/c1-6-4-7-5-8(11(12)13)2-3-9(7)10-6/h2-5,10H,1H3","IDJGRXQMAHESOD-UHFFFAOYSA-N"
"CC1=CNC2=C1C=C(C=C2)[N+](=O)[O-]","InChI=1S/C9H8N2O2/c1-6-5-10-9-3-2-7(11(12)13)4-8(6)9/h2-5,10H,1H3","LPFQDJBJGFUMRG-UHFFFAOYSA-N"
"CC1=C(C2=CC=CC=C2N1)C=O","InChI=1S/C10H9NO/c1-7-9(6-12)8-4-2-3-5-10(8)11-7/h2-6,11H,1H3","CYZIVXOEJNAIBS-UHFFFAOYSA-N"
"O=Cc(c1)c(c2)c(ccc2)n(C)1","InChI=1S/C10H9NO/c1-11-6-8(7-12)9-4-2-3-5-10(9)11/h2-7H,1H3","KXYBYRKRRGSZCX-UHFFFAOYSA-N"
"O=Cc(c1)n(C)c(c2)c(ccc2)1","InChI=1S/C10H9NO/c1-11-9(7-12)6-8-4-2-3-5-10(8)11/h2-7H,1H3","IBNGPIOSWCMJGG-UHFFFAOYSA-N"
"CC(=O)C1=CC2=CC=CC=C2N1","InChI=1S/C10H9NO/c1-7(12)10-6-8-4-2-3-5-9(8)11-10/h2-6,11H,1H3","QXJMCSBBTMVSJS-UHFFFAOYSA-N"
"CC(=O)C1=CNC2=CC=CC=C21","InChI=1S/C10H9NO/c1-7(12)9-6-11-10-5-3-2-4-8(9)10/h2-6,11H,1H3","VUIMBZIZZFSQEE-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=C(C=C2)[N+](=O)[O-])C","InChI=1S/C10H10N2O2/c1-6-7(2)11-10-4-3-8(12(13)14)5-9(6)10/h3-5,11H,1-2H3","LKIMRQIKTONPER-UHFFFAOYSA-N"
"Cc1c([nH]c2c1ccc(c2)[N+](=O)[O-])C","InChI=1S/C10H10N2O2/c1-6-7(2)11-10-5-8(12(13)14)3-4-9(6)10/h3-5,11H,1-2H3","QQZPUGDUSPXQEI-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC=C2[N+](=O)[O-])C","InChI=1S/C10H10N2O2/c1-6-7(2)11-10-8(6)4-3-5-9(10)12(13)14/h3-5,11H,1-2H3","ONCCVOJTXZBTDY-UHFFFAOYSA-N"
"CC1=C(NC2=C1C(=CC=C2)[N+](=O)[O-])C","InChI=1S/C10H10N2O2/c1-6-7(2)11-8-4-3-5-9(10(6)8)12(13)14/h3-5,11H,1-2H3","PQVLMUJSDORONP-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(O)cc(c2)c1n(C)c(C)2","InChI=1S/C10H10N2O3/c1-6-3-7-4-10(13)9(12(14)15)5-8(7)11(6)2/h3-5,13H,1-2H3","LDKJCZFMASHXCF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c(O)2)c(c1)c(cc2)n(C)c(C)1","InChI=1S/C10H10N2O3/c1-6-5-7-8(11(6)2)3-4-9(13)10(7)12(14)15/h3-5,13H,1-2H3","AAHRWLRCEUVGFY-UHFFFAOYSA-N"
"CC(=O)N(C2)N=C(C2)c(c1)ccnc1","InChI=1S/C10H11N3O/c1-8(14)13-7-4-10(12-13)9-2-5-11-6-3-9/h2-3,5-6H,4,7H2,1H3","VDHRBRSJHARSSG-UHFFFAOYSA-N"
"CC(=O)N(C2)N=C(C2)c(c1)nccc1","InChI=1S/C10H11N3O/c1-8(14)13-7-5-10(12-13)9-4-2-3-6-11-9/h2-4,6H,5,7H2,1H3","PYKHTMUBEZWTIU-UHFFFAOYSA-N"
"CC(C1)Nc(c2)c(ccc2)C1","InChI=1S/C10H13N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h2-5,8,11H,6-7H2,1H3","JZICUKPOZUKZLL-UHFFFAOYSA-N"
"CC(=O)c(c1)c(c2)c(ccc2)n(C([2H])([2H])[2H])1","InChI=1S/C11H11NO/c1-8(13)10-7-12(2)11-6-4-3-5-9(10)11/h3-7H,1-2H3/i2D3","HYLFRICFKVJJOZ-BMSJAHLVSA-N"
"CC(=O)c(c1)n(C([2H])([2H])[2H])c(c2)c(ccc2)1","InChI=1S/C11H11NO/c1-8(13)11-7-9-5-3-4-6-10(9)12(11)2/h3-7H,1-2H3/i2D3","SVUKISNBRDNDMF-BMSJAHLVSA-N"
"CC1=C(NC2=CC(=C(C=C12)OC([2H])([2H])[2H])[N+](=O)[O-])C","InChI=1S/C11H12N2O3/c1-6-7(2)12-9-5-10(13(14)15)11(16-3)4-8(6)9/h4-5,12H,1-3H3/i3D3","ZLSBCSFIBGGDQS-HPRDVNIFSA-N"
"[O-1][N+1](=O)c(c2)cc(n(C)1)c(c2)c(C(C)=O)c1","InChI=1S/C11H10N2O3/c1-7(14)10-6-12(2)11-5-8(13(15)16)3-4-9(10)11/h3-6H,1-2H3","DJCNZIVWZCTHIP-UHFFFAOYSA-N"
"[O-1][N+1](=O)C(C([H])=2)=C([H])n(c([H])1)c(C([H])2)c(C(C)=O)c(C)1","InChI=1S/C11H10N2O3/c1-7-5-12-6-9(13(15)16)3-4-10(12)11(7)8(2)14/h3-6H,1-2H3","NRACPSDSVVJUHL-UHFFFAOYSA-N"
"c(c1)con1","InChI=1S/C3H3NO/c1-2-4-5-3-1/h1-3H","CTAPFRYPJLPFDF-UHFFFAOYSA-N"
"C1=CNN=C1","InChI=1S/C3H4N2/c1-2-4-5-3-1/h1-3H,(H,4,5)","WTKZEGDFNFYCGP-UHFFFAOYSA-N"
"CC1=CC=NN1","InChI=1S/C4H6N2/c1-4-2-3-5-6-4/h2-3H,1H3,(H,5,6)","XKVUYEYANWFIJX-UHFFFAOYSA-N"
"[H]c(c([H])1)c([H])n(C)n1","InChI=1S/C4H6N2/c1-6-4-2-3-5-6/h2-4H,1H3","UQFQONCQIQEYPJ-UHFFFAOYSA-N"
"Cc(n1)c(Br)c(C)o1","InChI=1S/C5H6BrNO/c1-3-5(6)4(2)8-7-3/h1-2H3","GYHZPSUAMYIFQD-UHFFFAOYSA-N"
"Cc(n1)c(Cl)c(C)o1","InChI=1S/C5H6ClNO/c1-3-5(6)4(2)8-7-3/h1-2H3","JTJWPHJWCFVTMS-UHFFFAOYSA-N"
"Cc(n1)c(I)c(C)o1","InChI=1S/C5H6INO/c1-3-5(6)4(2)8-7-3/h1-2H3","NMNOXVWRJISEFE-UHFFFAOYSA-N"
"Cc(n1)c([N+1]([O-1])=O)c(C)o1","InChI=1S/C5H6N2O3/c1-3-5(7(8)9)4(2)10-6-3/h1-2H3","PMQFLWLYAXYFHG-UHFFFAOYSA-N"
"Cc(n1)cc(C)o1","InChI=1S/C5H7NO/c1-4-3-5(2)7-6-4/h3H,1-2H3","FICAQKBMCKEFDI-UHFFFAOYSA-N"
"Cc(n1)c(C)sc1","InChI=1S/C5H7NS/c1-4-5(2)7-3-6-4/h3H,1-2H3","UWSONZCNXUSTKW-UHFFFAOYSA-N"
"Cc(c1)nc(C)s1","InChI=1S/C5H7NS/c1-4-3-7-5(2)6-4/h3H,1-2H3","OBSLLHNATPQFMJ-UHFFFAOYSA-N"
"[H]c(c([H])1)c(C)nn(C)1","InChI=1S/C5H8N2/c1-5-3-4-7(2)6-5/h3-4H,1-2H3","NODLZCJDRXTSJO-UHFFFAOYSA-N"
"[H]c(n1)c(C)c([H])n(C)1","InChI=1S/C5H8N2/c1-5-3-6-7(2)4-5/h3-4H,1-2H3","SZQCPPRPWDXLMM-UHFFFAOYSA-N"
"[H]c(n1)c([H])c(C)n(C)1","InChI=1S/C5H8N2/c1-5-3-4-6-7(5)2/h3-4H,1-2H3","LSZQMSSIUQNTDX-UHFFFAOYSA-N"
"CC1=CC(=NN1)C","InChI=1S/C5H8N2/c1-4-3-5(2)7-6-4/h3H,1-2H3,(H,6,7)","SDXAWLJRERMRKF-UHFFFAOYSA-N"
"CC(C1)=NCC1","InChI=1S/C5H9N/c1-5-3-2-4-6-5/h2-4H2,1H3","CTSZPNIMMLSKDV-UHFFFAOYSA-N"
"Cc(n1)c(C)sc(C)1","InChI=1S/C6H9NS/c1-4-5(2)8-6(3)7-4/h1-3H3","BAMPVSWRQZNDQC-UHFFFAOYSA-N"
"[H]c(c(C)1)c(C)n(C)n1","InChI=1S/C6H10N2/c1-5-4-6(2)8(3)7-5/h4H,1-3H3","HNOQAFMOBRWDKQ-UHFFFAOYSA-N"
"CC1=C(NN=C1C)C","InChI=1S/C6H10N2/c1-4-5(2)7-8-6(4)3/h1-3H3,(H,7,8)","HUVAAOZUPLEYBH-UHFFFAOYSA-N"
"[H]C(C1)=C(C)N(C)C1","InChI=1S/C6H11N/c1-6-4-3-5-7(6)2/h4H,3,5H2,1-2H3","MFGQUMAXNNHCNG-UHFFFAOYSA-N"
"CCC(C1)=NCC1","InChI=1S/C6H11N/c1-2-6-4-3-5-7-6/h2-5H2,1H3","MEPINLVYDXPOSN-UHFFFAOYSA-N"
"c(c2)cc(n1)c(c2)sc1","InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H","IOJUPLGTWVMSFF-UHFFFAOYSA-N"
"C1CCC2=C(C1)C=NN2","InChI=1S/C7H10N2/c1-2-4-7-6(3-1)5-8-9-7/h5H,1-4H2,(H,8,9)","GDSQTWDUCDSZEY-UHFFFAOYSA-N"
"[H]c(n1)c([H])c(C2)n(CCC2)1","InChI=1S/C7H10N2/c1-2-6-9-7(3-1)4-5-8-9/h4-5H,1-3,6H2","IDHRHHLXBFGLSE-UHFFFAOYSA-N"
"CC(=N1)C(C)(C)C(C)=N1","InChI=1S/C7H12N2/c1-5-7(3,4)6(2)9-8-5/h1-4H3","AIHABYFCZQBWLH-UHFFFAOYSA-N"
"c(c1)ccnc1","InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H","JUJWROOIHBZHMG-UHFFFAOYSA-N"
"C(C1)CCNC1","InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2","NQRYJNQNLNOLGT-UHFFFAOYSA-N"
"Oc(c1)nccc1","InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)","UBQKCCHYAOITMY-UHFFFAOYSA-N"
"CN(C1)CCCC1","InChI=1S/C6H13N/c1-7-5-3-2-4-6-7/h2-6H2,1H3","PAMIQIKDUOTOBW-UHFFFAOYSA-N"
"CC(C1)CCN(C)C1","InChI=1S/C7H15N/c1-7-3-5-8(2)6-4-7/h7H,3-6H2,1-2H3","TVSMLBGFGKLKOO-UHFFFAOYSA-N"
"CC(C1)CN(C)CC1","InChI=1S/C7H15N/c1-7-4-3-5-8(2)6-7/h7H,3-6H2,1-2H3","ONQLCPDIXPYJSS-UHFFFAOYSA-N"
"CC(C1)N(C)CCC1","InChI=1S/C7H15N/c1-7-5-3-4-6-8(7)2/h7H,3-6H2,1-2H3","MWUISCCBFHLWLY-UHFFFAOYSA-N"
"OC(=O)c(c1)nccc1","InChI=1S/C6H5NO2/c8-6(9)5-3-1-2-4-7-5/h1-4H,(H,8,9)","SIOXPEMLGUPBBT-UHFFFAOYSA-N"
"CC(C1)N(C)C(C)CC1","InChI=1S/C8H17N/c1-7-5-4-6-8(2)9(7)3/h7-8H,4-6H2,1-3H3","COSHJOZVKGAYBP-UHFFFAOYSA-N"
"c(c2)cc(c1)c(c2)ncc1","InChI=1S/C9H7N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-7H","SMWDFEZZVXVKRB-UHFFFAOYSA-N"
"CC(=C2)n(n1)c(C=C2)cc1","InChI=1S/C8H8N2/c1-7-3-2-4-8-5-6-9-10(7)8/h2-6H,1H3","WWDGTWAATSJUIM-UHFFFAOYSA-N"
"C(N2)Cc(c1)c(C2)ccc1","InChI=1S/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4,10H,5-7H2","UWYZHKAOTLEWKK-UHFFFAOYSA-N"
"C(C2)Cc(c1)c(C2)cnc1","InChI=1S/C9H11N/c1-2-4-9-7-10-6-5-8(9)3-1/h5-7H,1-4H2","HTMGQIXFZMZZKD-UHFFFAOYSA-N"
"CC(C)(C)c(c1)nccc1","InChI=1S/C9H13N/c1-9(2,3)8-6-4-5-7-10-8/h4-7H,1-3H3","UUIMDJFBHNDZOW-UHFFFAOYSA-N"
"Cc(c1)nc(c2)c(ccc2)c1","InChI=1S/C10H9N/c1-8-6-7-9-4-2-3-5-10(9)11-8/h2-7H,1H3","SMUQFGGVLNAIOZ-UHFFFAOYSA-N"
"Cc(c1)c(c2)c(ccc2)nc1","InChI=1S/C10H9N/c1-8-6-7-11-10-5-3-2-4-9(8)10/h2-7H,1H3","MUDSDYNRBDKLGK-UHFFFAOYSA-N"
"Cc(c1)cc(c2)c(ncc2)c1","InChI=1S/C10H9N/c1-8-4-5-10-9(7-8)3-2-6-11-10/h2-7H,1H3","LUYISICIYVKBTA-UHFFFAOYSA-N"
"Cc(c1)cc(n2)c(ccc2)c1","InChI=1S/C10H9N/c1-8-4-5-9-3-2-6-11-10(9)7-8/h2-7H,1H3","KDYVCOSVYOSHOL-UHFFFAOYSA-N"
"Cc(c1)c(n2)c(ccc2)cc1","InChI=1S/C10H9N/c1-8-4-2-5-9-6-3-7-11-10(8)9/h2-7H,1H3","JRLTTZUODKEYDH-UHFFFAOYSA-N"
"Oc(c1)cc(c2)c(ncc2)c1","InChI=1S/C9H7NO/c11-8-3-4-9-7(6-8)2-1-5-10-9/h1-6,11H","OVYWMEWYEJLIER-UHFFFAOYSA-N"
"Oc(c1)cc(n2)c(ccc2)c1","InChI=1S/C9H7NO/c11-8-4-3-7-2-1-5-10-9(7)6-8/h1-6,11H","XCRPPAPDRUBKRJ-UHFFFAOYSA-N"
"CCC#Cc(c1)cnc(C)c1","InChI=1S/C10H11N/c1-3-4-5-10-7-6-9(2)11-8-10/h6-8H,3H2,1-2H3","SOXYKYZFWYEZFK-UHFFFAOYSA-N"
"C#Cc(c1)cnc(c1)C(O)=O","InChI=1S/C8H5NO2/c1-2-6-3-4-7(8(10)11)9-5-6/h1,3-5H,(H,10,11)","ZCSPZVBBZKXFHF-UHFFFAOYSA-N"
"Cc(c1)cc(C2)c(CCC2)n1","InChI=1S/C10H13N/c1-8-6-9-4-2-3-5-10(9)11-7-8/h6-7H,2-5H2,1H3","GMMKZUPOLVXWFF-UHFFFAOYSA-N"
"OC(=O)C=Cc(c1)nccc1","InChI=1S/C8H7NO2/c10-8(11)5-4-7-3-1-2-6-9-7/h1-6H,(H,10,11)/b5-4+","LKDFTXDJKHGCAC-SNAWJCMRSA-N"
"CNN(C)C","InChI=1S/C3H10N2/c1-4-5(2)3/h4H,1-3H3","NIIPNAJXERMYOG-UHFFFAOYSA-N"
"CCNN(C)C","InChI=1S/C4H12N2/c1-4-5-6(2)3/h5H,4H2,1-3H3","TWWCBLSUGOSDIY-UHFFFAOYSA-N"
"CCCNN(C)C","InChI=1S/C5H14N2/c1-4-5-6-7(2)3/h6H,4-5H2,1-3H3","OZBIETPCMMGBGS-UHFFFAOYSA-N"
"CCCCNN(C)C","InChI=1S/C6H16N2/c1-4-5-6-7-8(2)3/h7H,4-6H2,1-3H3","RDWYDKHTFLJQJJ-UHFFFAOYSA-N"
"CCC(C)NN(C)C","InChI=1S/C6H16N2/c1-5-6(2)7-8(3)4/h6-7H,5H2,1-4H3","JNQHRUNRCVMHQV-UHFFFAOYSA-N"
"CCCCCNN(C)C","InChI=1S/C7H18N2/c1-4-5-6-7-8-9(2)3/h8H,4-7H2,1-3H3","YZLOLIUOQJTNRM-UHFFFAOYSA-N"
"CCCC(C)NN(C)C","InChI=1S/C7H18N2/c1-5-6-7(2)8-9(3)4/h7-8H,5-6H2,1-4H3","RQRHTWNEYRZHQK-UHFFFAOYSA-N"
"CN(C)NC(C)C(C)C","InChI=1S/C7H18N2/c1-6(2)7(3)8-9(4)5/h6-8H,1-5H3","GIVUQKPXEOZXCB-UHFFFAOYSA-N"
"CCCNN(CC)CC","InChI=1S/C7H18N2/c1-4-7-8-9(5-2)6-3/h8H,4-7H2,1-3H3","YFTVJZZMQIPLDM-UHFFFAOYSA-N"
"CCN(CC)NC(C)C","InChI=1S/C7H18N2/c1-5-9(6-2)8-7(3)4/h7-8H,5-6H2,1-4H3","NXZICZUBTFZKTO-UHFFFAOYSA-N"
"CCC(C)NN(CC)CC","InChI=1S/C8H20N2/c1-5-8(4)9-10(6-2)7-3/h8-9H,5-7H2,1-4H3","WFQSIAIFBOBSOD-UHFFFAOYSA-N"
"CCCCCNN(CC)CC","InChI=1S/C9H22N2/c1-4-7-8-9-10-11(5-2)6-3/h10H,4-9H2,1-3H3","MVMRYSSNWDNQEZ-UHFFFAOYSA-N"
"CCCNN(CCC)CCC","InChI=1S/C9H22N2/c1-4-7-10-11(8-5-2)9-6-3/h10H,4-9H2,1-3H3","JOGSSTIPCUFRHC-UHFFFAOYSA-N"
"CCCCC(C)NN(CC)CC","InChI=1S/C10H24N2/c1-5-8-9-10(4)11-12(6-2)7-3/h10-11H,5-9H2,1-4H3","XDLSHZQLGZQWAF-UHFFFAOYSA-N"
"C=CCNN(CC=C)CC=C","InChI=1S/C9H16N2/c1-4-7-10-11(8-5-2)9-6-3/h4-6,10H,1-3,7-9H2","DQSIAGHCYOKRFM-UHFFFAOYSA-N"
"CC=CCNN(CC=CC)CC=CC","InChI=1S/C12H22N2/c1-4-7-10-13-14(11-8-5-2)12-9-6-3/h4-9,13H,10-12H2,1-3H3/b7-4+,8-5+,9-6+","ROGVVIJLTDOPKB-OTWDQPKHSA-N"
"CC=NNC","InChI=1S/C3H8N2/c1-3-5-4-2/h3-4H,1-2H3/b5-3+","WIMYYXRANPYBED-HWKANZROSA-N"
"CCNN=CC","InChI=1S/C4H10N2/c1-3-5-6-4-2/h3,6H,4H2,1-2H3/b5-3+","ZVIGWRFKAYDBHV-HWKANZROSA-N"
"CCCNN=CC","InChI=1S/C5H12N2/c1-3-5-7-6-4-2/h4,7H,3,5H2,1-2H3/b6-4+","JBTBOJIWJFQQPH-GQCTYLIASA-N"
"CC=NNC(C)C","InChI=1S/C5H12N2/c1-4-6-7-5(2)3/h4-5,7H,1-3H3/b6-4+","CHDZJJJPEGMSAM-GQCTYLIASA-N"
"CNN=CC(C)C","InChI=1S/C5H12N2/c1-5(2)4-7-6-3/h4-6H,1-3H3/b7-4+","QLVOGAHIAVPTFB-QPJJXVBHSA-N"
"CCCCNN=CC","InChI=1S/C6H14N2/c1-3-5-6-8-7-4-2/h4,8H,3,5-6H2,1-2H3/b7-4+","CGCWYQXCVFERRJ-QPJJXVBHSA-N"
"CCCC=NNCC","InChI=1S/C6H14N2/c1-3-5-6-8-7-4-2/h6-7H,3-5H2,1-2H3/b8-6+","YICJUYKPMNNKIA-SOFGYWHQSA-N"
"CCNN=CC(C)C","InChI=1S/C6H14N2/c1-4-7-8-5-6(2)3/h5-7H,4H2,1-3H3/b8-5+","RKTNZIQSYZDTJV-VMPITWQZSA-N"
"CCCCNN=CCC","InChI=1S/C7H16N2/c1-3-5-7-9-8-6-4-2/h6,9H,3-5,7H2,1-2H3/b8-6+","HSFHCHXOARWRSD-SOFGYWHQSA-N"
"O=Cc(c1)cc(OC)c(O)c1","InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3","MWOOGOJBHIARFG-UHFFFAOYSA-N"
"O=Cc(c1)c(O)c(OC)cc1","InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-9)8(7)10/h2-5,10H,1H3","JJVNINGBHGBWJH-UHFFFAOYSA-N"
"O=Cc(c1)ccc(OC)c1","InChI=1S/C8H8O2/c1-10-8-4-2-7(6-9)3-5-8/h2-6H,1H3","ZRSNZINYAWTAHE-UHFFFAOYSA-N"
"CC(=O)c(c1)ccc(Br)c1","InChI=1S/C8H7BrO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3","WYECURVXVYPVAT-UHFFFAOYSA-N"
"COc(c1)ccc(C=CC(O)=O)c1","InChI=1S/C10H10O3/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-4+","AFDXODALSZRGIH-QPJJXVBHSA-N"
"COc(c1)c(OC)cc(C(C)=O)c(O)1","InChI=1S/C10H12O4/c1-6(11)7-4-9(13-2)10(14-3)5-8(7)12/h4-5,12H,1-3H3","KEQHBVWVKYHDCS-UHFFFAOYSA-N"
"COc(c1)c(O)cc(C(C)=O)c(O)1","InChI=1S/C9H10O4/c1-5(10)6-3-8(12)9(13-2)4-7(6)11/h3-4,11-12H,1-2H3","TXBDGLVJCSOBLF-UHFFFAOYSA-N"
"CC(=O)c(c1)c(O)ccc(O)1","InChI=1S/C8H8O3/c1-5(9)7-4-6(10)2-3-8(7)11/h2-4,10-11H,1H3","WLDWSGZHNBANIO-UHFFFAOYSA-N"
"COc(c1)cc(C(C)=O)c(O)c1","InChI=1S/C9H10O3/c1-6(10)8-5-7(12-2)3-4-9(8)11/h3-5,11H,1-2H3","MLIBGOFSXXWRIY-UHFFFAOYSA-N"
"COc(c1)c(O)c(cc1)C(C)=O","InChI=1S/C9H10O3/c1-6(10)7-4-3-5-8(12-2)9(7)11/h3-5,11H,1-2H3","VZEOJJIAYZCDPI-UHFFFAOYSA-N"
"c(c3)ccc(c3)CCC(=C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C17H14O2/c18-16-12-14(11-10-13-6-2-1-3-7-13)19-17-9-5-4-8-15(16)17/h1-9,12H,10-11H2","VNZNWFQJBFLELF-UHFFFAOYSA-N"
"COc(c3)c(ccc3)CCC(=C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C18H16O3/c1-20-17-8-4-2-6-13(17)10-11-14-12-16(19)15-7-3-5-9-18(15)21-14/h2-9,12H,10-11H2,1H3","MXICWRQECYSJOT-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(=O)C=C(CCc(c2)cccc2)1","InChI=1S/C18H16O3/c1-20-14-9-10-16-17(19)11-15(21-18(16)12-14)8-7-13-5-3-2-4-6-13/h2-6,9-12H,7-8H2,1H3","BWXDUMOSQSGFDH-UHFFFAOYSA-N"
"COc(c3)cc(C(=O)1)c(c3)OC(CCc(c2)cccc2)=C1","InChI=1S/C18H16O3/c1-20-14-9-10-18-16(11-14)17(19)12-15(21-18)8-7-13-5-3-2-4-6-13/h2-6,9-12H,7-8H2,1H3","JOYYVGVYUHRBAE-UHFFFAOYSA-N"
"COc(c3)c(O1)c(cc3)C(=O)C=C(CCc(c2)cccc2)1","InChI=1S/C18H16O3/c1-20-17-9-5-8-15-16(19)12-14(21-18(15)17)11-10-13-6-3-2-4-7-13/h2-9,12H,10-11H2,1H3","ZNQDWWWTGJNVBY-UHFFFAOYSA-N"
"CC(=O)Nc(c1)ccc(O)c1","InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)","RZVAJINKPMORJF-UHFFFAOYSA-N"
"COc(c2)c(c(O)cc2)C(=O)CC(=O)CCc(c1)cccc1","InChI=1S/C18H18O4/c1-22-17-9-5-8-15(20)18(17)16(21)12-14(19)11-10-13-6-3-2-4-7-13/h2-9,20H,10-12H2,1H3","MJQKQMBXOFONLS-UHFFFAOYSA-N"
"COc(c2)cc(c(O)c2)C(=O)CC(=O)CCc(c1)cccc1","InChI=1S/C18H18O4/c1-22-15-9-10-17(20)16(12-15)18(21)11-14(19)8-7-13-5-3-2-4-6-13/h2-6,9-10,12,20H,7-8,11H2,1H3","YLCRSEPRBRMYQY-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(C(=O)2)c(OC(CCc(c3)cccc3)=C2)1","InChI=1S/C19H18O4/c1-21-18-11-15-16(20)10-14(23-17(15)12-19(18)22-2)9-8-13-6-4-3-5-7-13/h3-7,10-12H,8-9H2,1-2H3","MVQOWXHYPYRBOE-UHFFFAOYSA-N"
"Oc(c3)cc(C(=O)1)c(c3)OC(CCc(c2)cccc2)=C1","InChI=1S/C17H14O3/c18-13-7-9-17-15(10-13)16(19)11-14(20-17)8-6-12-4-2-1-3-5-12/h1-5,7,9-11,18H,6,8H2","QIYUDFMVCDXKBQ-UHFFFAOYSA-N"
"OC(C1)C(C2)CC(C2)1","InChI=1S/C7H12O/c8-7-4-5-1-2-6(7)3-5/h5-8H,1-4H2/t5-,6+,7-/m1/s1","ZQTYQMYDIHMKQB-DSYKOEDSSA-N"
"OC(C1)C(C2)CC(C2)1","InChI=1S/C7H12O/c8-7-4-5-1-2-6(7)3-5/h5-8H,1-4H2/t5-,6+,7+/m1/s1","ZQTYQMYDIHMKQB-VQVTYTSYSA-N"
"OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m0/s1","DTGKSKDOIYIVQL-OYNCUSHFSA-N"
"OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8+,10+/m0/s1","DTGKSKDOIYIVQL-QXFUBDJGSA-N"
"[H]c(n1)n(C)c(C(=O)2)c1N(C)C(=O)N(C)2","InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3","RYYVLZVUVIJVGH-UHFFFAOYSA-N"
"NC(=O)c(c1)cccc1","InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)","KXDAEFPNCMNJSK-UHFFFAOYSA-N"
"NC(=O)c(c1)c(O)ccc1","InChI=1S/C7H7NO2/c8-7(10)5-3-1-2-4-6(5)9/h1-4,9H,(H2,8,10)","SKZKKFZAGNVIMN-UHFFFAOYSA-N"
"CCOc(c1)c(ccc1)C(N)=O","InChI=1S/C9H11NO2/c1-2-12-8-6-4-3-5-7(8)9(10)11/h3-6H,2H2,1H3,(H2,10,11)","SBNKFTQSBPKMBZ-UHFFFAOYSA-N"
"CCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C10H22O2Si/c1-5-6-7-8-9-10(11)12-13(2,3)4/h5-9H2,1-4H3","AMUGRUMFZAKWNM-UHFFFAOYSA-N"
"CCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C11H24O2Si/c1-5-6-7-8-9-10-11(12)13-14(2,3)4/h5-10H2,1-4H3","GRHSLTISTCPPAT-UHFFFAOYSA-N"
"CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C12H26O2Si/c1-5-6-7-8-9-10-11-12(13)14-15(2,3)4/h5-11H2,1-4H3","ISTGUORKGWWKMI-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C13H28O2Si/c1-5-6-7-8-9-10-11-12-13(14)15-16(2,3)4/h5-12H2,1-4H3","FGTNBYWFNITQJR-UHFFFAOYSA-N"
"CCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C14H30O2Si/c1-5-6-7-8-9-10-11-12-13-14(15)16-17(2,3)4/h5-13H2,1-4H3","PVQUEUNCRLSHJP-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C15H32O2Si/c1-5-6-7-8-9-10-11-12-13-14-15(16)17-18(2,3)4/h5-14H2,1-4H3","RHDZBWSXEZTMPK-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C16H34O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16(17)18-19(2,3)4/h5-15H2,1-4H3","UZUTZCYXYDHJAT-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C18H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-21(2,3)4/h5-17H2,1-4H3","SHDTWSQDHLKGEO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C19H40O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-22(2,3)4/h5-18H2,1-4H3","HKNNSWCACQFVIK-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C20H42O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-23(2,3)4/h5-19H2,1-4H3","KCEZRIREPDDPDI-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C21H44O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h5-20H2,1-4H3","DDLPZVTUKLKVQB-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C22H46O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-25(2,3)4/h5-21H2,1-4H3","DQTLRECATIBSSN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C23H48O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-26(2,3)4/h5-22H2,1-4H3","AYSGFBVOWSXJCN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C24H50O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-27(2,3)4/h5-23H2,1-4H3","RZWSAJMDACSTKQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C25H52O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27-28(2,3)4/h5-24H2,1-4H3","BJBBFOVJCKMBAL-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C26H54O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27)28-29(2,3)4/h5-25H2,1-4H3","KYTCCEWJBLIPMI-UHFFFAOYSA-N"
"CCCCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C17H34O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-20(2,3)4/h8-9H,5-7,10-16H2,1-4H3/b9-8-","LMYWVFVYLKKYSP-HJWRWDBZSA-N"
"CCCCCCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C19H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-22(2,3)4/h10-11H,5-9,12-18H2,1-4H3/b11-10-","UNUADFKHVGBUHA-KHPPLWFESA-N"
"CCCCCCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C19H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-22(2,3)4/h10-11H,5-9,12-18H2,1-4H3/b11-10+","UNUADFKHVGBUHA-ZHACJKMWSA-N"
"CCCCCCCCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C21H42O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h12-13H,5-11,14-20H2,1-4H3/b13-12+","GAODWSYPSJBKGB-OUKQBFOZSA-N"
"CCCCCCCCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C21H42O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h12-13H,5-11,14-20H2,1-4H3/b13-12-","GAODWSYPSJBKGB-SEYXRHQNSA-N"
"CCCCCC=CCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C21H40O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h9-10,12-13H,5-8,11,14-20H2,1-4H3/b10-9-,13-12-","MXGBYOVWUYSJSN-UTJQPWESSA-N"
"CCCCCC=CCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C21H40O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h9-10,12-13H,5-8,11,14-20H2,1-4H3/b10-9+,13-12+","MXGBYOVWUYSJSN-OKLKQMLOSA-N"
"CCC=CCC=CCC=CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C21H38O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-24(2,3)4/h6-7,9-10,12-13H,5,8,11,14-20H2,1-4H3/b7-6-,10-9-,13-12-","DCFAEXKJEMZTKR-QNEBEIHSSA-N"
"CCCCCCCCC=CCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C25H50O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27-28(2,3)4/h12-13H,5-11,14-24H2,1-4H3/b13-12-","AYZOMQWLRBJULM-SEYXRHQNSA-N"
"CCCCCCCCCCCCCCC=CCCCC(=O)O[Si](C)(C)C","InChI=1S/C23H46O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-26(2,3)4/h18-19H,5-17,20-22H2,1-4H3/b19-18-","RJXIKISKUHWPGB-HNENSFHCSA-N"
"CCCCCCCCC=CCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C27H54O2Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(28)29-30(2,3)4/h12-13H,5-11,14-26H2,1-4H3/b13-12-","OQABBMMAIBXADF-SEYXRHQNSA-N"
"Cc(c1)c(ccc1)C(=O)O[Si](C)(C)C","InChI=1S/C11H16O2Si/c1-9-7-5-6-8-10(9)11(12)13-14(2,3)4/h5-8H,1-4H3","QWDJSIANUZLFHV-UHFFFAOYSA-N"
"Cc(c1)cc(cc1)C(=O)O[Si](C)(C)C","InChI=1S/C11H16O2Si/c1-9-6-5-7-10(8-9)11(12)13-14(2,3)4/h5-8H,1-4H3","MFPKMKJUNGWICD-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C11H16O2Si/c1-9-5-7-10(8-6-9)11(12)13-14(2,3)4/h5-8H,1-4H3","GKODXEXJNJLBCA-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(c1)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-9-6-7-11(10(2)8-9)12(13)14-15(3,4)5/h6-8H,1-5H3","MYTFEBMPQUXFJH-UHFFFAOYSA-N"
"Cc(c1)c(C)cc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-9-6-7-11(8-10(9)2)12(13)14-15(3,4)5/h6-8H,1-5H3","GVQLTVPJABMNKV-UHFFFAOYSA-N"
"Cc(c1)cc(cc(C)1)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-9-6-10(2)8-11(7-9)12(13)14-15(3,4)5/h6-8H,1-5H3","GBGATKYBYBVWNS-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)c(c1)ccc(c1)O[Si](C)(C)C","InChI=1S/C13H22O3Si2/c1-17(2,3)15-12-9-7-11(8-10-12)13(14)16-18(4,5)6/h7-10H,1-6H3","XVCXIVAVMFNKDH-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1O[Si](C)(C)C)c(ccc1)O[Si](C)(C)C","InChI=1S/C16H30O4Si3/c1-21(2,3)18-13-11-10-12-14(19-22(4,5)6)15(13)16(17)20-23(7,8)9/h10-12H,1-9H3","APVNJYLNHAHELF-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(ccc1)C(=O)O[Si](C)(C)C","InChI=1S/C14H22O4Si2/c1-19(2,3)17-13(15)11-9-7-8-10-12(11)14(16)18-20(4,5)6/h7-10H,1-6H3","JUZOFKLPPHUUMC-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)c(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C14H22O4Si2/c1-19(2,3)17-13(15)11-7-9-12(10-8-11)14(16)18-20(4,5)6/h7-10H,1-6H3","XNDCJULFVFHXBR-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(C(=O)O[Si](C)(C)C)c(cc1)C(=O)O[Si](C)(C)C","InChI=1S/C18H30O6Si3/c1-25(2,3)22-16(19)13-11-10-12-14(17(20)23-26(4,5)6)15(13)18(21)24-27(7,8)9/h10-12H,1-9H3","MCOGBFHSUQCHJJ-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)cc(cc1C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C18H30O6Si3/c1-25(2,3)22-16(19)13-10-14(17(20)23-26(4,5)6)12-15(11-13)18(21)24-27(7,8)9/h10-12H,1-9H3","NIFKKMJOBRRANX-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(C(=O)O[Si](C)(C)C)cc(C(=O)O[Si](C)(C)C)c(C(=O)O[Si](C)(C)C)1","InChI=1S/C22H38O8Si4/c1-31(2,3)27-19(23)15-13-17(21(25)29-33(7,8)9)18(22(26)30-34(10,11)12)14-16(15)20(24)28-32(4,5)6/h13-14H,1-12H3","BKFGZLAJFGESBT-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C14H16O2Si/c1-17(2,3)16-14(15)13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,1-3H3","UUTZVQNCBBAIBO-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C14H16O2Si/c1-17(2,3)16-14(15)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3","LCECHEBBTQXPPG-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(O[Si](C)(C)C)c(c2)c(ccc2)c1","InChI=1S/C17H24O3Si2/c1-21(2,3)19-16-14-10-8-7-9-13(14)11-12-15(16)17(18)20-22(4,5)6/h7-12H,1-6H3","VOQDDXJNIUGFKD-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1O[Si](C)(C)C)c(c2)c(ccc2)cc1","InChI=1S/C17H24O3Si2/c1-21(2,3)19-15-12-11-13-9-7-8-10-14(13)16(15)17(18)20-22(4,5)6/h7-12H,1-6H3","DZGQTVQTZLFKGN-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(O[Si](C)(C)C)cc(c2)c(ccc2)1","InChI=1S/C17H24O3Si2/c1-21(2,3)19-16-12-14-10-8-7-9-13(14)11-15(16)17(18)20-22(4,5)6/h7-12H,1-6H3","SGSKFENRYUZSIQ-UHFFFAOYSA-N"
"CCCCCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C18H40O3Si2/c1-8-9-10-11-12-13-14-15-16-17(20-22(2,3)4)18(19)21-23(5,6)7/h17H,8-16H2,1-7H3","YLQUHHPRDMSJTR-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C20H44O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19(22-24(2,3)4)20(21)23-25(5,6)7/h19H,8-18H2,1-7H3","RDVMVTBJXWMHMH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C22H48O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21(24-26(2,3)4)22(23)25-27(5,6)7/h21H,8-20H2,1-7H3","ZDIZSQOYKPNOIV-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C24H52O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(26-28(2,3)4)24(25)27-29(5,6)7/h23H,8-22H2,1-7H3","ZCCYWXIRPWEWFM-UHFFFAOYSA-N"
"C(CCCCCCCCCCCCCCCCCC)(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C26H56O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(28-30(2,3)4)26(27)29-31(5,6)7/h25H,8-24H2,1-7H3","UVWFZVLVNGBIJE-UHFFFAOYSA-N"
"CCC(C)CCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C15H32O2Si/c1-6-14(2)12-10-8-7-9-11-13-15(16)17-18(3,4)5/h14H,6-13H2,1-5H3","QESOHYICRZEKLH-UHFFFAOYSA-N"
"CCC(C)CCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C16H34O2Si/c1-6-15(2)13-11-9-7-8-10-12-14-16(17)18-19(3,4)5/h15H,6-14H2,1-5H3","IHHDEEVODWBADL-UHFFFAOYSA-N"
"CCC(C)CCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C17H36O2Si/c1-6-16(2)14-12-10-8-7-9-11-13-15-17(18)19-20(3,4)5/h16H,6-15H2,1-5H3","ISWALEPYECAUOV-UHFFFAOYSA-N"
"CCC(C)CCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C18H38O2Si/c1-6-17(2)15-13-11-9-7-8-10-12-14-16-18(19)20-21(3,4)5/h17H,6-16H2,1-5H3","DAZJVRZDDOKGCP-UHFFFAOYSA-N"
"CCC(C)CCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C20H42O2Si/c1-6-19(2)17-15-13-11-9-7-8-10-12-14-16-18-20(21)22-23(3,4)5/h19H,6-18H2,1-5H3","GBSVQRPDHICZLY-UHFFFAOYSA-N"
"CCC(C)CCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C21H44O2Si/c1-6-20(2)18-16-14-12-10-8-7-9-11-13-15-17-19-21(22)23-24(3,4)5/h20H,6-19H2,1-5H3","YEGUXTXZHGLIGR-UHFFFAOYSA-N"
"CCC(C)CCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C22H46O2Si/c1-6-21(2)19-17-15-13-11-9-7-8-10-12-14-16-18-20-22(23)24-25(3,4)5/h21H,6-20H2,1-5H3","HNKZWPWPYTXLNR-UHFFFAOYSA-N"
"O(C)C(C(OC)([H])1)(C(OC)(C(COC)([H])OC1(OCC(N(C)C(=O)CCCCCCCCCCCCCCCCCCCCCCC)([H])C(C(=C(CCCCCCCCCCCCC)[H])[H])([H])OC)[H])[H])[H]","InChI=1S/C54H105NO8/c1-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-50(56)55(3)47(45-62-54-53(61-8)52(60-7)51(59-6)49(63-54)46-57-4)48(58-5)43-41-39-37-35-33-31-22-20-18-16-14-12-10-2/h41,43,47-49,51-54H,9-40,42,44-46H2,1-8H3/b43-41+/t47-,48-,49?,51?,52?,53?,54?/m0/s1","OKQZRCRESBPWKR-MFHORLMWSA-N"
"C(C1(OC(C3([H])O)(C(CO)(OC(C3([H])O)([H])OC([H])(C2([H])O)C(CO)(OC(OCC(C([H])(O)C(=C([H])CCCCCCCCCCCCC)[H])(NC(=O)CCCCCCCCCCCCCCCCCCCCCCC)[H])(C([H])(O)2)[H])[H])[H])[H])[H])([H])(O)C(C([H])(O)C([H])(O1)CO)([H])O","InChI=1S/C60H113NO18/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-48(66)61-43(44(65)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2)42-74-58-54(72)51(69)56(46(40-63)76-58)79-60-55(73)52(70)57(47(41-64)77-60)78-59-53(71)50(68)49(67)45(39-62)75-59/h35,37,43-47,49-60,62-65,67-73H,3-34,36,38-42H2,1-2H3,(H,61,66)/b37-35+/t43-,44+,45?,46?,47?,49?,50?,51?,52?,53?,54?,55?,56?,57?,58?,59?,60?/m0/s1","MRVRZXMLIKCXOT-BRFIPFQISA-N"
"O(C([H])3OCC(C([H])(O)C(=C(CCCCCCCCCCCCC)[H])[H])([H])NC(=O)CCCCCCCCCCCCCCCCC)C(C(C([H])(O)C3([H])O)(OC([H])(C2([H])O)OC([H])(C(C([H])(O)2)([H])OC(O1)(C([H])(C(C([H])(O)C([H])1CO)([H])O)NC(C)=O)[H])CO)[H])([H])CO","InChI=1S/C56H104N2O18/c1-4-6-8-10-12-14-16-18-19-21-23-25-27-29-31-33-44(64)58-39(40(63)32-30-28-26-24-22-20-17-15-13-11-9-7-5-2)37-71-55-50(69)48(67)53(42(35-60)73-55)76-56-51(70)49(68)52(43(36-61)74-56)75-54-45(57-38(3)62)47(66)46(65)41(34-59)72-54/h30,32,39-43,45-56,59-61,63,65-70H,4-29,31,33-37H2,1-3H3,(H,57,62)(H,58,64)/b32-30+/t39-,40+,41?,42?,43?,45?,46?,47?,48?,49?,50?,51?,52?,53?,54?,55?,56?/m0/s1","FOCMISOLVPZNSV-YDZBSKKZSA-N"
"c(c4)ccc(c4)C(=C1)Oc(c32)c(ccc(cccc3)2)C(=O)1","InChI=1S/C19H12O2/c20-17-12-18(14-7-2-1-3-8-14)21-19-15-9-5-4-6-13(15)10-11-16(17)19/h1-12H","VFMMPHCGEFXGIP-UHFFFAOYSA-N"
"CC(=O)Oc(c3)cc(O1)c(c3)C(=O)C(C)C(c(c2)cccc2)1","InChI=1S/C18H16O4/c1-11-17(20)15-9-8-14(21-12(2)19)10-16(15)22-18(11)13-6-4-3-5-7-13/h3-11,18H,1-2H3","VFEOZVUQKFQCPV-UHFFFAOYSA-N"
"c(c5)(O)cc(c(c52)C(C(OC(O3)C(C(C(C3COC(C4O)OC(C(C4O)O)C)O)O)O)=C(O2)c(c1)ccc(O)c1O)=O)O","InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3","IKGXIBQEEMLURG-UHFFFAOYSA-N"
"Cc(c3)cc(O1)c(c(C)3)C(=O)CC(c(c2)cccc2)1","InChI=1S/C17H16O2/c1-11-8-12(2)17-14(18)10-15(19-16(17)9-11)13-6-4-3-5-7-13/h3-9,15H,10H2,1-2H3","FGUBFGWYEYFGRK-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(O1)C([2H])([2H])C(=O)c(c2)c(ccc2)1","InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2/i10D2","ZONYXWQDUYMKFB-KBMKNGFXSA-N"
"c(c3)ccc(c3)C(C1)C(=O)c(c2)c(ccc2)O1","InChI=1S/C15H12O2/c16-15-12-8-4-5-9-14(12)17-10-13(15)11-6-2-1-3-7-11/h1-9,13H,10H2","RTRZOHKLISMNRD-UHFFFAOYSA-N"
"CC(=O)Oc(c3)cc(O1)c(c3)C(=O)CC(c(c2)cccc2)1","InChI=1S/C17H14O4/c1-11(18)20-13-7-8-14-15(19)10-16(21-17(14)9-13)12-5-3-2-4-6-12/h2-9,16H,10H2,1H3","FYRRXPWKGPMJGS-UHFFFAOYSA-N"
"CCOCC(C(=O)2)C(Oc(c3)c(ccc3)2)c(c1)cccc1","InChI=1S/C18H18O3/c1-2-20-12-15-17(19)14-10-6-7-11-16(14)21-18(15)13-8-4-3-5-9-13/h3-11,15,18H,2,12H2,1H3","DYIDBRFSFOBDRS-UHFFFAOYSA-N"
"Cc(c(C)3)cc(O1)c(c3)C(=O)C(O)=C1c(c2)c(O)ccc2","InChI=1S/C17H14O4/c1-9-7-12-14(8-10(9)2)21-17(16(20)15(12)19)11-5-3-4-6-13(11)18/h3-8,18,20H,1-2H3","VWLRAEZRMWHEKE-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2","ZONYXWQDUYMKFB-UHFFFAOYSA-N"
"ClCC(C(=O)2)C(Oc(c3)c(ccc3)2)c(c1)cccc1","InChI=1S/C16H13ClO2/c17-10-13-15(18)12-8-4-5-9-14(12)19-16(13)11-6-2-1-3-7-11/h1-9,13,16H,10H2","NYJFZNXMDGRALL-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(=O)C(O)=C(c(c2)cccc2)1","InChI=1S/C16H12O4/c1-19-11-7-8-12-13(9-11)20-16(15(18)14(12)17)10-5-3-2-4-6-10/h2-9,18H,1H3","IPRIGHIBTRMTDP-UHFFFAOYSA-N"
"Cc(c3)cc(O1)c(c(C)3)C(=O)C(O)=C1c(c2)c(O)ccc2","InChI=1S/C17H14O4/c1-9-7-10(2)14-13(8-9)21-17(16(20)15(14)19)11-5-3-4-6-12(11)18/h3-8,18,20H,1-2H3","JKOTWEMYCDJUBR-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(O1)=C(O)C(=O)c(c2)c(c(C)cc(C)2)1","InChI=1S/C18H16O4/c1-10-8-11(2)17-14(9-10)15(19)16(20)18(22-17)12-4-6-13(21-3)7-5-12/h4-9,20H,1-3H3","QZGAIHVBUJBVAJ-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(O1)=C(OC(C)=O)C(=O)c(c2)c(c(C)cc(C)2)1","InChI=1S/C20H18O5/c1-11-9-12(2)18-16(10-11)17(22)20(24-13(3)21)19(25-18)14-5-7-15(23-4)8-6-14/h5-10H,1-4H3","PPEZBPVFRKFLPH-UHFFFAOYSA-N"
"COc(c3)c(ccc3)C(O1)=C(O)C(=O)c(c2)c(c(C)cc(C)2)1","InChI=1S/C18H16O4/c1-10-8-11(2)17-13(9-10)15(19)16(20)18(22-17)12-6-4-5-7-14(12)21-3/h4-9,20H,1-3H3","CKYROZVHVFINGB-UHFFFAOYSA-N"
"Cc(c4)cc(C(=O)3)c(c(C)4)OC(=C(O)3)c(c1)cc(O2)c(OC2)c1","InChI=1S/C18H14O5/c1-9-5-10(2)17-12(6-9)15(19)16(20)18(23-17)11-3-4-13-14(7-11)22-8-21-13/h3-7,20H,8H2,1-2H3","RXMMWEZQTMBQMX-UHFFFAOYSA-N"
"Cc(c(C)4)cc(O1)c(c4)C(=O)C(O)=C1c(c2)cc(O3)c(OC3)c2","InChI=1S/C18H14O5/c1-9-5-12-14(6-10(9)2)23-18(17(20)16(12)19)11-3-4-13-15(7-11)22-8-21-13/h3-7,20H,8H2,1-2H3","PWMCXORTEBREOI-UHFFFAOYSA-N"
"Cc(c4)cc(O1)c(c(C)4)C(=O)C(O)=C1c(c2)cc(O3)c(OC3)c2","InChI=1S/C18H14O5/c1-9-5-10(2)15-14(6-9)23-18(17(20)16(15)19)11-3-4-12-13(7-11)22-8-21-12/h3-7,20H,8H2,1-2H3","RGZLZBBUYLAGAY-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(O1)=C(O)C(=O)c(c2)c(cc(OC)c(OC)2)1","InChI=1S/C18H16O6/c1-21-11-6-4-10(5-7-11)18-17(20)16(19)12-8-14(22-2)15(23-3)9-13(12)24-18/h4-9,20H,1-3H3","IOZLPDWMWQMTRB-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(C(=O)2)c1OC(c(c3)cccc3)=C(O)2","InChI=1S/C17H14O5/c1-20-13-8-11-12(9-14(13)21-2)22-17(16(19)15(11)18)10-6-4-3-5-7-10/h3-9,19H,1-2H3","CXKVYFJOUOCBNA-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(O1)=C(O)C(=O)c(c2)c(cc(OC)c2)1","InChI=1S/C17H14O5/c1-20-11-5-3-10(4-6-11)17-16(19)15(18)13-8-7-12(21-2)9-14(13)22-17/h3-9,19H,1-2H3","IFHXSMSQHPVVSF-UHFFFAOYSA-N"
"Oc(c3)ccc(c3)C(=C1)Oc(c(C)2)c(cc(C)c2)C(=O)1","InChI=1S/C17H14O3/c1-10-7-11(2)17-14(8-10)15(19)9-16(20-17)12-3-5-13(18)6-4-12/h3-9,18H,1-2H3","OFKORUIULNKNTE-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(=C1)Oc(c2)c(ccc(OC)2)C(=O)1","InChI=1S/C17H14O4/c1-19-12-5-3-11(4-6-12)16-10-15(18)14-8-7-13(20-2)9-17(14)21-16/h3-10H,1-2H3","LGTXUFBDCDFQIU-UHFFFAOYSA-N"
"COc(c3)c(ccc3)C(O1)=C([H])C(=O)c(c2)c(c(C)cc(C)2)1","InChI=1S/C18H16O3/c1-11-8-12(2)18-14(9-11)15(19)10-17(21-18)13-6-4-5-7-16(13)20-3/h4-10H,1-3H3","HFHBEJUXTUJQQE-UHFFFAOYSA-N"
"Cc(c4)cc(O1)c(c(C)4)C(=O)C=C1c(c2)cc(O3)c(OC3)c2","InChI=1S/C18H14O4/c1-10-5-11(2)18-13(19)8-15(22-17(18)6-10)12-3-4-14-16(7-12)21-9-20-14/h3-8H,9H2,1-2H3","IJEQRGAFOCRACT-UHFFFAOYSA-N"
"Cc(c4)cc(O1)c(c(C)4)C(=O)CC1c(c2)cc(O3)c(OC3)c2","InChI=1S/C18H16O4/c1-10-5-11(2)18-13(19)8-15(22-17(18)6-10)12-3-4-14-16(7-12)21-9-20-14/h3-7,15H,8-9H2,1-2H3","SPBSYOLNSKXKCE-UHFFFAOYSA-N"
"Oc(c3)ccc(c3)C(C1)Oc(c(C)2)c(cc(C)c2)C(=O)1","InChI=1S/C17H16O3/c1-10-7-11(2)17-14(8-10)15(19)9-16(20-17)12-3-5-13(18)6-4-12/h3-8,16,18H,9H2,1-2H3","LSMHCOJGFISUKD-UHFFFAOYSA-N"
"Cc(c3)cc(O1)c(c(C)3)C(=O)CC1c(c2)c(O)ccc2","InChI=1S/C17H16O3/c1-10-7-11(2)17-14(19)9-15(20-16(17)8-10)12-5-3-4-6-13(12)18/h3-8,15,18H,9H2,1-2H3","DEKDBFXVDVDQPZ-UHFFFAOYSA-N"
"COc(c3)c(ccc3)C(C1)Oc(c(C)2)c(cc(C)c2)C(=O)1","InChI=1S/C18H18O3/c1-11-8-12(2)18-14(9-11)15(19)10-17(21-18)13-6-4-5-7-16(13)20-3/h4-9,17H,10H2,1-3H3","QMWLBAVBYOGPTM-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(C1)Oc(c(C)2)c(cc(C)c2)C(=O)1","InChI=1S/C18H18O3/c1-11-8-12(2)18-15(9-11)16(19)10-17(21-18)13-4-6-14(20-3)7-5-13/h4-9,17H,10H2,1-3H3","UNFLBMXWNRUSEV-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(C1)Oc(c2)c(cc(C)c(C)2)C(=O)1","InChI=1S/C18H18O3/c1-11-8-15-16(19)10-17(21-18(15)9-12(11)2)13-4-6-14(20-3)7-5-13/h4-9,17H,10H2,1-3H3","VCYHOARLXPOAOS-UHFFFAOYSA-N"
"CC(=O)Oc(c3)ccc(c3)C(C1)Oc(c2)c(c(C)cc(C)2)C(=O)1","InChI=1S/C19H18O4/c1-11-8-12(2)19-16(21)10-17(23-18(19)9-11)14-4-6-15(7-5-14)22-13(3)20/h4-9,17H,10H2,1-3H3","WNRAFEAHULVCKS-UHFFFAOYSA-N"
"ON=C(C(=O)3)C(Oc(c4)c(c(C)cc(C)4)3)c(c1)cc(O2)c(OC2)c1","InChI=1S/C18H15NO5/c1-9-5-10(2)15-14(6-9)24-18(16(19-21)17(15)20)11-3-4-12-13(7-11)23-8-22-12/h3-7,18,21H,8H2,1-2H3/b19-16+","ANHGPFLAHXFYNN-KNTRCKAVSA-N"
"COc(c(O)3)cc(cc3)C(C1)Oc(c2)c(c(C)cc(C)2)C(=O)1","InChI=1S/C18H18O4/c1-10-6-11(2)18-14(20)9-15(22-17(18)7-10)12-4-5-13(19)16(8-12)21-3/h4-8,15,19H,9H2,1-3H3","LHBVQDKFRXIKGP-UHFFFAOYSA-N"
"Nc(c3)ccc(c3)C(C1)Oc(c2)c(c(C)cc(C)2)C(=O)1","InChI=1S/C17H17NO2/c1-10-7-11(2)17-14(19)9-15(20-16(17)8-10)12-3-5-13(18)6-4-12/h3-8,15H,9,18H2,1-2H3","NPPGNJXCMWJYPI-UHFFFAOYSA-N"
"CC(=O)Nc(c3)ccc(c3)C(C1)Oc(c2)c(c(C)cc(C)2)C(=O)1","InChI=1S/C19H19NO3/c1-11-8-12(2)19-16(22)10-17(23-18(19)9-11)14-4-6-15(7-5-14)20-13(3)21/h4-9,17H,10H2,1-3H3,(H,20,21)","XXBMDLRCMGSQSQ-UHFFFAOYSA-N"
"CC(=O)c(c(O)1)c(O)c(O)c(C)c1","InChI=1S/C9H10O4/c1-4-3-6(11)7(5(2)10)9(13)8(4)12/h3,11-13H,1-2H3","KYXHSGUXHJTBLS-UHFFFAOYSA-N"
"OC(=O)c(c3)cc(C(=O)2)c(c3)OC(=C(O)2)c(c1)cc(I)cc1","InChI=1S/C16H9IO5/c17-10-3-1-2-8(6-10)15-14(19)13(18)11-7-9(16(20)21)4-5-12(11)22-15/h1-7,19H,(H,20,21)","ACGTVGWMSVOYBS-UHFFFAOYSA-N"
"OC(=O)c(c3)cc(C(=O)1)c(c3)OC(c(c2)cccc2)=C(O)1","InChI=1S/C16H10O5/c17-13-11-8-10(16(19)20)6-7-12(11)21-15(14(13)18)9-4-2-1-3-5-9/h1-8,18H,(H,19,20)","JCIWJNAORFOXFT-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(O2)c(C(=O)C=C2c(c3)cc(OC(C)=O)c(OC(C)=O)c3)c(OC(C)=O)1","InChI=1S/C23H18O10/c1-11(24)29-16-8-21(32-14(4)27)23-17(28)10-19(33-22(23)9-16)15-5-6-18(30-12(2)25)20(7-15)31-13(3)26/h5-10H,1-4H3","MABQMQKDSPCURQ-UHFFFAOYSA-N"
"CN(C)c(c3)ccc(c3)C(C1)Oc(c2)c(cc(C)c2)C(=O)1","InChI=1S/C18H19NO2/c1-12-4-9-17-15(10-12)16(20)11-18(21-17)13-5-7-14(8-6-13)19(2)3/h4-10,18H,11H2,1-3H3","LZAVASCVCOFBTO-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(C2)Oc(c(C)1)c(C(=O)2)c(O)c(C)c(O)1","InChI=1S/C18H18O5/c1-9-16(20)10(2)18-15(17(9)21)13(19)8-14(23-18)11-4-6-12(22-3)7-5-11/h4-7,14,20-21H,8H2,1-3H3","DZTRDRPCROOSOG-UHFFFAOYSA-N"
"OC(=O)c(c4)c(ccc4)C(=O)Oc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)cccc1","InChI=1S/C23H16O6/c24-19-13-21(14-6-2-1-3-7-14)29-20-11-10-15(12-18(19)20)28-23(27)17-9-5-4-8-16(17)22(25)26/h1-12,21H,13H2,(H,25,26)","BMZDOTQPNIOTIM-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C1)Oc(c2)c(cc(Br)c2)C(=O)1","InChI=1S/C15H11BrO2/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-8,15H,9H2","XTTJSFMIDKNCOE-UHFFFAOYSA-N"
"CC(=O)Oc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)cc(OC)c(OC)c1","InChI=1S/C19H18O6/c1-11(20)24-13-5-7-16-14(9-13)15(21)10-18(25-16)12-4-6-17(22-2)19(8-12)23-3/h4-9,18H,10H2,1-3H3","RELNJUQGCPEVRP-UHFFFAOYSA-N"
"COc(c3)cc(O2)c(c3)C(=O)C(C2)c(c1)cccc1","InChI=1S/C16H14O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-9,14H,10H2,1H3","JVMWFGYBGRWDEO-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(=O)Nc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)cccc1","InChI=1S/C22H17NO3/c24-19-14-21(15-7-3-1-4-8-15)26-20-12-11-17(13-18(19)20)23-22(25)16-9-5-2-6-10-16/h1-13,21H,14H2,(H,23,25)","VVLMZPNQHMEDNQ-UHFFFAOYSA-N"
"COc(c3)c(OC)cc(c3)C(C1)Oc(c2)c(cc(O)c2)C(=O)1","InChI=1S/C17H16O5/c1-20-15-5-3-10(7-17(15)21-2)16-9-13(19)12-8-11(18)4-6-14(12)22-16/h3-8,16,18H,9H2,1-2H3","QRGSYHNTHPLRPD-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)ccc(c3)C(C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C15H11NO4/c17-13-9-15(20-14-4-2-1-3-12(13)14)10-5-7-11(8-6-10)16(18)19/h1-8,15H,9H2","TULCIAFZYJZBAM-UHFFFAOYSA-N"
"CC(=O)Oc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)c(OC)ccc1","InChI=1S/C18H16O5/c1-11(19)22-12-7-8-17-14(9-12)15(20)10-18(23-17)13-5-3-4-6-16(13)21-2/h3-9,18H,10H2,1-2H3","GTJHJYSMVKNZOP-UHFFFAOYSA-N"
"Nc(c3)cc(cc3)C(C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C15H13NO2/c16-11-5-3-4-10(8-11)15-9-13(17)12-6-1-2-7-14(12)18-15/h1-8,15H,9,16H2","BXYQSMKNOOKDIR-UHFFFAOYSA-N"
"CC(=O)Nc(c3)cc(O1)c(c3)C(=O)CC(c(c2)cccc2)1","InChI=1S/C17H15NO3/c1-11(19)18-13-7-8-14-15(20)10-16(21-17(14)9-13)12-5-3-2-4-6-12/h2-9,16H,10H2,1H3,(H,18,19)","ZPDRCBYTTWCYMW-UHFFFAOYSA-N"
"c(c3)ccc(c3)C([2H])(C1)C(O)c(c2)c(ccc2)C1","InChI=1S/C16H16O/c17-16-14-9-5-4-8-13(14)10-11-15(16)12-6-2-1-3-7-12/h1-9,15-17H,10-11H2/i15D","OKDIYKQVCBYZIJ-RWFJLFJASA-N"
"Brc(c3)cc(cc3)C(O1)=C(O)C(=O)c(c2)c(ccc2)1","InChI=1S/C15H9BrO3/c16-10-5-3-4-9(8-10)15-14(18)13(17)11-6-1-2-7-12(11)19-15/h1-8,18H","FTMVUENCCJQCAB-UHFFFAOYSA-N"
"Oc(c3)ccc(c3)C(O1)=C(O)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H","IYRMWMYZSQPJKC-UHFFFAOYSA-N"
"OC(=O)c(c3)cc(C(=O)2)c(c3)OC(=C(O)2)c(c1)cc(Br)cc1","InChI=1S/C16H9BrO5/c17-10-3-1-2-8(6-10)15-14(19)13(18)11-7-9(16(20)21)4-5-12(11)22-15/h1-7,19H,(H,20,21)","CQWMVSAKTPVMRP-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(OC(C)=O)CC(c(c2)cccc2)1","InChI=1S/C18H18O4/c1-12(19)21-18-11-16(13-6-4-3-5-7-13)22-17-10-14(20-2)8-9-15(17)18/h3-10,16,18H,11H2,1-2H3","RJUZLULBRKENPV-UHFFFAOYSA-N"
"Clc(c3)cc(cc3)C(O1)=C(O)C(=O)c(c2)c(ccc2)1","InChI=1S/C15H9ClO3/c16-10-5-3-4-9(8-10)15-14(18)13(17)11-6-1-2-7-12(11)19-15/h1-8,18H","VEJWQQOOYBOGGJ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)cc(cc3)C(O1)=C(O)C(=O)c(c2)c(ccc(C(O)=O)2)1","InChI=1S/C16H9NO7/c18-13-11-7-9(16(20)21)4-5-12(11)24-15(14(13)19)8-2-1-3-10(6-8)17(22)23/h1-7,19H,(H,20,21)","XSUPIVYAFIPKTM-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(O1)=C(O)C(=O)c(c2)c(ccc(I)2)1","InChI=1S/C15H9IO3/c16-10-6-7-12-11(8-10)13(17)14(18)15(19-12)9-4-2-1-3-5-9/h1-8,18H","TZKBZRSSMGARTJ-UHFFFAOYSA-N"
"Clc(c3)cc(O1)c(c3)C(=O)C(O)=C1c(c2)cccc2","InChI=1S/C15H9ClO3/c16-10-6-7-11-12(8-10)19-15(14(18)13(11)17)9-4-2-1-3-5-9/h1-8,18H","DAIAUZNYEIUDCP-UHFFFAOYSA-N"
"COc(c(O)3)cc(cc3)C(O1)=C(O)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3","IZQSVPBOUDKVDZ-UHFFFAOYSA-N"
"OC(=O)c(c3)cc(C(=O)2)c(c3)OC(=C(O)2)c(c1)ccc(I)c1","InChI=1S/C16H9IO5/c17-10-4-1-8(2-5-10)15-14(19)13(18)11-7-9(16(20)21)3-6-12(11)22-15/h1-7,19H,(H,20,21)","LXZQMVDUYUFJPI-UHFFFAOYSA-N"
"OC(=O)c(c3)cc(C(=O)1)c(c3)OC(c(c2)ccc(Br)c2)=C(O)1","InChI=1S/C16H9BrO5/c17-10-4-1-8(2-5-10)15-14(19)13(18)11-7-9(16(20)21)3-6-12(11)22-15/h1-7,19H,(H,20,21)","NIXJAZGDYIPAIN-UHFFFAOYSA-N"
"Cc(c4)ccc(c4)S(=O)(=O)OC(C(=O)1)C(c(c3)cccc3)Oc(c2)c(ccc2)1","InChI=1S/C22H18O5S/c1-15-11-13-17(14-12-15)28(24,25)27-22-20(23)18-9-5-6-10-19(18)26-21(22)16-7-3-2-4-8-16/h2-14,21-22H,1H3","GBGORJRCCXMRKG-UHFFFAOYSA-N"
"COc(c3)cc(O2)c(c3)C([2H])(O)C(C2)c(c1)cccc1","InChI=1S/C16H16O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-9,14,16-17H,10H2,1H3/i16D","FNCVQDHRTCWUHR-QNLPYAOMSA-N"
"OC(=O)c(c3)cc(C(=O)1)c(c3)OC(c(c2)ccc(Cl)c2)=C(O)1","InChI=1S/C16H9ClO5/c17-10-4-1-8(2-5-10)15-14(19)13(18)11-7-9(16(20)21)3-6-12(11)22-15/h1-7,19H,(H,20,21)","OPGIOCSFKZBZTC-UHFFFAOYSA-N"
"Oc(c3)cc(O1)c(c3)C(=O)C=C1c(c2)cccc2","InChI=1S/C15H10O3/c16-11-6-7-12-13(17)9-14(18-15(12)8-11)10-4-2-1-3-5-10/h1-9,16H","MQGPSCMMNJKMHQ-UHFFFAOYSA-N"
"Clc(c3)cc(cc3)C(=C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C15H9ClO2/c16-11-5-3-4-10(8-11)15-9-13(17)12-6-1-2-7-14(12)18-15/h1-9H","JWTQJUQJIRWZLA-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(=C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C16H12O3/c1-18-12-8-6-11(7-9-12)16-10-14(17)13-4-2-3-5-15(13)19-16/h2-10H,1H3","OMICQBVLCVRFGN-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(=C2)Oc(c(I)1)c(C(=O)2)c(OC)cc(OC)1","InChI=1S/C18H15IO5/c1-21-11-6-4-10(5-7-11)13-8-12(20)16-14(22-2)9-15(23-3)17(19)18(16)24-13/h4-9H,1-3H3","IQMRCLWZANBISD-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)NC(=C1)C(=O)c(c2)c(ccc2)O1","InChI=1S/C16H11NO3/c18-15-12-8-4-5-9-14(12)20-10-13(15)17-16(19)11-6-2-1-3-7-11/h1-10H,(H,17,19)","OKPNWMHDUXGYHN-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(=O)C(c(c2)cccc2)C(O)1","InChI=1S/C16H14O4/c1-19-11-7-8-12-13(9-11)20-16(18)14(15(12)17)10-5-3-2-4-6-10/h2-9,14,16,18H,1H3","VRUIPIIBPDPQRB-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)NC(C1)C(=O)c(c2)c(ccc2)O1","InChI=1S/C16H13NO3/c18-15-12-8-4-5-9-14(12)20-10-13(15)17-16(19)11-6-2-1-3-7-11/h1-9,13H,10H2,(H,17,19)","NEEZWDKDAFKEOA-UHFFFAOYSA-N"
"COc(c3)cc(O2)c(c3)C(=O)C(=C2)c(c1)cccc1","InChI=1S/C16H12O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-10H,1H3","IECSQLKWZBEUGA-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C(O)1)C(=O)c(c2)c(ccc2)O1","InChI=1S/C15H12O3/c16-14-11-8-4-5-9-12(11)18-15(17)13(14)10-6-2-1-3-7-10/h1-9,13,15,17H","CPBYTAYFHIHDNI-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c4)ccc(c4)C(=O)Oc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)occ1","InChI=1S/C20H13NO7/c22-16-11-19(18-2-1-9-26-18)28-17-8-7-14(10-15(16)17)27-20(23)12-3-5-13(6-4-12)21(24)25/h1-10,19H,11H2","UJOGVGBLSNNPKE-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C1)Oc(c2)c(cc(I)c2)C(=O)1","InChI=1S/C15H11IO2/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-8,15H,9H2","QRHHQHRVDBZHGP-UHFFFAOYSA-N"
"Cc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)cccc1","InChI=1S/C16H14O2/c1-11-7-8-15-13(9-11)14(17)10-16(18-15)12-5-3-2-4-6-12/h2-9,16H,10H2,1H3","BTQWFEVKJXMNQE-UHFFFAOYSA-N"
"CC(=O)Nc(c4)cc(O1)c(c4)C(=O)CC1c(c2)cc(O3)c(OC3)c2","InChI=1S/C18H15NO5/c1-10(20)19-12-3-4-13-14(21)8-16(24-17(13)7-12)11-2-5-15-18(6-11)23-9-22-15/h2-7,16H,8-9H2,1H3,(H,19,20)","YQXREYWEDQXUNV-UHFFFAOYSA-N"
"COc(c1)c(N)cc(C(=O)3)c1OC(C3)c(c2)cccc2","InChI=1S/C16H15NO3/c1-19-16-9-15-11(7-12(16)17)13(18)8-14(20-15)10-5-3-2-4-6-10/h2-7,9,14H,8,17H2,1H3","IHKWTLQMXZOQND-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)C(C1)Oc(c2)c(cc(O)c2)C(=O)1","InChI=1S/C16H14O3/c1-10-2-4-11(5-3-10)16-9-14(18)13-8-12(17)6-7-15(13)19-16/h2-8,16-17H,9H2,1H3","RZHHNCVZNMURGI-UHFFFAOYSA-N"
"Nc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)cccc1","InChI=1S/C15H13NO2/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-8,15H,9,16H2","AJKZYFLOTLGXCO-UHFFFAOYSA-N"
"CC(=O)Nc(c3)ccc(c3)C(C1)Oc(c2)c(cc(C)c2)C(=O)1","InChI=1S/C18H17NO3/c1-11-3-8-17-15(9-11)16(21)10-18(22-17)13-4-6-14(7-5-13)19-12(2)20/h3-9,18H,10H2,1-2H3,(H,19,20)","JNJWVQJGVWODHM-UHFFFAOYSA-N"
"Oc(c3)cc(O1)c(c(O)3)C(=O)CC(c(c2)cccc2)1","InChI=1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2","URFCJEUYXNAHFI-UHFFFAOYSA-N"
"Cc(c(C)4)cc(O1)c(c4)C(=O)CC1c(c2)cc(O3)c(OC3)c2","InChI=1S/C18H16O4/c1-10-5-13-14(19)8-16(22-17(13)6-11(10)2)12-3-4-15-18(7-12)21-9-20-15/h3-7,16H,8-9H2,1-2H3","TZRLTMJHLNNTSE-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(OC(C)=O)C(OC)C1c(c2)cc(OC)c(OC)c2","InChI=1S/C21H24O7/c1-12(22)27-20-15-8-7-14(23-2)11-17(15)28-19(21(20)26-5)13-6-9-16(24-3)18(10-13)25-4/h6-11,19-21H,1-5H3","OVIAFOWBNDYEQC-UHFFFAOYSA-N"
"O=C(C1)c(c4)c(ccc4)OC1c(c2)cc(O3)c(OC3)c2","InChI=1S/C16H12O4/c17-12-8-15(20-13-4-2-1-3-11(12)13)10-5-6-14-16(7-10)19-9-18-14/h1-7,15H,8-9H2","VSTVOSHZGMALFF-UHFFFAOYSA-N"
"ON=C(c21)C(=Cc(c4)cccc4)C(c(c3)cccc3)Oc(cccc2)1","InChI=1S/C22H17NO2/c24-23-21-18-13-7-8-14-20(18)25-22(17-11-5-2-6-12-17)19(21)15-16-9-3-1-4-10-16/h1-15,22,24H/b19-15+,23-21+","QBQHFLJYAZQNHP-ZTKBUNODSA-N"
"O=C(C1)c(c4)c(ccc4)OC1c(c2)c(c3)c(ccc3)cc2","InChI=1S/C19H14O2/c20-17-12-19(21-18-11-4-3-9-16(17)18)15-10-5-7-13-6-1-2-8-14(13)15/h1-11,19H,12H2","UPZUEXDENBCKAD-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(O)C(OC)C1c(c2)cc(OC)c(OC)c2","InChI=1S/C19H22O6/c1-21-12-6-7-13-15(10-12)25-18(19(24-4)17(13)20)11-5-8-14(22-2)16(9-11)23-3/h5-10,17-20H,1-4H3","UKFZSRVPMBFEQX-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(C1)Oc(c(N)2)c(ccc2)C(=O)1","InChI=1S/C16H15NO3/c1-19-11-7-5-10(6-8-11)15-9-14(18)12-3-2-4-13(17)16(12)20-15/h2-8,15H,9,17H2,1H3","GLLONMLBZUYGCJ-UHFFFAOYSA-N"
"CC(=O)Nc(c3)c(ccc3)C(C1)Oc(c2)c(ccc2)C(=O)1","InChI=1S/C17H15NO3/c1-11(19)18-14-8-4-2-6-12(14)17-10-15(20)13-7-3-5-9-16(13)21-17/h2-9,17H,10H2,1H3,(H,18,19)","KGWSRYUPLPMQGY-UHFFFAOYSA-N"
"Cc(c3)cc(c(c3)2)C(=O)C(=CO2)c(c1)cccc1","InChI=1S/C16H12O2/c1-11-7-8-15-13(9-11)16(17)14(10-18-15)12-5-3-2-4-6-12/h2-10H,1H3","WPPSYROXFNGOGO-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c(O)3)C(=O)CC([H])1c(c2)ccc(O)c2","InChI=1S/C16H14O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-7,14,17-18H,8H2,1H3/t14-/m1/s1","DJOJDHGQRNZXQQ-CQSZACIVSA-N"
"c(c3)ccc(c3)C(=C1)C(=O)c(c2)c(ccc2)O1","InChI=1S/C15H10O2/c16-15-12-8-4-5-9-14(12)17-10-13(15)11-6-2-1-3-7-11/h1-10H","GOMNOOKGLZYEJT-UHFFFAOYSA-N"
"COc(c3)cc(O2)c(c(OC)3)C(=O)C(=C2)c(c1)cccc1","InChI=1S/C17H14O4/c1-19-12-8-14(20-2)16-15(9-12)21-10-13(17(16)18)11-6-4-3-5-7-11/h3-10H,1-2H3","CDSSYLTXYXEANW-UHFFFAOYSA-N"
"CC(=O)Nc(c3)cc(C(=O)2)c(c3)OC(C2)c(c1)cccc1","InChI=1S/C17H15NO3/c1-11(19)18-13-7-8-16-14(9-13)15(20)10-17(21-16)12-5-3-2-4-6-12/h2-9,17H,10H2,1H3,(H,18,19)","FXLWPUMMSQFKLQ-UHFFFAOYSA-N"
"COc(c(C)1)c(=O)c(O)c(C)c(=O)1","InChI=1S/C9H10O4/c1-4-6(10)5(2)9(13-3)8(12)7(4)11/h11H,1-3H3","BUFFKORPJSMABA-UHFFFAOYSA-N"
"CC(=C)COC(OCC(C)=C)C(C)C","InChI=1S/C12H22O2/c1-9(2)7-13-12(11(5)6)14-8-10(3)4/h11-12H,1,3,7-8H2,2,4-6H3","RTUVALNOUGJLOR-UHFFFAOYSA-N"
"OCC(C)(C)OCC(C)=C","InChI=1S/C8H16O2/c1-7(2)5-10-8(3,4)6-9/h9H,1,5-6H2,2-4H3","VIYJKNBZRRVSLZ-UHFFFAOYSA-N"
"CC(=C)COC(C(C)C)OCC(C)(C)OCC(C)=C","InChI=1S/C16H30O3/c1-12(2)9-17-15(14(5)6)18-11-16(7,8)19-10-13(3)4/h14-15H,1,3,9-11H2,2,4-8H3","GELZIAQNOBTODO-UHFFFAOYSA-N"
"CC(=C)COC(C)(C)COC(C)(C)CO","InChI=1S/C12H24O3/c1-10(2)7-14-12(5,6)9-15-11(3,4)8-13/h13H,1,7-9H2,2-6H3","QSZCPGMPLJTNHH-UHFFFAOYSA-N"
"OCCC(C)(C)OCCC(C)=C","InChI=1S/C10H20O2/c1-9(2)5-8-12-10(3,4)6-7-11/h11H,1,5-8H2,2-4H3","OYSGDRSBCITWNM-UHFFFAOYSA-N"
"OCCC(C)(C)OCCC(C)(C)OCCC(C)=C","InChI=1S/C15H30O3/c1-13(2)7-11-17-15(5,6)9-12-18-14(3,4)8-10-16/h16H,1,7-12H2,2-6H3","AMHIUBLQGDHLIM-UHFFFAOYSA-N"
"COC(=O)CC(=C(C)1)C(=O)CC1","InChI=1S/C9H12O3/c1-6-3-4-8(10)7(6)5-9(11)12-2/h3-5H2,1-2H3","BKYLKYCUGLTFMT-UHFFFAOYSA-N"
"COC(=O)CCC(C1)=CC(=O)C1","InChI=1S/C9H12O3/c1-12-9(11)5-3-7-2-4-8(10)6-7/h6H,2-5H2,1H3","KGVGYHPHMLHEME-UHFFFAOYSA-N"
"C=CCc(c1)cccc1","InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-5,7-8H,1,6H2","HJWLCRVIBGQPNF-UHFFFAOYSA-N"
"C=CCc(c1)ccc(OC)c1","InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3,5-8H,1,4H2,2H3","ZFMSMUAANRJZFM-UHFFFAOYSA-N"
"C=CCc(c1)cc(OC)c(OC(C)=O)c1","InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4,6-8H,1,5H2,2-3H3","SCCDQYPEOIRVGX-UHFFFAOYSA-N"
"C=CCc(c1)cc(OC)c(O)c1","InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3,5-7,11H,1,4H2,2H3","RRAFCDWBNXTKKO-UHFFFAOYSA-N"
"C=CCc(c1)cc(OC)c(OC)c1","InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3","ZYEMGPIYFIJGTP-UHFFFAOYSA-N"
"C=CCc(c1)cc(OC)c(OC([2H])([2H])[2H])c1","InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4,6-8H,1,5H2,2-3H3/i2D3","ZYEMGPIYFIJGTP-BMSJAHLVSA-N"
"Oc(c2)cc(c(=O)1)c(c(O)2)c(=O)cc(O)1","InChI=1S/C10H6O5/c11-4-1-5-9(6(12)2-4)7(13)3-8(14)10(5)15/h1-3,11-12,14H","RROPNRTUMVVUED-UHFFFAOYSA-N"
"COc(c1)cc(c(=O)2)c(c(=O)cc(O)2)c(OC)1","InChI=1S/C12H10O5/c1-16-6-3-7-11(10(4-6)17-2)8(13)5-9(14)12(7)15/h3-5,14H,1-2H3","ADTSNWYKAAWAQG-UHFFFAOYSA-N"
"O=C(C=3)OC(C1)C(C3)(C(=O)2)CC(C)(O2)C(I)1","InChI=1S/C11H11IO4/c1-10-5-11(9(14)16-10)3-2-8(13)15-7(11)4-6(10)12/h2-3,6-7H,4-5H2,1H3","LEUOKTNTKDLUQE-UHFFFAOYSA-N"
"O=C(C=3)OC(C=2)C(C3)(C1)C(=O)OC(C)(C2)1","InChI=1S/C11H10O4/c1-10-4-2-7-11(6-10,9(13)15-10)5-3-8(12)14-7/h2-5,7H,6H2,1H3","CKKDYPCQXYYSIM-UHFFFAOYSA-N"
"c(c3)ccc(c3)SC(C(=O)1)C(C2)C(CCC2)1","InChI=1S/C14H16OS/c15-13-11-8-4-5-9-12(11)14(13)16-10-6-2-1-3-7-10/h1-3,6-7,11-12,14H,4-5,8-9H2","GNHINNRRWCHFTJ-UHFFFAOYSA-N"
"OCC(C3)C(C1)C(C23)C(OC)(OC2)C1","InChI=1S/C11H18O3/c1-13-11-3-2-9-7(5-12)4-8(6-14-11)10(9)11/h7-10,12H,2-6H2,1H3","QNFPXFUJNCJJHW-UHFFFAOYSA-N"
"NC(=O)C(C1)=CCC1","InChI=1S/C6H9NO/c7-6(8)5-3-1-2-4-5/h3H,1-2,4H2,(H2,7,8)","DSLSPCZKJILYBT-UHFFFAOYSA-N"
"COCC(=C1)C(=O)C(F)=C(COC)C=C1","InChI=1S/C11H13FO3/c1-14-6-8-4-3-5-9(7-15-2)11(13)10(8)12/h3-5H,6-7H2,1-2H3","VQJHQFBMIBVACZ-UHFFFAOYSA-N"
"OCC(=C1)C(=O)C(OC)=C(CO)C=C(Cl)1","InChI=1S/C10H11ClO4/c1-15-10-7(5-13)3-8(11)2-6(4-12)9(10)14/h2-3,12-13H,4-5H2,1H3","KNWMRZAETQDUJD-UHFFFAOYSA-N"
"O=NC(=C1)C=C(C)C(=O)C(O)=C(C)1","InChI=1S/C9H9NO3/c1-5-3-7(10-13)4-6(2)9(12)8(5)11/h3-4H,1-2H3,(H,11,12)","JTNJTPJDLDIAGS-UHFFFAOYSA-N"
"COC(=C(C)1)C(=O)C(C)=CC=C1","InChI=1S/C10H12O2/c1-7-5-4-6-8(2)10(12-3)9(7)11/h4-6H,1-3H3","ZMADITLKRZMPTL-UHFFFAOYSA-N"
"BrCC(C=1)=C(O)C(=O)C(CBr)=CC1","InChI=1S/C9H8Br2O2/c10-4-6-2-1-3-7(5-11)9(13)8(6)12/h1-3H,4-5H2,(H,12,13)","OPQWVLFKSUMZJT-UHFFFAOYSA-N"
"COCC(C=1)=C(O)C(=O)C(COC)=CC(Cl)1","InChI=1S/C11H13ClO4/c1-15-5-7-3-9(12)4-8(6-16-2)11(14)10(7)13/h3-4H,5-6H2,1-2H3,(H,13,14)","OVUPIXOMXACNCQ-UHFFFAOYSA-N"
"CCOC(=O)C(C=1)=C(C(COC)=2)C(=C(COC)C=CC2)C(C#N)1","InChI=1S/C18H19NO4/c1-4-23-18(20)15-8-14(9-19)16-12(10-21-2)6-5-7-13(11-22-3)17(15)16/h5-8H,4,10-11H2,1-3H3","UPKJDBGZJQMZTK-UHFFFAOYSA-N"
"COC(=C(CBr)1)C(=O)C(CBr)=CC=C1","InChI=1S/C10H10Br2O2/c1-14-10-8(6-12)4-2-3-7(5-11)9(10)13/h2-4H,5-6H2,1H3","ATXNYVUTDZSSJD-UHFFFAOYSA-N"
"COCC(C=1)=C(O)C(=O)C(COC)=CC1","InChI=1S/C11H14O4/c1-14-6-8-4-3-5-9(7-15-2)11(13)10(8)12/h3-5H,6-7H2,1-2H3,(H,12,13)","QCKWUNMZGGJGGT-UHFFFAOYSA-N"
"CCOC(=O)C(C(N)=1)=C(C(COC)=2)C(=C(COC)C=CC2)C(C#N)1","InChI=1S/C18H20N2O4/c1-4-24-18(21)16-15-12(10-23-3)7-5-6-11(9-22-2)14(15)13(8-19)17(16)20/h5-7H,4,9-10,20H2,1-3H3","XXGOOIFTAAWFFB-UHFFFAOYSA-N"
"COCC(C=3)=C(C(C#N)=1)C(C(=CC3)2)=C(C(=O)OC2)C1","InChI=1S/C15H11NO3/c1-18-7-9-3-2-4-10-8-19-15(17)12-5-11(6-16)13(9)14(10)12/h2-5H,7-8H2,1H3","LUPUKQSSBBJBDK-UHFFFAOYSA-N"
"COCC(=C2)C(=C(C#N)1)C(=C(COC)C=C2)C(C#N)=C(N)1","InChI=1S/C16H15N3O2/c1-20-8-10-4-3-5-11(9-21-2)15-13(7-18)16(19)12(6-17)14(10)15/h3-5H,8-9,19H2,1-2H3","YACFGHXTHMBNKK-UHFFFAOYSA-N"
"COCC(=C1)C(=O)C(OC)=C(COC)C=C(Cl)1","InChI=1S/C12H15ClO4/c1-15-6-8-4-10(13)5-9(7-16-2)12(17-3)11(8)14/h4-5H,6-7H2,1-3H3","MYSZZVLKJNMEPM-UHFFFAOYSA-N"
"COCC(=C1)C(=O)C(OC)=C(COC)C=C1","InChI=1S/C12H16O4/c1-14-7-9-5-4-6-10(8-15-2)12(16-3)11(9)13/h4-6H,7-8H2,1-3H3","JNASCJGTZDPQTB-UHFFFAOYSA-N"
"CC(C=1)=C(O)C(=O)C(C)=CC1","InChI=1S/C9H10O2/c1-6-4-3-5-7(2)9(11)8(6)10/h3-5H,1-2H3,(H,10,11)","XWUQRGGMMROJDR-UHFFFAOYSA-N"
"COCC(C=2)=c(o1)c(C(COC)=CC2)c(C#N)c(=O)1","InChI=1S/C14H13NO4/c1-17-7-9-4-3-5-10(8-18-2)13-12(9)11(6-15)14(16)19-13/h3-5H,7-8H2,1-2H3","REIDKTNDNOMATR-UHFFFAOYSA-N"
"COC(=C21)C(=O)C(CCCCCCCC2)=CC=C1","InChI=1S/C16H22O2/c1-18-16-14-10-7-5-3-2-4-6-9-13(15(16)17)11-8-12-14/h8,11-12H,2-7,9-10H2,1H3","QDSUTFXJGVJSFT-UHFFFAOYSA-N"
"C(C2)CCCC(C=1)=C(O)C(=O)C(CCC2)=CC1","InChI=1S/C15H20O2/c16-14-12-8-5-3-1-2-4-6-9-13(15(14)17)11-7-10-12/h7,10-11H,1-6,8-9H2,(H,16,17)","BQQGHBJODQRYOB-UHFFFAOYSA-N"
"C(C2)CCCC(C=1)=C(O)C(=O)C(CCC2)=CC(Br)1","InChI=1S/C15H19BrO2/c16-13-9-11-7-5-3-1-2-4-6-8-12(10-13)15(18)14(11)17/h9-10H,1-8H2,(H,17,18)","MXCGVEWCDPPUND-UHFFFAOYSA-N"
"C(C3)CCCC(=C1)C(=O)C(=O)C(CCC3)=CC(N=Nc(c2)cccc2)1","InChI=1S/C21H24N2O2/c24-20-16-10-6-3-1-2-4-7-11-17(21(20)25)15-19(14-16)23-22-18-12-8-5-9-13-18/h5,8-9,12-15,19H,1-4,6-7,10-11H2/b23-22+","WJZNGDMCEJWEGB-GHVJWSGMSA-N"
"CNC(=C21)C(=O)C(CCCCCCCC2)=CC=C1","InChI=1S/C16H23NO/c1-17-15-13-9-6-4-2-3-5-7-10-14(16(15)18)12-8-11-13/h8,11-12H,2-7,9-10H2,1H3,(H,17,18)","WHGBDABPPUJDAD-UHFFFAOYSA-N"
"CC(C=1)=C(O)C(=O)C(C)=CC(N=Nc(c2)cccc2)1","InChI=1S/C15H14N2O2/c1-10-8-13(9-11(2)15(19)14(10)18)17-16-12-6-4-3-5-7-12/h3-9H,1-2H3,(H,18,19)/b17-16+","LUHNBQJRYZIKBC-WUKNDPDISA-N"
"CC(=O)ON=C(C=1)C=C(C)C(=O)C(=O)C(C)1","InChI=1S/C11H11NO4/c1-6-4-9(12-16-8(3)13)5-7(2)11(15)10(6)14/h4-5H,1-3H3","WSVOYBYRCFSTRY-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C=C(C1)CCCC1","InChI=1S/C8H14/c1-2-8-6-4-3-5-7-8/h2H,3-7H2,1H3/i1D3","BPBOWYWUOUJKLO-FIBGUPNXSA-N"
"C1=CC=C2C(=C1)C3=C(N2)C=NC=C3","InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H","AIFRHYZBTHREPW-UHFFFAOYSA-N"
"CC1=NC=CC2=C1NC3=CC=CC=C23","InChI=1S/C12H10N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-7,14H,1H3","PSFDQSOCUJVVGF-UHFFFAOYSA-N"
"Nc(c2)ncc(c2)c(c1)cccc1","InChI=1S/C11H10N2/c12-11-7-6-10(8-13-11)9-4-2-1-3-5-9/h1-8H,(H2,12,13)","OAPVIBHQRYFYSE-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)c(c2)c(ncc2)c1","InChI=1S/C13H9N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h1-9H","HCAUQPZEWLULFJ-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)c(c2)c(ccc2)n1","InChI=1S/C13H9N/c1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13/h1-9H","RDOWQLZANAYVLL-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C3=C(N2)N=C(C=C3)N","InChI=1S/C11H9N3/c12-10-6-5-8-7-3-1-2-4-9(7)13-11(8)14-10/h1-6H,(H3,12,13,14)","FJTNLJLPLJDTRM-UHFFFAOYSA-N"
"Nc(c3)nc(c(c3)1)n(C=2)c(C=CC2)n1","InChI=1S/C10H8N4/c11-8-5-4-7-10(13-8)14-6-2-1-3-9(14)12-7/h1-6H,(H2,11,13)","BUXVIXBGMQXWGT-UHFFFAOYSA-N"
"CC1=C2C3=CC=CC=C3NC2=CC(=N1)N","InChI=1S/C12H11N3/c1-7-12-8-4-2-3-5-9(8)15-10(12)6-11(13)14-7/h2-6,15H,1H3,(H2,13,14)","LKKMLIBUAXYLOY-UHFFFAOYSA-N"
"CC1=C(N=C2C(=C1)C3=CC=CC=C3N2)N","InChI=1S/C12H11N3/c1-7-6-9-8-4-2-3-5-10(8)14-12(9)15-11(7)13/h2-6H,1H3,(H3,13,14,15)","IVLCGFRPPGNALI-UHFFFAOYSA-N"
"Nc(c3)nc(c(c3)1)n(C=2)c(C(C)=CC2)n1","InChI=1S/C11H10N4/c1-7-3-2-6-15-10(7)13-8-4-5-9(12)14-11(8)15/h2-6H,1H3,(H2,12,14)","AYLURHVFAYRSHT-UHFFFAOYSA-N"
"Nc(n1)n(C)c(c2)c1c(c3)c(ncc3)c2","InChI=1S/C11H10N4/c1-15-9-5-4-8-7(3-2-6-13-8)10(9)14-11(15)12/h2-6H,1H3,(H2,12,14)","ARZWATDYIYAUTA-UHFFFAOYSA-N"
"CC1=C(N=C(C2=C1NC3=CC=CC=C32)C)N","InChI=1S/C13H13N3/c1-7-12-11(8(2)15-13(7)14)9-5-3-4-6-10(9)16-12/h3-6,16H,1-2H3,(H2,14,15)","LVTKHGUGBGNBPL-UHFFFAOYSA-N"
"Nc(n1)n(C)c(c(C)2)c1c(c3)c(ncc3)c2","InChI=1S/C12H12N4/c1-7-6-9-8(4-3-5-14-9)10-11(7)16(2)12(13)15-10/h3-6H,1-2H3,(H2,13,15)","GMGWMIJIGUYNAY-UHFFFAOYSA-N"
"Cc(c3)nc(c(n3)2)c(n1)c(cc2)n(C)c(N)1","InChI=1S/C11H11N5/c1-6-5-13-7-3-4-8-10(9(7)14-6)15-11(12)16(8)2/h3-5H,1-2H3,(H2,12,15)","DVCCCQNKIYNAKB-UHFFFAOYSA-N"
"C1CC2=C(C1)C3=C(C=CC=N3)C4=C2C5=CC=CC=C5N4","InChI=1S/C18H14N2/c1-2-9-15-13(5-1)16-11-6-3-7-12(11)17-14(18(16)20-15)8-4-10-19-17/h1-2,4-5,8-10,20H,3,6-7H2","JSXZMKNQTHRIJD-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCOCC(CO[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C23H52O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-24-21-23(26-28(5,6)7)22-25-27(2,3)4/h23H,8-22H2,1-7H3","YCRROHFKFUKIRO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCOCC(CO[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C25H56O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26-23-25(28-30(5,6)7)24-27-29(2,3)4/h25H,8-24H2,1-7H3","DDZWTAIRKULPRO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCOCC(CO[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C27H60O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-25-27(30-32(5,6)7)26-29-31(2,3)4/h27H,8-26H2,1-7H3","YGPFXYRLWXBLIE-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCCOCC(CO[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C27H58O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-28-25-27(30-32(5,6)7)26-29-31(2,3)4/h15-16,27H,8-14,17-26H2,1-7H3/b16-15+","VVGHXQKPBMQJBV-FOCLMDBBSA-N"
"CCCCCCCCC=CCCCCCCCCCC(=O)OC","InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h10-11H,3-9,12-20H2,1-2H3/b11-10+","RBKMRGOHCLRTLZ-ZHACJKMWSA-N"
"CCCCCCCCC=CCCCCCCCCCCCC(=O)OC","InChI=1S/C23H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h10-11H,3-9,12-22H2,1-2H3/b11-10+","ZYNDJIBBPLNPOW-ZHACJKMWSA-N"
"C(C(C=CCCCCCCCCCCCCC)O[Si](C)(C)C)(NC(C)=O)CO[Si](C)(C)C","InChI=1S/C26H55NO3Si2/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26(30-32(6,7)8)25(27-24(2)28)23-29-31(3,4)5/h21-22,25-26H,9-20,23H2,1-8H3,(H,27,28)/b22-21+","UTVHVTRVBAKCGF-QURGRASLSA-N"
"CC(C)C=NNc(c1)cccc1","InChI=1S/C10H14N2/c1-9(2)8-11-12-10-6-4-3-5-7-10/h3-9,12H,1-2H3/b11-8+","JRPJYFGSRTYOBF-DHZHZOJOSA-N"
"CCCNN=Cc(c1)cccc1","InChI=1S/C10H14N2/c1-2-8-11-12-9-10-6-4-3-5-7-10/h3-7,9,11H,2,8H2,1H3/b12-9+","RQQZJBZKGMZQOG-FMIVXFBMSA-N"
"CNN=C(C)C","InChI=1S/C4H10N2/c1-4(2)6-5-3/h5H,1-3H3","JXSSEZYJBTUIGX-UHFFFAOYSA-N"
"CCNN=C(C)C","InChI=1S/C5H12N2/c1-4-6-7-5(2)3/h6H,4H2,1-3H3","USOUWWPTYXEQDQ-UHFFFAOYSA-N"
"CCCNN=C(C)C","InChI=1S/C6H14N2/c1-4-5-7-8-6(2)3/h7H,4-5H2,1-3H3","BBXDSCHJVVIYFF-UHFFFAOYSA-N"
"CC(C)NN=C(C)C","InChI=1S/C6H14N2/c1-5(2)7-8-6(3)4/h5,7H,1-4H3","NEMJPYNJMBONJU-UHFFFAOYSA-N"
"CCNN=C(C)CC","InChI=1S/C6H14N2/c1-4-6(3)8-7-5-2/h7H,4-5H2,1-3H3/b8-6-","PCKXYWXISYJOTB-VURMDHGXSA-N"
"CCC(C)NN=C(C)CC","InChI=1S/C8H18N2/c1-5-7(3)9-10-8(4)6-2/h7,9H,5-6H2,1-4H3/b10-8-","PSEJHDMQAHLTJM-NTMALXAHSA-N"
"C=NN(C)C","InChI=1S/C3H8N2/c1-4-5(2)3/h1H2,2-3H3","NDNVSJIXYFNRDR-UHFFFAOYSA-N"
"CC=NN(C)C","InChI=1S/C4H10N2/c1-4-5-6(2)3/h4H,1-3H3/b5-4+","FDWQPDLACZBQBC-SNAWJCMRSA-N"
"CCC=NN(C)C","InChI=1S/C5H12N2/c1-4-5-6-7(2)3/h5H,4H2,1-3H3/b6-5+","FWXVUFLNENPJHD-AATRIKPKSA-N"
"CC=NN(C1)CCC1","InChI=1S/C6H12N2/c1-2-7-8-5-3-4-6-8/h2H,3-6H2,1H3/b7-2+","OKUPUIZUELNRNE-FARCUNLSSA-N"
"CC=NN(CC)CC","InChI=1S/C6H14N2/c1-4-7-8(5-2)6-3/h4H,5-6H2,1-3H3/b7-4+","XUPJINYFRLDNCY-QPJJXVBHSA-N"
"CCCC=NN(C)C","InChI=1S/C6H14N2/c1-4-5-6-7-8(2)3/h6H,4-5H2,1-3H3/b7-6+","SEEKWDSXURZRIV-VOTSOKGWSA-N"
"CC(C)C=NN(C)C","InChI=1S/C6H14N2/c1-6(2)5-7-8(3)4/h5-6H,1-4H3/b7-5+","WQDBBOLZIXTESN-FNORWQNLSA-N"
"CC=NN(C1)CCCC1","InChI=1S/C7H14N2/c1-2-8-9-6-4-3-5-7-9/h2H,3-7H2,1H3/b8-2+","ANZXBMPSDRAZTQ-KRXBUXKQSA-N"
"CCCN(N=C)CCC","InChI=1S/C7H16N2/c1-4-6-9(8-3)7-5-2/h3-7H2,1-2H3","GFWCHVXFEKXRSY-UHFFFAOYSA-N"
"CC=NN(CC)C(C)C","InChI=1S/C7H16N2/c1-5-8-9(6-2)7(3)4/h5,7H,6H2,1-4H3/b8-5+","KBQAGUKZIMHXKW-VMPITWQZSA-N"
"CCC=NN(CC)CC","InChI=1S/C7H16N2/c1-4-7-8-9(5-2)6-3/h7H,4-6H2,1-3H3/b8-7+","KIKLTTLXIQUYDB-BQYQJAHWSA-N"
"CCCCC=NN(C)C","InChI=1S/C7H16N2/c1-4-5-6-7-8-9(2)3/h7H,4-6H2,1-3H3/b8-7-","GETAETQIBNJCHL-FPLPWBNLSA-N"
"CC=NN(C1)CCCCC1","InChI=1S/C8H16N2/c1-2-9-10-7-5-3-4-6-8-10/h2H,3-8H2,1H3/b9-2+","XLYFNXWSNVFHET-XNWCZRBMSA-N"
"CC=NN(C(C)C)C(C)C","InChI=1S/C8H18N2/c1-6-9-10(7(2)3)8(4)5/h6-8H,1-5H3/b9-6+","APXNZZVBAPDZPY-RMKNXTFCSA-N"
"CCN(CC)N=CC(C)C","InChI=1S/C8H18N2/c1-5-10(6-2)9-7-8(3)4/h7-8H,5-6H2,1-4H3/b9-7+","KDMGAIKQJYFJMZ-VQHVLOKHSA-N"
"CCC=NN(CCC)CCC","InChI=1S/C9H20N2/c1-4-7-10-11(8-5-2)9-6-3/h7H,4-6,8-9H2,1-3H3/b10-7+","HZLLEYSUZNQXGX-JXMROGBWSA-N"
"CCCC=NN(CC(C)C)C(C)C","InChI=1S/C11H24N2/c1-6-7-8-12-13(11(4)5)9-10(2)3/h8,10-11H,6-7,9H2,1-5H3/b12-8+","RUIGJZCKVBPILW-XYOKQWHBSA-N"
"CCCCCCC=NN(CC)CC","InChI=1S/C11H24N2/c1-4-7-8-9-10-11-12-13(5-2)6-3/h11H,4-10H2,1-3H3/b12-11+","SJQVGFKERUZNDC-VAWYXSNFSA-N"
"CCCC=NN(CCCC)CCCC","InChI=1S/C12H26N2/c1-4-7-10-13-14(11-8-5-2)12-9-6-3/h10H,4-9,11-12H2,1-3H3/b13-10+","SUXRDGHXUJLOLZ-JLHYYAGUSA-N"
"CCCC=NN(CC(C)C)CC(C)C","InChI=1S/C12H26N2/c1-6-7-8-13-14(9-11(2)3)10-12(4)5/h8,11-12H,6-7,9-10H2,1-5H3/b13-8+","ASPGBKIEGSGRKE-MDWZMJQESA-N"
"c(c3)ccc(c3)C=NN(Cc(c2)cccc2)Cc(c1)cccc1","InChI=1S/C21H20N2/c1-4-10-19(11-5-1)16-22-23(17-20-12-6-2-7-13-20)18-21-14-8-3-9-15-21/h1-16H,17-18H2/b22-16+","GLRHIFIUOXQKIX-CJLVFECKSA-N"
"CCCC=NN(C)CCOCC","InChI=1S/C9H20N2O/c1-4-6-7-10-11(3)8-9-12-5-2/h7H,4-6,8-9H2,1-3H3/b10-7+","FDQLPAGFGLXPAD-JXMROGBWSA-N"
"CC(C)=NN(C)C","InChI=1S/C5H12N2/c1-5(2)6-7(3)4/h1-4H3","IDSMDKUVIBSETN-UHFFFAOYSA-N"
"CCN(CC)N=C(C)C","InChI=1S/C7H16N2/c1-5-9(6-2)8-7(3)4/h5-6H2,1-4H3","GGVIFVVMUPEGHJ-UHFFFAOYSA-N"
"CCC(CC)=NN(C)C","InChI=1S/C7H16N2/c1-5-7(6-2)8-9(3)4/h5-6H2,1-4H3","LXFGNBFOJJSPPZ-UHFFFAOYSA-N"
"CCN(N=C(C)C)C(C)C","InChI=1S/C8H18N2/c1-6-10(8(4)5)9-7(2)3/h8H,6H2,1-5H3","FQBTUCJQGSWWGU-UHFFFAOYSA-N"
"CCC(C)=NN(CC)CC","InChI=1S/C8H18N2/c1-5-8(4)9-10(6-2)7-3/h5-7H2,1-4H3/b9-8-","KMWQDYIEBWJWIC-HJWRWDBZSA-N"
"CC(C)CC(C)=NN(C)C","InChI=1S/C8H18N2/c1-7(2)6-8(3)9-10(4)5/h7H,6H2,1-5H3/b9-8-","ILLZUURQEMRVTN-HJWRWDBZSA-N"
"CC(C)=NN(C(C)C)C(C)C","InChI=1S/C9H20N2/c1-7(2)10-11(8(3)4)9(5)6/h8-9H,1-6H3","BMWCIZCYWKLTLD-UHFFFAOYSA-N"
"CCCCN(CCCC)N=C(C)C","InChI=1S/C11H24N2/c1-5-7-9-13(10-8-6-2)12-11(3)4/h5-10H2,1-4H3","SKQMJBSBCUKOPF-UHFFFAOYSA-N"
"CC(C)CN(CC(C)C)N=C(C)C","InChI=1S/C11H24N2/c1-9(2)7-13(8-10(3)4)12-11(5)6/h9-10H,7-8H2,1-6H3","PTVAXZOEUGRZMV-UHFFFAOYSA-N"
"CCOCCN(C)N=C(C)CC","InChI=1S/C9H20N2O/c1-5-9(3)10-11(4)7-8-12-6-2/h5-8H2,1-4H3/b10-9-","XKAMZPQHAMBEET-KTKRTIGZSA-N"
"C=CCNN=CC","InChI=1S/C5H10N2/c1-3-5-7-6-4-2/h3-4,7H,1,5H2,2H3/b6-4+","KEZWDEMPHZSOJV-GQCTYLIASA-N"
"CCC=NNCC=C","InChI=1S/C6H12N2/c1-3-5-7-8-6-4-2/h3,6-7H,1,4-5H2,2H3/b8-6+","POQUCILEWSEAQS-SOFGYWHQSA-N"
"C=CCNN=C(C)C","InChI=1S/C6H12N2/c1-4-5-7-8-6(2)3/h4,7H,1,5H2,2-3H3","ODEDRFAFCSZTSO-UHFFFAOYSA-N"
"CC=NNC(C)C=C","InChI=1S/C6H12N2/c1-4-6(3)8-7-5-2/h4-6,8H,1H2,2-3H3/b7-5+","GDILWUJKAMSFQD-FNORWQNLSA-N"
"C=CCNN=CC(C)C","InChI=1S/C7H14N2/c1-4-5-8-9-6-7(2)3/h4,6-8H,1,5H2,2-3H3/b9-6+","WPPLATYTIDUBIO-RMKNXTFCSA-N"
"C=CCN(C)N=C(C)C","InChI=1S/C7H14N2/c1-5-6-9(4)8-7(2)3/h5H,1,6H2,2-4H3","NLCRTRDPCWXYKO-UHFFFAOYSA-N"
"C#CCN(C)N=C(C)C","InChI=1S/C7H12N2/c1-5-6-9(4)8-7(2)3/h1H,6H2,2-4H3","DACHQBBVFBDBSA-UHFFFAOYSA-N"
"CCCC=NNCC=CC","InChI=1S/C8H16N2/c1-3-5-7-9-10-8-6-4-2/h3,5,8-9H,4,6-7H2,1-2H3/b5-3+,10-8+","NJOLUQSSLMAZEB-KWRXBJJZSA-N"
"CCC(C)=NNC(C)C=C","InChI=1S/C8H16N2/c1-5-7(3)9-10-8(4)6-2/h5,7,9H,1,6H2,2-4H3/b10-8-","FZUFUZKXCVIZON-NTMALXAHSA-N"
"C=CCN(C)N=C(C)CC","InChI=1S/C8H16N2/c1-5-7-10(4)9-8(3)6-2/h5H,1,6-7H2,2-4H3/b9-8-","CQUSZUHIHJRXMG-HJWRWDBZSA-N"
"CCC=NN(CC=C)CC=C","InChI=1S/C9H16N2/c1-4-7-10-11(8-5-2)9-6-3/h5-7H,2-4,8-9H2,1H3/b10-7+","QOVUMEUQTMXUOS-JXMROGBWSA-N"
"C=CC=NN(CC=C)CC=C","InChI=1S/C9H14N2/c1-4-7-10-11(8-5-2)9-6-3/h4-7H,1-3,8-9H2/b10-7+","UBWAKKDBDWRUAI-JXMROGBWSA-N"
"CC=CC=NN(C)C","InChI=1S/C6H12N2/c1-4-5-6-7-8(2)3/h4-6H,1-3H3/b5-4+,7-6+","KVKJBRFOURXWON-YTXTXJHMSA-N"
"CC=C(C)C=NN(C)C","InChI=1S/C7H14N2/c1-5-7(2)6-8-9(3)4/h5-6H,1-4H3/b7-5-,8-6+","OQGHKNMZJCKZBC-CGXWXWIYSA-N"
"CC(C)=CC=NN(C)C","InChI=1S/C7H14N2/c1-7(2)5-6-8-9(3)4/h5-6H,1-4H3/b8-6+","KZFYEQGUCXROPI-SOFGYWHQSA-N"
"CN(C)N=C(C)C(C)=C","InChI=1S/C7H14N2/c1-6(2)7(3)8-9(4)5/h1H2,2-5H3/b8-7-","JLTPVBBSSSBMDA-FPLPWBNLSA-N"
"CC=CC=NNC(C)C","InChI=1S/C7H14N2/c1-4-5-6-8-9-7(2)3/h4-7,9H,1-3H3/b5-4+,8-6+","VFPIMXUWBJRDMY-DVBIZMGNSA-N"
"CCN(CC)N=CC(C)=C","InChI=1S/C8H16N2/c1-5-10(6-2)9-7-8(3)4/h7H,3,5-6H2,1-2,4H3/b9-7+","PYAFLBXZPSGUKT-VQHVLOKHSA-N"
"CC=CC=NN(CC)CC","InChI=1S/C8H16N2/c1-4-7-8-9-10(5-2)6-3/h4,7-8H,5-6H2,1-3H3/b7-4+,9-8+","DJLGQXBRZAYBJR-NUXDXBQRSA-N"
"CC=C(C)C=NN(CC)CC","InChI=1S/C9H18N2/c1-5-9(4)8-10-11(6-2)7-3/h5,8H,6-7H2,1-4H3/b9-5-,10-8+","GJHYEYLGKWDLMY-APQBBXBWSA-N"
"CCC(=C)C=NN(CC)CC","InChI=1S/C9H18N2/c1-5-9(4)8-10-11(6-2)7-3/h8H,4-7H2,1-3H3","OMRAIPQMRLJSRZ-UHFFFAOYSA-N"
"CC=C(C)C(C)=NNC(C)C","InChI=1S/C9H18N2/c1-6-8(4)9(5)11-10-7(2)3/h6-7,10H,1-5H3/b8-6+,11-9+","ZMWUOVWPBZTVIZ-ZOIFJEAISA-N"
"CCCC(=C)C=NNC(C)C","InChI=1S/C9H18N2/c1-5-6-9(4)7-10-11-8(2)3/h7-8,11H,4-6H2,1-3H3","IMGUGCJNSIIXAW-UHFFFAOYSA-N"
"CC(C)NN=CC(=C)C(C)C","InChI=1S/C9H18N2/c1-7(2)9(5)6-10-11-8(3)4/h6-8,11H,5H2,1-4H3/b10-6+","OATICRMJGGIIEI-UXBLZVDNSA-N"
"CCC=C(C)C=NN(CC)CC","InChI=1S/C10H20N2/c1-5-8-10(4)9-11-12(6-2)7-3/h8-9H,5-7H2,1-4H3/b10-8+,11-9+","UNYHHDLZDYMYLQ-GFULKKFKSA-N"
"CCN(CC)N=CC(C)=C(C)C","InChI=1S/C10H20N2/c1-6-12(7-2)11-8-10(5)9(3)4/h8H,6-7H2,1-5H3/b11-8+","MJRKGYWACUZMMJ-DHZHZOJOSA-N"
"CCCC(=C)C=NN(CC)CC","InChI=1S/C10H20N2/c1-5-8-10(4)9-11-12(6-2)7-3/h9H,4-8H2,1-3H3","OKCMQBMWYJSETE-UHFFFAOYSA-N"
"CCN(CC)N=CC(=C)C(C)C","InChI=1S/C10H20N2/c1-6-12(7-2)11-8-10(5)9(3)4/h8-9H,5-7H2,1-4H3/b11-8+","WQOIIQRGAJMOOT-DHZHZOJOSA-N"
"CCCN(CCC)N=CC=C(C)C","InChI=1S/C11H22N2/c1-5-9-13(10-6-2)12-8-7-11(3)4/h7-8H,5-6,9-10H2,1-4H3/b12-8+","FTMKRAVFLAKCFZ-XYOKQWHBSA-N"
"CCCCN(CCCC)N=CC=C(C)C","InChI=1S/C13H26N2/c1-5-7-11-15(12-8-6-2)14-10-9-13(3)4/h9-10H,5-8,11-12H2,1-4H3/b14-10+","YRNUSWNJDPYSFU-GXDHUFHOSA-N"
"CC(C1)=NNC1","InChI=1S/C4H8N2/c1-4-2-3-5-6-4/h5H,2-3H2,1H3","MWCHLFKQTXSQJV-UHFFFAOYSA-N"
"CC(C1)NN=C1","InChI=1S/C4H8N2/c1-4-2-3-5-6-4/h3-4,6H,2H2,1H3","KDTSAMBCRXSULF-UHFFFAOYSA-N"
"[H]C(C1)=NN(C)C(C)1","InChI=1S/C5H10N2/c1-5-3-4-6-7(5)2/h4-5H,3H2,1-2H3","YTDZUPBPWJAQDV-UHFFFAOYSA-N"
"CC(C=1)C(C)NN1","InChI=1S/C5H10N2/c1-4-3-6-7-5(4)2/h3-5,7H,1-2H3","SOAGQMUXRXXXPM-UHFFFAOYSA-N"
"CC(C)(C1)NN=C1","InChI=1S/C5H10N2/c1-5(2)3-4-6-7-5/h4,7H,3H2,1-2H3","FLYZAKYDSFYRRD-UHFFFAOYSA-N"
"CCC(C1)=NNC1","InChI=1S/C5H10N2/c1-2-5-3-4-6-7-5/h6H,2-4H2,1H3","WYAQEFBMDQTMID-UHFFFAOYSA-N"
"CN(C1)N=C(C)C(C)1","InChI=1S/C6H12N2/c1-5-4-8(3)7-6(5)2/h5H,4H2,1-3H3","UWCOGVAFZZBWAT-UHFFFAOYSA-N"
"[H]C(=N1)C(C)C(C)N(C)1","InChI=1S/C6H12N2/c1-5-4-7-8(3)6(5)2/h4-6H,1-3H3","QZXPNIFNBFPOML-UHFFFAOYSA-N"
"CC(N1)C(C)C(C)=N1","InChI=1S/C6H12N2/c1-4-5(2)7-8-6(4)3/h4-5,7H,1-3H3","NBUOBRBXCTZHFM-UHFFFAOYSA-N"
"CC(=N1)CC(C)(C)N1","InChI=1S/C6H12N2/c1-5-4-6(2,3)8-7-5/h8H,4H2,1-3H3","MEVTUZFUVAZEPY-UHFFFAOYSA-N"
"CCC(C=1)CN(C)N1","InChI=1S/C6H12N2/c1-3-6-4-7-8(2)5-6/h4,6H,3,5H2,1-2H3","DHEAFGCWGYSLFH-UHFFFAOYSA-N"
"CCCC(C1)NN=C1","InChI=1S/C6H12N2/c1-2-3-6-4-5-7-8-6/h5-6,8H,2-4H2,1H3","YJMMTFQSMKYWSB-UHFFFAOYSA-N"
"C=CCN(C1)N=C([H])C1","InChI=1S/C6H10N2/c1-2-5-8-6-3-4-7-8/h2,4H,1,3,5-6H2","ZWAMZBCFMBMWPU-UHFFFAOYSA-N"
"CCC(=N1)C(C)CN(C)1","InChI=1S/C7H14N2/c1-4-7-6(2)5-9(3)8-7/h6H,4-5H2,1-3H3","VEXJHDVLCQKJJU-UHFFFAOYSA-N"
"CCC(C(C)1)N(C)N=C1","InChI=1S/C7H14N2/c1-4-7-6(2)5-8-9(7)3/h5-7H,4H2,1-3H3","LSAFIEKJCBNDJB-UHFFFAOYSA-N"
"CCC(C)(N1)CC(C)=N1","InChI=1S/C7H14N2/c1-4-7(3)5-6(2)8-9-7/h9H,4-5H2,1-3H3","DKISPJYYXPWNTG-UHFFFAOYSA-N"
"CC(C)N(C1)N=C(C)C1","InChI=1S/C7H14N2/c1-6(2)9-5-4-7(3)8-9/h6H,4-5H2,1-3H3","CKWZASMUQGBSSE-UHFFFAOYSA-N"
"CCCN(C1)N=C(C)C1","InChI=1S/C7H14N2/c1-3-5-9-6-4-7(2)8-9/h3-6H2,1-2H3","XXCCMDLLIVHSJT-UHFFFAOYSA-N"
"CCCC(C1)C([H])=NN(C)1","InChI=1S/C7H14N2/c1-3-4-7-5-8-9(2)6-7/h5,7H,3-4,6H2,1-2H3","SUETXQJIPUGALV-UHFFFAOYSA-N"
"CC(C)c(c1)c(O)cc(C)c1","InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3","MGSRCZKZVOBKFT-UHFFFAOYSA-N"
"CC(C)c(c1)cc(O)c(C)c1","InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7,11H,1-3H3","RECUKUPTGUEGMW-UHFFFAOYSA-N"
"O=C(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3","DSSYKIVIOFKYAU-UHFFFAOYSA-N"
"CCCCCCC(O1)C(=O)C=C(C)1","InChI=1S/C11H18O2/c1-3-4-5-6-7-11-10(12)8-9(2)13-11/h8,11H,3-7H2,1-2H3","AAUWBAWSKVOBFL-UHFFFAOYSA-N"
"Cc(c1)cc(C(C)(C)C)c(O)c1C(C)(C)C","InChI=1S/C15H24O/c1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h8-9,16H,1-7H3","NLZUEZXRPGMBCV-UHFFFAOYSA-N"
"C=CCSSC","InChI=1S/C4H8S2/c1-3-4-6-5-2/h3H,1,4H2,2H3","XNZOTQPMYMCTBZ-UHFFFAOYSA-N"
"CSSSC","InChI=1S/C2H6S3/c1-3-5-4-2/h1-2H3","YWHLKYXPLRWGSE-UHFFFAOYSA-N"
"CCCCCSS","InChI=1S/C5H12S2/c1-2-3-4-5-7-6/h6H,2-5H2,1H3","DPLYGYOSWLFGGY-UHFFFAOYSA-N"
"CCCCCSSC","InChI=1S/C6H14S2/c1-3-4-5-6-8-7-2/h3-6H2,1-2H3","VDJXDNLYBDHPHP-UHFFFAOYSA-N"
"CSSSSC","InChI=1S/C2H6S4/c1-3-5-6-4-2/h1-2H3","NPNIZCVKXVRCHF-UHFFFAOYSA-N"
"C=CCCC#N","InChI=1S/C5H7N/c1-2-3-4-5-6/h2H,1,3-4H2","CFEYBLWMNFZOPB-UHFFFAOYSA-N"
"C=CCCN=C=S","InChI=1S/C5H7NS/c1-2-3-4-6-5-7/h2H,1,3-4H2","SKIHGKNFJKJXPX-UHFFFAOYSA-N"
"C=CCCCN=C=S","InChI=1S/C6H9NS/c1-2-3-4-5-7-6-8/h2H,1,3-5H2","DBISBKDNOKIADM-UHFFFAOYSA-N"
"N#CCCCCSC","InChI=1S/C6H11NS/c1-8-6-4-2-3-5-7/h2-4,6H2,1H3","XPUDGEZWSNPCMM-UHFFFAOYSA-N"
"N#CCCc(c1)cccc1","InChI=1S/C9H9N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7H2","ACRWYXSKEHUQDB-UHFFFAOYSA-N"
"N#CCCCCCSC","InChI=1S/C7H13NS/c1-9-7-5-3-2-4-6-8/h2-5,7H2,1H3","ULSCBSNSXYDREI-UHFFFAOYSA-N"
"N#CCCCCCCSC","InChI=1S/C8H15NS/c1-10-8-6-4-2-3-5-7-9/h2-6,8H2,1H3","MAMGGQVRQMBXMB-UHFFFAOYSA-N"
"S=C=NCCc(c1)cccc1","InChI=1S/C9H9NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2","IZJDOKYDEWTZSO-UHFFFAOYSA-N"
"N#CCCCCCCCSC","InChI=1S/C9H17NS/c1-11-9-7-5-3-2-4-6-8-10/h2-7,9H2,1H3","BWZCPICNIWWLFX-UHFFFAOYSA-N"
"N#CCCCCCCCCSC","InChI=1S/C10H19NS/c1-12-10-8-6-4-2-3-5-7-9-11/h2-8,10H2,1H3","KQKRRHTVZQEXBX-UHFFFAOYSA-N"
"CCCCCCCCCCCCC=C","InChI=1S/C14H28/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3H,1,4-14H2,2H3","HFDVRLIODXPAHB-UHFFFAOYSA-N"
"ClC(Cl)(Cl)Cl","InChI=1S/CCl4/c2-1(3,4)5","VZGDMQKNWNREIO-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)c(c1)ccc(N)c1","InChI=1S/C12H12N2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H,13-14H2","HFACYLZERDEVSX-UHFFFAOYSA-N"
"Oc(c(Cl)1)c(Cl)c(Cl)c(Cl)c(Cl)1","InChI=1S/C6HCl5O/c7-1-2(8)4(10)6(12)5(11)3(1)9/h12H","IZUPBVBPLAPZRR-UHFFFAOYSA-N"
"ClCCOCCCl","InChI=1S/C4H8Cl2O/c5-1-3-7-4-2-6/h1-4H2","ZNSMNVMLTJELDZ-UHFFFAOYSA-N"
"ClCOCCl","InChI=1S/C2H4Cl2O/c3-1-5-2-4/h1-2H2","HRQGCQVOJVTVLU-UHFFFAOYSA-N"
"C=COCCCl","InChI=1S/C4H7ClO/c1-2-6-4-3-5/h2H,1,3-4H2","DNJRKFKAFWSXSE-UHFFFAOYSA-N"
"Clc(c1)cc(c2)c(ccc2)c1","InChI=1S/C10H7Cl/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H","CGYGETOMCSJHJU-UHFFFAOYSA-N"
"Oc(c1)cc(C)c(Cl)c1","InChI=1S/C7H7ClO/c1-5-4-6(9)2-3-7(5)8/h2-4,9H,1H3","CFKMVGJGLGKFKI-UHFFFAOYSA-N"
"ClC(Cl)Cl","InChI=1S/CHCl3/c2-1(3)4/h1H","HEDRZPFGACZZDS-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(C(Cl)Cl)c(c1)ccc(Cl)c1","InChI=1S/C14H10Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8,13-14H","AHJKRLASYNVKDZ-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(=C(Cl)Cl)c(c1)ccc(Cl)c1","InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H","UCNVFOCBFJOQAL-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(c(c1)ccc(Cl)c1)C(Cl)(Cl)Cl","InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H","YVGGHNCTFXOJCH-UHFFFAOYSA-N"
"C=C(Cl)Cl","InChI=1S/C2H2Cl2/c1-2(3)4/h1H2","LGXVIGDEPROXKC-UHFFFAOYSA-N"
"CC(Cl)CCl","InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3","KNKRKFALVUDBJE-UHFFFAOYSA-N"
"ClCC=CCl","InChI=1S/C3H4Cl2/c4-2-1-3-5/h1-2H,3H2/b2-1+","UOORRWUZONOOLO-OWOJBTEDSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(C)c1","InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3","RMBFBMJGBANMMK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(C)c(cc1)[N+1]([O-1])=O","InChI=1S/C7H6N2O4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3","XTRDKALNCIHHNI-UHFFFAOYSA-N"
"CC(=C1)CC(C)(C)CC(=O)1","InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3","HJOVHMDZYOCNQW-UHFFFAOYSA-N"
"C=CC=O","InChI=1S/C3H4O/c1-2-3-4/h2-3H,1H2","HGINCPLSRVDWNT-UHFFFAOYSA-N"
"C=CC#N","InChI=1S/C3H3N/c1-2-3-4/h2H,1H2","NLHHRLWOUZZQLW-UHFFFAOYSA-N"
"Clc(c1)cccc1","InChI=1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H","MVPPADPHJFYWMZ-UHFFFAOYSA-N"
"Clc(c(Cl)1)c(Cl)c(Cl)c(Cl)c(Cl)1","InChI=1S/C6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9","CKAPSXZOOQJIBF-UHFFFAOYSA-N"
"Clc(c1)cc(Cl)c(Cl)c1","InChI=1S/C6H3Cl3/c7-4-1-2-5(8)6(9)3-4/h1-3H","PBKONEOXTCPAFI-UHFFFAOYSA-N"
"CCCl","InChI=1S/C2H5Cl/c1-2-3/h2H2,1H3","HRYZWHHZPQKTII-UHFFFAOYSA-N"
"CC(Cl)Cl","InChI=1S/C2H4Cl2/c1-2(3)4/h2H,1H3","SCYULBFZEHDVBN-UHFFFAOYSA-N"
"ClCCCl","InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2","WSLDOOZREJYCGB-UHFFFAOYSA-N"
"ClC(Cl)(Cl)C(Cl)(Cl)Cl","InChI=1S/C2Cl6/c3-1(4,5)2(6,7)8","VHHHONWQHHHLTI-UHFFFAOYSA-N"
"ClC(Cl)C(Cl)Cl","InChI=1S/C2H2Cl4/c3-1(4)2(5)6/h1-2H","QPFMBZIOSGYJDE-UHFFFAOYSA-N"
"CC(Cl)(Cl)Cl","InChI=1S/C2H3Cl3/c1-2(3,4)5/h1H3","UOCLXMDMGBRAIB-UHFFFAOYSA-N"
"ClCC(Cl)Cl","InChI=1S/C2H3Cl3/c3-1-2(4)5/h2H,1H2","UBOXGVDOUJQMTN-UHFFFAOYSA-N"
"Nc(c2)c(Cl)cc(c2)c(c1)cc(Cl)c(N)c1","InChI=1S/C12H10Cl2N2/c13-9-5-7(1-3-11(9)15)8-2-4-12(16)10(14)6-8/h1-6H,15-16H2","HUWXDEQWWKGHRV-UHFFFAOYSA-N"
"ClC(=C(Cl)1)C(Cl)(C(Cl)(Cl)2)C([H])(C([H])54)C([H])(C([H])(C5)C([H])(O3)C([H])34)C(Cl)12","InChI=1S/C12H8Cl6O/c13-8-9(14)11(16)5-3-1-2(6-7(3)19-6)4(5)10(8,15)12(11,17)18/h2-7H,1H2/t2-,3+,4-,5+,6-,7+,10-,11+","DFBKLUNHFCTMDC-GKRDHZSOSA-N"
"CCc(c1)cccc1","InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3","YNQLUTRBYVCPMQ-UHFFFAOYSA-N"
"ClCCOCOCCCl","InChI=1S/C5H10Cl2O2/c6-1-3-8-5-9-4-2-7/h1-5H2","NLXGURFLBLRZRO-UHFFFAOYSA-N"
"CC(C)(Cl)OC(C)(C)Cl","InChI=1S/C6H12Cl2O/c1-5(2,7)9-6(3,4)8/h1-4H3","BULHJTXRZFEUDQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)Oc(c1)ccc(Br)c1","InChI=1S/C12H9BrO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H","JDUYPUMQALQRCN-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C12H9ClO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H","PGPNJCAMHOJTEF-UHFFFAOYSA-N"
"FC(F)(Cl)Cl","InChI=1S/CCl2F2/c2-1(3,4)5","PXBRQCKWGAHEHS-UHFFFAOYSA-N"
"CBr","InChI=1S/CH3Br/c1-2/h1H3","GZUXJHMPEANEGY-UHFFFAOYSA-N"
"CCl","InChI=1S/CH3Cl/c1-2/h1H3","NEHMKBQYUWJMIP-UHFFFAOYSA-N"
"ClCCl","InChI=1S/CH2Cl2/c2-1-3/h1H2","YMWUJEATGCHHMB-UHFFFAOYSA-N"
"FC(Cl)(Cl)Cl","InChI=1S/CCl3F/c2-1(3,4)5","CYRMSUTZVYGINF-UHFFFAOYSA-N"
"[H]C(=C([H])3)C(Cl)C(C31)C(Cl)(C(Cl)=2)C(Cl)(Cl)C(Cl)(C(Cl)2)1","InChI=1S/C10H5Cl7/c11-4-2-1-3-5(4)9(15)7(13)6(12)8(3,14)10(9,16)17/h1-5H","FRCCEHPWNOQAEU-UHFFFAOYSA-N"
"ClC(Cl)=C(Cl)C(Cl)=C(Cl)Cl","InChI=1S/C4Cl6/c5-1(3(7)8)2(6)4(9)10","RWNKSTSCBHKHTB-UHFFFAOYSA-N"
"ClC(C(Cl)=1)=C(Cl)C(Cl)(Cl)C(Cl)1","InChI=1S/C5Cl6/c6-1-2(7)4(9)5(10,11)3(1)8","VUNCWTMEJYMOOR-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cccc1","InChI=1S/C6H5NO2/c8-7(9)6-4-2-1-3-5-6/h1-5H","LQNUZADURLCDLV-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(O)c(C)1","InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3","ZXVONLUNISGICL-UHFFFAOYSA-N"
"C=CCl","InChI=1S/C2H3Cl/c1-2-3/h2H,1H2","BZHJMEDXRYGGRV-UHFFFAOYSA-N"
"COC(O1)C([H])(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C)1","InChI=1S/C22H55O9PSi5/c1-24-22-21(29-35(8,9)10)20(28-34(5,6)7)19(27-33(2,3)4)18(26-22)17-25-32(23,30-36(11,12)13)31-37(14,15)16/h18-22H,17H2,1-16H3","RJXOEHNQWFJEQZ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(NCCO[Si](C)(C)C)c1","InChI=1S/C11H17N3O5Si/c1-20(2,3)19-7-6-12-10-5-4-9(13(15)16)8-11(10)14(17)18/h4-5,8,12H,6-7H2,1-3H3","PPBSFFPMABCFSN-UHFFFAOYSA-N"
"COC(C1)C(OC)C(O)C(OC)O1","InChI=1S/C8H16O5/c1-10-5-4-13-8(12-3)6(9)7(5)11-2/h5-9H,4H2,1-3H3/t5-,6-,7+,8?/m1/s1","VXOPRCAXQLGBIS-HBFKVTOISA-N"
"COCC(O1)C(OC)C(OC)C(O)C(OC)1","InChI=1S/C10H20O6/c1-12-5-6-8(13-2)9(14-3)7(11)10(15-4)16-6/h6-11H,5H2,1-4H3/t6-,7+,8-,9-,10+/m1/s1","MJCQVUQCEVACLB-ZOZBQHSOSA-N"
"COCC(O1)C(OC)C(O)C(O)C(OC)1","InChI=1S/C9H18O6/c1-12-4-5-8(13-2)6(10)7(11)9(14-3)15-5/h5-11H,4H2,1-3H3/t5-,6-,7+,8-,9+/m1/s1","UKSOTSKNRMTYIO-ZEBDFXRSSA-N"
"COC(O1)C(OC)C(O)C(O)C(C)1","InChI=1S/C8H16O5/c1-4-5(9)6(10)7(11-2)8(12-3)13-4/h4-10H,1-3H3/t4-,5+,6+,7-,8+/m1/s1","ZIRPXMSHWUAJJI-HNEXDWKRSA-N"
"[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])OC(=O)C(C)=C","InChI=1S/C7H12O2/c1-5(2)7(8)9-6(3)4/h6H,1H2,2-4H3/i3D3,4D3,6D","BOQSSGDQNWEFSX-XHTSFSSMSA-N"
"CC(=C)C(=O)OC([2H])(C)C","InChI=1S/C7H12O2/c1-5(2)7(8)9-6(3)4/h6H,1H2,2-4H3/i6D","BOQSSGDQNWEFSX-RAMDWTOOSA-N"
"[2H]C([2H])([2H])C([H])(C([2H])([2H])[2H])OC(=O)C(C)=C","InChI=1S/C7H12O2/c1-5(2)7(8)9-6(3)4/h6H,1H2,2-4H3/i3D3,4D3","BOQSSGDQNWEFSX-LIJFRPJRSA-N"
"OCCc(c1)cccc1","InChI=1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2","WRMNZCZEMHIOCP-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(O)c(c1)cccc1","InChI=1S/C13H12O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13-14H","QILSFLSDHQAZET-UHFFFAOYSA-N"
"CC(O)c(c1)cccc1","InChI=1S/C8H10O/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3","WAPNOHKVXSQRPX-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(=O)OCC(C)C","InChI=1S/C12H16O3/c1-9(2)8-15-12(13)10-4-6-11(14-3)7-5-10/h4-7,9H,8H2,1-3H3","HQYSDZUOGBUYJA-UHFFFAOYSA-N"
"N#Cc(c1)ccc(c1)C(O)=O","InChI=1S/C8H5NO2/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4H,(H,10,11)","ADCUEPOHPCPMCE-UHFFFAOYSA-N"
"N#Cc(c1)ccc(c1)C(=O)OCC(C)C","InChI=1S/C12H13NO2/c1-9(2)8-15-12(14)11-5-3-10(7-13)4-6-11/h3-6,9H,8H2,1-2H3","RYFXHNFLVQQUPO-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C11H13NO4/c1-8(2)7-16-11(13)9-3-5-10(6-4-9)12(14)15/h3-6,8H,7H2,1-2H3","DCZWILGYHRWANR-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(F)c1","InChI=1S/C9H9FO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3","UMPRJGKLMUDRHL-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(N)cc1","InChI=1S/C9H11NO2/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6H,2,10H2,1H3","ZMCBYSBVJIMENC-UHFFFAOYSA-N"
"OC(=O)c(c1)c(F)ccc1","InChI=1S/C7H5FO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)","NSTREUWFTAOOKS-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(F)cc1","InChI=1S/C7H5FO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)","MXNBDFWNYRNIBH-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(F)cc1","InChI=1S/C9H9FO2/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3","SMMIKBXLEWTSJD-UHFFFAOYSA-N"
"OC(=O)c(c1)ccc(F)c1","InChI=1S/C7H5FO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)","BBYDXOIZLAWGSL-UHFFFAOYSA-N"
"OC(=O)c(c1)c(Cl)ccc1","InChI=1S/C7H5ClO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)","IKCLCGXPQILATA-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(Cl)cc1","InChI=1S/C7H5ClO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)","LULAYUGMBFYYEX-UHFFFAOYSA-N"
"OC(=O)c(c1)ccc(Cl)c1","InChI=1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)","XRHGYUZYPHTUJZ-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=O)c(c1)cccc1","InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H","RWCCWEUUXYIKHB-UHFFFAOYSA-N"
"COC(=O)C(=O)OC","InChI=1S/C4H6O4/c1-7-3(5)4(6)8-2/h1-2H3","LOMVENUNSWAXEN-UHFFFAOYSA-N"
"CCCOC(=O)c(c1)c(ccc1)C(=O)OCCC","InChI=1S/C14H18O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3","MQHNKCZKNAJROC-UHFFFAOYSA-N"
"CI","InChI=1S/CH3I/c1-2/h1H3","INQOMBQAUSQDDS-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(I)c1","InChI=1S/C9H9IO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3","YCBJOQUNPLTBGG-UHFFFAOYSA-N"
"CC(=C)C(=O)Cl","InChI=1S/C4H5ClO/c1-3(2)4(5)6/h1H2,2H3","VHRYZQNGTZXDNX-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C15H18O2Si/c1-18(2,3)17-15(16)11-13-9-6-8-12-7-4-5-10-14(12)13/h4-10H,11H2,1-3H3","FUAQQDROLSPOHA-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C14H24O3Si2/c1-18(2,3)16-13(12-10-8-7-9-11-12)14(15)17-19(4,5)6/h7-11,13H,1-6H3","QGQNCTUAZAEYNK-UHFFFAOYSA-N"
"Cc(c1)c(O[Si](C)(C)C)c(cc1)C(=O)O[Si](C)(C)C","InChI=1S/C14H24O3Si2/c1-11-9-8-10-12(13(11)16-18(2,3)4)14(15)17-19(5,6)7/h8-10H,1-7H3","MMUCIJOPDDWEJV-UHFFFAOYSA-N"
"Cc(c1)cc(O[Si](C)(C)C)c(c1)C(=O)O[Si](C)(C)C","InChI=1S/C14H24O3Si2/c1-11-8-9-12(14(15)17-19(5,6)7)13(10-11)16-18(2,3)4/h8-10H,1-7H3","WMMUZRDZZSRQEF-UHFFFAOYSA-N"
"O=C(CCCCCC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C13H28O4Si2/c1-18(2,3)16-12(14)10-8-7-9-11-13(15)17-19(4,5)6/h7-11H2,1-6H3","VOLKRTUGJXKFMI-UHFFFAOYSA-N"
"O=C(C=Cc(c1)ccc(c1)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C15H24O3Si2/c1-19(2,3)17-14-10-7-13(8-11-14)9-12-15(16)18-20(4,5)6/h7-12H,1-6H3/b12-9+","RKLSIGFDXPECDB-FMIVXFBMSA-N"
"O=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)c(c1)cccc1","InChI=1S/C15H24O3Si2/c1-19(2,3)17-14(13-10-8-7-9-11-13)12-15(16)18-20(4,5)6/h7-12H,1-6H3/b14-12+","KBQOSPPQSQZAEJ-WYMLVPIESA-N"
"c(c1)ccc(c1)C(CO[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C15H26O3Si2/c1-19(2,3)17-12-14(13-10-8-7-9-11-13)15(16)18-20(4,5)6/h7-11,14H,12H2,1-6H3","PASLIDCFUAELRD-UHFFFAOYSA-N"
"COc(c1)c(ccc1C(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C14H24O4Si2/c1-16-13-10-11(14(15)18-20(5,6)7)8-9-12(13)17-19(2,3)4/h8-10H,1-7H3","UQZKEPFYTGMPKU-UHFFFAOYSA-N"
"CCC(c(c1)cccc1)C(=O)O[Si](C)(C)C","InChI=1S/C13H20O2Si/c1-5-12(11-9-7-6-8-10-11)13(14)15-16(2,3)4/h6-10,12H,5H2,1-4H3","VYKUZPWIVBWKQA-UHFFFAOYSA-N"
"O=C(CC=CCC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C12H24O4Si2/c1-17(2,3)15-11(13)9-7-8-10-12(14)16-18(4,5)6/h7-8H,9-10H2,1-6H3/b8-7+","ZHDWBZJDVFQQQO-BQYQJAHWSA-N"
"C[Si](C)(C)OC(=O)C(C(C1)CCC1)C(=O)O[Si](C)(C)C","InChI=1S/C14H28O4Si2/c1-19(2,3)17-13(15)12(11-9-7-8-10-11)14(16)18-20(4,5)6/h11-12H,7-10H2,1-6H3","UPRVYQOMRQKYCY-UHFFFAOYSA-N"
"O=C(CCCCCCC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C14H30O4Si2/c1-19(2,3)17-13(15)11-9-7-8-10-12-14(16)18-20(4,5)6/h7-12H2,1-6H3","LWDVKORSFQXPHL-UHFFFAOYSA-N"
"C[Si](C)(C)OCC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C12H30O4Si3/c1-17(2,3)14-10-11(15-18(4,5)6)12(13)16-19(7,8)9/h11H,10H2,1-9H3","VTLZEKUPFUIGJQ-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C15H24O4Si2/c1-20(2,3)18-14(16)13(12-10-8-7-9-11-12)15(17)19-21(4,5)6/h7-11,13H,1-6H3","AIZHQFQKWQSRKR-UHFFFAOYSA-N"
"COc(c1)c(ccc(CC(=O)O[Si](C)(C)C)1)O[Si](C)(C)C","InChI=1S/C15H26O4Si2/c1-17-14-10-12(11-15(16)19-21(5,6)7)8-9-13(14)18-20(2,3)4/h8-10H,11H2,1-7H3","PPAQHWGGSXMRBE-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(C)C(=O)O[Si](C)(C)C","InChI=1S/C19H40O2Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18(2)19(20)21-22(3,4)5/h18H,6-17H2,1-5H3","VTUHRCMSKKPSFY-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)CC(C1)(CCC1)CC(=O)O[Si](C)(C)C","InChI=1S/C15H30O4Si2/c1-20(2,3)18-13(16)11-15(9-7-8-10-15)12-14(17)19-21(4,5)6/h7-12H2,1-6H3","FWYIOQBWIAFANE-UHFFFAOYSA-N"
"CCCC(CCC)(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C15H32O4Si2/c1-9-11-15(12-10-2,13(16)18-20(3,4)5)14(17)19-21(6,7)8/h9-12H2,1-8H3","DWLIUIJNJMCHOA-UHFFFAOYSA-N"
"C(CCCC(=O)O[Si](C)(C)C)CCCC(=O)O[Si](C)(C)C","InChI=1S/C15H32O4Si2/c1-20(2,3)18-14(16)12-10-8-7-9-11-13-15(17)19-21(4,5)6/h7-13H2,1-6H3","UGESQDAUQLNVHU-UHFFFAOYSA-N"
"c(c1)ccc(c1)CC(C(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C16H26O4Si2/c1-21(2,3)19-15(17)14(16(18)20-22(4,5)6)12-13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3","AKZYXWZPWVNMMW-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)CC(c(c1)cccc1)C(=O)O[Si](C)(C)C","InChI=1S/C16H26O4Si2/c1-21(2,3)19-15(17)12-14(13-10-8-7-9-11-13)16(18)20-22(4,5)6/h7-11,14H,12H2,1-6H3","QSFAPKMHJXZWEF-UHFFFAOYSA-N"
"COc(c1)c(ccc(C=CC(=O)O[Si](C)(C)C)1)O[Si](C)(C)C","InChI=1S/C16H26O4Si2/c1-18-15-12-13(8-10-14(15)19-21(2,3)4)9-11-16(17)20-22(5,6)7/h8-12H,1-7H3/b11-9+","UQBSUVIBJIXFQT-PKNBQFBNSA-N"
"COc(c1)c(O[Si](C)(C)C)c(OC)cc1C(=O)O[Si](C)(C)C","InChI=1S/C15H26O5Si2/c1-17-12-9-11(15(16)20-22(6,7)8)10-13(18-2)14(12)19-21(3,4)5/h9-10H,1-8H3","KWOFGVXBWXVAJU-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(C1)C(C)(C)C(C)(C1)C(=O)O[Si](C)(C)C","InChI=1S/C16H32O4Si2/c1-15(2)12(13(17)19-21(4,5)6)10-11-16(15,3)14(18)20-22(7,8)9/h12H,10-11H2,1-9H3","CFIGMGJVGDCELR-UHFFFAOYSA-N"
"C(CCCCC(=O)O[Si](C)(C)C)CCCC(=O)O[Si](C)(C)C","InChI=1S/C16H34O4Si2/c1-21(2,3)19-15(17)13-11-9-7-8-10-12-14-16(18)20-22(4,5)6/h7-14H2,1-6H3","BDACUOPQFMCPLO-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)CC(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C13H30O5Si3/c1-19(2,3)16-11(13(15)18-21(7,8)9)10-12(14)17-20(4,5)6/h11H,10H2,1-9H3","QCOBWZRPFJZHGU-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)c(O[Si](C)(C)C)c(cc1)C(=O)O[Si](C)(C)C","InChI=1S/C19H26O3Si2/c1-23(2,3)21-18-16(15-11-8-7-9-12-15)13-10-14-17(18)19(20)22-24(4,5)6/h7-14H,1-6H3","DUSFUWDBRHTRHV-UHFFFAOYSA-N"
"C(CCCCC(=O)O[Si](C)(C)C)CCCCC(=O)O[Si](C)(C)C","InChI=1S/C17H36O4Si2/c1-22(2,3)20-16(18)14-12-10-8-7-9-11-13-15-17(19)21-23(4,5)6/h7-15H2,1-6H3","WANRKRMIBVTYBU-UHFFFAOYSA-N"
"Cc(c1)cc(c(C)c1)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-9-6-7-10(2)11(8-9)12(13)14-15(3,4)5/h6-8H,1-5H3","DDDBDWYEBRVNBB-UHFFFAOYSA-N"
"COc(c1)cc(CC(=O)O[Si](C)(C)C)c(OC)c1","InChI=1S/C13H20O4Si/c1-15-11-6-7-12(16-2)10(8-11)9-13(14)17-18(3,4)5/h6-8H,9H2,1-5H3","ZPSFULASMKZAKO-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(O[Si](C)(C)C)c(cc1)O[Si](C)(C)C","InChI=1S/C16H30O4Si3/c1-21(2,3)18-14-12-10-11-13(15(14)19-22(4,5)6)16(17)20-23(7,8)9/h10-12H,1-9H3","IPIPJXIWUUYKNS-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)cc(O[Si](C)(C)C)c(c1)O[Si](C)(C)C","InChI=1S/C16H30O4Si3/c1-21(2,3)18-14-11-10-13(16(17)20-23(7,8)9)12-15(14)19-22(4,5)6/h10-12H,1-9H3","DVAGRNBRUDZPDF-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(O[Si](C)(C)C)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H28O3Si2/c1-24(2,3)22-19(21)20(23-25(4,5)6,17-13-9-7-10-14-17)18-15-11-8-12-16-18/h7-16H,1-6H3","HDZAYJSSMMEYNX-UHFFFAOYSA-N"
"C(CCCC=CC(=O)O[Si](C)(C)C)CCCCC(=O)O[Si](C)(C)C","InChI=1S/C18H36O4Si2/c1-23(2,3)21-17(19)15-13-11-9-7-8-10-12-14-16-18(20)22-24(4,5)6/h13,15H,7-12,14,16H2,1-6H3/b15-13+","XUSCELGAZUEVPT-FYWRMAATSA-N"
"CC(C)C(C3)=CC(=C2)C([H])(C3)C(C)(C1)C([H])(C2)C(C)(CC1)C(=O)O[Si](C)(C)C","InChI=1S/C23H38O2Si/c1-16(2)17-9-11-19-18(15-17)10-12-20-22(19,3)13-8-14-23(20,4)21(24)25-26(5,6)7/h10,15-16,19-20H,8-9,11-14H2,1-7H3/t19-,20+,22+,23+/m0/s1","RXWFRYPIQODUHW-KKSHJYNMSA-N"
"C(CCCCCC(=O)O[Si](C)(C)C)CCCCC(=O)O[Si](C)(C)C","InChI=1S/C18H38O4Si2/c1-23(2,3)21-17(19)15-13-11-9-7-8-10-12-14-16-18(20)22-24(4,5)6/h7-16H2,1-6H3","RJYFZCUYOIINDS-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)CC(C)(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C15H34O5Si3/c1-15(20-23(8,9)10,11-13(16)18-21(2,3)4)12-14(17)19-22(5,6)7/h11-12H2,1-10H3","SWDDFRVEZJUJJD-UHFFFAOYSA-N"
"CC(C)CCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C23H48O2Si/c1-22(2)20-18-16-14-12-10-8-6-7-9-11-13-15-17-19-21-23(24)25-26(3,4)5/h22H,6-21H2,1-5H3","UHFRRFHGAYNJOT-UHFFFAOYSA-N"
"C[Si](C)(C)Oc(c1)ccc(c1)C(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C17H32O4Si3/c1-22(2,3)19-15-12-10-14(11-13-15)16(20-23(4,5)6)17(18)21-24(7,8)9/h10-13,16H,1-9H3","YPRXSYQBVBCYJZ-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)Cc(c1)cc(O[Si](C)(C)C)c(c1)O[Si](C)(C)C","InChI=1S/C17H32O4Si3/c1-22(2,3)19-15-11-10-14(12-16(15)20-23(4,5)6)13-17(18)21-24(7,8)9/h10-12H,13H2,1-9H3","RYYDTJQPEUISHG-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)Cc(c1)c(ccc(O[Si](C)(C)C)1)O[Si](C)(C)C","InChI=1S/C17H32O4Si3/c1-22(2,3)19-15-10-11-16(20-23(4,5)6)14(12-15)13-17(18)21-24(7,8)9/h10-12H,13H2,1-9H3","NLTJSNRUCPSKFR-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c2)c(ccc2)c(c1)c(ccc1)C(=O)O[Si](C)(C)C","InChI=1S/C20H26O4Si2/c1-25(2,3)23-19(21)17-13-9-7-11-15(17)16-12-8-10-14-18(16)20(22)24-26(4,5)6/h7-14H,1-6H3","WEMHCCRHWUYMOB-UHFFFAOYSA-N"
"C(CCCCCC(=O)O[Si](C)(C)C)CCCCCC(=O)O[Si](C)(C)C","InChI=1S/C19H40O4Si2/c1-24(2,3)22-18(20)16-14-12-10-8-7-9-11-13-15-17-19(21)23-25(4,5)6/h7-17H2,1-6H3","QMAWNDBFLCEGKZ-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)CC(=CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C15H30O6Si3/c1-22(2,3)19-13(16)10-12(15(18)21-24(7,8)9)11-14(17)20-23(4,5)6/h10H,11H2,1-9H3/b12-10+","RHDPKJMZPKZKTA-ZRDIBKRKSA-N"
"O=C(O[Si](C)(C)C)CC(=CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C15H30O6Si3/c1-22(2,3)19-13(16)10-12(15(18)21-24(7,8)9)11-14(17)20-23(4,5)6/h10H,11H2,1-9H3/b12-10-","RHDPKJMZPKZKTA-BENRWUELSA-N"
"O=C(O[Si](C)(C)C)CC(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C15H32O6Si3/c1-22(2,3)19-13(16)10-12(15(18)21-24(7,8)9)11-14(17)20-23(4,5)6/h12H,10-11H2,1-9H3","VEXAYJWEIRRBOE-UHFFFAOYSA-N"
"O=C(C=Cc(c1)cc(O[Si](C)(C)C)c(c1)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C18H32O4Si3/c1-23(2,3)20-16-12-10-15(14-17(16)21-24(4,5)6)11-13-18(19)22-25(7,8)9/h10-14H,1-9H3/b13-11+","MBIYCWDFSLHMSI-ACCUITESSA-N"
"CC(C)CCCCCCCCCCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C24H50O2Si/c1-23(2)21-19-17-15-13-11-9-7-6-8-10-12-14-16-18-20-22-24(25)26-27(3,4)5/h23H,6-22H2,1-5H3","WECMMLXJSWEMQD-UHFFFAOYSA-N"
"C(CCCCCCCC(=O)O[Si](C)(C)C)CCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C22H46O4Si2/c1-27(2,3)25-21(23)19-17-15-13-11-9-7-8-10-12-14-16-18-20-22(24)26-28(4,5)6/h7-20H2,1-6H3","YANZXOCRRABPGY-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C16H38O6Si4/c1-23(2,3)19-13(15(17)21-25(7,8)9)14(20-24(4,5)6)16(18)22-26(10,11)12/h13-14H,1-12H3","LPQBQHQEJJCWBZ-UHFFFAOYSA-N"
"C(CCCCCCCCC(=O)O[Si](C)(C)C)CCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C24H50O4Si2/c1-29(2,3)27-23(25)21-19-17-15-13-11-9-7-8-10-12-14-16-18-20-22-24(26)28-30(4,5)6/h7-22H2,1-6H3","VDMOBMJETWUJLJ-UHFFFAOYSA-N"
"O=Cc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C11H14O3Si/c1-15(2,3)14-11(13)10-6-4-9(8-12)5-7-10/h4-8H,1-3H3","LLLSJLOFPKECPD-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(O[Si](C)(C)C)c(c1)cc(O[Si](C)(C)C)c(c1)O[Si](C)(C)C","InChI=1S/C20H40O5Si4/c1-26(2,3)22-17-14-13-16(15-18(17)23-27(4,5)6)19(24-28(7,8)9)20(21)25-29(10,11)12/h13-15,19H,1-12H3","MDAKQGIALDYWHV-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(CCCCCCCCCCCCCCCCCCCC)O[Si](C)(C)C","InChI=1S/C28H60O3Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(30-32(2,3)4)28(29)31-33(5,6)7/h27H,8-26H2,1-7H3","RSDJSUMKDHUJPY-UHFFFAOYSA-N"
"c(O[Si](C)(C)C)(c2)ccc(c2)C(CCC(=O)O[Si](C)(C)C)(c(c1)ccc(O[Si](C)(C)C)c1)C","InChI=1S/C26H42O4Si3/c1-26(20-19-25(27)30-33(8,9)10,21-11-15-23(16-12-21)28-31(2,3)4)22-13-17-24(18-14-22)29-32(5,6)7/h11-18H,19-20H2,1-10H3","HPGZDRRKNPSYSR-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(C1)C(C(=O)O[Si](C)(C)C)C(C(=O)O[Si](C)(C)C)C(C(=O)O[Si](C)(C)C)1","InChI=1S/C21H42O8Si4/c1-30(2,3)26-18(22)14-13-15(19(23)27-31(4,5)6)17(21(25)29-33(10,11)12)16(14)20(24)28-32(7,8)9/h14-17H,13H2,1-12H3","ZZWJSMOLYCPOFX-UHFFFAOYSA-N"
"COc(c1)c(ccc1)C(=O)O[Si](C)(C)C","InChI=1S/C11H16O3Si/c1-13-10-8-6-5-7-9(10)11(12)14-15(2,3)4/h5-8H,1-4H3","LWBFIZBQVRDUMY-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(c21)c(c3)c(ccc3)c(cccc2)1","InChI=1S/C17H18O2Si/c1-20(2,3)19-17(18)16-14-10-6-4-8-12(14)13-9-5-7-11-15(13)16/h4-11,16H,1-3H3","XYXUFGRMSJQXCQ-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C18H18O2Si/c1-21(2,3)20-18(19)17-15-10-6-4-8-13(15)12-14-9-5-7-11-16(14)17/h4-12H,1-3H3","JTUMBWFAVUSXJY-UHFFFAOYSA-N"
"C=CCCCCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C14H28O2Si/c1-5-6-7-8-9-10-11-12-13-14(15)16-17(2,3)4/h5H,1,6-13H2,2-4H3","VMXRWOBZWPBJEY-UHFFFAOYSA-N"
"O=C(CC(C1)CCC1)O[Si](C)(C)C","InChI=1S/C10H20O2Si/c1-13(2,3)12-10(11)8-9-6-4-5-7-9/h9H,4-8H2,1-3H3","MPPGRILZFNBLIQ-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C=CC(=O)O[Si](C)(C)C","InChI=1S/C13H18O3Si/c1-15-12-8-5-11(6-9-12)7-10-13(14)16-17(2,3)4/h5-10H,1-4H3/b10-7+","YQVAQSPGNGFHAH-JXMROGBWSA-N"
"O=C(CC(C1)CCCC1)O[Si](C)(C)C","InChI=1S/C11H22O2Si/c1-14(2,3)13-11(12)9-10-7-5-4-6-8-10/h10H,4-9H2,1-3H3","YKJZHLWHFWFOOE-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(C1)=CC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)1","InChI=1S/C19H42O5Si4/c1-25(2,3)21-16-13-15(19(20)24-28(10,11)12)14-17(22-26(4,5)6)18(16)23-27(7,8)9/h13,16-18H,14H2,1-12H3/t16-,17-,18-/m0/s1","LMFAUEGOCMAFIW-BZSNNMDCSA-N"
"CCCCc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C14H22O2Si/c1-5-6-7-12-8-10-13(11-9-12)14(15)16-17(2,3)4/h8-11H,5-7H2,1-4H3","QCIYBSTWFOLQPL-UHFFFAOYSA-N"
"C(C1)CCC(C1)C(=O)O[Si](C)(C)C","InChI=1S/C10H20O2Si/c1-13(2,3)12-10(11)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3","PYJUBHQOZUNCIC-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)CC(=O)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-10-5-7-11(8-6-10)9-12(13)14-15(2,3)4/h5-8H,9H2,1-4H3","LXJDXPPJXKOURQ-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)C=CC(=O)O[Si](C)(C)C","InChI=1S/C13H18O2Si/c1-11-5-7-12(8-6-11)9-10-13(14)15-16(2,3)4/h5-10H,1-4H3/b10-9+","FXVQMFXMBNRJBF-MDZDMXLPSA-N"
"c(c2)ccc(c2)C(C(C1)CCC1)C(=O)O[Si](C)(C)C","InChI=1S/C16H24O2Si/c1-19(2,3)18-16(17)15(14-11-7-8-12-14)13-9-5-4-6-10-13/h4-6,9-10,14-15H,7-8,11-12H2,1-3H3","LLMWGMYFEFHAIY-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(c(c1)cccc1)C(=O)O[Si](C)(C)C","InChI=1S/C17H20O2Si/c1-20(2,3)19-17(18)16(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13,16H,1-3H3","QSBLMZZLVMXTHB-UHFFFAOYSA-N"
"CCOc(c1)c(ccc1)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O3Si/c1-5-14-11-9-7-6-8-10(11)12(13)15-16(2,3)4/h6-9H,5H2,1-4H3","LPNQWYXWIIDKLT-UHFFFAOYSA-N"
"C(C1)=CCC(C1)C(=O)O[Si](C)(C)C","InChI=1S/C10H18O2Si/c1-13(2,3)12-10(11)9-7-5-4-6-8-9/h4-5,9H,6-8H2,1-3H3","BFVIGVPKTFVFNX-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(C)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-10(11-8-6-5-7-9-11)12(13)14-15(2,3)4/h5-10H,1-4H3","OMYJQVPBIWDUAO-UHFFFAOYSA-N"
"O=C(CCc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-15(2,3)14-12(13)10-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3","GRONVOGSDOJOMG-UHFFFAOYSA-N"
"CC(C)CCCCCCC(=O)O[Si](C)(C)C","InChI=1S/C13H28O2Si/c1-12(2)10-8-6-7-9-11-13(14)15-16(3,4)5/h12H,6-11H2,1-5H3","RPEGLTSXQCBJRY-UHFFFAOYSA-N"
"O=C(CC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C9H20O4Si2/c1-14(2,3)12-8(10)7-9(11)13-15(4,5)6/h7H2,1-6H3","ATCKJLDGNXGLAO-UHFFFAOYSA-N"
"O=C(CCC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C10H22O4Si2/c1-15(2,3)13-9(11)7-8-10(12)14-16(4,5)6/h7-8H2,1-6H3","QUUDZINXVRFXLB-UHFFFAOYSA-N"
"O=C(CCCC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C11H24O4Si2/c1-16(2,3)14-10(12)8-7-9-11(13)15-17(4,5)6/h7-9H2,1-6H3","UWZGPXOJVOOLSG-UHFFFAOYSA-N"
"O=C(CCCCC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C12H26O4Si2/c1-17(2,3)15-11(13)9-7-8-10-12(14)16-18(4,5)6/h7-10H2,1-6H3","DVGSOFSBBKDKRU-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O4Si/c1-14-10-7-6-9(8-11(10)15-2)12(13)16-17(3,4)5/h6-8H,1-5H3","JZIXRRXJQVBHJP-UHFFFAOYSA-N"
"CCCCCc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C15H24O2Si/c1-5-6-7-8-13-9-11-14(12-10-13)15(16)17-18(2,3)4/h9-12H,5-8H2,1-4H3","JKDYEPCDZXAYSI-UHFFFAOYSA-N"
"CCCCOc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C14H22O3Si/c1-5-6-11-16-13-9-7-12(8-10-13)14(15)17-18(2,3)4/h7-10H,5-6,11H2,1-4H3","SJNBPQNORONGJJ-UHFFFAOYSA-N"
"c(c(CC=C(C)C)1)c(C(=C4)C(c(c2)c(O4)cc(OC(=O)c(c3)cccc3)c2)=O)ccc1O","InChI=1S/C27H22O5/c1-17(2)8-9-20-14-19(10-13-24(20)28)23-16-31-25-15-21(11-12-22(25)26(23)29)32-27(30)18-6-4-3-5-7-18/h3-8,10-16,28H,9H2,1-2H3","YCNLHISKOPZIFS-UHFFFAOYSA-N"
"Oc(c4)cc(O3)c(c4)C(=O)C(=C([H])3)c(c2)cc(C1)c(c2)OC(C)(C)C1","InChI=1S/C20H18O4/c1-20(2)8-7-13-9-12(3-6-17(13)24-20)16-11-23-18-10-14(21)4-5-15(18)19(16)22/h3-6,9-11,21H,7-8H2,1-2H3","XYQGRDVFZGPOQG-UHFFFAOYSA-N"
"c(c23)cc(cc(OC=C(c(c4)cc(O5)c(CCC5(C)C)c4)C3=O)2)OCc(c1)cccc1","InChI=1S/C27H24O4/c1-27(2)13-12-19-8-9-20(14-24(19)31-27)23-17-30-25-15-21(10-11-22(25)26(23)28)29-16-18-6-4-3-5-7-18/h3-11,14-15,17H,12-13,16H2,1-2H3","NVODLKVRPZHUMH-UHFFFAOYSA-N"
"CC(C)=CCc(c(O)3)cc(cc3)C(=C1)C(=O)c(c(O)2)c(cc(O)c2)O1","InChI=1S/C20H18O5/c1-11(2)3-4-13-7-12(5-6-16(13)22)15-10-25-18-9-14(21)8-17(23)19(18)20(15)24/h3,5-10,21-23H,4H2,1-2H3","SWDSVBNAMCDHTF-UHFFFAOYSA-N"
"Oc(c4)cc(O3)c(c(O)4)C(=O)C(=C([H])3)c(c2)cc(C1)c(c2)OC(C)(C)C1","InChI=1S/C20H18O5/c1-20(2)6-5-12-7-11(3-4-16(12)25-20)14-10-24-17-9-13(21)8-15(22)18(17)19(14)23/h3-4,7-10,21-22H,5-6H2,1-2H3","VEFSEOVEILGQAE-UHFFFAOYSA-N"
"CC(C1)=C(C)C(=O)C1","InChI=1S/C7H10O/c1-5-3-4-7(8)6(5)2/h3-4H2,1-2H3","UZLQSPYGTUMKGS-UHFFFAOYSA-N"
"CCC(=C(C)1)C(=O)CC1","InChI=1S/C8H12O/c1-3-7-6(2)4-5-8(7)9/h3-5H2,1-2H3","TZJMINBYXYFIGT-UHFFFAOYSA-N"
"CCCC(=C(C)1)C(=O)CC1","InChI=1S/C9H14O/c1-3-4-8-7(2)5-6-9(8)10/h3-6H2,1-2H3","IAGSPEBQNJDWDZ-UHFFFAOYSA-N"
"CCCCC(=C(C)1)C(=O)CC1","InChI=1S/C10H16O/c1-3-4-5-9-8(2)6-7-10(9)11/h3-7H2,1-2H3","SHRWKGXPNYYGGO-UHFFFAOYSA-N"
"CCCCCC(=C(C)1)C(=O)CC1","InChI=1S/C11H18O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h3-8H2,1-2H3","YCIXWYOBMVNGTB-UHFFFAOYSA-N"
"CCCCCCC(C)=CCC(=O)OC","InChI=1S/C12H22O2/c1-4-5-6-7-8-11(2)9-10-12(13)14-3/h9H,4-8,10H2,1-3H3/b11-9+","LKPVXFWQTFXGMA-PKNBQFBNSA-N"
"COC(=O)CCC(C)=CCC(=O)OC","InChI=1S/C10H16O4/c1-8(4-6-9(11)13-2)5-7-10(12)14-3/h4H,5-7H2,1-3H3/b8-4+","WDXUKHTUMXKOSS-XBXARRHUSA-N"
"O=C(C=1)Oc(c2)c(ccc2)C1","InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H","ZYGHJZDHTFUPRJ-UHFFFAOYSA-N"
"O=C(C=2)Oc(c1)c(C2)ccc(O)1","InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H","ORHBXUUXSCNDEV-UHFFFAOYSA-N"
"COc(c1)cc(O2)c(C=CC(=O)2)c1","InChI=1S/C10H8O3/c1-12-8-4-2-7-3-5-10(11)13-9(7)6-8/h2-6H,1H3","LIIALPBMIOVAHH-UHFFFAOYSA-N"
"Oc(c2)cc(O1)c(c2)C(C)=CC(=O)1","InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3","HSHNITRMYYLLCV-UHFFFAOYSA-N"
"CC(=O)Oc(c2)cc(O1)c(c2)C(C)=CC(=O)1","InChI=1S/C12H10O4/c1-7-5-12(14)16-11-6-9(15-8(2)13)3-4-10(7)11/h3-6H,1-2H3","HXVZGASCDAGAPS-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C(C)=CC(=O)1","InChI=1S/C11H10O3/c1-7-5-11(12)14-10-6-8(13-2)3-4-9(7)10/h3-6H,1-2H3","UDFPKNSWSYBIHO-UHFFFAOYSA-N"
"O=C(C=2)Oc(c1)c(C2)cc(C)c(O)1","InChI=1S/C10H8O3/c1-6-4-7-2-3-10(12)13-9(7)5-8(6)11/h2-5,11H,1H3","QWQWBHZHRMHXOC-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(C)cc(C=2)c(OC(=O)C2)1","InChI=1S/C12H10O4/c1-7-5-9-3-4-12(14)16-11(9)6-10(7)15-8(2)13/h3-6H,1-2H3","AYHSRSLMDCLHKM-UHFFFAOYSA-N"
"COc(c1)c(C)cc(C=2)c(OC(=O)C2)1","InChI=1S/C11H10O3/c1-7-5-8-3-4-11(12)14-10(8)6-9(7)13-2/h3-6H,1-2H3","XROAZTOPXRDRAO-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C(O)=C(C)C(=O)1","InChI=1S/C11H10O4/c1-6-10(12)8-4-3-7(14-2)5-9(8)15-11(6)13/h3-5,12H,1-2H3","UOJHKPDAGSUGJI-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C(OC)=C(C)C(=O)1","InChI=1S/C12H12O4/c1-7-11(15-3)9-5-4-8(14-2)6-10(9)16-12(7)13/h4-6H,1-3H3","RTHGEQXOKQQJIL-UHFFFAOYSA-N"
"[2H]C([2H])([2H])Oc(c1)cc(C)cc1","InChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3/i2D3","OSIGJGFTADMDOB-BMSJAHLVSA-N"
"COc(c1)ccc(C)c1","InChI=1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3","CHLICZRVGGXEOD-UHFFFAOYSA-N"
"[2H]C([2H])([2H])Oc(c1)ccc(C)c1","InChI=1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3/i2D3","CHLICZRVGGXEOD-BMSJAHLVSA-N"
"CC(O)CCC(C(C)(C)1)C(C(=C2)C(=O)CC2)1","InChI=1S/C14H22O2/c1-9(15)7-8-11-13(14(11,2)3)10-5-4-6-12(10)16/h5,9,11,13,15H,4,6-8H2,1-3H3","IOUIEWFXKAZFEN-UHFFFAOYSA-N"
"CC(=O)CCC([H])(C(C)(C)1)C([H])(C(=C([H])2)C(=C)CC2)1","InChI=1S/C15H22O/c1-10-6-5-7-12(10)14-13(15(14,3)4)9-8-11(2)16/h7,13-14H,1,5-6,8-9H2,2-4H3/t13-,14+/m0/s1","CDXNKWAMDXZEKB-UONOGXRCSA-N"
"OCC(C1)=C([H])CC1","InChI=1S/C6H10O/c7-5-6-3-1-2-4-6/h3,7H,1-2,4-5H2","WJDFLCXFDSYKID-UHFFFAOYSA-N"
"COC(=O)CC(=O)CCC(C1)=CCC1","InChI=1S/C11H16O3/c1-14-11(13)8-10(12)7-6-9-4-2-3-5-9/h4H,2-3,5-8H2,1H3","XIEUINFEKFZBLX-UHFFFAOYSA-N"
"COC(=O)C(C(=O)2)(C31)C(CCC3)(CC2)1","InChI=1S/C11H14O3/c1-14-9(13)11-7-3-2-5-10(7,11)6-4-8(11)12/h7H,2-6H2,1H3","JHOMMICRSSKRMH-UHFFFAOYSA-N"
"CCC(C1)C(=O)C(C(=O)OC)(C32)C(CCC3)12","InChI=1S/C13H18O3/c1-3-8-7-12-6-4-5-9(12)13(12,10(8)14)11(15)16-2/h8-9H,3-7H2,1-2H3","CRFJZZJUYVEICX-UHFFFAOYSA-N"
"COC(=O)C(C(=O)2)(C31)C(CCC3)(CC(CC)(CC)2)1","InChI=1S/C15H22O3/c1-4-13(5-2)9-14-8-6-7-10(14)15(14,11(13)16)12(17)18-3/h10H,4-9H2,1-3H3","WCOJHCWNWYBOOQ-UHFFFAOYSA-N"
"CCC(C1)C(O)C(C(=O)OC)(C32)C(CCC3)12","InChI=1S/C13H20O3/c1-3-8-7-12-6-4-5-9(12)13(12,10(8)14)11(15)16-2/h8-10,14H,3-7H2,1-2H3","DGQYWWMBLOMTPO-UHFFFAOYSA-N"
"CCCC(=O)CC(=O)OC(C1)C(CCC(C)1)C(C)C","InChI=1S/C16H28O3/c1-5-6-13(17)10-16(18)19-15-9-12(4)7-8-14(15)11(2)3/h11-12,14-15H,5-10H2,1-4H3/t12-,14?,15-/m0/s1","VUQAUGNLGQCAEF-JDLVMGNASA-N"
"CCC(CC(C2)=CCC2)C(=O)CC(=O)OC(C1)C(CCC(C)1)C(C)C","InChI=1S/C22H36O3/c1-5-18(13-17-8-6-7-9-17)20(23)14-22(24)25-21-12-16(4)10-11-19(21)15(2)3/h8,15-16,18-19,21H,5-7,9-14H2,1-4H3/t16-,18?,19+,21-/m1/s1","SFMNHMUJLBEBKS-GSYZTTQLSA-N"
"CC(C4)CC(C(C4)C(C)C)OC(=O)C(C(=O)2)(C31)C(CCC3)(CC(CC)2)1","InChI=1S/C22H34O3/c1-5-15-12-21-10-6-7-18(21)22(21,19(15)23)20(24)25-17-11-14(4)8-9-16(17)13(2)3/h13-18H,5-12H2,1-4H3/t14-,15?,16?,17-,18?,21?,22?/m1/s1","QYTWWGBGNCCYSF-UPJDIYRESA-N"
"CC(C4)CC(C(C4)C(C)C)OC(=O)C(C(O)2)(C31)C(CCC3)(CC(CC)2)1","InChI=1S/C22H36O3/c1-5-15-12-21-10-6-7-18(21)22(21,19(15)23)20(24)25-17-11-14(4)8-9-16(17)13(2)3/h13-19,23H,5-12H2,1-4H3/t14-,15-,16?,17-,18+,19+,21+,22?/m1/s1","QWNGCUFGYYKGMH-FHYZNXDSSA-N"
"CC(=O)Oc(c1)cc(O2)c(C=CC(=O)2)c1","InChI=1S/C11H8O4/c1-7(12)14-9-4-2-8-3-5-11(13)15-10(8)6-9/h2-6H,1H3","MGZOXZPZHVOXQB-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C(OC(C)=O)=C(C)C(=O)1","InChI=1S/C13H12O5/c1-7-12(17-8(2)14)10-5-4-9(16-3)6-11(10)18-13(7)15/h4-6H,1-3H3","LQVKPXGBCILWSQ-UHFFFAOYSA-N"
"C([H])(COC)(C([H])(OC)3)OC(C([H])(N(C(C)=O)C)C(OC)3[H])(OC([H])(C(OC)([H])1)C(C(OC([H])(C2([H])COC)C(OC)([H])C(C(OC([H])(C(C(OC)([H])COC)([H])OC)C(COC)OC)([H])O2)(OC)[H])(OC([H])1COC)[H])(OC)[H])[H]","InChI=1S/C41H77NO21/c1-22(43)42(2)28-34(54-13)30(52-11)25(19-46-5)58-39(28)63-36-31(53-12)26(20-47-6)59-41(38(36)57-16)62-33-27(21-48-7)60-40(37(56-15)35(33)55-14)61-32(24(50-9)18-45-4)29(51-10)23(49-8)17-44-3/h23-41H,17-21H2,1-16H3/t23-,24-,25?,26-,27?,28-,29+,30-,31?,32+,33-,34?,35?,36-,37?,38?,39-,40-,41?/m0/s1","PKYCUEWEXYFXFG-OLHDMOLWSA-N"
"O(C(C)=O)C(C([H])1OC(C)=O)([H])C(OC([H])(C1([H])OC(C)=O)COC(C)=O)(OC(C(COC(C)=O)([H])OC(C)=O)([H])C(OC(C)=O)([H])C(OC(C)=O)([H])COC(C)=O)[H]","InChI=1S/C30H42O20/c1-13(31)40-10-22(43-16(4)34)25(45-18(6)36)26(23(44-17(5)35)11-41-14(2)32)50-30-29(48-21(9)39)28(47-20(8)38)27(46-19(7)37)24(49-30)12-42-15(3)33/h22-30H,10-12H2,1-9H3/t22-,23?,24?,25+,26+,27-,28?,29-,30-/m0/s1","QXJVGLXOXOQUHQ-QDPWPMGESA-N"
"C(C)(=O)OC(COC(C)=O)C(C([H])(C([H])(COC(C)=O)OC(C)=O)OC(C)=O)(OC(C1([H])OC(C)=O)([H])OC([H])(COC(C)=O)C(OC(C([H])2OC(C)=O)([H])OC(C([H])(C([H])2OC(C)=O)OC(C)=O)([H])COC(C)=O)(C1(OC(C)=O)[H])[H])[H]","InChI=1S/C42H58O28/c1-17(43)55-13-29(59-21(5)47)33(61-23(7)49)34(30(60-22(6)48)14-56-18(2)44)69-41-40(66-28(12)54)38(64-26(10)52)36(32(68-41)16-58-20(4)46)70-42-39(65-27(11)53)37(63-25(9)51)35(62-24(8)50)31(67-42)15-57-19(3)45/h29-42H,13-16H2,1-12H3/t29-,30-,31?,32?,33+,34+,35-,36-,37?,38?,39-,40-,41-,42+/m0/s1","XMFGNCMOBKDRJQ-VCIDRMRESA-N"
"C([H])(C([H])(OC(C)=O)1)(C([H])(OC(OC(C([H])2OC(C)=O)([H])C(COC(C)=O)([H])OC([H])(C2([H])OC(C)=O)OC(C(OC(C)=O)(C(OC(C)=O)(COC(C)=O)[H])[H])([H])C([H])(COC(C)=O)OC(C)=O)([H])C(NC(C)=O)1[H])COC(C)=O)OC(C)=O","InChI=1S/C42H59NO27/c1-17(44)43-33-38(64-26(10)53)36(63-25(9)52)31(15-58-20(4)47)67-41(33)69-37-32(16-59-21(5)48)68-42(40(66-28(12)55)39(37)65-27(11)54)70-35(30(61-23(7)50)14-57-19(3)46)34(62-24(8)51)29(60-22(6)49)13-56-18(2)45/h29-42H,13-16H2,1-12H3,(H,43,44)/t29-,30-,31?,32?,33-,34+,35?,36+,37+,38?,39?,40-,41-,42-/m0/s1","AAAPTNPUJGQBPO-JDCUDQCVSA-N"
"C(OC(C([H])3COC(C)=O)(C([H])(OC(C)=O)C(OC(C)=O)(C(O3)(OC([H])(C([H])2OC(C)=O)C([H])(NC(C)=O)C([H])(OC(COC(C)=O)2[H])OC(C1([H])COC(C)=O)C(C(OC(C)=O)([H])C([H])(O1)OC([H])(C([H])(OC(C)=O)COC(C)=O)C(OC(C)=O)([H])C(OC(C)=O)(COC(C)=O)[H])(OC(C)=O)[H])[H])[H])[H])(C)=O","InChI=1S/C54H75NO35/c1-21(56)55-41-47(90-54-50(83-34(14)69)48(81-32(12)67)45(80-31(11)66)39(86-54)19-74-25(5)60)44(79-30(10)65)38(18-73-24(4)59)85-52(41)88-46-40(20-75-26(6)61)87-53(51(84-35(15)70)49(46)82-33(13)68)89-43(37(77-28(8)63)17-72-23(3)58)42(78-29(9)64)36(76-27(7)62)16-71-22(2)57/h36-54H,16-20H2,1-15H3,(H,55,56)/t36-,37+,38+,39?,40-,41+,42+,43+,44+,45-,46?,47?,48?,49-,50-,51?,52?,53?,54-/m0/s1","IITLWDNNMAJZFH-QMXGIRNMSA-N"
"[H]C(C1(OC(C([H])3OC(C)=O)([H])C(OC(C)=O)([H])C([H])(OC(C([H])(COC(C)=O)OC(C)=O)([H])C([H])(C(OC(C)=O)([H])COC(C)=O)OC(C)=O)OC3([H])COC(C)=O)[H])(NC(C)=O)C(OC(C)=O)([H])C([H])(OC([H])(C(OC(C)=O)([H])2)OC(C([H])(OC(C)=O)C2([H])OC(C)=O)(COC(C)=O)[H])C([H])(O1)COC(C)=O","InChI=1S/C54H75NO35/c1-21(56)55-41-47(81-32(12)67)44(89-53-50(83-34(14)69)48(82-33(13)68)45(79-30(10)65)39(86-53)19-74-25(5)60)38(18-73-24(4)59)85-52(41)90-49-46(80-31(11)66)40(20-75-26(6)61)87-54(51(49)84-35(15)70)88-43(37(77-28(8)63)17-72-23(3)58)42(78-29(9)64)36(76-27(7)62)16-71-22(2)57/h36-54H,16-20H2,1-15H3,(H,55,56)/t36-,37+,38?,39?,40?,41-,42+,43+,44-,45-,46+,47?,48?,49+,50-,51?,52-,53-,54+/m0/s1","GMMJPIMJZQGJRJ-IMUUHPHKSA-N"
"O=C(O1)C(=C)C([H])(C4)C([H])1CC(C)(C([H])43)C([H])(O2)C([H])(C(=O)C([H])(C)3)2","InChI=1S/C15H18O4/c1-6-8-4-9-7(2)11(16)12-13(19-12)15(9,3)5-10(8)18-14(6)17/h7-10,12-13H,1,4-5H2,2-3H3/t7-,8-,9+,10-,12+,13+,15-/m1/s1","ILXNJGJFJRUHHW-SVWYSVCKSA-N"
"CC(=O)OC([H])(C1)C([H])(C(=C)3)C([H])(OC(=O)3)C([H])(C(C)=2)C([H])(C(=O)C([H])2)C([H])(C)1","InChI=1S/C17H20O5/c1-7-5-11(19)13-8(2)6-12(21-10(4)18)15-9(3)17(20)22-16(15)14(7)13/h5,8,12-16H,3,6H2,1-2,4H3/t8-,12-,13+,14-,15+,16+/m0/s1","VETNMUXXCNEZFK-OYBMWFINSA-N"
"[H]C(C)(C3)C(C1)C(C)(CC3)CC([H])(O2)C([H])1C(C)(O)C(=O)2","InChI=1S/C15H24O3/c1-9-5-4-6-14(2)8-12-11(7-10(9)14)15(3,17)13(16)18-12/h9-12,17H,4-8H2,1-3H3/t9-,10?,11-,12+,14+,15-/m0/s1","UQPYSUOAPAJVOE-SQGOOWKJSA-N"
"O=C(O1)C(=C)C([H])(C2)C([H])1CC(C)(C([H])(O)4)C2(O3)C(C)(CC4)3","InChI=1S/C15H20O4/c1-8-9-6-15-13(2,7-10(9)18-12(8)17)11(16)4-5-14(15,3)19-15/h9-11,16H,1,4-7H2,2-3H3/t9-,10+,11+,13-,14+,15-/m0/s1","HGCXXEYNHRNBTF-JQRSIXJKSA-N"
"CC(=O)OC([H])(C4)C([H])(C(=C)5)C([H])(OC(=O)5)C([H])(C(C)32)C(C(C)(O)4)(O1)C([H])1C([H])(O3)2","InChI=1S/C17H20O7/c1-6-9-8(21-7(2)18)5-15(3,20)17-11(10(9)22-14(6)19)16(4)12(23-16)13(17)24-17/h8-13,20H,1,5H2,2-4H3/t8-,9+,10-,11-,12-,13+,15+,16+,17-/m0/s1","ZLXIFWIIPCMMHF-BJVHOVFPSA-N"
"CCCOC(C)=O","InChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3","YKYONYBAUNKHLG-UHFFFAOYSA-N"
"CC(C)OC(C)=O","InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3","JMMWKPVZQRWMSS-UHFFFAOYSA-N"
"CCCCOC(C)=O","InChI=1S/C6H12O2/c1-3-4-5-8-6(2)7/h3-5H2,1-2H3","DKPFZGUDAPQIHT-UHFFFAOYSA-N"
"CC(C)COC(C)=O","InChI=1S/C6H12O2/c1-5(2)4-8-6(3)7/h5H,4H2,1-3H3","GJRQTCIYDGXPES-UHFFFAOYSA-N"
"CCC(C)OC(C)=O","InChI=1S/C6H12O2/c1-4-5(2)8-6(3)7/h5H,4H2,1-3H3","DCKVNWZUADLDEH-UHFFFAOYSA-N"
"CC(C)CCOC(C)=O","InChI=1S/C7H14O2/c1-6(2)4-5-9-7(3)8/h6H,4-5H2,1-3H3","MLFHJEHSLIIPHL-UHFFFAOYSA-N"
"CC(=O)OCC(C)(C)C","InChI=1S/C7H14O2/c1-6(8)9-5-7(2,3)4/h5H2,1-4H3","QLNYTCSELYEEPV-UHFFFAOYSA-N"
"CC(=O)OCCc(c1)cccc1","InChI=1S/C10H12O2/c1-9(11)12-8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3","MDHYEMXUFSJLGV-UHFFFAOYSA-N"
"C=CC(C(C)C)OC(C)=O","InChI=1S/C8H14O2/c1-5-8(6(2)3)10-7(4)9/h5-6,8H,1H2,2-4H3","XAKHEXKHMNYRCG-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCOC(C)=O","InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8+","HIGQPQRQIQDZMP-DHZHZOJOSA-N"
"CC(C)=CCCC(C)(C=C)OC(C)=O","InChI=1S/C12H20O2/c1-6-12(5,14-11(4)13)9-7-8-10(2)3/h6,8H,1,7,9H2,2-5H3","UWKAYLJWKGQEPM-UHFFFAOYSA-N"
"CC(=O)OC(C)(C)C#CC(C)(C)OC(C)=O","InChI=1S/C12H18O4/c1-9(13)15-11(3,4)7-8-12(5,6)16-10(2)14/h1-6H3","JTSBDFUPOCMOBR-UHFFFAOYSA-N"
"CC(=O)OC(C=1)C(CCC(C)1)C(C)C","InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h7-8,11-12H,5-6H2,1-4H3","NADGBBLSBLDJEH-UHFFFAOYSA-N"
"CC(=O)OC(C1)C(=CCC(C)1)C(C)C","InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h6,8-9,12H,5,7H2,1-4H3","UWINAUQIAJDQEK-UHFFFAOYSA-N"
"CC(=O)OC(C1)C(CCC(C)1)=C(C)C","InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h9,12H,5-7H2,1-4H3","ZAPTZQHAWAYFSW-UHFFFAOYSA-N"
"CC(=O)OC(C(C)(C)1)C(C)(C2)CC(C2)1","InChI=1S/C12H20O2/c1-8(13)14-10-11(2,3)9-5-6-12(10,4)7-9/h9-10H,5-7H2,1-4H3","JUWUWIGZUVEFQB-UHFFFAOYSA-N"
"CC(=O)OC(C1)C(CCC1)OC(C)=O","InChI=1S/C10H16O4/c1-7(11)13-9-5-3-4-6-10(9)14-8(2)12/h9-10H,3-6H2,1-2H3","NSTPWRQTPXJRSP-UHFFFAOYSA-N"
"CC(=O)OC(C(C)1)C(OC(C)=O)C(C(C)C)CC1","InChI=1S/C14H24O4/c1-8(2)12-7-6-9(3)13(17-10(4)15)14(12)18-11(5)16/h8-9,12-14H,6-7H2,1-5H3","UQPARNPFQUTRPS-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(=O)OCCOC(=O)C([2H])([2H])[2H]","InChI=1S/C6H10O4/c1-5(7)9-3-4-10-6(2)8/h3-4H2,1-2H3/i1D3,2D3","JTXMVXSTHSMVQF-WFGJKAKNSA-N"
"COc(c4)ccc(c4)C(C(=O)3)=C(O)c(c(O3)1)c(OC)c(C=2)c(OC(C)(C)C2)c1","InChI=1S/C22H20O6/c1-22(2)10-9-14-15(28-22)11-16-18(20(14)26-4)19(23)17(21(24)27-16)12-5-7-13(25-3)8-6-12/h5-11,23H,1-4H3","MBZKDBQDALOSRP-UHFFFAOYSA-N"
"CC(C1)Oc(c2)c(ccc2)C(O)1","InChI=1S/C10H12O2/c1-7-6-9(11)8-4-2-3-5-10(8)12-7/h2-5,7,9,11H,6H2,1H3/t7-,9-/m0/s1","DWBIZQGILMWHRS-CBAPKCEASA-N"
"c(c3)ccc(c3)C(O1)C([2H])([2H])C(O)c(c2)c(ccc2)1","InChI=1S/C15H14O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,13,15-16H,10H2/i10D2","YTMFRMLVZQOBDR-KBMKNGFXSA-N"
"COc(c3)cc(O1)c(c3)C([H])(O)CC([H])(c(c2)cccc2)1","InChI=1S/C16H16O3/c1-18-12-7-8-13-14(17)10-15(19-16(13)9-12)11-5-3-2-4-6-11/h2-9,14-15,17H,10H2,1H3/t14-,15+/m1/s1","GMKMWNMOLXKFNU-CABCVRRESA-N"
"COc(c3)cc(O1)c(c3)C([H])(O)CC([H])(c(c2)cccc2)1","InChI=1S/C16H16O3/c1-18-12-7-8-13-14(17)10-15(19-16(13)9-12)11-5-3-2-4-6-11/h2-9,14-15,17H,10H2,1H3/t14-,15+/m0/s1","GMKMWNMOLXKFNU-LSDHHAIUSA-N"
"COc(c3)cc(O2)c(c3)C=C(C2)c(c1)cccc1","InChI=1S/C16H14O2/c1-17-15-8-7-13-9-14(11-18-16(13)10-15)12-5-3-2-4-6-12/h2-10H,11H2,1H3","LSZIRYVRGHKUGG-UHFFFAOYSA-N"
"COc(c3)cc(O2)c(c3)C([2H])(O)C(C2)c(c1)cccc1","InChI=1S/C16H16O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-9,14,16-17H,10H2,1H3/t14?,16-/m1/s1/i16D","FNCVQDHRTCWUHR-IMRRLIKASA-N"
"COc(c3)cc(O2)c(c3)C([2H])(O)C(C2)c(c1)cccc1","InChI=1S/C16H16O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-9,14,16-17H,10H2,1H3/t14?,16-/m0/s1/i16D","FNCVQDHRTCWUHR-FRSDTZJCSA-N"
"COc(c3)cc(O2)c(c3)C([H])(O)C(C2)c(c1)cccc1","InChI=1S/C16H16O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-9,14,16-17H,10H2,1H3/t14?,16-/m0/s1","FNCVQDHRTCWUHR-WMCAAGNKSA-N"
"COc(c3)cc(O2)c(c3)C([H])(O)C(C2)c(c1)cccc1","InChI=1S/C16H16O3/c1-18-12-7-8-13-15(9-12)19-10-14(16(13)17)11-5-3-2-4-6-11/h2-9,14,16-17H,10H2,1H3/t14?,16-/m1/s1","FNCVQDHRTCWUHR-BZSJEYESSA-N"
"OCc(c1)cccc1","InChI=1S/C7H8O/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2","WVDDGKGOMKODPV-UHFFFAOYSA-N"
"CCC(C)Cl","InChI=1S/C4H9Cl/c1-3-4(2)5/h4H,3H2,1-2H3","BSPCSKHALVHRSR-UHFFFAOYSA-N"
"Cc(c1)cc(cc1)C(=O)Cl","InChI=1S/C8H7ClO/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3","YHOYYHYBFSYOSQ-UHFFFAOYSA-N"
"CCC(O)C(O)=O","InChI=1S/C4H8O3/c1-2-3(5)4(6)7/h3,5H,2H2,1H3,(H,6,7)","AFENDNXGAFYKQO-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])OC(=O)c(c1)cccc1","InChI=1S/C10H12O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h3-8H,1-2H3/i1D3,2D3,8D","FEXQDZTYJVXMOS-UNAVHCQLSA-N"
"CCN(CC)c(c1)cccc1","InChI=1S/C10H15N/c1-3-11(4-2)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3","GGSUCNLOZRCGPQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C12H10O/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H","USIUVYZYUHIAEV-UHFFFAOYSA-N"
"CCOCCOCCO","InChI=1S/C6H14O3/c1-2-8-5-6-9-4-3-7/h7H,2-6H2,1H3","XXJWXESWEXIICW-UHFFFAOYSA-N"
"COCCOCCOCCO","InChI=1S/C7H16O4/c1-9-4-5-11-7-6-10-3-2-8/h8H,2-7H2,1H3","JLGLQAWTXXGVEM-UHFFFAOYSA-N"
"OCC(C)OCC(C)OCC(C)O","InChI=1S/C9H20O4/c1-7(11)5-12-9(3)6-13-8(2)4-10/h7-11H,4-6H2,1-3H3","LCZVSXRMYJUNFX-UHFFFAOYSA-N"
"NCCCCCCN","InChI=1S/C6H16N2/c7-5-3-1-2-4-6-8/h1-8H2","NAQMVNRVTILPCV-UHFFFAOYSA-N"
"CCCCOC(=O)C(=O)OCCCC","InChI=1S/C10H18O4/c1-3-5-7-13-9(11)10(12)14-8-6-4-2/h3-8H2,1-2H3","JKRZOJADNVOXPM-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)c(ccc1)C(=O)OC(C)C","InChI=1S/C14H18O4/c1-9(2)17-13(15)11-7-5-6-8-12(11)14(16)18-10(3)4/h5-10H,1-4H3","QWDBCIAVABMJPP-UHFFFAOYSA-N"
"Nc(c1)c(N)ccc1","InChI=1S/C6H8N2/c7-5-3-1-2-4-6(5)8/h1-4H,7-8H2","GEYOCULIXLDCMW-UHFFFAOYSA-N"
"Nc(c1)cc(N)cc1","InChI=1S/C6H8N2/c7-5-2-1-3-6(8)4-5/h1-4H,7-8H2","WZCQRUWWHSTZEM-UHFFFAOYSA-N"
"Nc(c1)ccc(N)c1","InChI=1S/C6H8N2/c7-5-1-2-6(8)4-3-5/h1-4H,7-8H2","CBCKQZAAMUWICA-UHFFFAOYSA-N"
"CC(=O)OC(C)(C)C","InChI=1S/C6H12O2/c1-5(7)8-6(2,3)4/h1-4H3","WMOVHXAZOJBABW-UHFFFAOYSA-N"
"C=CCOC(C)=O","InChI=1S/C5H8O2/c1-3-4-7-5(2)6/h3H,1,4H2,2H3","FWZUNOYOVVKUNF-UHFFFAOYSA-N"
"CCCCCCOC(C)=O","InChI=1S/C8H16O2/c1-3-4-5-6-7-10-8(2)9/h3-7H2,1-2H3","AOGQPLXWSUTHQB-UHFFFAOYSA-N"
"CCCCCCCOC(C)=O","InChI=1S/C9H18O2/c1-3-4-5-6-7-8-11-9(2)10/h3-8H2,1-2H3","ZCZSIDMEHXZRLG-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(C)ccc1","InChI=1S/C9H10O2/c1-7-5-3-4-6-9(7)11-8(2)10/h3-6H,1-2H3","AMZORBZSQRUXNC-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cccc1","InChI=1S/C8H8O2/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3","IPBVNPXQWQGGJP-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(C)cc1","InChI=1S/C9H10O2/c1-7-4-3-5-9(6-7)11-8(2)10/h3-6H,1-2H3","OTGAHJPFNKQGAE-UHFFFAOYSA-N"
"CC(=O)Oc(c1)ccc(C)c1","InChI=1S/C9H10O2/c1-7-3-5-9(6-4-7)11-8(2)10/h3-6H,1-2H3","CDJJKTLOZJAGIZ-UHFFFAOYSA-N"
"CC(=C)OC(C)=O","InChI=1S/C5H8O2/c1-4(2)7-5(3)6/h1H2,2-3H3","HETCEOQFVDFGSY-UHFFFAOYSA-N"
"CC(=O)OCc(c1)cccc1","InChI=1S/C9H10O2/c1-8(10)11-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3","QUKGYYKBILRGFE-UHFFFAOYSA-N"
"COc(c1)ccc(COC(C)=O)c1","InChI=1S/C10H12O3/c1-8(11)13-7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3","HFNGYHHRRMSKEU-UHFFFAOYSA-N"
"Oc(c1)cccc1","InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H","ISWSIDIOOBJBQZ-UHFFFAOYSA-N"
"CCCCOCCOC(C)=O","InChI=1S/C8H16O3/c1-3-4-5-10-6-7-11-8(2)9/h3-7H2,1-2H3","NQBXSWAWVZHKBZ-UHFFFAOYSA-N"
"CCCCCCCCOC(C)=O","InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-12-10(2)11/h3-9H2,1-2H3","YLYBTZIQSIBWLI-UHFFFAOYSA-N"
"O=C(Oc(c2)cccc2)c(c1)cccc1","InChI=1S/C13H10O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H","FCJSHPDYVMKCHI-UHFFFAOYSA-N"
"CCCOC(=O)c(c1)ccc(N)c1","InChI=1S/C10H13NO2/c1-2-7-13-10(12)8-3-5-9(11)6-4-8/h3-6H,2,7,11H2,1H3","NBFQYHKHPBMJJV-UHFFFAOYSA-N"
"[2H]C([2H])([2H])OC(=O)c(c1)c(ccc1)C(=O)OC([2H])([2H])[2H]","InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3/i1D3,2D3","NIQCNGHVCWTJSM-WFGJKAKNSA-N"
"[2H]C([2H])([2H])OC(=O)c(c1)cc(cc1)C(=O)OC([2H])([2H])[2H]","InChI=1S/C10H10O4/c1-13-9(11)7-4-3-5-8(6-7)10(12)14-2/h3-6H,1-2H3/i1D3,2D3","VNGOYPQMJFJDLV-WFGJKAKNSA-N"
"[2H]C([2H])([2H])OC(=O)c(c1)ccc(c1)C(=O)OC([2H])([2H])[2H]","InChI=1S/C10H10O4/c1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h3-6H,1-2H3/i1D3,2D3","WOZVHXUHUFLZGK-WFGJKAKNSA-N"
"Nc(c1)c(c2)c(ccc2)cc1","InChI=1S/C10H9N/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H,11H2","RUFPHBVGCFYCNW-UHFFFAOYSA-N"
"c(c1)ccc(c1)S(=O)(=O)Cl","InChI=1S/C6H5ClO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H","CSKNSYBAZOQPLR-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)c(ccc1)C(=O)OCC(C)C","InChI=1S/C16H22O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3","MGWAVDBGNNKXQV-UHFFFAOYSA-N"
"CCCCCCCCCO","InChI=1S/C9H20O/c1-2-3-4-5-6-7-8-9-10/h10H,2-9H2,1H3","ZWRUINPWMLAQRD-UHFFFAOYSA-N"
"CCCCCCCCCCO","InChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3","MWKFXSUHUHTGQN-UHFFFAOYSA-N"
"CCCCCCCCCCCO","InChI=1S/C11H24O/c1-2-3-4-5-6-7-8-9-10-11-12/h12H,2-11H2,1H3","KJIOQYGWTQBHNH-UHFFFAOYSA-N"
"Cc(c1)ccc(N)c1","InChI=1S/C7H9N/c1-6-2-4-7(8)5-3-6/h2-5H,8H2,1H3","RZXMPPFPUUCRFN-UHFFFAOYSA-N"
"Cc(c1)c(N)ccc1","InChI=1S/C7H9N/c1-6-4-2-3-5-7(6)8/h2-5H,8H2,1H3","RNVCVTLRINQCPJ-UHFFFAOYSA-N"
"OC(=O)c(c1)c(N)ccc1","InChI=1S/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10)","RWZYAGGXGHYGMB-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)ccc(N)c1","InChI=1S/C11H15NO2/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7H,2-3,8,12H2,1H3","IUWVALYLNVXWKX-UHFFFAOYSA-N"
"[H]C(C)=C([H])[Si](C)(C)C","InChI=1S/C6H14Si/c1-5-6-7(2,3)4/h5-6H,1-4H3/b6-5-","UDYJJCZCPMQSQG-WAYWQWQTSA-N"
"c(c1)ccc(c1)[Ge](C)(C)Cl","InChI=1S/C8H11ClGe/c1-10(2,9)8-6-4-3-5-7-8/h3-7H,1-2H3","QBQSJNDUKDWNNK-UHFFFAOYSA-N"
"C[Si](C)(C)C([H])=C([H])[Ge](C)(C)C","InChI=1S/C8H20GeSi/c1-9(2,3)7-8-10(4,5)6/h7-8H,1-6H3/b8-7+","VPXZBSSDIIKKIR-BQYQJAHWSA-N"
"CC(C)(C)C#C[Si](C)(C)C","InChI=1S/C9H18Si/c1-9(2,3)7-8-10(4,5)6/h1-6H3","GKWFJPNWRGGCSB-UHFFFAOYSA-N"
"C[Si](C)(C)[SiH]([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C9H28Si4/c1-11(2,3)10(12(4,5)6)13(7,8)9/h10H,1-9H3","SQMFULTZZQBFBM-UHFFFAOYSA-N"
"C[Si](C)(C)[Ge](C)(C)O[Ge](C)(C)[Si](C)(C)C","InChI=1S/C10H30Ge2OSi2/c1-11(2,14(5,6)7)13-12(3,4)15(8,9)10/h1-10H3","VWJRZDAXOVPKFT-UHFFFAOYSA-N"
"c(c1)ccc(c1)C#C[Si](C)(C)C","InChI=1S/C11H14Si/c1-12(2,3)10-9-11-7-5-4-6-8-11/h4-8H,1-3H3","UZIXCCMXZQWTPB-UHFFFAOYSA-N"
"c(c1)ccc(c1)[Ge](C)(C)[Si](C)(C)C","InChI=1S/C11H20GeSi/c1-12(2,13(3,4)5)11-9-7-6-8-10-11/h6-10H,1-5H3","JVMCSXQIPYOLCJ-UHFFFAOYSA-N"
"[SiH3][SiH2]c(c(C)1)c(C)c(C)c(C)c(C)1","InChI=1S/C11H20Si2/c1-6-7(2)9(4)11(13-12)10(5)8(6)3/h13H2,1-5,12H3","DRMCADSYZXWPER-UHFFFAOYSA-N"
"c(c1)ccc(c1)C#C[Si](C)(C)[Ge](C)(C)C","InChI=1S/C13H20GeSi/c1-14(2,3)15(4,5)12-11-13-9-7-6-8-10-13/h6-10H,1-5H3","OSGGAEACJZIQGF-UHFFFAOYSA-N"
"c(c1)ccc(c1)C#C[Ge](C)(C)[Si](C)(C)C","InChI=1S/C13H20GeSi/c1-14(2,15(3,4)5)12-11-13-9-7-6-8-10-13/h6-10H,1-5H3","LBNYGBSLQZPBGK-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)Cl","InChI=1S/C6H15ClSi/c1-6(2,3)8(4,5)7/h1-5H3","BCNZYOJHNLTNEZ-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)N(C)[Si](C)(C)1","InChI=1S/C10H15NSi/c1-11-10-7-5-4-6-9(10)8-12(11,2)3/h4-7H,8H2,1-3H3","UOMQNMMLQAXCRY-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)N([Si](C)(C)C)[Si](C)(C)1","InChI=1S/C12H21NSi2/c1-14(2,3)13-12-9-7-6-8-11(12)10-15(13,4)5/h6-9H,10H2,1-5H3","NEIMZHHLBBODEX-UHFFFAOYSA-N"
"ClC[Si](C)(C)N(C1)c(c2)c(ccc2)C1","InChI=1S/C11H16ClNSi/c1-14(2,9-12)13-8-7-10-5-3-4-6-11(10)13/h3-6H,7-9H2,1-2H3","HXPQWHXZBPQXHD-UHFFFAOYSA-N"
"CCN(c(c1)cccc1)[Si](C)(C)C(C)(C)C","InChI=1S/C14H25NSi/c1-7-15(13-11-9-8-10-12-13)16(5,6)14(2,3)4/h8-12H,7H2,1-6H3","NGNXCQKDIRSRJC-UHFFFAOYSA-N"
"c(c1)ccc(c1)N[Si](C)(C)C(C)(C)C","InChI=1S/C12H21NSi/c1-12(2,3)14(4,5)13-11-9-7-6-8-10-11/h6-10,13H,1-5H3","UITYJPORVGLJRW-UHFFFAOYSA-N"
"c(c1)ccc(c1)N([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C","InChI=1S/C18H35NSi2/c1-17(2,3)20(7,8)19(16-14-12-11-13-15-16)21(9,10)18(4,5)6/h11-15H,1-10H3","PUCQSUCIXUFKSK-UHFFFAOYSA-N"
"CCCCN(c(c1)cccc1)[Si](C)(C)C(C)(C)C","InChI=1S/C16H29NSi/c1-7-8-14-17(15-12-10-9-11-13-15)18(5,6)16(2,3)4/h9-13H,7-8,14H2,1-6H3","BJYXUWNDSGJBDX-UHFFFAOYSA-N"
"CC(C)c(c1)cc(C(C)C)c(c(C(C)C)1)[Si](F)(F)C(C)(C)C","InChI=1S/C19H32F2Si/c1-12(2)15-10-16(13(3)4)18(17(11-15)14(5)6)22(20,21)19(7,8)9/h10-14H,1-9H3","UZVOOYYAXOKYBB-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=C([H])1)[Si](C)(C)C(c(c2)cccc2)=C([H])1","InChI=1S/C18H18Si/c1-19(2)17(15-9-5-3-6-10-15)13-14-18(19)16-11-7-4-8-12-16/h3-14H,1-2H3","YCBUIVXZVYHASK-UHFFFAOYSA-N"
"c(c1[Si](C(c(c5)cccc5)=3)(C(c(c4)cccc4)=C([H])C3[H])Cc(c2)cccc2)cccc1","InChI=1S/C29H24Si/c1-5-13-24(14-6-1)23-30(27-19-11-4-12-20-27)28(25-15-7-2-8-16-25)21-22-29(30)26-17-9-3-10-18-26/h1-22H,23H2","FKYJOIQFIUOZLC-UHFFFAOYSA-N"
"ClC[Si](C)(C)Cl","InChI=1S/C3H8Cl2Si/c1-6(2,5)3-4/h3H2,1-2H3","ITKVLPYNJQOCPW-UHFFFAOYSA-N"
"ClC[Si](C)(C)C","InChI=1S/C4H11ClSi/c1-6(2,3)4-5/h4H2,1-3H3","OOCUOKHIVGWCTJ-UHFFFAOYSA-N"
"c(c3)ccc(c3)C([Si](C)(C)1)=C(c(c2)cccc2)[Si](C)(C)O1","InChI=1S/C18H22OSi2/c1-20(2)17(15-11-7-5-8-12-15)18(21(3,4)19-20)16-13-9-6-10-14-16/h5-14H,1-4H3","KYNANOAHFJKIQU-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=C(c(c2)cccc2)1)[Si](C)(C)[Si](C)(C)[Si](C)(C)1","InChI=1S/C20H28Si3/c1-21(2)19(17-13-9-7-10-14-17)20(18-15-11-8-12-16-18)22(3,4)23(21,5)6/h7-16H,1-6H3","YSFSRQJKMIFGKF-UHFFFAOYSA-N"
"CC(=C)[Si](C)(C)C","InChI=1S/C6H14Si/c1-6(2)7(3,4)5/h1H2,2-5H3","IIWSLXWOGWUDPL-UHFFFAOYSA-N"
"CC=C([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C9H22Si2/c1-8-9(10(2,3)4)11(5,6)7/h8H,1-7H3","XSBNQCZGJKAOHO-UHFFFAOYSA-N"
"FCO[SiH](C(C)(C)C)c(c1C(C)(C)C)c(cc(C(C)(C)C)c1)C(C)(C)C","InChI=1S/C23H41FOSi/c1-20(2,3)16-13-17(21(4,5)6)19(18(14-16)22(7,8)9)26(25-15-24)23(10,11)12/h13-14,26H,15H2,1-12H3","DMIAYICLLVFFMQ-UHFFFAOYSA-N"
"c(c1)(cc(C)c([Si](F)(F)c(c2C(C)(C)C)c(cc(C(C)(C)C)c2)C(C)(C)C)c1C)C","InChI=1S/C27H40F2Si/c1-17-13-18(2)23(19(3)14-17)30(28,29)24-21(26(7,8)9)15-20(25(4,5)6)16-22(24)27(10,11)12/h13-16H,1-12H3","JGNYTBUXBLOFHF-UHFFFAOYSA-N"
"c(c1)(cc(c([Si](O)(F)c(c2C(C)(C)C)c(cc(C(C)(C)C)c2)C(C)(C)C)c1C)C)C","InChI=1S/C27H41FOSi/c1-17-13-18(2)23(19(3)14-17)30(28,29)24-21(26(7,8)9)15-20(25(4,5)6)16-22(24)27(10,11)12/h13-16,29H,1-12H3","BLFNVIZZHRCALN-UHFFFAOYSA-N"
"O=C=Nc(c1)cccc1","InChI=1S/C7H5NO/c9-6-8-7-4-2-1-3-5-7/h1-5H","DGTNSSLYPYDJGL-UHFFFAOYSA-N"
"CC(C)(C)Nc(c1)cccc1","InChI=1S/C10H15N/c1-10(2,3)11-9-7-5-4-6-8-9/h4-8,11H,1-3H3","ABRWESLGGMHKEA-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(cc(Br)1)C(C)(C)C","InChI=1S/C14H21Br/c1-13(2,3)10-7-11(14(4,5)6)9-12(15)8-10/h7-9H,1-6H3","BUOWTUULDKULFI-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(cc1C(C)(C)C)C(C)(C)C","InChI=1S/C14H21NO2/c1-13(2,3)10-7-11(14(4,5)6)9-12(8-10)15(16)17/h7-9H,1-6H3","LUYJFRAXBOUNPV-UHFFFAOYSA-N"
"CC(C)(C)c(c1)ccc(c1)C(C)(C)C","InChI=1S/C14H22/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h7-10H,1-6H3","OOWNNCMFKFBNOF-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(cc1)C(C)(C)C","InChI=1S/C14H22/c1-13(2,3)11-8-7-9-12(10-11)14(4,5)6/h7-10H,1-6H3","ILNDSSCEZZFNGE-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(cc1C(C)(C)C)[Si](C)(C)C","InChI=1S/C17H30Si/c1-16(2,3)13-10-14(17(4,5)6)12-15(11-13)18(7,8)9/h10-12H,1-9H3","ZVCPSTJBKOWAOL-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(cc1C(C)(C)C)C(C)(C)C","InChI=1S/C18H30/c1-16(2,3)13-10-14(17(4,5)6)12-15(11-13)18(7,8)9/h10-12H,1-9H3","GUFMBISUSZUUCB-UHFFFAOYSA-N"
"CC(=C)C(C)=C","InChI=1S/C6H10/c1-5(2)6(3)4/h1,3H2,2,4H3","SDJHPPZKZZWAKF-UHFFFAOYSA-N"
"[H]C([Si](C)(C)C)=C([H])[Si](C)(C)Cl","InChI=1S/C7H17ClSi2/c1-9(2,3)6-7-10(4,5)8/h6-7H,1-5H3/b7-6+","WEMBKSMRXMFHPR-VOTSOKGWSA-N"
"C[SiH](C)C([H])=C([H])[Si](C)(C)C","InChI=1S/C7H18Si2/c1-8(2)6-7-9(3,4)5/h6-8H,1-5H3/b7-6+","CREOOXLOBAKASH-VOTSOKGWSA-N"
"C[Si](C)(C)C(=C)[Si](C)(C)C","InChI=1S/C8H20Si2/c1-8(9(2,3)4)10(5,6)7/h1H2,2-7H3","CVCQWLSMIOKNLE-UHFFFAOYSA-N"
"CC(C)(C)C([H])=C([H])[Si](C)(C)C","InChI=1S/C9H20Si/c1-9(2,3)7-8-10(4,5)6/h7-8H,1-6H3/b8-7+","BRIDLWZGGDIJRM-BQYQJAHWSA-N"
"ClCCc(c1)c(Cl)ccc1","InChI=1S/C8H8Cl2/c9-6-5-7-3-1-2-4-8(7)10/h1-4H,5-6H2","NFWMXIVUTWWCNO-UHFFFAOYSA-N"
"C[SiH](Cl)CCc(c1)c(Cl)ccc1","InChI=1S/C9H12Cl2Si/c1-12(11)7-6-8-4-2-3-5-9(8)10/h2-5,12H,6-7H2,1H3","HLEZVSOYFMMODO-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)[Si](C)(C1)[Si](C)(C)C","InChI=1S/C12H20Si2/c1-13(2,3)14(4)10-9-11-7-5-6-8-12(11)14/h5-8H,9-10H2,1-4H3","WUMUSHPXANMKDT-UHFFFAOYSA-N"
"CCCCCCCCC(=O)NCc(c1)cc(OC)c(O)c1","InChI=1S/C17H27NO3/c1-3-4-5-6-7-8-9-17(20)18-13-14-10-11-15(19)16(12-14)21-2/h10-12,19H,3-9,13H2,1-2H3,(H,18,20)","RGOVYLWUIBMPGK-UHFFFAOYSA-N"
"O=C(C1)NC(=O)C1","InChI=1S/C4H5NO2/c6-3-1-2-4(7)5-3/h1-2H2,(H,5,6,7)","KZNICNPSHKQLFF-UHFFFAOYSA-N"
"Oc(c2)cc(O)c(c2)C(=O)c(c1)cccc1","InChI=1S/C13H10O3/c14-10-6-7-11(12(15)8-10)13(16)9-4-2-1-3-5-9/h1-8,14-15H","ZXDDPOHVAMWLBH-UHFFFAOYSA-N"
"COc(c2)cc(O)c(c2)C(=O)c(c1)cccc1","InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3","DXGLGDHPHMLXJC-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(O)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C19H16O/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,20H","LZTRCELOJRDYMQ-UHFFFAOYSA-N"
"CCOC(=O)N(C(OCC)1)c(c2)c(ccc2)C=C1","InChI=1S/C14H17NO3/c1-3-17-13-10-9-11-7-5-6-8-12(11)15(13)14(16)18-4-2/h5-10,13H,3-4H2,1-2H3","GKQLYSROISKDLL-UHFFFAOYSA-N"
"O=C(C=CC=Cc(c2)cc(O3)c(OC3)c2)Nc(c1)cccc1","InChI=1S/C18H15NO3/c20-18(19-15-7-2-1-3-8-15)9-5-4-6-14-10-11-16-17(12-14)22-13-21-16/h1-12H,13H2,(H,19,20)/b6-4+,9-5+","SDVNECXUKBRJNJ-REZHQCRGSA-N"
"CCN(CC)C(=O)C=CC=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C16H19NO3/c1-3-17(4-2)16(18)8-6-5-7-13-9-10-14-15(11-13)20-12-19-14/h5-11H,3-4,12H2,1-2H3/b7-5+,8-6+","HERKSPCMCQYVSE-KQQUZDAGSA-N"
"O=C(C=CC=Cc(c2)cc(O3)c(OC3)c2)N(C1)CCOC1","InChI=1S/C16H17NO4/c18-16(17-7-9-19-10-8-17)4-2-1-3-13-5-6-14-15(11-13)21-12-20-14/h1-6,11H,7-10,12H2/b3-1+,4-2+","BVFLEPVRTQXJQL-ZPUQHVIOSA-N"
"CCCCN(CCCC)C(=O)C=CC=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C20H27NO3/c1-3-5-13-21(14-6-4-2)20(22)10-8-7-9-17-11-12-18-19(15-17)24-16-23-18/h7-12,15H,3-6,13-14,16H2,1-2H3/b9-7+,10-8+","LPDKQEPRDJFFLZ-FIFLTTCUSA-N"
"O=C(C=CC=Cc(c2)cc(O3)c(OC3)c2)N(C)c(c1)cccc1","InChI=1S/C19H17NO3/c1-20(16-8-3-2-4-9-16)19(21)10-6-5-7-15-11-12-17-18(13-15)23-14-22-17/h2-13H,14H2,1H3/b7-5+,10-6+","AFGJIUYXNRMJKD-YLNKAEQOSA-N"
"CC(C)N(C(C)C)C(=O)C=CC=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C18H23NO3/c1-13(2)19(14(3)4)18(20)8-6-5-7-15-9-10-16-17(11-15)22-12-21-16/h5-11,13-14H,12H2,1-4H3/b7-5+,8-6+","XUXUBWLCLZNEFG-KQQUZDAGSA-N"
"CCCN(CCC)C(=O)C=CC=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C18H23NO3/c1-3-11-19(12-4-2)18(20)8-6-5-7-15-9-10-16-17(13-15)22-14-21-16/h5-10,13H,3-4,11-12,14H2,1-2H3/b7-5+,8-6+","BKOZTEJUHNEVPU-KQQUZDAGSA-N"
"CCN(C(=O)C=CC=Cc(c2)cc(O3)c(OC3)c2)c(c1)cccc1","InChI=1S/C20H19NO3/c1-2-21(17-9-4-3-5-10-17)20(22)11-7-6-8-16-12-13-18-19(14-16)24-15-23-18/h3-14H,2,15H2,1H3/b8-6+,11-7+","YIOPYDKKDRORTK-JMFBPXTISA-N"
"O=C(C=CC=Cc(c2)cc(O3)c(OC3)c2)N(C1)CCC1","InChI=1S/C16H17NO3/c18-16(17-9-3-4-10-17)6-2-1-5-13-7-8-14-15(11-13)20-12-19-14/h1-2,5-8,11H,3-4,9-10,12H2/b5-1+,6-2+","GQIJYUMTOUBHSH-IJIVKGSJSA-N"
"[H]C(C([H])=C([H])c(c2)cc(O3)c(OC3)c2)=C([H])C(=O)N(C1)CCCC1","InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+","MXXWOMGUGJBKIW-YPCIICBESA-N"
"c(c3)cc(C1)c(c3)c(c2)c(ccc2)1","InChI=1S/C13H10/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)12/h1-8H,9H2","NIHNNTQXNPWCJQ-UHFFFAOYSA-N"
"O=C(c21)c(c3)c(ccc3)c(cccc2)1","InChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H","YLQWCDOCJODRMT-UHFFFAOYSA-N"
"CCOC(=O)C=CC=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C14H14O4/c1-2-16-14(15)6-4-3-5-11-7-8-12-13(9-11)18-10-17-12/h3-9H,2,10H2,1H3/b5-3+,6-4+","KQDXOQJALDYLMO-GGWOSOGESA-N"
"OC(=O)C([H])=C([H])C([H])=C([H])c(c1)cc(O2)c(OC2)c1","InChI=1S/C12H10O4/c13-12(14)4-2-1-3-9-5-6-10-11(7-9)16-8-15-10/h1-7H,8H2,(H,13,14)/b3-1+,4-2+","RHBGITBPARBDPH-ZPUQHVIOSA-N"
"C1=CC=C2C(=C1)C(=CN2)CC(=O)O","InChI=1S/C10H9NO2/c12-10(13)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H,5H2,(H,12,13)","SEOVTRFCIGRIMH-UHFFFAOYSA-N"
"OC(=O)C([H])(N)Cc(c1)cc(O)c(O)c1","InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m1/s1","WTDRDQBEARUVNC-ZCFIWIBFSA-N"
"NCC([H])(O)c(c1)cc(O)c(O)c1","InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1","SFLSHLFXELFNJZ-QMMMGPOBSA-N"
"c(c2)ccc(c2)C(=O)C(=O)c(c1)cccc1","InChI=1S/C14H10O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10H","WURBFLDFSFBTLW-UHFFFAOYSA-N"
"COc(c1)c(C5=4)c(OC(=O)C(C(=O)CC5)4)c(C32)c(OC(OC=C3)2)1","InChI=1S/C17H12O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h4-6,8,17H,2-3H2,1H3","OQIQSTLJSLGHID-UHFFFAOYSA-N"
"COc(c1)c(C5=4)c(OC(=O)C(C(=O)CC5)4)c(C32)c(OC(OCC3)2)1","InChI=1S/C17H14O6/c1-20-10-6-11-14(8-4-5-21-17(8)22-11)15-13(10)7-2-3-9(18)12(7)16(19)23-15/h6,8,17H,2-5H2,1H3","WWSYXEZEXMQWHT-UHFFFAOYSA-N"
"COc(c3)c(C5=4)c(OC(=O)C(C(=O)OCC5)4)c(c31)C([H])(C([H])=2)C([H])(OC([H])2)O1","InChI=1S/C17H12O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h3,5-6,8,17H,2,4H2,1H3/t8-,17+/m0/s1","XWIYFDMXXLINPU-WNWIJWBNSA-N"
"COc(c3)c(C5=4)c(OC(=O)C(C(=O)OCC5)4)c(c31)C([H])(C2)C([H])(OC2)O1","InChI=1S/C17H14O7/c1-20-9-6-10-12(8-3-5-22-17(8)23-10)14-11(9)7-2-4-21-15(18)13(7)16(19)24-14/h6,8,17H,2-5H2,1H3/t8-,17+/m0/s1","WPCVRWVBBXIRMA-WNWIJWBNSA-N"
"N#Cc(c(=O)1)c(C#N)c(=O)c(Cl)c(Cl)1","InChI=1S/C8Cl2N2O2/c9-5-6(10)8(14)4(2-12)3(1-11)7(5)13","HZNVUJQVZSTENZ-UHFFFAOYSA-N"
"CC(=O)CC(c(c3)cccc3)C(C(=O)1)=C(O)c(c2)c(ccc2)O1","InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3","PJVWKTKQMONHTI-UHFFFAOYSA-N"
"CC(=O)c(c2)ccc(c2)S(=O)(=O)NC(=O)NC(C1)CCCC1","InChI=1S/C15H20N2O4S/c1-11(18)12-7-9-14(10-8-12)22(20,21)17-15(19)16-13-5-3-2-4-6-13/h7-10,13H,2-6H2,1H3,(H2,16,17,19)","VGZSUPCWNCWDAN-UHFFFAOYSA-N"
"CCCN(CCC)c(c([N+1]([O-1])=O)1)c([N+1]([O-1])=O)cc(c1)C(F)(F)F","InChI=1S/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3","ZSDSQXJSNMTJDA-UHFFFAOYSA-N"
"COC1=C(C=CC(=C1)/C=C/C(=O)CC(=O)/C=C/C2=CC(=C(C=C2)O)OC)O","InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-12,24-25H,13H2,1-2H3/b7-3+,8-4+","VFLDPWHFBUODDF-FCXRPNKRSA-N"
"c(c4)ccc(c4)c(c1)cn(c32)c1Sc(cccc3)2","InChI=1S/C16H11NS/c1-2-6-12(7-3-1)13-10-16-17(11-13)14-8-4-5-9-15(14)18-16/h1-11H","XMWBLLRPZGAGCI-UHFFFAOYSA-N"
"C[Si](C)(C)O[Si](C)(C)C","InChI=1S/C6H18OSi2/c1-8(2,3)7-9(4,5)6/h1-6H3","UQEAIHBTYFGYIE-UHFFFAOYSA-N"
"CC(C)(C)O[Si](C)(C)C","InChI=1S/C7H18OSi/c1-7(2,3)8-9(4,5)6/h1-6H3","PGZGBYCKAOEPQZ-UHFFFAOYSA-N"
"C[SiH](C)c(c1)cccc1","InChI=1S/C8H12Si/c1-9(2)8-6-4-3-5-7-8/h3-7,9H,1-2H3","ZISUALSZTAEPJH-UHFFFAOYSA-N"
"COc(c1)ccc(c1)[Si](C)(C)Cl","InChI=1S/C9H13ClOSi/c1-11-8-4-6-9(7-5-8)12(2,3)10/h4-7H,1-3H3","RTYNSTRFACIKRL-UHFFFAOYSA-N"
"CO[Si](C)(C)c(c1)cccc1","InChI=1S/C9H14OSi/c1-10-11(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3","REQXNMOSXYEQLM-UHFFFAOYSA-N"
"COc(c1)ccc(c1)[SiH](C)C","InChI=1S/C9H14OSi/c1-10-8-4-6-9(7-5-8)11(2)3/h4-7,11H,1-3H3","SMCZAFXJZGCLQH-UHFFFAOYSA-N"
"COc(c1)ccc(c1)[Si](C)(C)C","InChI=1S/C10H16OSi/c1-11-9-5-7-10(8-6-9)12(2,3)4/h5-8H,1-4H3","XYZOPPYWEMJIAD-UHFFFAOYSA-N"
"COc(c1)ccc(c1)[Si](C)(C)OC","InChI=1S/C10H16O2Si/c1-11-9-5-7-10(8-6-9)13(3,4)12-2/h5-8H,1-4H3","NYZIQYZVZFTFBF-UHFFFAOYSA-N"
"CC(=C)c(c1)ccc(c1)[SiH](C)C","InChI=1S/C11H16Si/c1-9(2)10-5-7-11(8-6-10)12(3)4/h5-8,12H,1H2,2-4H3","PBKACEYOTGHHBZ-UHFFFAOYSA-N"
"CC(=C)c(c1)ccc(c1)[Si](C)(C)C","InChI=1S/C12H18Si/c1-10(2)11-6-8-12(9-7-11)13(3,4)5/h6-9H,1H2,2-5H3","IFMXBBNZFOAHBB-UHFFFAOYSA-N"
"CC(=C)c(c1)ccc(c1)[Si](C)(C)OC","InChI=1S/C12H18OSi/c1-10(2)11-6-8-12(9-7-11)14(4,5)13-3/h6-9H,1H2,2-5H3","IPKWQMUUORAUAI-UHFFFAOYSA-N"
"O=Cc(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C12H20OSi2/c1-14(2,3)15(4,5)12-8-6-11(10-13)7-9-12/h6-10H,1-5H3","NEJCUBIDSVZCHT-UHFFFAOYSA-N"
"O=Cc(c1)c(ccc1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C12H20OSi2/c1-14(2,3)15(4,5)12-9-7-6-8-11(12)10-13/h6-10H,1-5H3","WNESRHPOMYTGRC-UHFFFAOYSA-N"
"C[Si](C)(C)C(O1)c(c2)c(ccc2)[Si](C)(C)1","InChI=1S/C12H20OSi2/c1-14(2,3)12-10-8-6-7-9-11(10)15(4,5)13-12/h6-9,12H,1-5H3","XJKCNSJHPQYYEU-UHFFFAOYSA-N"
"O=Cc(c1)ccc(c1)[Si](C)(C)OC(C)(C)C","InChI=1S/C13H20O2Si/c1-13(2,3)15-16(4,5)12-8-6-11(10-14)7-9-12/h6-10H,1-5H3","ZEPNRRYDCQESKB-UHFFFAOYSA-N"
"CC(=C)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C14H24Si2/c1-12(2)13-8-10-14(11-9-13)16(6,7)15(3,4)5/h8-11H,1H2,2-7H3","SYQYMCRKKHGMDB-UHFFFAOYSA-N"
"[H]C(CC([H])=C([H])I)=C([H])I","InChI=1S/C5H6I2/c6-4-2-1-3-5-7/h2-5H,1H2/b4-2-,5-3-","PSYRQZJSTOQMOF-JVLMNHKTSA-N"
"c(c2)ccc(c2)[SiH](C)[SiH](C)c(c1)cccc1","InChI=1S/C14H18Si2/c1-15(13-9-5-3-6-10-13)16(2)14-11-7-4-8-12-14/h3-12,15-16H,1-2H3","XHYDSQBIDFZOGB-UHFFFAOYSA-N"
"c(c3)ccc(c3)[SiH](c(c2)cccc2)c(c1)cccc1","InChI=1S/C18H16Si/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H","AKQNYQDSIDKVJZ-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)Cl","InChI=1S/C5H15ClSi2/c1-7(2,3)8(4,5)6/h1-5H3","GJCAUTWJWBFMFU-UHFFFAOYSA-N"
"C[Si](C)(C)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C7H18Cl2Si2/c1-10(2,3)7(8,9)11(4,5)6/h1-6H3","WWPQQMDJOWANKG-UHFFFAOYSA-N"
"C[Si](C)(C)C(Cl)[Si](C)(C)C","InChI=1S/C7H19ClSi2/c1-9(2,3)7(8)10(4,5)6/h7H,1-6H3","XNJGZHVYPBNLEB-UHFFFAOYSA-N"
"C[Si](C)(C)C[Si](C)(C)C","InChI=1S/C7H20Si2/c1-8(2,3)7-9(4,5)6/h7H2,1-6H3","GYIODRUWWNNGPI-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](Cl)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C9H27ClSi4/c1-11(2,3)14(10,12(4,5)6)13(7,8)9/h1-9H3","HCOROOJWVHFMRJ-UHFFFAOYSA-N"
"C[Si](C)(C)C([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C10H28Si3/c1-11(2,3)10(12(4,5)6)13(7,8)9/h10H,1-9H3","BNZSPXKCIAAEJK-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(c(C)1)[Si](C)(Cl)Cl","InChI=1S/C10H14Cl2Si/c1-7-5-8(2)10(9(3)6-7)13(4,11)12/h5-6H,1-4H3","PGCGLGVPISOWIV-UHFFFAOYSA-N"
"CNc(c1)cccc1","InChI=1S/C7H9N/c1-8-7-5-3-2-4-6-7/h2-6,8H,1H3","AFBPFSWMIHJQDM-UHFFFAOYSA-N"
"CC(C)[Si](C)(Cl)C(C)C","InChI=1S/C7H17ClSi/c1-6(2)9(5,8)7(3)4/h6-7H,1-5H3","XOLPGSHGGPYYQX-UHFFFAOYSA-N"
"CC(C)[SiH](C)C(C)C","InChI=1S/C7H18Si/c1-6(2)8(5)7(3)4/h6-8H,1-5H3","TYZIDFVXYCLNGN-UHFFFAOYSA-N"
"CN[Si](C)(C(C)C)C(C)C","InChI=1S/C8H21NSi/c1-7(2)10(6,9-5)8(3)4/h7-9H,1-6H3","AAXLXBDCHSZNOB-UHFFFAOYSA-N"
"c(c1)ccc(c1)N([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C12H23NSi2/c1-14(2,3)13(15(4,5)6)12-10-8-7-9-11-12/h7-11H,1-6H3","UUBHRQZKROMHOC-UHFFFAOYSA-N"
"c(c1)ccc(c1)N(C)[Si](C)(C)C(C)(C)C","InChI=1S/C13H23NSi/c1-13(2,3)15(5,6)14(4)12-10-8-7-9-11-12/h7-11H,1-6H3","GRHVMNXJECNYQT-UHFFFAOYSA-N"
"CC(C)[Si](C)(C(C)C)N(C)[Si](C)(C(C)C)C(C)C","InChI=1S/C15H37NSi2/c1-12(2)17(10,13(3)4)16(9)18(11,14(5)6)15(7)8/h12-15H,1-11H3","PXYIHSZXKDOWDJ-UHFFFAOYSA-N"
"c(c3)cc(c21)c(c3)[Si](C)(C)c(cccc2)1","InChI=1S/C14H14Si/c1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15/h3-10H,1-2H3","YJQFTKVGILQPMC-UHFFFAOYSA-N"
"c(c3)cc(c21)c(c3)[Si](C)(C)[Si](C)(C)c(cccc2)1","InChI=1S/C16H20Si2/c1-17(2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)18(17,3)4/h5-12H,1-4H3","QHXSSKNXFGRFAI-UHFFFAOYSA-N"
"c(c3)cc(c21)c(c3)[Si](C)([Si](C)(C)C)c(cccc2)1","InChI=1S/C16H20Si2/c1-17(2,3)18(4)15-11-7-5-9-13(15)14-10-6-8-12-16(14)18/h5-12H,1-4H3","KYDKAYOCFULJKS-UHFFFAOYSA-N"
"c(c3)cc(c21)c(c3)[Si](C)(C)O[Si](C)(C)c(cccc2)1","InChI=1S/C16H20OSi2/c1-18(2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)19(3,4)17-18/h5-12H,1-4H3","GRSNFLIGYUYVAI-UHFFFAOYSA-N"
"Cc(c(C)3)cc(c21)c(c3)[Si](C)(C)c(cc(C)c(C)c2)1","InChI=1S/C18H22Si/c1-11-7-15-16-8-12(2)14(4)10-18(16)19(5,6)17(15)9-13(11)3/h7-10H,1-6H3","VMIACFKGWPODOT-UHFFFAOYSA-N"
"c(c3)cc(c21)c(c3)[Si]([Si](C)(C)C)([Si](C)(C)C)c(cccc2)1","InChI=1S/C18H26Si3/c1-19(2,3)21(20(4,5)6)17-13-9-7-11-15(17)16-12-8-10-14-18(16)21/h7-14H,1-6H3","VVLXLOFKPLEEQP-UHFFFAOYSA-N"
"c(c3)cc(c21)c(c3)[Si](C)(C)[Si](C)(C)[Si](C)(C)c(cccc2)1","InChI=1S/C18H26Si3/c1-19(2)17-13-9-7-11-15(17)16-12-8-10-14-18(16)20(3,4)21(19,5)6/h7-14H,1-6H3","YFNCLGLQJVKJLI-UHFFFAOYSA-N"
"c(c4)ccc(c4)[Si](C)(c21)c(c3)c(ccc3)c(cccc2)1","InChI=1S/C19H16Si/c1-20(15-9-3-2-4-10-15)18-13-7-5-11-16(18)17-12-6-8-14-19(17)20/h2-14H,1H3","FWZYOTZZKGUNHT-UHFFFAOYSA-N"
"Cc(c(C)3)cc(c21)c(c3)[Si](C)(C)[Si](C)(C)c(cc(C)c(C)c2)1","InChI=1S/C20H28Si2/c1-13-9-17-18-10-14(2)16(4)12-20(18)22(7,8)21(5,6)19(17)11-15(13)3/h9-12H,1-8H3","FUJMQEAHBZWDST-UHFFFAOYSA-N"
"CC[Si](C)(CC)CC","InChI=1S/C7H18Si/c1-5-8(4,6-2)7-3/h5-7H2,1-4H3","JCSVHJQZTMYYFL-UHFFFAOYSA-N"
"C[Si](C)(C)C(C1)=CCC1","InChI=1S/C8H16Si/c1-9(2,3)8-6-4-5-7-8/h6H,4-5,7H2,1-3H3","NCRSFPYUKGCMLQ-UHFFFAOYSA-N"
"C[SiH](C)C=CC(C)(C)C","InChI=1S/C8H18Si/c1-8(2,3)6-7-9(4)5/h6-7,9H,1-5H3/b7-6+","AQHDHCUGDPHLTD-VOTSOKGWSA-N"
"C(C1)CC=C(C1)[Si](C)(C)C","InChI=1S/C9H18Si/c1-10(2,3)9-7-5-4-6-8-9/h7H,4-6,8H2,1-3H3","GCNCLIUGTVEEBJ-UHFFFAOYSA-N"
"CC[Si](CC)(CC)C=C[Si](C)(C)C","InChI=1S/C11H26Si2/c1-7-13(8-2,9-3)11-10-12(4,5)6/h10-11H,7-9H2,1-6H3/b11-10+","XGAKZDDPVFAGBU-ZHACJKMWSA-N"
"CC[Si](CC)(CC)C=CC(C)(C)C","InChI=1S/C12H26Si/c1-7-13(8-2,9-3)11-10-12(4,5)6/h10-11H,7-9H2,1-6H3/b11-10+","NMCXIZRJYSJQHC-ZHACJKMWSA-N"
"CC(C)(C)C=C([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C12H28Si2/c1-12(2,3)10-11(13(4,5)6)14(7,8)9/h10H,1-9H3","CLHGWWUIDFQPPX-UHFFFAOYSA-N"
"CC(C)(C)CC([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C12H30Si2/c1-12(2,3)10-11(13(4,5)6)14(7,8)9/h11H,10H2,1-9H3","BTWDZAHAMUXDLR-UHFFFAOYSA-N"
"COCOC","InChI=1S/C3H8O2/c1-4-3-5-2/h3H2,1-2H3","NKDDWNXOKDWJAK-UHFFFAOYSA-N"
"COCCOC","InChI=1S/C4H10O2/c1-5-3-4-6-2/h3-4H2,1-2H3","XTHFKEDIFFGKHM-UHFFFAOYSA-N"
"COC(C)OC","InChI=1S/C4H10O2/c1-4(5-2)6-3/h4H,1-3H3","SPEUIVXLLWOEMJ-UHFFFAOYSA-N"
"COC(C)(C)OC","InChI=1S/C5H12O2/c1-5(2,6-3)7-4/h1-4H3","HEWZVZIVELJPQZ-UHFFFAOYSA-N"
"CCCC=O","InChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3","ZTQSAGDEMFDKMZ-UHFFFAOYSA-N"
"O=CC(C)C","InChI=1S/C4H8O/c1-4(2)3-5/h3-4H,1-2H3","AMIMRNSIRUDHCM-UHFFFAOYSA-N"
"CCCCC=O","InChI=1S/C5H10O/c1-2-3-4-5-6/h5H,2-4H2,1H3","HGBOYTHUEUWSSQ-UHFFFAOYSA-N"
"O=CCC(C)C","InChI=1S/C5H10O/c1-5(2)3-4-6/h4-5H,3H2,1-2H3","YGHRJJRRZDOVPD-UHFFFAOYSA-N"
"CCCCCC=O","InChI=1S/C6H12O/c1-2-3-4-5-6-7/h6H,2-5H2,1H3","JARKCYVAAOWBJS-UHFFFAOYSA-N"
"CCCCCCC=O","InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h7H,2-6H2,1H3","FXHGMKSSBGDXIY-UHFFFAOYSA-N"
"CCCCCCCC=O","InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h8H,2-7H2,1H3","NUJGJRNETVAIRJ-UHFFFAOYSA-N"
"CCCCCCCCC=O","InChI=1S/C9H18O/c1-2-3-4-5-6-7-8-9-10/h9H,2-8H2,1H3","GYHFUZHODSMOHU-UHFFFAOYSA-N"
"CCCCCCCCCC=O","InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h10H,2-9H2,1H3","KSMVZQYAVGTKIV-UHFFFAOYSA-N"
"COC(=O)CNC(=O)C([H])(C)NC(=O)C([H])(C)NC(=O)CNC(C)=O","InChI=1S/C13H22N4O6/c1-7(12(21)15-6-11(20)23-4)17-13(22)8(2)16-10(19)5-14-9(3)18/h7-8H,5-6H2,1-4H3,(H,14,18)(H,15,21)(H,16,19)(H,17,22)/t7-,8+/m0/s1","QXDJNCUBXZBMIK-JGVFFNPUSA-N"
"COC(=O)CNC(=O)C([H])(NC(=O)CNC(=O)CNC(C)=O)C([H])(C)CC","InChI=1S/C15H26N4O6/c1-5-9(2)14(15(24)18-8-13(23)25-4)19-12(22)7-17-11(21)6-16-10(3)20/h9,14H,5-8H2,1-4H3,(H,16,20)(H,17,21)(H,18,24)(H,19,22)/t9-,14-/m0/s1","ZCQBUIJWUQUPFI-XPTSAGLGSA-N"
"COC(=O)CNC(=O)C([H])(NC(=O)C([H])(NC(=O)CNC(C)=O)C([H])(C)CC)C([H])(C)CC","InChI=1S/C19H34N4O6/c1-7-11(3)16(18(27)21-10-15(26)29-6)23-19(28)17(12(4)8-2)22-14(25)9-20-13(5)24/h11-12,16-17H,7-10H2,1-6H3,(H,20,24)(H,21,27)(H,22,25)(H,23,28)/t11-,12-,16-,17-/m0/s1","OHYIWPIFHCOLOP-SYWGBEHUSA-N"
"COC(=O)CNC(=O)C([H])(NC(=O)C([H])(NC(=O)CNC(C)=O)Cc(c1)cccc1)C([H])(C)CC","InChI=1S/C22H32N4O6/c1-5-14(2)20(22(31)24-13-19(29)32-4)26-21(30)17(11-16-9-7-6-8-10-16)25-18(28)12-23-15(3)27/h6-10,14,17,20H,5,11-13H2,1-4H3,(H,23,27)(H,24,31)(H,25,28)(H,26,30)/t14-,17+,20-/m0/s1","UVUSOYPESJDGFD-NQYLQCIDSA-N"
"CC(=O)c(c1)cccc1","InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3","KWOLFJPFCHCOCG-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(=O)c(c1)cccc1","InChI=1S/C8H8O/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H3/i1D3","KWOLFJPFCHCOCG-FIBGUPNXSA-N"
"CCC(=O)OC","InChI=1S/C4H8O2/c1-3-4(5)6-2/h3H2,1-2H3","RJUFJBKOKNCXHH-UHFFFAOYSA-N"
"CCOC(=O)CC","InChI=1S/C5H10O2/c1-3-5(6)7-4-2/h3-4H2,1-2H3","FKRCODPIKNYEAC-UHFFFAOYSA-N"
"CCCOC(=O)CC","InChI=1S/C6H12O2/c1-3-5-8-6(7)4-2/h3-5H2,1-2H3","MCSINKKTEDDPNK-UHFFFAOYSA-N"
"CCC(=O)OC(C)C","InChI=1S/C6H12O2/c1-4-6(7)8-5(2)3/h5H,4H2,1-3H3","IJMWOMHMDSDKGK-UHFFFAOYSA-N"
"CCC(=O)OCC(C)C","InChI=1S/C7H14O2/c1-4-7(8)9-5-6(2)3/h6H,4-5H2,1-3H3","FZXRXKLUIMKDEL-UHFFFAOYSA-N"
"CCCOCCC","InChI=1S/C6H14O/c1-3-5-7-6-4-2/h3-6H2,1-2H3","POLCUAVZOMRGSN-UHFFFAOYSA-N"
"CC(C)OC(C)C","InChI=1S/C6H14O/c1-5(2)7-6(3)4/h5-6H,1-4H3","ZAFNJMIOTHYJRJ-UHFFFAOYSA-N"
"CCCCOCCCC","InChI=1S/C8H18O/c1-3-5-7-9-8-6-4-2/h3-8H2,1-2H3","DURPTKYDGMDSBL-UHFFFAOYSA-N"
"CC(C)COCC(C)C","InChI=1S/C8H18O/c1-7(2)5-9-6-8(3)4/h7-8H,5-6H2,1-4H3","SZNYYWIUQFZLLT-UHFFFAOYSA-N"
"CC(C)CCOCCC(C)C","InChI=1S/C10H22O/c1-9(2)5-7-11-8-6-10(3)4/h9-10H,5-8H2,1-4H3","AQZGPSLYZOOYQP-UHFFFAOYSA-N"
"CCCCCCOCCCCCC","InChI=1S/C12H26O/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-12H2,1-2H3","BPIUIOXAFBGMNB-UHFFFAOYSA-N"
"c(c2)ccc(c2)COCc(c1)cccc1","InChI=1S/C14H14O/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10H,11-12H2","MHDVGSVTJDSBDK-UHFFFAOYSA-N"
"CCCCCCOC(=O)c(c1)cccc1","InChI=1S/C13H18O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3","UUGLJVMIFJNVFH-UHFFFAOYSA-N"
"CCCCCOC(=O)c(c1)cccc1","InChI=1S/C12H16O2/c1-2-3-7-10-14-12(13)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3","QKNZNUNCDJZTCH-UHFFFAOYSA-N"
"O=C(OCc(c2)cccc2)c(c1)cccc1","InChI=1S/C14H12O2/c15-14(13-9-5-2-6-10-13)16-11-12-7-3-1-4-8-12/h1-10H,11H2","SESFRYSPDFLNCH-UHFFFAOYSA-N"
"NCc(c1)cccc1","InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2","WGQKYBSKWIADBV-UHFFFAOYSA-N"
"N#CCc(c1)cccc1","InChI=1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2","SUSQOBVLVYHIEX-UHFFFAOYSA-N"
"CCC(=O)OCc(c1)cccc1","InChI=1S/C10H12O2/c1-2-10(11)12-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3","VHOMAPWVLKRQAZ-UHFFFAOYSA-N"
"COC(C)=O","InChI=1S/C3H6O2/c1-3(4)5-2/h1-2H3","KXKVLQRXCPHEJC-UHFFFAOYSA-N"
"CCOC(C)=O","InChI=1S/C4H8O2/c1-3-6-4(2)5/h3H2,1-2H3","XEKOWRVHYACXOJ-UHFFFAOYSA-N"
"CCCCCOC(C)=O","InChI=1S/C7H14O2/c1-3-4-5-6-9-7(2)8/h3-6H2,1-2H3","PGMYKACGEOXYJE-UHFFFAOYSA-N"
"CCCCC(CC)COC(C)=O","InChI=1S/C10H20O2/c1-4-6-7-10(5-2)8-12-9(3)11/h10H,4-8H2,1-3H3","WOYWLLHHWAMFCB-UHFFFAOYSA-N"
"CC(=O)OC(C1)CCCC1","InChI=1S/C8H14O2/c1-7(9)10-8-5-3-2-4-6-8/h8H,2-6H2,1H3","YYLLIJHXUHJATK-UHFFFAOYSA-N"
"CCCc(c1)cccc1","InChI=1S/C9H12/c1-2-6-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3","ODLMAHJVESYWTB-UHFFFAOYSA-N"
"CC(C)c(c1)cccc1","InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3","RWGFKTVRMDUZSP-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(C)c1","InChI=1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3","GWHJZXXIDMPWGX-UHFFFAOYSA-N"
"CCCCc(c1)cccc1","InChI=1S/C10H14/c1-2-3-7-10-8-5-4-6-9-10/h4-6,8-9H,2-3,7H2,1H3","OCKPCBLVNKHBMX-UHFFFAOYSA-N"
"CC(C)Cc(c1)cccc1","InChI=1S/C10H14/c1-9(2)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","KXUHSQYYJYAXGZ-UHFFFAOYSA-N"
"CCC(C)c(c1)cccc1","InChI=1S/C10H14/c1-3-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3","ZJMWRROPUADPEA-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cccc1","InChI=1S/C10H14/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3","YTZKOQUCBOVLHL-UHFFFAOYSA-N"
"CC(C)c(c1)ccc(C)c1","InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3","HFPZCAJZSCWRBC-UHFFFAOYSA-N"
"CCC(C)(C)c(c1)cccc1","InChI=1S/C11H16/c1-4-11(2,3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3","QHTJSSMHBLGUHV-UHFFFAOYSA-N"
"CC(C)c(c1)ccc(C(C)C)c1","InChI=1S/C12H18/c1-9(2)11-5-7-12(8-6-11)10(3)4/h5-10H,1-4H3","SPPWGCYEYAMHDT-UHFFFAOYSA-N"
"O=C(C1)CCC1","InChI=1S/C5H8O/c6-5-3-1-2-4-5/h1-4H2","BGTOWKSIORTVQH-UHFFFAOYSA-N"
"O=C(C1)CCCCCCCCCC1","InChI=1S/C12H22O/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h1-11H2","SXVPOSFURRDKBO-UHFFFAOYSA-N"
"OC(C1)CCC1","InChI=1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2","XCIXKGXIYUWCLL-UHFFFAOYSA-N"
"OC(C1)CCCCCCCCCC1","InChI=1S/C12H24O/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h12-13H,1-11H2","SFVWPXMPRCIVOK-UHFFFAOYSA-N"
"C(C1)CCCC1","InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2","XDTMQSROBMDMFD-UHFFFAOYSA-N"
"C(C1)CC=CC1","InChI=1S/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2","HGCIXCUEYOPUTN-UHFFFAOYSA-N"
"C(C2)CCC(C2)c(c1)cccc1","InChI=1S/C12H16/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2","IGARGHRYKHJQSM-UHFFFAOYSA-N"
"C(C=1)C=CC=CC1","InChI=1S/C7H8/c1-2-4-6-7-5-3-1/h1-6H,7H2","CHVJITGCYZJHLR-UHFFFAOYSA-N"
"C(C1)CCCCCC1","InChI=1S/C8H16/c1-2-4-6-8-7-5-3-1/h1-8H2","WJTCGQSWYFHTAC-UHFFFAOYSA-N"
"C(C1)CCC=CCC1","InChI=1S/C8H14/c1-2-4-6-8-7-5-3-1/h1-2H,3-8H2/b2-1-","URYYVOIYTNXXBN-UPHRSURJSA-N"
"C(C1)CC=CC=CC1","InChI=1S/C8H12/c1-2-4-6-8-7-5-3-1/h1-4H,5-8H2/b3-1-,4-2-","RRKODOZNUZCUBN-CCAGOZQPSA-N"
"C(C1)C=CCCC=C1","InChI=1S/C8H12/c1-2-4-6-8-7-5-3-1/h1-2,7-8H,3-6H2/b2-1-,8-7-","VYXHVRARDIDEHS-QGTKBVGQSA-N"
"C(C1)C=CCCC=CCCC=C1","InChI=1S/C12H18/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2,7-10H,3-6,11-12H2/b2-1-,9-7+,10-8+","ZOLLIQAKMYWTBR-RYMQXAEESA-N"
"C(C1)CCCCC=CCCCC1","InChI=1S/C12H22/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2H,3-12H2/b2-1-","HYPABJGVBDSCIT-UPHRSURJSA-N"
"C(C1)CCCCCCCCCC1","InChI=1S/C12H24/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-12H2","DDTBPAQBQHZRDW-UHFFFAOYSA-N"
"CCCCCCC=C","InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3","KWKAKUADMBZCLK-UHFFFAOYSA-N"
"CCCCCCCCC=C","InChI=1S/C10H20/c1-3-5-7-9-10-8-6-4-2/h3H,1,4-10H2,2H3","AFFLGGQVNFXPEV-UHFFFAOYSA-N"
"CC(C)C(C1)CC(O)C(C)C1","InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)10(11)6-9/h7-11H,4-6H2,1-3H3","ULJXKUJMXIVDOY-UHFFFAOYSA-N"
"CC(=C)C(C1)CC(O)C(C)C1","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h8-11H,1,4-6H2,2-3H3","KRCZYMFUWVJCLI-UHFFFAOYSA-N"
"CC(=C)C(C1)CC(O)C(C)=C1","InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3","BAVONGHXFVOKBV-UHFFFAOYSA-N"
"CCCC","InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3","IJDNQMDRQITEOD-UHFFFAOYSA-N"
"CC(C)C","InChI=1S/C4H10/c1-4(2)3/h4H,1-3H3","NNPPMTNAJDCUHE-UHFFFAOYSA-N"
"C(C1)O1","InChI=1S/C2H4O/c1-2-3-1/h1-2H2","IAYPIBMASNFSPL-UHFFFAOYSA-N"
"","InChI=1S/CO2/c2-1-3","CURLTUGMZLYLDI-UHFFFAOYSA-N"
"CC","InChI=1S/C2H6/c1-2/h1-2H3","OTMSDBZUPAUEDD-UHFFFAOYSA-N"
"CC(C)=C","InChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3","VQTUBCCKSQIDNK-UHFFFAOYSA-N"
"C=CC=C","InChI=1S/C4H6/c1-3-4-2/h3-4H,1-2H2","KAKZBPTYRLMSJV-UHFFFAOYSA-N"
"CC=C","InChI=1S/C3H6/c1-3-2/h3H,1H2,2H3","QQONPFPTGQHPMA-UHFFFAOYSA-N"
"C","InChI=1S/CH4/h1H4","VNWKTOKETHGBQD-UHFFFAOYSA-N"
"c(c2)cc(c1)c(c2)ccc1","InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H","UFWIBTONFRDIAS-UHFFFAOYSA-N"
"C(=C2)C=CC(=C1)C(=C2)C=C1","InChI=1S/C10H8/c1-2-5-9-7-4-8-10(9)6-3-1/h1-8H","CUFNKYGDVFVPHO-UHFFFAOYSA-N"
"Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C11H10/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H3","QPUYECUOLPXSFR-UHFFFAOYSA-N"
"Cc(c1)cc(c2)c(ccc2)c1","InChI=1S/C11H10/c1-9-6-7-10-4-2-3-5-11(10)8-9/h2-8H,1H3","QIMMUPPBPVKWKM-UHFFFAOYSA-N"
"c(c3)cc(C=1)c(c32)c(ccc2)C1","InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H","HXGDTGSAIMULJN-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)cccc1","InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H","ZUOUZKKEUPVFJK-UHFFFAOYSA-N"
"c(c3)cc(C1)c(c32)c(ccc2)C1","InChI=1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2","CWRYPZZKDGJXCA-UHFFFAOYSA-N"
"Cc(c1)c(C)c(c2)c(ccc2)c1","InChI=1S/C12H12/c1-9-7-8-11-5-3-4-6-12(11)10(9)2/h3-8H,1-2H3","QNLZIZAQLLYXTC-UHFFFAOYSA-N"
"Cc(c1)cc(c(C)2)c(ccc2)c1","InChI=1S/C12H12/c1-9-6-7-11-5-3-4-10(2)12(11)8-9/h3-8H,1-2H3","SPUWFVKLHHEKGV-UHFFFAOYSA-N"
"Cc(c1)c(C)cc(c2)c(ccc2)1","InChI=1S/C12H12/c1-9-7-11-5-3-4-6-12(11)8-10(9)2/h3-8H,1-2H3","WWGUMAYGTYQSGA-UHFFFAOYSA-N"
"Cc(c2)cc(c1)c(c2)cc(C)c1","InChI=1S/C12H12/c1-9-3-5-12-8-10(2)4-6-11(12)7-9/h3-8H,1-2H3","YGYNBBAUIYTWBF-UHFFFAOYSA-N"
"c(c3)cc(o1)c(c3)c(c2)c(ccc2)1","InChI=1S/C12H8O/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H","TXCDCPKCNAJMEE-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C14H10/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-10H","YNPNZTXNASCQKK-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)cc(c2)c(ccc2)1","InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H","MWPLVEDNUUSJAV-UHFFFAOYSA-N"
"Cc(c3)cc(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C15H12/c1-11-6-9-15-13(10-11)8-7-12-4-2-3-5-14(12)15/h2-10H,1H3","KANLOADZXMMCQA-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c41)c(c2c3)c(ccc2)cc1","InChI=1S/C16H10/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-10H","BBEAQIROQSPTKN-UHFFFAOYSA-N"
"c(c4)cc(c(c4)1)c(c3)c(c2cc3)c(ccc2)1","InChI=1S/C16H10/c1-2-8-13-12(7-1)14-9-3-5-11-6-4-10-15(13)16(11)14/h1-10H","GVEPBJHOBDJJJI-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)cc(c13)c(c2)c(ccc2)cc1","InChI=1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H","DXBHBZVCASKNBY-UHFFFAOYSA-N"
"c(c4)cc(c(c4)1)c(c3)c(ccc3)c(c2)c(ccc2)1","InChI=1S/C18H12/c1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18/h1-12H","SLGBZMMZGDRARJ-UHFFFAOYSA-N"
"c(c5)cc(c21)c(c54)c(ccc4)c(c3)c(c(cc3)ccc2)1","InChI=1S/C20H12/c1-5-13-6-2-11-17-18-12-4-8-14-7-3-10-16(20(14)18)15(9-1)19(13)17/h1-12H","CSHWQDPOILHKBI-UHFFFAOYSA-N"
"c(c5)cc(c4)c(c5)c(c1)c(c34)c(c2cc3)c(ccc2)c1","InChI=1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H","FMMWHPNWAFZXNH-UHFFFAOYSA-N"
"c(c5)cc(c1)c(c5)c(c4)c(c(cc4)2)c1c(c3)c(ccc3)2","InChI=1S/C20H12/c1-2-7-14-13(6-1)12-19-16-9-4-3-8-15(16)18-11-5-10-17(14)20(18)19/h1-12H","FTOVXSOBNPWTSH-UHFFFAOYSA-N"
"c(c5)cc(c1)c(c5)cc(c32)c1c(c4)c(c(cc4)ccc3)2","InChI=1S/C20H12/c1-2-6-15-12-19-17-10-4-8-13-7-3-9-16(20(13)17)18(19)11-14(15)5-1/h1-12H","HAXBIWFMXWRORI-UHFFFAOYSA-N"
"c(c6)cc(c(c6)5)c(c4)c(c15)c(c3c4)c(c2cc3)c(ccc2)c1","InChI=1S/C22H12/c1-2-7-17-16(6-1)18-11-10-14-9-8-13-4-3-5-15-12-19(17)22(18)21(14)20(13)15/h1-12H","SXQBHARYMNFBPS-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H","WDCYWAQPCXBPJA-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C6H4N2O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H","FYFDQJRXFWGIBS-UHFFFAOYSA-N"
"Cc(c1)cc([N+1]([O-1])=O)c(c1)[N+1]([O-1])=O","InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3","INYDMNPNDHRJQJ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C10H7NO2/c12-11(13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H","RJKGJBPXVHTNJL-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C10H7NO2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H","ZJYJZEAJZXVAMF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(ccc2)c(c1)cccc1","InChI=1S/C12H9NO2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H","YOJKKXRJMXIKSR-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc(cc2)c(c1)cccc1","InChI=1S/C12H9NO2/c14-13(15)12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9H","FYRPEHRWMVMHQM-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(c3)c(c(cc3)2)c(CC2)c1","InChI=1S/C12H9NO2/c14-13(15)11-7-6-9-5-4-8-2-1-3-10(11)12(8)9/h1-3,6-7H,4-5H2","CUARLQDWYSRQDF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)cc(C1)c(c3)c(c2)c(ccc2)1","InChI=1S/C13H9NO2/c15-14(16)11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)13/h1-6,8H,7H2","XFOHWECQTFIEIX-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(c1)c(cc2)c(cc1)[N+1]([O-1])=O","InChI=1S/C10H6N2O4/c13-11(14)9-5-1-3-7-8(9)4-2-6-10(7)12(15)16/h1-6H","ZUTCJXFCHHDFJS-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(c1cc2)c(ccc1)[N+1]([O-1])=O","InChI=1S/C10H6N2O4/c13-11(14)8-5-1-3-7-4-2-6-9(10(7)8)12(15)16/h1-6H","AVCSMMMOCOTIHF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)c(c(=O)1)c(cc3)c(=O)c(c2)c(ccc2)1","InChI=1S/C14H7NO4/c16-13-8-4-1-2-5-9(8)14(17)12-10(13)6-3-7-11(12)15(18)19/h1-7H","YCANAXVBJKNANM-UHFFFAOYSA-N"
"Cn(c1)ccc1","InChI=1S/C5H7N/c1-6-4-2-3-5-6/h2-5H,1H3","OXHNLMTVIGZXSG-UHFFFAOYSA-N"
"c(c1)nccn1","InChI=1S/C4H4N2/c1-2-6-4-3-5-1/h1-4H","KYQCOXFCLRTKLS-UHFFFAOYSA-N"
"Cc(c1)c(C)c(N)cc1","InChI=1S/C8H11N/c1-6-4-3-5-8(9)7(6)2/h3-5H,9H2,1-2H3","VVAKEQGKZNKUSU-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(N)c1","InChI=1S/C8H11N/c1-6-3-4-8(9)7(2)5-6/h3-5H,9H2,1-2H3","CZZZABOKJQXEBO-UHFFFAOYSA-N"
"Cc(c1)cc(N)c(C)c1","InChI=1S/C8H11N/c1-6-3-4-7(2)8(9)5-6/h3-5H,9H2,1-2H3","VOWZNBNDMFLQGM-UHFFFAOYSA-N"
"Cc(c1)c(N)c(C)cc1","InChI=1S/C8H11N/c1-6-4-3-5-7(2)8(6)9/h3-5H,9H2,1-2H3","UFFBMTHBGFGIHF-UHFFFAOYSA-N"
"Nc(c1)cc(C)c(C)c1","InChI=1S/C8H11N/c1-6-3-4-8(9)5-7(6)2/h3-5H,9H2,1-2H3","DOLQYFPDPKPQSS-UHFFFAOYSA-N"
"Cc(c1)cc(N)cc(C)1","InChI=1S/C8H11N/c1-6-3-7(2)5-8(9)4-6/h3-5H,9H2,1-2H3","MKARNSWMMBGSHX-UHFFFAOYSA-N"
"c(c2)cc(c1)c(c2)cnc1","InChI=1S/C9H7N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-7H","AWJUIBRHMBBTKR-UHFFFAOYSA-N"
"c(c2)cc(n1)c(c2)ncc1","InChI=1S/C8H6N2/c1-2-4-8-7(3-1)9-5-6-10-8/h1-6H","XSCHRSMBECNVNS-UHFFFAOYSA-N"
"Cc(c1)nc(c2)c(ccc2)c(C)1","InChI=1S/C11H11N/c1-8-7-9(2)12-11-6-4-3-5-10(8)11/h3-7H,1-2H3","ZTNANFDSJRRZRJ-UHFFFAOYSA-N"
"Cc(c2)cc(c1)c(c2)nc(C)c1","InChI=1S/C11H11N/c1-8-3-6-11-10(7-8)5-4-9(2)12-11/h3-7H,1-2H3","JJPSZKIOGBRMHK-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)c(c1)cccc1","InChI=1S/C12H11N/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,13H2","DMVOXQPQNTYEKQ-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)nc(c2)c(ccc2)1","InChI=1S/C13H9N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-9H","DZBUGLKDJFMEHC-UHFFFAOYSA-N"
"Cc(c(C)1)c(=O)c(C)c(C)c(=O)1","InChI=1S/C10H12O2/c1-5-6(2)10(12)8(4)7(3)9(5)11/h1-4H3","WAMKWBHYPYBEJY-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC","InChI=1S/C16H34/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3-16H2,1-2H3","DCAYPVUWAIABOU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC","InChI=1S/C18H38/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h3-18H2,1-2H3","RZJRJXONCZWCBN-UHFFFAOYSA-N"
"CCCCCCCC=CC","InChI=1S/C10H20/c1-3-5-7-9-10-8-6-4-2/h3,5H,4,6-10H2,1-2H3/b5-3+","YKNMBTZOEVIJCM-HWKANZROSA-N"
"CCOC(=O)c(c1)ccc(OC)c1","InChI=1S/C10H12O3/c1-3-13-10(11)8-4-6-9(12-2)7-5-8/h4-7H,3H2,1-2H3","FHUODBDRWMIBQP-UHFFFAOYSA-N"
"N#Cc(c1)c(C)ccc1","InChI=1S/C8H7N/c1-7-4-2-3-5-8(7)6-9/h2-5H,1H3","NWPNXBQSRGKSJB-UHFFFAOYSA-N"
"CCOc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C8H9NO3/c1-2-12-8-5-3-7(4-6-8)9(10)11/h3-6H,2H2,1H3","NWPKEYHUZKMWKJ-UHFFFAOYSA-N"
"CCc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C8H9NO2/c1-2-7-3-5-8(6-4-7)9(10)11/h3-6H,2H2,1H3","RESTWAHJFMZUIZ-UHFFFAOYSA-N"
"[2H]C(C)(C)O","InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i3D","KFZMGEQAYNKOFK-WFVSFCRTSA-N"
"[2H]C([2H])([2H])C([H])(O)C([2H])([2H])[2H]","InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i1D3,2D3","KFZMGEQAYNKOFK-WFGJKAKNSA-N"
"[2H]C([2H])([2H])C([2H])(O)C([2H])([2H])[2H]","InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i1D3,2D3,3D","KFZMGEQAYNKOFK-YYWVXINBSA-N"
"CC(=O)c(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C8H7NO3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5H,1H3","ARKIFHPFTHVKDT-UHFFFAOYSA-N"
"CC(=O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-5H,1H3","YQYGPGKTNQNXMH-UHFFFAOYSA-N"
"O=Cc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C7H5NO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-5H","ZETIVVHRRQLWFW-UHFFFAOYSA-N"
"O=Cc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C7H5NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H","BXRFQSNOROATLV-UHFFFAOYSA-N"
"CCC(=O)c(c1)cccc1","InChI=1S/C9H10O/c1-2-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3","KRIOVPPHQSLHCZ-UHFFFAOYSA-N"
"CCCC(=O)c(c1)cccc1","InChI=1S/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3","FFSAXUULYPJSKH-UHFFFAOYSA-N"
"CC(C)C(=O)c(c1)cccc1","InChI=1S/C10H12O/c1-8(2)10(11)9-6-4-3-5-7-9/h3-8H,1-2H3","BSMGLVDZZMBWQB-UHFFFAOYSA-N"
"CCCCC(=O)c(c1)cccc1","InChI=1S/C11H14O/c1-2-3-9-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3","XKGLSKVNOSHTAD-UHFFFAOYSA-N"
"CCCCCC(=O)c(c1)cccc1","InChI=1S/C12H16O/c1-2-3-5-10-12(13)11-8-6-4-7-9-11/h4,6-9H,2-3,5,10H2,1H3","MAHPVQDVMLWUAG-UHFFFAOYSA-N"
"COC(=O)C(C)=C","InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3","VVQNEPGJFQJSBK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(Cl)c1","InChI=1S/C6H4ClNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H","CZGCEKJOLUNIFY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(Br)c1","InChI=1S/C6H4BrNO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H","ZDFBKZUDCQQKAC-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(I)c1","InChI=1S/C6H4INO2/c7-5-1-3-6(4-2-5)8(9)10/h1-4H","SCCCFNJTCDSLCY-UHFFFAOYSA-N"
"N#Cc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C7H4N2O2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H","NKJIFDNZPGLLSH-UHFFFAOYSA-N"
"CC(=C)C(O)=O","InChI=1S/C4H6O2/c1-3(2)4(5)6/h1H2,2H3,(H,5,6)","CERQOIWHTDAKMF-UHFFFAOYSA-N"
"CCOC(=O)C(C)=C","InChI=1S/C6H10O2/c1-4-8-6(7)5(2)3/h2,4H2,1,3H3","SUPCQIBBMFXVTL-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C)=C","InChI=1S/C7H12O2/c1-5(2)7(8)9-6(3)4/h6H,1H2,2-4H3","BOQSSGDQNWEFSX-UHFFFAOYSA-N"
"CCCCOC(=O)C(C)=C","InChI=1S/C8H14O2/c1-4-5-6-10-8(9)7(2)3/h2,4-6H2,1,3H3","SOGAXMICEFXMKE-UHFFFAOYSA-N"
"CC(C)COC(=O)C(C)=C","InChI=1S/C8H14O2/c1-6(2)5-10-8(9)7(3)4/h6H,3,5H2,1-2,4H3","RUMACXVDVNRZJZ-UHFFFAOYSA-N"
"CC(=C)C(=O)OC(C)(C)C","InChI=1S/C8H14O2/c1-6(2)7(9)10-8(3,4)5/h1H2,2-5H3","SJMYWORNLPSJQO-UHFFFAOYSA-N"
"CCCCCCOC(=O)C(C)=C","InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h2,4-8H2,1,3H3","LNCPIMCVTKXXOY-UHFFFAOYSA-N"
"C=CCOC(=O)C(C)=C","InChI=1S/C7H10O2/c1-4-5-9-7(8)6(2)3/h4H,1-2,5H2,3H3","FBCQUCJYYPMKRO-UHFFFAOYSA-N"
"CCCCC(CC)COC(=O)C(C)=C","InChI=1S/C12H22O2/c1-5-7-8-11(6-2)9-14-12(13)10(3)4/h11H,3,5-9H2,1-2,4H3","WDQMWEYDKDCEHT-UHFFFAOYSA-N"
"CCCOCCO","InChI=1S/C5H12O2/c1-2-4-7-5-3-6/h6H,2-5H2,1H3","YEYKMVJDLWJFOA-UHFFFAOYSA-N"
"CC(=C)c(c1)cccc1","InChI=1S/C9H10/c1-8(2)9-6-4-3-5-7-9/h3-7H,1H2,2H3","XYLMUPLGERFSHI-UHFFFAOYSA-N"
"CCOCCOCC","InChI=1S/C6H14O2/c1-3-7-5-6-8-4-2/h3-6H2,1-2H3","LZDKZFUFMNSQCJ-UHFFFAOYSA-N"
"COCCOC(C)=O","InChI=1S/C5H10O3/c1-5(6)8-4-3-7-2/h3-4H2,1-2H3","XLLIQLLCWZCATF-UHFFFAOYSA-N"
"CCOCCOC(C)=O","InChI=1S/C6H12O3/c1-3-8-4-5-9-6(2)7/h3-5H2,1-2H3","SVONRAPFKPVNKG-UHFFFAOYSA-N"
"Cc(c1)cncc1","InChI=1S/C6H7N/c1-6-3-2-4-7-5-6/h2-5H,1H3","ITQTTZVARXURQS-UHFFFAOYSA-N"
"CCC#N","InChI=1S/C3H5N/c1-2-3-4/h2H2,1H3","FVSKHRXBFJPNKK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)C(=O)Cl","InChI=1S/C7H4ClNO3/c8-7(10)5-1-3-6(4-2-5)9(11)12/h1-4H","SKDHHIUENRGTHK-UHFFFAOYSA-N"
"O=c(o1)c(c2)c(ccc2)c(=O)1","InChI=1S/C8H4O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4H","LGRFSURHDFAFJT-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)c(ccc1)C(=O)OCCCC","InChI=1S/C16H22O4/c1-3-5-11-19-15(17)13-9-7-8-10-14(13)16(18)20-12-6-4-2/h7-10H,3-6,11-12H2,1-2H3","DOIRQSBPFJWKBE-UHFFFAOYSA-N"
"CCCCC(CC)COC(=O)c(c1)c(ccc1)C(=O)OCC(CC)CCCC","InChI=1S/C24H38O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,15-16,19-20H,5-10,13-14,17-18H2,1-4H3","BJQHLKABXJIVAM-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)c(c1)c(ccc1)C(=O)OCCCCCC","InChI=1S/C22H34O4/c1-3-5-7-9-10-14-18-26-22(24)20-16-12-11-15-19(20)21(23)25-17-13-8-6-4-2/h11-12,15-16H,3-10,13-14,17-18H2,1-2H3","LZCTXAGBGKLUBX-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)c(c1)c(ccc1)C(=O)OCCCCCCCC","InChI=1S/C24H38O4/c1-3-5-7-9-11-15-19-27-23(25)21-17-13-14-18-22(21)24(26)28-20-16-12-10-8-6-4-2/h13-14,17-18H,3-12,15-16,19-20H2,1-2H3","MQIUGAXCHLFZKX-UHFFFAOYSA-N"
"c(c1C(=O)OCCCCCCCCCC)(cccc1)C(=O)OCCCCCCCC","InChI=1S/C26H42O4/c1-3-5-7-9-11-12-14-18-22-30-26(28)24-20-16-15-19-23(24)25(27)29-21-17-13-10-8-6-4-2/h15-16,19-20H,3-14,17-18,21-22H2,1-2H3","LVAGMBHLXLZJKZ-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCC(=O)OC","InChI=1S/C12H22O4/c1-15-11(13)9-7-5-3-4-6-8-10-12(14)16-2/h3-10H2,1-2H3","ALOUNLDAKADEEB-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCCCCCC(=O)OCCCC","InChI=1S/C18H34O4/c1-3-5-15-21-17(19)13-11-9-7-8-10-12-14-18(20)22-16-6-4-2/h3-16H2,1-2H3","PYGXAGIECVVIOZ-UHFFFAOYSA-N"
"CCCCC(CC)COC(=O)CCCCCCCCC(=O)OCC(CC)CCCC","InChI=1S/C26H50O4/c1-5-9-17-23(7-3)21-29-25(27)19-15-13-11-12-14-16-20-26(28)30-22-24(8-4)18-10-6-2/h23-24H,5-22H2,1-4H3","VJHINFRRDQUWOJ-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCC(=O)OCCCC","InChI=1S/C14H26O4/c1-3-5-11-17-13(15)9-7-8-10-14(16)18-12-6-4-2/h3-12H2,1-2H3","XTJFFFGAUHQWII-UHFFFAOYSA-N"
"CCCCC(CC)COC(=O)CCCCC(=O)OCC(CC)CCCC","InChI=1S/C22H42O4/c1-5-9-13-19(7-3)17-25-21(23)15-11-12-16-22(24)26-18-20(8-4)14-10-6-2/h19-20H,5-18H2,1-4H3","SAOKZLXYCUGLFA-UHFFFAOYSA-N"
"COC(=O)CCCCCC(=O)OC","InChI=1S/C9H16O4/c1-12-8(10)6-4-3-5-7-9(11)13-2/h3-7H2,1-2H3","SHWINQXIGSEZAP-UHFFFAOYSA-N"
"COC(=O)CCCCCCC(=O)OC","InChI=1S/C10H18O4/c1-13-9(11)7-5-3-4-6-8-10(12)14-2/h3-8H2,1-2H3","LNLCRJXCNQABMV-UHFFFAOYSA-N"
"COC(=O)CCCCCCCC(=O)OC","InChI=1S/C11H20O4/c1-14-10(12)8-6-4-3-5-7-9-11(13)15-2/h3-9H2,1-2H3","DRUKNYVQGHETPO-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCC(=O)OC","InChI=1S/C13H24O4/c1-16-12(14)10-8-6-4-3-5-7-9-11-13(15)17-2/h3-11H2,1-2H3","LADJFIHHYMBJHB-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCC(=O)OC","InChI=1S/C14H26O4/c1-17-13(15)11-9-7-5-3-4-6-8-10-12-14(16)18-2/h3-12H2,1-2H3","IZMOTZDBVPMOFE-UHFFFAOYSA-N"
"CCCCOC(=O)CC(O)(CC(=O)OCCCC)C(=O)OCCCC","InChI=1S/C18H32O7/c1-4-7-10-23-15(19)13-18(22,17(21)25-12-9-6-3)14-16(20)24-11-8-5-2/h22H,4-14H2,1-3H3","ZFOZVQLOBQUTQQ-UHFFFAOYSA-N"
"CCCCOC(=O)CC(OC(C)=O)(CC(=O)OCCCC)C(=O)OCCCC","InChI=1S/C20H34O8/c1-5-8-11-25-17(22)14-20(28-16(4)21,19(24)27-13-10-7-3)15-18(23)26-12-9-6-2/h5-15H2,1-4H3","QZCLKYGREBVARF-UHFFFAOYSA-N"
"CCCCOC(=O)CC(C(=O)OCCCC)=C([H])C(=O)OCCCC","InChI=1S/C18H30O6/c1-4-7-10-22-16(19)13-15(18(21)24-12-9-6-3)14-17(20)23-11-8-5-2/h13H,4-12,14H2,1-3H3/b15-13+","BANLNYYTSYHBAP-FYWRMAATSA-N"
"CCCCOC(=O)CC(CC(=O)OCCCC)C(=O)OCCCC","InChI=1S/C18H32O6/c1-4-7-10-22-16(19)13-15(18(21)24-12-9-6-3)14-17(20)23-11-8-5-2/h15H,4-14H2,1-3H3","HNICOURSUYWHPJ-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCCC(=O)OCCCC","InChI=1S/C15H28O4/c1-3-5-12-18-14(16)10-8-7-9-11-15(17)19-13-6-4-2/h3-13H2,1-2H3","IQYKLRJIMOPPKB-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCCCC(=O)OCCCC","InChI=1S/C16H30O4/c1-3-5-13-19-15(17)11-9-7-8-10-12-16(18)20-14-6-4-2/h3-14H2,1-2H3","LBXQUCHUHCBNTC-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCCCCC(=O)OCCCC","InChI=1S/C17H32O4/c1-3-5-14-20-16(18)12-10-8-7-9-11-13-17(19)21-15-6-4-2/h3-15H2,1-2H3","RISLXYINQFKFRL-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCCCCCCC(=O)OCCCC","InChI=1S/C19H36O4/c1-3-5-16-22-18(20)14-12-10-8-7-9-11-13-15-19(21)23-17-6-4-2/h3-17H2,1-2H3","MSFKNLZQTPJTLY-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCCCCCCCC(=O)OCCCC","InChI=1S/C20H38O4/c1-3-5-17-23-19(21)15-13-11-9-7-8-10-12-14-16-20(22)24-18-6-4-2/h3-18H2,1-2H3","PYWJUJAIGZXCMW-UHFFFAOYSA-N"
"CCCCOC(=O)CCCCCCCCCCCC(=O)OCCCC","InChI=1S/C21H40O4/c1-3-5-18-24-20(22)16-14-12-10-8-7-9-11-13-15-17-21(23)25-19-6-4-2/h3-19H2,1-2H3","VFGWOKLWEAJYNL-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCC(=O)OCCCCCC","InChI=1S/C18H34O4/c1-3-5-7-11-15-21-17(19)13-9-10-14-18(20)22-16-12-8-6-4-2/h3-16H2,1-2H3","HHECSPXBQJHZAF-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCCC(=O)OCCCCCC","InChI=1S/C19H36O4/c1-3-5-7-12-16-22-18(20)14-10-9-11-15-19(21)23-17-13-8-6-4-2/h3-17H2,1-2H3","IVDOEOOGJHETHB-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCCCC(=O)OCCCCCC","InChI=1S/C20H38O4/c1-3-5-7-13-17-23-19(21)15-11-9-10-12-16-20(22)24-18-14-8-6-4-2/h3-18H2,1-2H3","SZHOZZSBXPUVHJ-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCCCCC(=O)OCCCCCC","InChI=1S/C21H40O4/c1-3-5-7-14-18-24-20(22)16-12-10-9-11-13-17-21(23)25-19-15-8-6-4-2/h3-19H2,1-2H3","MJOKHGMXPJXFTG-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCCCCCCC(=O)OCCCCCC","InChI=1S/C23H44O4/c1-3-5-7-16-20-26-22(24)18-14-12-10-9-11-13-15-19-23(25)27-21-17-8-6-4-2/h3-21H2,1-2H3","PPIZSURHTCDRRT-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCCCCCCCC(=O)OCCCCCC","InChI=1S/C24H46O4/c1-3-5-7-17-21-27-23(25)19-15-13-11-9-10-12-14-16-20-24(26)28-22-18-8-6-4-2/h3-22H2,1-2H3","SPTBNOJZNIWTFY-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCCCCCCCCC(=O)OCCCCCC","InChI=1S/C25H48O4/c1-3-5-7-18-22-28-24(26)20-16-14-12-10-9-11-13-15-17-21-25(27)29-23-19-8-6-4-2/h3-23H2,1-2H3","JHXYDMXNJPPANJ-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCCCCCC(=O)OCCCCCC","InChI=1S/C22H42O4/c1-3-5-7-15-19-25-21(23)17-13-11-9-10-12-14-18-22(24)26-20-16-8-6-4-2/h3-20H2,1-2H3","GQIDSVPVVYHXAP-UHFFFAOYSA-N"
"CCCCOC(=O)c(c2)c(ccc2)C(=O)OCc(c1)cccc1","InChI=1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3","IRIAEXORFWYRCZ-UHFFFAOYSA-N"
"CCCCOC(=O)COC(=O)c(c1)c(ccc1)C(=O)OCCCC","InChI=1S/C18H24O6/c1-3-5-11-22-16(19)13-24-18(21)15-10-8-7-9-14(15)17(20)23-12-6-4-2/h7-10H,3-6,11-13H2,1-2H3","GOJCZVPJCKEBQV-UHFFFAOYSA-N"
"CCOC(=O)c(c1)c(ccc1)C(=O)OCC","InChI=1S/C12H14O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h5-8H,3-4H2,1-2H3","FLKPEMZONWLCSK-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C13H16O4/c1-3-4-9-17-13(15)11-8-6-5-7-10(11)12(14)16-2/h5-8H,3-4,9H2,1-2H3","XXFSYINDUHLBIL-UHFFFAOYSA-N"
"CCCCC(CC)COC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C17H24O4/c1-4-6-9-13(5-2)12-21-17(19)15-11-8-7-10-14(15)16(18)20-3/h7-8,10-11,13H,4-6,9,12H2,1-3H3","MQYNKBGLFNKJPL-UHFFFAOYSA-N"
"CCCCCCOC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C15H20O4/c1-3-4-5-8-11-19-15(17)13-10-7-6-9-12(13)14(16)18-2/h6-7,9-10H,3-5,8,11H2,1-2H3","XXLNRTDEQNSKEZ-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C17H24O4/c1-3-4-5-6-7-10-13-21-17(19)15-12-9-8-11-14(15)16(18)20-2/h8-9,11-12H,3-7,10,13H2,1-2H3","SJMMDRTYFFDPBJ-UHFFFAOYSA-N"
"CCCCCCCCCCOC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C19H28O4/c1-3-4-5-6-7-8-9-12-15-23-19(21)17-14-11-10-13-16(17)18(20)22-2/h10-11,13-14H,3-9,12,15H2,1-2H3","OXRWHMFJAPZSRT-UHFFFAOYSA-N"
"c(c3)ccc(c3)COC(=O)c(c2)c(ccc2)C(=O)OCc(c1)cccc1","InChI=1S/C22H18O4/c23-21(25-15-17-9-3-1-4-10-17)19-13-7-8-14-20(19)22(24)26-16-18-11-5-2-6-12-18/h1-14H,15-16H2","UCVPKAZCQPRWAY-UHFFFAOYSA-N"
"CCOC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C11H12O4/c1-3-15-11(13)9-7-5-4-6-8(9)10(12)14-2/h4-7H,3H2,1-2H3","HGERXYZHJFOFNE-UHFFFAOYSA-N"
"COC(=O)c(c2)c(ccc2)C(=O)OCc(c1)cccc1","InChI=1S/C16H14O4/c1-19-15(17)13-9-5-6-10-14(13)16(18)20-11-12-7-3-2-4-8-12/h2-10H,11H2,1H3","AKKMBTJVARDPMB-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OCCCC","InChI=1S/C20H40O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20(21)22-19-6-4-2/h3-19H2,1-2H3","GLYJVQDYLFAUFC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCCCC","InChI=1S/C22H44O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21-6-4-2/h3-21H2,1-2H3","ULBTUVJTXULMLP-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)OCCCC","InChI=1S/C24H48O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(25)26-23-6-4-2/h3-23H2,1-2H3","WZRBMKGXBAVSQL-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCC","InChI=1S/C26H52O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26(27)28-25-6-4-2/h3-25H2,1-2H3","SLUTZBDOCDXRSH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCCCC","InChI=1S/C28H56O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28(29)30-27-6-4-2/h3-27H2,1-2H3","AKFTUIYQTXLHIH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OCCCCCC","InChI=1S/C22H44O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-20-22(23)24-21-19-8-6-4-2/h3-21H2,1-2H3","IOVYZELOJXWQKD-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCCCCCC","InChI=1S/C24H48O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-22-24(25)26-23-21-8-6-4-2/h3-23H2,1-2H3","SMWDEDPRQFUXNH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)OCCCCCC","InChI=1S/C26H52O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-26(27)28-25-23-8-6-4-2/h3-25H2,1-2H3","MPLBHUPXLJXOLF-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)OCCCCCC","InChI=1S/C28H56O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26-28(29)30-27-25-8-6-4-2/h3-27H2,1-2H3","SZHHTCPIUIMTIX-UHFFFAOYSA-N"
"C(CCCCCCCCCCCCCCCCCCC(=O)OCCCCCC)CCCC","InChI=1S/C30H60O2/c1-3-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-28-30(31)32-29-27-8-6-4-2/h3-29H2,1-2H3","MSAXLBRULWLEJE-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCC(=O)OCCCC","InChI=1S/C22H42O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(23)24-21-6-4-2/h12-13H,3-11,14-21H2,1-2H3/b13-12-","WIBFFTLQMKKBLZ-SEYXRHQNSA-N"
"N#Cc(c1)cc(cc1)C(=O)OCC(C)C","InChI=1S/C12H13NO2/c1-9(2)8-15-12(14)11-5-3-4-10(6-11)7-13/h3-6,9H,8H2,1-2H3","WYLBZEVZADZBKE-UHFFFAOYSA-N"
"CC(C)COC(=O)c(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C11H13NO4/c1-8(2)7-16-11(13)9-4-3-5-10(6-9)12(14)15/h3-6,8H,7H2,1-2H3","XGXZBLXZWJRBCZ-UHFFFAOYSA-N"
"COc(c1)cc(cc1)C(=O)OCC(C)C","InChI=1S/C12H16O3/c1-9(2)8-15-12(13)10-5-4-6-11(7-10)14-3/h4-7,9H,8H2,1-3H3","YMOAQFMEIBYZJW-UHFFFAOYSA-N"
"N#Cc(c1)ccc(c1)C(=O)OC(C([2H])([2H])[2H])C([2H])([2H])[2H]","InChI=1S/C11H11NO2/c1-8(2)14-11(13)10-5-3-9(7-12)4-6-10/h3-6,8H,1-2H3/i1D3,2D3","NFNBGZCLCQVHRY-WFGJKAKNSA-N"
"C(C1)COC1","InChI=1S/C4H8O/c1-2-4-5-3-1/h1-4H2","WYURNTSHIVDZCO-UHFFFAOYSA-N"
"N#Cc(c1)ccc(c1)C(=O)OC(C)C","InChI=1S/C11H11NO2/c1-8(2)14-11(13)10-5-3-9(7-12)4-6-10/h3-6,8H,1-2H3","NFNBGZCLCQVHRY-UHFFFAOYSA-N"
"CCC(N)CO","InChI=1S/C4H11NO/c1-2-4(5)3-6/h4,6H,2-3,5H2,1H3","JCBPETKZIGVZRE-UHFFFAOYSA-N"
"CCC(C)=O","InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3","ZWEHNKRNPOVVGH-UHFFFAOYSA-N"
"CC(C)CC(=O)CC(C)C","InChI=1S/C9H18O/c1-7(2)5-9(10)6-8(3)4/h7-8H,5-6H2,1-4H3","PTTPXKJBFFKCEK-UHFFFAOYSA-N"
"O=C(C1)OCC1","InChI=1S/C4H6O2/c5-4-2-1-3-6-4/h1-3H2","YEJRWHAVMIAJKC-UHFFFAOYSA-N"
"CCC(O)CO","InChI=1S/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3","BMRWNKZVCUKKSR-UHFFFAOYSA-N"
"CN(C)C(C)=O","InChI=1S/C4H9NO/c1-4(6)5(2)3/h1-3H3","FXHOOIRPVKKKFG-UHFFFAOYSA-N"
"CC(C)C(C)O","InChI=1S/C5H12O/c1-4(2)5(3)6/h4-6H,1-3H3","MXLMTQWGSQIYOW-UHFFFAOYSA-N"
"CC(C)CC(C)O","InChI=1S/C6H14O/c1-5(2)4-6(3)7/h5-7H,4H2,1-3H3","WVYWICLMDOOCFB-UHFFFAOYSA-N"
"CC(C)CC(=O)c(c1)cccc1","InChI=1S/C11H14O/c1-9(2)8-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","HEOVGVNITGAUKL-UHFFFAOYSA-N"
"COc(c1)c(N)ccc1","InChI=1S/C7H9NO/c1-9-7-5-3-2-4-6(7)8/h2-5H,8H2,1H3","VMPITZXILSNTON-UHFFFAOYSA-N"
"CCCCOC(=O)C([H])=C([H])C","InChI=1S/C8H14O2/c1-3-5-7-10-8(9)6-4-2/h4,6H,3,5,7H2,1-2H3/b6-4+","GWCTUKHUBWMAMI-GQCTYLIASA-N"
"CCCCCl","InChI=1S/C4H9Cl/c1-2-3-4-5/h2-4H2,1H3","VFWCMGCRMGJXDK-UHFFFAOYSA-N"
"C(C2)CCC(C2)NC(C1)CCCC1","InChI=1S/C12H23N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h11-13H,1-10H2","XBPCUCUWBYBCDP-UHFFFAOYSA-N"
"CCCCOC(=O)C(C)O","InChI=1S/C7H14O3/c1-3-4-5-10-7(9)6(2)8/h6,8H,3-5H2,1-2H3","MRABAEUHTLLEML-UHFFFAOYSA-N"
"CCCCOC(=O)CCC","InChI=1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3","XUPYJHCZDLZNFP-UHFFFAOYSA-N"
"COc(c1)cccc1","InChI=1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3","RDOXTESZEPMUJZ-UHFFFAOYSA-N"
"COC(=O)CC(=O)OC","InChI=1S/C5H8O4/c1-8-4(6)3-5(7)9-2/h3H2,1-2H3","BEPAFCGSDWSTEL-UHFFFAOYSA-N"
"CC(O)CCC(C)O","InChI=1S/C6H14O2/c1-5(7)3-4-6(2)8/h5-8H,3-4H2,1-2H3","OHMBHFSEKCCCBW-UHFFFAOYSA-N"
"COC(=O)CCC(=O)OC","InChI=1S/C6H10O4/c1-9-5(7)3-4-6(8)10-2/h3-4H2,1-2H3","MUXOBHXGJLMRAB-UHFFFAOYSA-N"
"COc(c1)ccc(N)c1","InChI=1S/C7H9NO/c1-9-7-4-2-6(8)3-5-7/h2-5H,8H2,1H3","BHAAPTBBJKJZER-UHFFFAOYSA-N"
"COC(=O)CCCCC(=O)OC","InChI=1S/C8H14O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-6H2,1-2H3","UDSFAEKRVUSQDD-UHFFFAOYSA-N"
"COC(=O)CCCC(=O)OC","InChI=1S/C7H12O4/c1-10-6(8)4-3-5-7(9)11-2/h3-5H2,1-2H3","XTDYIOOONNVFMA-UHFFFAOYSA-N"
"NCCO","InChI=1S/C2H7NO/c3-1-2-4/h4H,1-3H2","HZAXFHJVJLSVMW-UHFFFAOYSA-N"
"OCCCCO","InChI=1S/C4H10O2/c5-3-1-2-4-6/h5-6H,1-4H2","WERYXYBDKMZEQL-UHFFFAOYSA-N"
"OCCCCCO","InChI=1S/C5H12O2/c6-4-2-1-3-5-7/h6-7H,1-5H2","ALQSHHUCVQOPAS-UHFFFAOYSA-N"
"OCCCO","InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2","YPFDHNVEDLHUCE-UHFFFAOYSA-N"
"COC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3","NIQCNGHVCWTJSM-UHFFFAOYSA-N"
"CCCCCCCCCCCOC(=O)c(c1)cccc1","InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-13-16-20-18(19)17-14-11-10-12-15-17/h10-12,14-15H,2-9,13,16H2,1H3","YEHGKFOTJWYCBN-UHFFFAOYSA-N"
"CCCCCCCCCOC(=O)c(c1)cccc1","InChI=1S/C16H24O2/c1-2-3-4-5-6-7-11-14-18-16(17)15-12-9-8-10-13-15/h8-10,12-13H,2-7,11,14H2,1H3","VUHMHACHBVTPMF-UHFFFAOYSA-N"
"OCC(C)O","InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3","DNIAPMSPPWPWGF-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(c1)C(=O)OC","InChI=1S/C10H10O4/c1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h3-6H,1-2H3","WOZVHXUHUFLZGK-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(cc1)C(=O)OC","InChI=1S/C10H10O4/c1-13-9(11)7-4-3-5-8(6-7)10(12)14-2/h3-6H,1-2H3","VNGOYPQMJFJDLV-UHFFFAOYSA-N"
"CCCCNCCCC","InChI=1S/C8H19N/c1-3-5-7-9-8-6-4-2/h9H,3-8H2,1-2H3","JQVDAXLFBXTEQA-UHFFFAOYSA-N"
"CC(N)=O","InChI=1S/C2H5NO/c1-2(3)4/h1H3,(H2,3,4)","DLFVBJFMPXGRIB-UHFFFAOYSA-N"
"CCCCCC(C)C","InChI=1S/C8H18/c1-4-5-6-7-8(2)3/h8H,4-7H2,1-3H3","JVSWJIKNEAIKJW-UHFFFAOYSA-N"
"CCCC(C)C","InChI=1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3","AFABGHUZZDYHJO-UHFFFAOYSA-N"
"CCCC(O)=O","InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)","FERIUCNNQQJTOY-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC(=O)N(C1)CCC1","InChI=1S/C21H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21(23)22-19-16-17-20-22/h2-20H2,1H3","HGOPYGUCWZFCID-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)N(C1)CCC1","InChI=1S/C22H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h2-21H2,1H3","AEBDOCOLSSICMC-UHFFFAOYSA-N"
"CCCCCCCCC([H])=C([H])CCCCCCCC(=O)N(C1)CCC1","InChI=1S/C22H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h9-10H,2-8,11-21H2,1H3/b10-9-","KEMZFVSIIGZOCH-KTKRTIGZSA-N"
"CCCCCCCCCCCCCCC(C)C(=O)OC","InChI=1S/C18H36O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)18(19)20-3/h17H,4-16H2,1-3H3","OAMQXAKDCJRWHE-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(O)CC","InChI=1S/C15H32O/c1-3-5-6-7-8-9-10-11-12-13-14-15(16)4-2/h15-16H,3-14H2,1-2H3","WVZVEGVDRAOXNT-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(=O)CC","InChI=1S/C15H30O/c1-3-5-6-7-8-9-10-11-12-13-14-15(16)4-2/h3-14H2,1-2H3","YELXTWKVTZTDCM-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCCCCO","InChI=1S/C20H40O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21/h9-10,21H,2-8,11-20H2,1H3/b10-9+","QYOZAXQSDUAPDS-MDZDMXLPSA-N"
"C(CCCCCCCC(OCCCCCCCCCCCCCCCCCC)=O)CCCCCCC","InChI=1S/C34H68O2/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-36-34(35)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h3-33H2,1-2H3","BILPUZXRUDPOOF-UHFFFAOYSA-N"
"","InChI=1S/C30H54O2Si/c1-20(2)10-9-11-21(3)24-12-13-25-23-18-27-30(31-27)19-22(32-33(6,7)8)14-17-29(30,5)26(23)15-16-28(24,25)4/h20-27H,9-19H2,1-8H3/t21-,22+,23+,24-,25+,26+,27+,28-,29-,30+/m1/s1","AZHUYKSUWGBLAU-ROMNCUSUSA-N"
"","InChI=1S/C25H40O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-21,26H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20+,21+,24+,25-/m1/s1/i14D2","BNXKKGNFJUFIND-XGZZKPOLSA-N"
"CCCCCCCCCCCCCCCC(O)CC(=O)OCC","InChI=1S/C20H40O3/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19(21)18-20(22)23-4-2/h19,21H,3-18H2,1-2H3","BXRPWBZYLZSTNL-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C22H46O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22(23)24-2)25-26(3,4)5/h21H,6-20H2,1-5H3","MPVPFICBAYSSLQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C23H48O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23(24)25-2)26-27(3,4)5/h22H,6-21H2,1-5H3","VMAQKURDBISNDM-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C24H50O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24(25)26-2)27-28(3,4)5/h23H,6-22H2,1-5H3","AIDIPDFVXORXLT-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C25H52O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25(26)27-2)28-29(3,4)5/h24H,6-23H2,1-5H3","KAWPRWNCFLMHOR-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C26H54O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26(27)28-2)29-30(3,4)5/h25H,6-24H2,1-5H3","QSSVMTKWPPSPAQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C27H56O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(27(28)29-2)30-31(3,4)5/h26H,6-25H2,1-5H3","GRADXVJUAVCNHF-UHFFFAOYSA-N"
"C(CC(C(OC)=O)O[Si](C)(C)C)CCCCCCCCCCCCCCCCCCCC","InChI=1S/C28H58O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(28(29)30-2)31-32(3,4)5/h27H,6-26H2,1-5H3","IBDXNSNFZWQOOS-UHFFFAOYSA-N"
"","InChI=1S/C29H39F9O4/c1-15(4-9-22(39)42-23(27(30,31)32)28(33,34)35)19-7-8-20-18-6-5-16-14-17(41-24(40)29(36,37)38)10-12-25(16,2)21(18)11-13-26(19,20)3/h15-21,23H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20+,21+,25+,26-/m1/s1","QSMCWSQCJINJEC-WSWXKWDLSA-N"
"C(C(OC(C(F)(F)F)=O)3)(C(C(C(C4)(C3(CC(C4)OC(C(F)(F)F)=O)[H])C)2[H])(C(C1)(C(C)(CC2)C([H])(C1)C(CCC(=O)OC(C(F)(F)F)C(F)(F)F)([H])C)[H])[H])OC(C(F)(F)F)=O","InChI=1S/C33H37F15O8/c1-13(4-7-19(49)54-23(29(34,35)36)30(37,38)39)15-5-6-16-20-17(9-11-27(15,16)2)28(3)10-8-14(53-24(50)31(40,41)42)12-18(28)21(55-25(51)32(43,44)45)22(20)56-26(52)33(46,47)48/h13-18,20-23H,4-12H2,1-3H3/t13-,14-,15-,16+,17+,18+,20+,21-,22+,27-,28-/m1/s1","ZMQPGXCUJGKHOP-VEOIIIRKSA-N"
"","InChI=1S/C29H39F9O4/c1-15(4-9-22(39)42-23(27(30,31)32)28(33,34)35)19-7-8-20-18-6-5-16-14-17(41-24(40)29(36,37)38)10-12-25(16,2)21(18)11-13-26(19,20)3/h15-21,23H,4-14H2,1-3H3/t15-,16+,17+,18+,19-,20+,21+,25+,26-/m1/s1","QSMCWSQCJINJEC-MIRCAXOXSA-N"
"","InChI=1S/C31H38F12O6/c1-14(4-7-22(44)49-23(28(32,33)34)29(35,36)37)17-5-6-18-16-13-21(48-25(46)31(41,42)43)20-12-15(47-24(45)30(38,39)40)8-10-27(20,3)19(16)9-11-26(17,18)2/h14-21,23H,4-13H2,1-3H3/t14-,15-,16+,17-,18+,19+,20+,21+,26-,27-/m1/s1","KYEKUHZLTCKTMI-ZROIFKTNSA-N"
"C(C(OC(C(F)(F)F)=O)3)(C(C(C(C4)(C3(CC(C4)OC(C(F)(F)F)=O)[H])C)2[H])(C(C1)(C(C)(CC2)C([H])(C1)C(CCC(=O)OC(C(F)(F)F)C(F)(F)F)([H])C)[H])[H])OC(C(F)(F)F)=O","InChI=1S/C33H37F15O8/c1-13(4-7-19(49)54-23(29(34,35)36)30(37,38)39)15-5-6-16-20-17(9-11-27(15,16)2)28(3)10-8-14(53-24(50)31(40,41)42)12-18(28)21(55-25(51)32(43,44)45)22(20)56-26(52)33(46,47)48/h13-18,20-23H,4-12H2,1-3H3/t13-,14-,15-,16+,17+,18+,20+,21+,22-,27-,28-/m1/s1","ZMQPGXCUJGKHOP-UDFIMFMKSA-N"
"","InChI=1S/C31H38F12O6/c1-14(4-7-22(44)49-23(28(32,33)34)29(35,36)37)17-5-6-18-16-13-21(48-25(46)31(41,42)43)20-12-15(47-24(45)30(38,39)40)8-10-27(20,3)19(16)9-11-26(17,18)2/h14-21,23H,4-13H2,1-3H3/t14-,15-,16+,17-,18+,19+,20+,21-,26-,27-/m1/s1","KYEKUHZLTCKTMI-DKMDMZSLSA-N"
"C(C14)CC(C(CCC(C34)C(C)(C(=CC3)2)CCC(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)(C2)[H])1C)C(CCCC(C)C)C","InChI=1S/C31H45F7O2/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(13-15-27(20,4)25(22)14-16-28(23,24)5)40-26(39)29(32,33)30(34,35)31(36,37)38/h9,18-19,21-25H,6-8,10-17H2,1-5H3/t19-,21+,22?,23?,24?,25?,27+,28-/m1/s1","UGFHVHIEZCURFA-IINHWNONSA-N"
"C[Si](C)(C)OC([H])(C1)CCC(C([H])42)(C1=C([H])CC2(C(C3(C)CC4)([H])CCC3([H])C(C)CCCC(C)C)[H])C","InChI=1S/C30H54OSi/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(31-32(6,7)8)16-18-29(23,4)28(25)17-19-30(26,27)5/h12,21-22,24-28H,9-11,13-20H2,1-8H3/t22-,24+,25+,26-,27+,28+,29+,30-/m1/s1","CBVJJGRSRFXUPK-OCBUSCMESA-N"
"C(CC([H])(C)C(C)C)C(C(C4)(C(C)(C3(C4)[H])CCC([H])(C31[H])C(C2)(C(CC([H])(O[Si](C)(C)C)C2)=C([H])C1)C)[H])([H])C","InChI=1S/C31H56OSi/c1-21(2)22(3)10-11-23(4)27-14-15-28-26-13-12-24-20-25(32-33(7,8)9)16-18-30(24,5)29(26)17-19-31(27,28)6/h12,21-23,25-29H,10-11,13-20H2,1-9H3/t22-,23-,25+,26+,27-,28+,29+,30+,31-/m1/s1","VWYCDHUXOZENHE-MTJVUTKMSA-N"
"C(C4)C(CC(C34C)=C([H])CC(C23[H])(C(C1)([H])C(C)(CC2)C(C([H])(C)CCC(CC)([H])C(C)C)(C1)[H])[H])(O[Si](C)(C)C)[H]","InChI=1S/C32H58OSi/c1-10-24(22(2)3)12-11-23(4)28-15-16-29-27-14-13-25-21-26(33-34(7,8)9)17-19-31(25,5)30(27)18-20-32(28,29)6/h13,22-24,26-30H,10-12,14-21H2,1-9H3/t23-,24-,26+,27+,28-,29+,30+,31+,32-/m1/s1","XEWVATFZTBNDCF-BBWXUVGCSA-N"
"C(C([H])41)([H])(C(C)(C([H])3CC4)CCC(C3)([H])O)CCC(C)(C(C(C)CCCC(C)C)2)C1([H])CC2","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20+,21-,22+,23?,24+,25+,26+,27-/m1/s1","QYIXCDOBOSTCEI-FLWZNDCUSA-N"
"C(C(C([2H])([2H])[2H])([2H])CCCC(C)C(C1)C(C)(C4)C(C(C([H])2C4)([H])CCC([H])(C3)C2(C)CCC3([H])O)([H])C1)([2H])([2H])[2H]","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20+,21+,22+,23?,24+,25+,26+,27-/m1/s1/i1D3,2D3,18D","QYIXCDOBOSTCEI-ZIXNOYIFSA-N"
"COc(c3)cc(c(c3)2)C(C=N2)(C1)C(=C)N(C1)C(=O)C(F)(F)F","InChI=1S/C15H13F3N2O2/c1-9-14(5-6-20(9)13(21)15(16,17)18)8-19-12-4-3-10(22-2)7-11(12)14/h3-4,7-8H,1,5-6H2,2H3","RAEVVXJFQROQDJ-UHFFFAOYSA-N"
"C(C([H])41)([H])(C(C([H])3CC4)(C)CCCC3)CCC(C)(C(C(C)CCCC(C)C)2)C1([H])CC2","InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21-,22+,23?,24+,25+,26+,27-/m1/s1","XIIAYQZJNBULGD-GZHIZRLSSA-N"
"","InChI=1S/C27H44/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6,11-12,19-20,22-25H,7-10,13-18H2,1-5H3/t20-,22+,23-,24+,25+,26+,27-/m1/s1","RLHIRZFWJBOHHD-HKQCOZBKSA-N"
"","InChI=1S/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6,11,19-25H,7-10,12-18H2,1-5H3/t20-,21-,22+,23-,24+,25+,26+,27-/m1/s1","SFBMPHLOQAKIBY-XWLABEFZSA-N"
"O=C(C=Cc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C12H16O2Si/c1-15(2,3)14-12(13)10-9-11-7-5-4-6-8-11/h4-10H,1-3H3/b10-9+","HEVXLPBSUCJVAQ-MDZDMXLPSA-N"
"COc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C11H16O3Si/c1-13-10-7-5-9(6-8-10)11(12)14-15(2,3)4/h5-8H,1-4H3","AYGQUFGXOJWAHD-UHFFFAOYSA-N"
"O=C(CCC(C1)CCCC1)O[Si](C)(C)C","InChI=1S/C12H24O2Si/c1-15(2,3)14-12(13)10-9-11-7-5-4-6-8-11/h11H,4-10H2,1-3H3","VCAHYVCSQNXYQP-UHFFFAOYSA-N"
"CC(C)(C)c(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C14H22O2Si/c1-14(2,3)12-9-7-11(8-10-12)13(15)16-17(4,5)6/h7-10H,1-6H3","PLYFZJPAUGYADQ-UHFFFAOYSA-N"
"COc(c1)cc(cc1)C=CC(=O)O[Si](C)(C)C","InChI=1S/C13H18O3Si/c1-15-12-7-5-6-11(10-12)8-9-13(14)16-17(2,3)4/h5-10H,1-4H3/b9-8+","RGDYRMJCKDCLTE-CMDGGOBGSA-N"
"C[Si](C)(Cl)[Si](C)(C)Cl","InChI=1S/C4H12Cl2Si2/c1-7(2,5)8(3,4)6/h1-4H3","SFAZXBAPWCPIER-UHFFFAOYSA-N"
"CO[Si](OC)(OC)OC","InChI=1S/C4H12O4Si/c1-5-9(6-2,7-3)8-4/h1-4H3","LFQCEHFDDXELDD-UHFFFAOYSA-N"
"C[SiH](C)[SiH](C)C","InChI=1S/C4H14Si2/c1-5(2)6(3)4/h5-6H,1-4H3","RDWAGGBALVFUHB-UHFFFAOYSA-N"
"CC[SiH](C)CC","InChI=1S/C5H14Si/c1-4-6(3)5-2/h6H,4-5H2,1-3H3","UUTZEAQZDHSEAL-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)C","InChI=1S/C6H18Si2/c1-7(2,3)8(4,5)6/h1-6H3","NEXSMEBSBIABKL-UHFFFAOYSA-N"
"C[SiH2]c(c1)cccc1","InChI=1S/C7H10Si/c1-8-7-5-3-2-4-6-7/h2-6H,8H2,1H3","QRLBICHXRCOJDU-UHFFFAOYSA-N"
"CN(C)N=C(C1)CCC1","InChI=1S/C7H14N2/c1-9(2)8-7-5-3-4-6-7/h3-6H2,1-2H3","WEZHJSIEBKGPAO-UHFFFAOYSA-N"
"c(c1)ccc(c1)[Si](C)(C)Cl","InChI=1S/C8H11ClSi/c1-10(2,9)8-6-4-3-5-7-8/h3-7H,1-2H3","KWYZNESIGBQHJK-UHFFFAOYSA-N"
"C=CCCC(=O)C(C)(C)Br","InChI=1S/C8H13BrO/c1-4-5-6-7(10)8(2,3)9/h4H,1,5-6H2,2-3H3","AOWPRVPXYURVBN-UHFFFAOYSA-N"
"C=CC(=C)C[Si](C)(C)C","InChI=1S/C8H16Si/c1-6-8(2)7-9(3,4)5/h6H,1-2,7H2,3-5H3","JGVXFONXFYPFAK-UHFFFAOYSA-N"
"C[Si](C)(C)C#C[Si](C)(C)C","InChI=1S/C8H18Si2/c1-9(2,3)7-8-10(4,5)6/h1-6H3","ZDWYFWIBTZJGOR-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)[Si](C)(C)O1","InChI=1S/C9H12OSi/c1-11(2)9-6-4-3-5-8(9)7-10-11/h3-6H,7H2,1-2H3","GLZOQCBCUKBUJG-UHFFFAOYSA-N"
"C=C(C1)CCC(C)(C1)C(C)=O","InChI=1S/C10H16O/c1-8-4-6-10(3,7-5-8)9(2)11/h1,4-7H2,2-3H3","JSCQETDRSINWLO-UHFFFAOYSA-N"
"ClC[Si](C)(C)N(C)c(c1)cccc1","InChI=1S/C10H16ClNSi/c1-12(13(2,3)9-11)10-7-5-4-6-8-10/h4-8H,9H2,1-3H3","ALLAMHREESSLKW-UHFFFAOYSA-N"
"c(c1)ccc(c1)N(C)[Si](C)(C)C","InChI=1S/C10H17NSi/c1-11(12(2,3)4)10-8-6-5-7-9-10/h5-9H,1-4H3","LUZXFCNMHQMIBH-UHFFFAOYSA-N"
"FC(F)(F)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C10H27F3Si4/c1-14(2,3)17(10(11,12)13,15(4,5)6)16(7,8)9/h1-9H3","GLHNOPPKUIOCTF-UHFFFAOYSA-N"
"c(c2)ccc(c2)N=Nc(c1)cccc1","InChI=1S/C12H10N2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H/b14-13+","DMLAVOWQYNRWNQ-BUHFOSPRSA-N"
"c(c2)ccc(c2)[SiH2]c(c1)cccc1","InChI=1S/C12H12Si/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H,13H2","VDCSGNNYCFPWFK-UHFFFAOYSA-N"
"C=CC(=C)CC(C)(C)C(=O)C(C)C","InChI=1S/C12H20O/c1-7-10(4)8-12(5,6)11(13)9(2)3/h7,9H,1,4,8H2,2-3,5-6H3","SBYFNTNCYJALMR-UHFFFAOYSA-N"
"C=C(C1)CC(C)(C)C(=O)C(C)(C)C1","InChI=1S/C12H20O/c1-9-6-7-11(2,3)10(13)12(4,5)8-9/h1,6-8H2,2-5H3","WTVWRJYDHWAHLK-UHFFFAOYSA-N"
"ClC[Si](C)(C)N(c(c1)cccc1)[Si](C)(C)C","InChI=1S/C12H22ClNSi2/c1-15(2,3)14(16(4,5)11-13)12-9-7-6-8-10-12/h6-10H,11H2,1-5H3","LIFSXFXUFRZUAU-UHFFFAOYSA-N"
"C[Si](C)(C)[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C12H36Si5/c1-13(2,3)17(14(4,5)6,15(7,8)9)16(10,11)12/h1-12H3","BOJSDHZZKKYWAS-UHFFFAOYSA-N"
"CN(C)N=CC(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C13H26N2Si/c1-15(2)14-10-12-6-8-13(9-7-12)11-16(3,4)5/h8,10,12H,6-7,9,11H2,1-5H3/b14-10+","BXNPGGXMEZJXKR-GXDHUFHOSA-N"
"CC(=O)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C13H22OSi2/c1-11(14)12-7-9-13(10-8-12)16(5,6)15(2,3)4/h7-10H,1-6H3","RHZVIGVRZQHWGA-UHFFFAOYSA-N"
"CC(=O)C(C)(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C13H24OSi/c1-11(14)13(2)8-6-12(7-9-13)10-15(3,4)5/h6H,7-10H2,1-5H3","YIDRDQNBNNKTAA-UHFFFAOYSA-N"
"CC(C)(C)[Si](F)(F)C([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C14H36F2Si4/c1-13(2,3)20(15,16)14(17(4,5)6,18(7,8)9)19(10,11)12/h1-12H3","ZDCXZZOUTBYJPB-UHFFFAOYSA-N"
"C[Si](C)(C)C(O)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C15H30OSi3/c1-17(2,3)15(16)13-9-11-14(12-10-13)19(7,8)18(4,5)6/h9-12,15-16H,1-8H3","BFRCFBRSQSVTJZ-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(C(C)(C)C)c([Si](F)(F)F)c1C(C)(C)C","InChI=1S/C18H29F3Si/c1-16(2,3)12-10-13(17(4,5)6)15(22(19,20)21)14(11-12)18(7,8)9/h10-11H,1-9H3","ZVGWMROARPHAON-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(C(C)(C)C)c(c1C(C)(C)C)[Si](F)(F)C(C)(C)C","InChI=1S/C22H38F2Si/c1-19(2,3)15-13-16(20(4,5)6)18(17(14-15)21(7,8)9)25(23,24)22(10,11)12/h13-14H,1-12H3","QTOAVPZOPLUZID-UHFFFAOYSA-N"
"C=CCCC(=O)C(C)C","InChI=1S/C8H14O/c1-4-5-6-8(9)7(2)3/h4,7H,1,5-6H2,2-3H3","NJAYZISKWWQCJX-UHFFFAOYSA-N"
"C=CCC(C)(C)C(C)=O","InChI=1S/C8H14O/c1-5-6-8(3,4)7(2)9/h5H,1,6H2,2-4H3","AICKKCPBGSMRJG-UHFFFAOYSA-N"
"C=CC(=C)CCC(=O)C(C)C","InChI=1S/C10H16O/c1-5-9(4)6-7-10(11)8(2)3/h5,8H,1,4,6-7H2,2-3H3","IYFQOCPXUHQIMN-UHFFFAOYSA-N"
"C=CC(=C)CC(C)(C)C(C)=O","InChI=1S/C10H16O/c1-6-8(2)7-10(4,5)9(3)11/h6H,1-2,7H2,3-5H3","COQAKJCNHZRCGV-UHFFFAOYSA-N"
"C=CCC(C)(C)C(=O)C(C)C","InChI=1S/C10H18O/c1-6-7-10(4,5)9(11)8(2)3/h6,8H,1,7H2,2-5H3","UCARIABCKZAQBN-UHFFFAOYSA-N"
"CCC=CC(=C(C)C)O[Si](C)(C)C","InChI=1S/C11H22OSi/c1-7-8-9-11(10(2)3)12-13(4,5)6/h8-9H,7H2,1-6H3/b9-8+","XMLUNFLKLCCWQP-CMDGGOBGSA-N"
"C=CCC(C)(C)C(=C)O[Si](C)(C)C","InChI=1S/C11H22OSi/c1-8-9-11(3,4)10(2)12-13(5,6)7/h8H,1-2,9H2,3-7H3","SEIFSZWKKUPJQW-UHFFFAOYSA-N"
"C=CCC(C)(C)C(=C(C)C)O[Si](C)(C)C","InChI=1S/C13H26OSi/c1-9-10-13(4,5)12(11(2)3)14-15(6,7)8/h9H,1,10H2,2-8H3","HEERNIKATQJDAJ-UHFFFAOYSA-N"
"C[Si](C)(C)CC(C1)C(C)(C)C(=O)C(C)(C)1","InChI=1S/C13H26OSi/c1-12(2)8-10(9-15(5,6)7)13(3,4)11(12)14/h10H,8-9H2,1-7H3","QQGIKIMSAOMDCY-UHFFFAOYSA-N"
"C[Si](C)(C)CC(=C1)CC(C)(C)C(=O)C(C)(C)C1","InChI=1S/C15H28OSi/c1-14(2)9-8-12(11-17(5,6)7)10-15(3,4)13(14)16/h8H,9-11H2,1-7H3","IFNYFGDYSCEBQD-UHFFFAOYSA-N"
"C=CC(C[Si](C)(C)C)(C1)C(C)(C)C(=O)C(C)(C)1","InChI=1S/C15H28OSi/c1-9-15(11-17(6,7)8)10-13(2,3)12(16)14(15,4)5/h9H,1,10-11H2,2-8H3","HLDNWEJDMZLBMJ-UHFFFAOYSA-N"
"O=C(C(C)(C)1)C(C)(C)CC(=CC1)C[Sn](C)(C)C","InChI=1S/C12H19O.3CH3.Sn/c1-9-6-7-11(2,3)10(13)12(4,5)8-9;;;;/h6H,1,7-8H2,2-5H3;3*1H3;","HLYWPYLMMCZNEC-UHFFFAOYSA-N"
"C=CC[Si](C)(C)Cc(c1)cccc1","InChI=1S/C12H18Si/c1-4-10-13(2,3)11-12-8-6-5-7-9-12/h4-9H,1,10-11H2,2-3H3","MWHVQTOELUOXTM-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)[Si](C)(C)C","InChI=1S/C9H13NO2Si/c1-13(2,3)9-6-4-8(5-7-9)10(11)12/h4-7H,1-3H3","IJGJSNAIGBFOTK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(cc1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C11H19NO2Si2/c1-15(2,3)16(4,5)11-8-6-7-10(9-11)12(13)14/h6-9H,1-5H3","FCVHPSZRDHJMPG-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C11H19NO2Si2/c1-15(2,3)16(4,5)11-8-6-10(7-9-11)12(13)14/h6-9H,1-5H3","JBRHXSPSFSQEFQ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(cc1)[Si](C)(C)[Si](C)(C)[Si](C)(C)C","InChI=1S/C13H25NO2Si3/c1-17(2,3)19(6,7)18(4,5)13-10-8-9-12(11-13)14(15)16/h8-11H,1-7H3","FONSERSZTSBZOB-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)[Si](C)(C)C","InChI=1S/C13H25NO2Si3/c1-17(2,3)19(6,7)18(4,5)13-10-8-12(9-11-13)14(15)16/h8-11H,1-7H3","SFVPLOSWHJTENK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(cc1)[Si](C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C13H25NO2Si3/c1-17(2,3)19(7,18(4,5)6)13-10-8-9-12(11-13)14(15)16/h8-11H,1-7H3","IFUNCUBPOATDRW-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)[Si](C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C13H25NO2Si3/c1-17(2,3)19(7,18(4,5)6)13-10-8-12(9-11-13)14(15)16/h8-11H,1-7H3","NEEWTQVEDZXWHS-UHFFFAOYSA-N"
"CCOC(=O)C1=CC2=C(N1)C=C(C=C2)[N+](=O)[O-]","InChI=1S/C11H10N2O4/c1-2-17-11(14)10-5-7-3-4-8(13(15)16)6-9(7)12-10/h3-6,12H,2H2,1H3","SOMZLSPJSSDTAP-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC(=C2)C=O)C","InChI=1S/C11H11NO/c1-7-8(2)12-11-5-9(6-13)3-4-10(7)11/h3-6,12H,1-2H3","LVTRGCDDMKIQRG-UHFFFAOYSA-N"
"CC(=O)c(c1)c(c2)c(ccc2)n(C)1","InChI=1S/C11H11NO/c1-8(13)10-7-12(2)11-6-4-3-5-9(10)11/h3-7H,1-2H3","HYLFRICFKVJJOZ-UHFFFAOYSA-N"
"CC(=O)c(c1)n(C)c(c2)c(ccc2)1","InChI=1S/C11H11NO/c1-8(13)11-7-9-5-3-4-6-10(9)12(11)2/h3-7H,1-2H3","SVUKISNBRDNDMF-UHFFFAOYSA-N"
"CC1=C(C=C2C(=C(NC2=C1)C)C)[N+](=O)[O-]","InChI=1S/C11H12N2O2/c1-6-4-10-9(5-11(6)13(14)15)7(2)8(3)12-10/h4-5,12H,1-3H3","UOTLCGIMBYJWGC-UHFFFAOYSA-N"
"CC1=C(C=C2C(=C1)C(=C(N2)C)C)[N+](=O)[O-]","InChI=1S/C11H12N2O2/c1-6-4-9-7(2)8(3)12-10(9)5-11(6)13(14)15/h4-5,12H,1-3H3","CEMDATHNBYHTNE-UHFFFAOYSA-N"
"COc(c1)c([N+1]([O-1])=O)cc(n(C)2)c(cc(C)2)1","InChI=1S/C11H12N2O3/c1-7-4-8-5-11(16-3)10(13(14)15)6-9(8)12(7)2/h4-6H,1-3H3","SYTNQFPMEUPDRG-UHFFFAOYSA-N"
"CC1=C(NC2=CC(=C(C=C12)OC)[N+](=O)[O-])C","InChI=1S/C11H12N2O3/c1-6-7(2)12-9-5-10(13(14)15)11(16-3)4-8(6)9/h4-5,12H,1-3H3","ZLSBCSFIBGGDQS-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC(=C2OC)[N+](=O)[O-])C","InChI=1S/C11H12N2O3/c1-6-7(2)12-10-8(6)4-5-9(13(14)15)11(10)16-3/h4-5,12H,1-3H3","MRGJVNAKGRACSU-UHFFFAOYSA-N"
"CC1=C(NC2=CC(=C(C=C12)[N+](=O)[O-])OC)C","InChI=1S/C11H12N2O3/c1-6-7(2)12-9-5-11(16-3)10(13(14)15)4-8(6)9/h4-5,12H,1-3H3","WNIBLLMFJUFEAS-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC(=C2[N+](=O)[O-])OC)C","InChI=1S/C11H12N2O3/c1-6-7(2)12-10-8(6)4-5-9(16-3)11(10)13(14)15/h4-5,12H,1-3H3","QAOHBDPEVGQEAS-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC=C2OC)C","InChI=1S/C11H13NO/c1-7-8(2)12-11-9(7)5-4-6-10(11)13-3/h4-6,12H,1-3H3","QDRXDIHPWDIKRT-UHFFFAOYSA-N"
"COc(c2)cc(c1)c(c2)n(C)c(C)1","InChI=1S/C11H13NO/c1-8-6-9-7-10(13-3)4-5-11(9)12(8)2/h4-7H,1-3H3","FODAUNMFUIXBBO-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=C(C=C2)OC)C","InChI=1S/C11H13NO/c1-7-8(2)12-11-5-4-9(13-3)6-10(7)11/h4-6,12H,1-3H3","GZSTUEGIANKNTE-UHFFFAOYSA-N"
"CC(=O)N(C2)N=C(C(C)2)c(c1)nccc1","InChI=1S/C11H13N3O/c1-8-7-14(9(2)15)13-11(8)10-5-3-4-6-12-10/h3-6,8H,7H2,1-2H3","DBJNKVVVIZDDJW-UHFFFAOYSA-N"
"Cc(c2)ncc(c2)C(C1)=NN(C(C)=O)C1","InChI=1S/C11H13N3O/c1-8-3-4-10(7-12-8)11-5-6-14(13-11)9(2)15/h3-4,7H,5-6H2,1-2H3","MCDWTAVFEVBDOL-UHFFFAOYSA-N"
"C1=CC2=C(C(=C1)[N+](=O)[O-])NC3=C2C=C(C=C3)[N+](=O)[O-]","InChI=1S/C12H7N3O4/c16-14(17)7-4-5-10-9(6-7)8-2-1-3-11(15(18)19)12(8)13-10/h1-6,13H","MEFATMTVUAOEJH-UHFFFAOYSA-N"
"C1=CC2=C(C=C1[N+](=O)[O-])C3=C(N2)C=CC(=C3)[N+](=O)[O-]","InChI=1S/C12H7N3O4/c16-14(17)7-1-3-11-9(5-7)10-6-8(15(18)19)2-4-12(10)13-11/h1-6,13H","IARXLBTXILYASE-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C3=C(N2)C=CC(=C3)[N+](=O)[O-]","InChI=1S/C12H8N2O2/c15-14(16)8-5-6-12-10(7-8)9-3-1-2-4-11(9)13-12/h1-7,13H","ZYNHZTIMNJKVLK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)cc(c(n3)2)c(C1)c(cc2)N=C(C)1","InChI=1S/C12H9N3O2/c1-7-4-9-10-5-8(15(16)17)6-13-11(10)2-3-12(9)14-7/h2-3,5-6H,4H2,1H3","CVYXKRSWANJXDU-UHFFFAOYSA-N"
"Cc(c21)c(c3)c(ccc3)n(C=NC=C2)1","InChI=1S/C12H10N2/c1-9-10-4-2-3-5-12(10)14-8-13-7-6-11(9)14/h2-8H,1H3","FSBSZPYLKPMNDC-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)cc(c(C)1)c(c23)n(CC2)c(C)1","InChI=1S/C12H12N2O2/c1-7-8(2)13-4-3-9-5-10(14(15)16)6-11(7)12(9)13/h5-6H,3-4H2,1-2H3","SJIQRECQRDYYPG-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(N2)C(=CC=C3)Br","InChI=1S/C12H13BrN2/c1-7-5-11-9(6-14-7)8-3-2-4-10(13)12(8)15-11/h2-4,7,14-15H,5-6H2,1H3","IUQNYIYUFUHEIA-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(N2)C(=CC=C3)Cl","InChI=1S/C12H13ClN2/c1-7-5-11-9(6-14-7)8-3-2-4-10(13)12(8)15-11/h2-4,7,14-15H,5-6H2,1H3","AKTGQEFIXGTXKL-UHFFFAOYSA-N"
"Cc(n1)c(C)c(C)n(C)1","InChI=1S/C7H12N2/c1-5-6(2)8-9(4)7(5)3/h1-4H3","DUAZFYUNWBILMU-UHFFFAOYSA-N"
"CC(C)C(C1)=NCC1","InChI=1S/C7H13N/c1-6(2)7-4-3-5-8-7/h6H,3-5H2,1-2H3","QHOFHBIBSFDMDJ-UHFFFAOYSA-N"
"CCN(C1)C(C)CC1","InChI=1S/C7H15N/c1-3-8-6-4-5-7(8)2/h7H,3-6H2,1-2H3","JKNXMPSMAZUQMJ-UHFFFAOYSA-N"
"CC(C)C(C1)NCC1","InChI=1S/C7H15N/c1-6(2)7-4-3-5-8-7/h6-8H,3-5H2,1-2H3","UOADRGAJWNJVGC-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C=CN2","InChI=1S/C8H7N/c1-2-4-8-7(3-1)5-6-9-8/h1-6,9H","SIKJAQJRHWYJAI-UHFFFAOYSA-N"
"C=CCn(n1)c(C)c([H])c(C)1","InChI=1S/C8H12N2/c1-4-5-10-8(3)6-7(2)9-10/h4,6H,1,5H2,2-3H3","NXAGTQRRYZTDKV-UHFFFAOYSA-N"
"CC1=C(C(=NN1)C)CC=C","InChI=1S/C8H12N2/c1-4-5-8-6(2)9-10-7(8)3/h4H,1,5H2,2-3H3,(H,9,10)","QWUSIYGDHJDCEM-UHFFFAOYSA-N"
"CCCc(n1)c(CC)sc1","InChI=1S/C8H13NS/c1-3-5-7-8(4-2)10-6-9-7/h6H,3-5H2,1-2H3","RHMGQEGNNVLLDV-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)c(c1)noc1","InChI=1S/C9H6N2O3/c12-11(13)8-3-1-7(2-4-8)9-5-6-14-10-9/h1-6H","XXAAKZGOIOIOQB-UHFFFAOYSA-N"
"Clc(c2)nn(c2)c(c1)cccc1","InChI=1S/C9H7ClN2/c10-9-6-7-12(11-9)8-4-2-1-3-5-8/h1-7H","HWFSRRHSZVBHFW-UHFFFAOYSA-N"
"Clc(c2)cn(n2)c(c1)cccc1","InChI=1S/C9H7ClN2/c10-8-6-11-12(7-8)9-4-2-1-3-5-9/h1-7H","OAWHISBYSDFHHU-UHFFFAOYSA-N"
"Clc(c2)n(nc2)c(c1)cccc1","InChI=1S/C9H7ClN2/c10-9-6-7-11-12(9)8-4-2-1-3-5-8/h1-7H","OIYKQIJGNAJVOI-UHFFFAOYSA-N"
"c(c2)ccc(c2)n(c1)ncc1","InChI=1S/C9H8N2/c1-2-5-9(6-3-1)11-8-4-7-10-11/h1-8H","WITMXBRCQWOZPX-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=CC=NN2","InChI=1S/C9H8N2/c1-2-4-8(5-3-1)9-6-7-10-11-9/h1-7H,(H,10,11)","OEDUIFSDODUDRK-UHFFFAOYSA-N"
"C=CCc(c(C)1)c(C)n(C)n1","InChI=1S/C9H14N2/c1-5-6-9-7(2)10-11(4)8(9)3/h5H,1,6H2,2-4H3","YLBGZANVFWEKRE-UHFFFAOYSA-N"
"Cn(c1)c(cc1)C(C)(C)C","InChI=1S/C9H15N/c1-9(2,3)8-6-5-7-10(8)4/h5-7H,1-4H3","LTTLCYJYOPCRFI-UHFFFAOYSA-N"
"Cn(c1)cc(c1)C(C)(C)C","InChI=1S/C9H15N/c1-9(2,3)8-5-6-10(4)7-8/h5-7H,1-4H3","BEYQDADGJGDVGR-UHFFFAOYSA-N"
"CCCCn(n1)c(C)c([H])c(C)1","InChI=1S/C9H16N2/c1-4-5-6-11-9(3)7-8(2)10-11/h7H,4-6H2,1-3H3","CHDNZIRREFRIJW-UHFFFAOYSA-N"
"Cc(c2)nc(s2)c(c1)cccc1","InChI=1S/C10H9NS/c1-8-7-12-10(11-8)9-5-3-2-4-6-9/h2-7H,1H3","IPOHWQDCODUHTD-UHFFFAOYSA-N"
"Cc(c2)nn(c2)c(c1)cccc1","InChI=1S/C10H10N2/c1-9-7-8-12(11-9)10-5-3-2-4-6-10/h2-8H,1H3","RJXLUGSJEMSDPK-UHFFFAOYSA-N"
"Cc(c2)n(nc2)c(c1)cccc1","InChI=1S/C10H10N2/c1-9-7-8-11-12(9)10-5-3-2-4-6-10/h2-8H,1H3","GIPOQOUSJKAZMC-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C1)=NCC1","InChI=1S/C10H11N/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-3,5-6H,4,7-8H2","PQZAWZGYOZRUFT-UHFFFAOYSA-N"
"CC1=C(NC2=CC=CC=C12)C","InChI=1S/C10H11N/c1-7-8(2)11-10-6-4-3-5-9(7)10/h3-6,11H,1-2H3","PYFVEIDRTLBMHG-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CCN","InChI=1S/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2","APJYDQYYACXCRM-UHFFFAOYSA-N"
"Cc(c2)nn(c(C)2)c(c1)cccc1","InChI=1S/C11H12N2/c1-9-8-10(2)13(12-9)11-6-4-3-5-7-11/h3-8H,1-2H3","ULPMPUPEFBDQQA-UHFFFAOYSA-N"
"COc(n1)nccc1","InChI=1S/C5H6N2O/c1-8-5-6-3-2-4-7-5/h2-4H,1H3","YLZYSVYZMDJYOT-UHFFFAOYSA-N"
"COc(c1)cncn1","InChI=1S/C5H6N2O/c1-8-5-2-6-4-7-3-5/h2-4H,1H3","JIADELSANNMYFC-UHFFFAOYSA-N"
"Nc(n1)[n+1]([O-1])ccc1","InChI=1S/C4H5N3O/c5-4-6-2-1-3-7(4)8/h1-3H,(H2,5,6)","BAEWURLBOZSGIA-UHFFFAOYSA-N"
"CC(=O)c(c1)cncn1","InChI=1S/C6H6N2O/c1-5(9)6-2-7-4-8-3-6/h2-4H,1H3","COTYNDRSENVEFI-UHFFFAOYSA-N"
"CN(C)c(n1)nccc1","InChI=1S/C6H9N3/c1-9(2)6-7-4-3-5-8-6/h3-5H,1-2H3","OUMGIYIBWRLOAF-UHFFFAOYSA-N"
"CN(C)c(c1)cncn1","InChI=1S/C6H9N3/c1-9(2)6-3-7-5-8-4-6/h3-5H,1-2H3","JWVNPUBYKCSIKR-UHFFFAOYSA-N"
"COc(n1)ncc(C)c1","InChI=1S/C6H8N2O/c1-5-3-7-6(9-2)8-4-5/h3-4H,1-2H3","BCJLWYKGUBGKFP-UHFFFAOYSA-N"
"O=Cc(c(O)1)c(O)ncn1","InChI=1S/C5H4N2O3/c8-1-3-4(9)6-2-7-5(3)10/h1-2H,(H2,6,7,9,10)","LJMXTWXGOCCHQO-UHFFFAOYSA-N"
"COc(c1)cnc(OC)n1","InChI=1S/C6H8N2O2/c1-9-5-3-7-6(10-2)8-4-5/h3-4H,1-2H3","JCDHBXYIWAUNSH-UHFFFAOYSA-N"
"COc(n1)ncc(Cl)c1","InChI=1S/C5H5ClN2O/c1-9-5-7-2-4(6)3-8-5/h2-3H,1H3","GJNGJHZIOYFEOP-UHFFFAOYSA-N"
"CC(=O)C(=C(O)1)C(=O)NC=N1","InChI=1S/C6H6N2O3/c1-3(9)4-5(10)7-2-8-6(4)11/h2H,1H3,(H2,7,8,10,11)","PYJZBCIQPVBBPY-UHFFFAOYSA-N"
"N#CC(C(=O)1)=C(Cl)N=CN1","InChI=1S/C5H2ClN3O/c6-4-3(1-7)5(10)9-2-8-4/h2H,(H,8,9,10)","PEBPXXOYLASTAA-UHFFFAOYSA-N"
"COc(n1)ncc(c1)[N+1]([O-1])=O","InChI=1S/C5H5N3O3/c1-11-5-6-2-4(3-7-5)8(9)10/h2-3H,1H3","ZPUHFIFABZPKHA-UHFFFAOYSA-N"
"NC(=O)c(c(O)1)c(O)ncn1","InChI=1S/C5H5N3O3/c6-3(9)2-4(10)7-1-8-5(2)11/h1H,(H2,6,9)(H2,7,8,10,11)","RVVVQQNYGKCVMV-UHFFFAOYSA-N"
"CC(=O)C(=C(O)1)C(O)=NCN1","InChI=1S/C6H8N2O3/c1-3(9)4-5(10)7-2-8-6(4)11/h7,10H,2H2,1H3,(H,8,11)","SHGXAQVFSPSKPP-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(n1)nccc1","InChI=1S/C10H8N2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-8H","OXPDQFOKSZYEMJ-UHFFFAOYSA-N"
"CN(C)c(n1)ncc(Cl)c1","InChI=1S/C6H8ClN3/c1-10(2)6-8-3-5(7)4-9-6/h3-4H,1-2H3","NAMGQSSLAIYNCN-UHFFFAOYSA-N"
"CC(C2)N(C(=O)1)C(CC2)=NC=C1","InChI=1S/C9H12N2O/c1-7-3-2-4-8-10-6-5-9(12)11(7)8/h5-7H,2-4H2,1H3","HCJOGZBBWGQKGC-UHFFFAOYSA-N"
"CN(C)c(n1)ncc(c1)[N+1]([O-1])=O","InChI=1S/C6H8N4O2/c1-9(2)6-7-3-5(4-8-6)10(11)12/h3-4H,1-2H3","IFFZVNFNYKKNFB-UHFFFAOYSA-N"
"O=C(N1)NC(=O)C(=C1)C(C)(C)C","InChI=1S/C8H12N2O2/c1-8(2,3)5-4-9-7(12)10-6(5)11/h4H,1-3H3,(H2,9,10,11,12)","FFVVCDOCJNTZKL-UHFFFAOYSA-N"
"CCCCc(c1)cnc(C)c1","InChI=1S/C10H15N/c1-3-4-5-10-7-6-9(2)11-8-10/h6-8H,3-5H2,1-2H3","GSYSNSTWMPZEQK-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)nccc1","InChI=1S/C11H9N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-9H","VQGHOUODWALEFC-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)cncc1","InChI=1S/C11H9N/c1-2-5-10(6-3-1)11-7-4-8-12-9-11/h1-9H","HJKGBRPNSJADMB-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)ccnc1","InChI=1S/C11H9N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-9H","JVZRCNQLWOELDU-UHFFFAOYSA-N"
"c(c2)cnc(c2)c(c1)nccc1","InChI=1S/C10H8N2/c1-3-7-11-9(5-1)10-6-2-4-8-12-10/h1-8H","ROFVEXUMMXZLPA-UHFFFAOYSA-N"
"n(c2)ccc(c2)c(c1)ccnc1","InChI=1S/C10H8N2/c1-5-11-6-2-9(1)10-3-7-12-8-4-10/h1-8H","MWVTWFVJZLCBMC-UHFFFAOYSA-N"
"Oc(c1)nc(c2)c(ccc2)c(C)1","InChI=1S/C10H9NO/c1-7-6-10(12)11-9-5-3-2-4-8(7)9/h2-6H,1H3,(H,11,12)","APLVPBUBDFWWAD-UHFFFAOYSA-N"
"Cc(c2)nc(c1)c(c2)cc(O)c1","InChI=1S/C10H9NO/c1-7-2-3-8-6-9(12)4-5-10(8)11-7/h2-6,12H,1H3","USSQQASIZNTRAJ-UHFFFAOYSA-N"
"Cc(c1)nc(c(O)2)c(ccc2)c1","InChI=1S/C10H9NO/c1-7-5-6-8-3-2-4-9(12)10(8)11-7/h2-6,12H,1H3","NBYLBWHHTUWMER-UHFFFAOYSA-N"
"C#Cc(c1)cnc(c1)C(=O)OC","InChI=1S/C9H7NO2/c1-3-7-4-5-8(10-6-7)9(11)12-2/h1,4-6H,2H3","PGYCVRHIHIYNBF-UHFFFAOYSA-N"
"O=Cc(c1)ccc(O)c1","InChI=1S/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9H","RGHHSNMVTDWUBI-UHFFFAOYSA-N"
"O=C(C=1)C=CC(C)(O)C1","InChI=1S/C7H8O2/c1-7(9)4-2-6(8)3-5-7/h2-5,9H,1H3","MUBYTRYBVWQAKF-UHFFFAOYSA-N"
"OCCc(c1)ccc(OC)c1","InChI=1S/C9H12O2/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5,10H,6-7H2,1H3","AUWDOZOUJWEPBA-UHFFFAOYSA-N"
"OCCc(c1)cc(OC)c(OC)c1","InChI=1S/C10H14O3/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7,11H,5-6H2,1-2H3","SRQAJMUHZROVHW-UHFFFAOYSA-N"
"COc(c1)ccc(CCOC(C)=O)c1","InChI=1S/C11H14O3/c1-9(12)14-8-7-10-3-5-11(13-2)6-4-10/h3-6H,7-8H2,1-2H3","OBGXWJYYWCNXIT-UHFFFAOYSA-N"
"OCC(O)c(c1)cc(O)c(O)c1","InChI=1S/C8H10O4/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8-12H,4H2","MTVWFVDWRVYDOR-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(O2)c(C=CC(=O)2)1","InChI=1S/C11H10O4/c1-13-9-5-7-3-4-11(12)15-8(7)6-10(9)14-2/h3-6H,1-2H3","GUAFOGOEJLSQBT-UHFFFAOYSA-N"
"O=C(OCCC(O)(C3)CCC(C3)OC(=O)c(c2)cccc2)c(c1)cccc1","InChI=1S/C22H24O5/c23-20(17-7-3-1-4-8-17)26-16-15-22(25)13-11-19(12-14-22)27-21(24)18-9-5-2-6-10-18/h1-10,19,25H,11-16H2","NONMSTXNWTYWLX-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(CCOC(O2)C(O)C(O)C(O)C(CO)2)c1","InChI=1S/C16H24O8/c1-21-10-4-3-9(7-11(10)22-2)5-6-23-16-15(20)14(19)13(18)12(8-17)24-16/h3-4,7,12-20H,5-6,8H2,1-2H3","NKOSAPZFHNAXPP-UHFFFAOYSA-N"
"CC(=O)OCC(O1)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(OCCc(c2)ccc(O)c2)1","InChI=1S/C22H28O11/c1-12(23)29-11-18-19(30-13(2)24)20(31-14(3)25)21(32-15(4)26)22(33-18)28-10-9-16-5-7-17(27)8-6-16/h5-8,18-22,27H,9-11H2,1-4H3","UZIWUYYGCYEJFF-UHFFFAOYSA-N"
"COc(c2)ccc(c2)CCOC(O1)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(COC(C)=O)1","InChI=1S/C23H30O11/c1-13(24)30-12-19-20(31-14(2)25)21(32-15(3)26)22(33-16(4)27)23(34-19)29-11-10-17-6-8-18(28-5)9-7-17/h6-9,19-23H,10-12H2,1-5H3","QCGLDBJOIZTNGD-UHFFFAOYSA-N"
"O(C2OCCc(c3)cc(OC)c(OC)c3)C(C(C(C2O)O)OC(=O)C=Cc(c1)cc(OC)c(OC)c1)CO","InChI=1S/C27H34O11/c1-32-18-8-5-16(13-20(18)34-3)7-10-23(29)38-26-22(15-28)37-27(25(31)24(26)30)36-12-11-17-6-9-19(33-2)21(14-17)35-4/h5-10,13-14,22,24-28,30-31H,11-12,15H2,1-4H3/b10-7+","LZYWUAOYXKIXFZ-JXMROGBWSA-N"
"O(C2OCCc(c3)cc(OC)c(OC)c3)C(C(C(C2O)O)O)COC(=O)C=Cc(c1)cc(OC)c(OC)c1","InChI=1S/C27H34O11/c1-32-18-8-5-16(13-20(18)34-3)7-10-23(28)37-15-22-24(29)25(30)26(31)27(38-22)36-12-11-17-6-9-19(33-2)21(14-17)35-4/h5-10,13-14,22,24-27,29-31H,11-12,15H2,1-4H3/b10-7+","SSCNBXGVRXNOCP-JXMROGBWSA-N"
"O(CC(O3)C(C(C(C(OCCc(c4)ccc(c(OC)4)OC)3)O)O)OC(=O)C([H])=C([H])c(c2)cc(c(OC)c2)OC)C(C(O)1)OC(C(O)C(O)1)C","InChI=1S/C33H44O15/c1-17-26(35)27(36)29(38)33(46-17)45-16-24-31(48-25(34)11-8-18-6-9-20(40-2)22(14-18)42-4)28(37)30(39)32(47-24)44-13-12-19-7-10-21(41-3)23(15-19)43-5/h6-11,14-15,17,24,26-33,35-39H,12-13,16H2,1-5H3/b11-8+","CERZOTHONLEIEF-DHZHZOJOSA-N"
"C([H])(c(c4)cc(c(OC)c4)OC)=C([H])C(OC(C2CO)C(OC(C(O)3)OC(C)C(C(O)3)O)C(O)C(O2)OCCc(c1)cc(c(OC)c1)OC)=O","InChI=1S/C33H44O15/c1-17-26(36)27(37)28(38)33(45-17)48-31-29(39)32(44-13-12-19-7-10-21(41-3)23(15-19)43-5)46-24(16-34)30(31)47-25(35)11-8-18-6-9-20(40-2)22(14-18)42-4/h6-11,14-15,17,24,26-34,36-39H,12-13,16H2,1-5H3/b11-8+","XHBIBCHIAFJQBM-DHZHZOJOSA-N"
"O(C(C2O)OC(COC(C(=C(c(c4)cc(c(OC)c4)OC)[H])[H])=O)C(C2OC(O3)C(O)C(O)C(O)C(C)3)O)CCc(c1)cc(c(OC)c1)OC","InChI=1S/C33H44O15/c1-17-26(35)28(37)29(38)33(46-17)48-31-27(36)24(16-45-25(34)11-8-18-6-9-20(40-2)22(14-18)42-4)47-32(30(31)39)44-13-12-19-7-10-21(41-3)23(15-19)43-5/h6-11,14-15,17,24,26-33,35-39H,12-13,16H2,1-5H3/b11-8+","VSNJPCCOBFJULL-DHZHZOJOSA-N"
"C(OC)(C([H])(OC([H])(C3([H])OC)OC(C([H])(C([H])3OC)OC)([H])C)2)(C([H])(OC([H])(COC)C(OC)2[H])OCCc(c1)cc(OC)c(OC)c1)[H]","InChI=1S/C28H46O12/c1-16-21(32-5)23(34-7)25(35-8)28(38-16)40-24-22(33-6)20(15-29-2)39-27(26(24)36-9)37-13-12-17-10-11-18(30-3)19(14-17)31-4/h10-11,14,16,20-28H,12-13,15H2,1-9H3","PCHQTAASXLDCGM-UHFFFAOYSA-N"
"COc(c(OC)4)ccc(c4)CCOC(O1)C(C(OC(O2)C(C(C(C(CC(O3)C(C(C3)(OC)COC)OC)2)OC)OC)OC)C(C(CO)1)OC)OC","InChI=1S/C35H58O16/c1-37-18-35(46-10)19-48-24(32(35)45-9)16-23-26(40-4)28(42-6)30(43-7)34(49-23)51-29-27(41-5)25(17-36)50-33(31(29)44-8)47-14-13-20-11-12-21(38-2)22(15-20)39-3/h11-12,15,23-34,36H,13-14,16-19H2,1-10H3","QROCMEVIGXNSFG-UHFFFAOYSA-N"
"CC(=O)Oc(c3)ccc(c3)C(=C2)Oc(c1)c(C(=O)2)c(OC(C)=O)cc(OC(C)=O)1","InChI=1S/C21H16O8/c1-11(22)26-15-6-4-14(5-7-15)18-10-17(25)21-19(28-13(3)24)8-16(27-12(2)23)9-20(21)29-18/h4-10H,1-3H3","IVXFOQQPPONQTB-UHFFFAOYSA-N"
"CC(=O)Oc(c3)cc(O1)c(c(OC(C)=O)3)C(=O)C(OC(C)=O)=C1c(c2)cc(OC(C)=O)c(OC(C)=O)c2","InChI=1S/C25H20O12/c1-11(26)32-17-9-20(35-14(4)29)22-21(10-17)37-24(25(23(22)31)36-15(5)30)16-6-7-18(33-12(2)27)19(8-16)34-13(3)28/h6-10H,1-5H3","JQUHMSXLZZWRHU-UHFFFAOYSA-N"
"CC(C)=C(C(=O)1)CC([H])(C(=C)2)C(C)(CCC2)C1","InChI=1S/C15H22O/c1-10(2)12-8-13-11(3)6-5-7-15(13,4)9-14(12)16/h13H,3,5-9H2,1-2,4H3/t13-,15+/m0/s1","NKGSEACIYQINQJ-DZGCQCFKSA-N"
"O=c(o1)c(C)c(C2)c1=C([H])C(C)(C3)C([H])(C(=C)CC3)2","InChI=1S/C15H18O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h8,12H,1,4-7H2,2-3H3/t12-,15+/m0/s1","ZTVSGQPHMUYCRS-SWLSCSKDSA-N"
"O=C(O1)C(C)=C(C2)C([H])1CC(C)(C3)C([H])(C(=C)CC3)2","InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h12-13H,1,4-8H2,2-3H3/t12-,13-,15+/m0/s1","OQYBLUDOOFOBPO-KCQAQPDRSA-N"
"O=C(O1)C(C)=C(C2)C(O)1CC(C)(C3)C([H])(C(=C)CC3)2","InChI=1S/C15H20O3/c1-9-5-4-6-14(3)8-15(17)12(7-11(9)14)10(2)13(16)18-15/h11,17H,1,4-8H2,2-3H3/t11-,14+,15-/m0/s1","FBMORZZOJSDNRQ-GLQYFDAESA-N"
"C(C1)C([H])(O)CC(=C([H])4)C1(C([H])(C3([H])C4)CCC(C)(C23[H])C(CC2)([H])C(CCC([H])(CC)C(C)C)([H])C)C","InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1","KZJWDPNRJALLNS-VJSFXXLFSA-N"
"C(C2)C(C(C)(C)1)(C(C(C3)(C(C)(C(C5)(C)C([H])(C([H])(C4C(C)=C)C(C5)(C)CC4)C3)2)[H])(C)CCC1O)[H]","InChI=1S/C30H50O/c1-19(2)20-11-14-27(5)17-18-29(7)21(25(20)27)9-10-23-28(6)15-13-24(31)26(3,4)22(28)12-16-30(23,29)8/h20-25,31H,1,9-18H2,2-8H3/t20?,21-,22+,23-,24+,25-,27-,28+,29-,30-/m0/s1","MQYXUWHLBZFQQO-DWAGTTPDSA-N"
"Cc(c1)cc(N)cc1","InChI=1S/C7H9N/c1-6-3-2-4-7(8)5-6/h2-5H,8H2,1H3","JJYPMNFTHPTTDI-UHFFFAOYSA-N"
"OC(=O)C(C)(C)O","InChI=1S/C4H8O3/c1-4(2,7)3(5)6/h7H,1-2H3,(H,5,6)","BWLBGMIXKSTLSX-UHFFFAOYSA-N"
"O=Cc(c1)c(C=O)ccc1","InChI=1S/C8H6O2/c9-5-7-3-1-2-4-8(7)6-10/h1-6H","ZWLUXSQADUDCSB-UHFFFAOYSA-N"
"N#Cc(c1)c(C=O)ccc1","InChI=1S/C8H5NO/c9-5-7-3-1-2-4-8(7)6-10/h1-4,6H","QVTPWONEVZJCCS-UHFFFAOYSA-N"
"O=C=Nc(c1)cc(N=C=O)c(C)c1","InChI=1S/C9H6N2O2/c1-7-2-3-8(10-5-12)4-9(7)11-6-13/h2-4H,1H3","DVKJHBMWWAPEIU-UHFFFAOYSA-N"
"COC(=O)C=CC(=O)OC","InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+","LDCRTTXIJACKKU-ONEGZZNKSA-N"
"COC(=O)C=CC(=O)OC","InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3-","LDCRTTXIJACKKU-ARJAWSKDSA-N"
"CS(C)=O","InChI=1S/C2H6OS/c1-4(2)3/h1-2H3","IAZDPXIOMUYVGZ-UHFFFAOYSA-N"
"Nc(c1)cccc1","InChI=1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2","PAYRUJLWNCNPSJ-UHFFFAOYSA-N"
"ClC=C(Cl)Cl","InChI=1S/C2HCl3/c3-1-2(4)5/h1H","XSTXAVWGXDQKEL-UHFFFAOYSA-N"
"c(c1)cccc1","InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H","UHOVQNZJYSORNB-UHFFFAOYSA-N"
"COCC(O)=O","InChI=1S/C3H6O3/c1-6-2-3(4)5/h2H2,1H3,(H,4,5)","RMIODHQZRUFFFF-UHFFFAOYSA-N"
"COC(=O)CC(C)=O","InChI=1S/C5H8O3/c1-4(6)3-5(7)8-2/h3H2,1-2H3","WRQNANDWMGAFTP-UHFFFAOYSA-N"
"CCCCOC=O","InChI=1S/C5H10O2/c1-2-3-4-7-5-6/h5H,2-4H2,1H3","NMJJFJNHVMGPGM-UHFFFAOYSA-N"
"O=COCC(C)C","InChI=1S/C5H10O2/c1-5(2)3-7-4-6/h4-5H,3H2,1-2H3","AVMSWPWPYJVYKY-UHFFFAOYSA-N"
"CCOC(=O)C=CC(=O)OCC","InChI=1S/C8H12O4/c1-3-11-7(9)5-6-8(10)12-4-2/h5-6H,3-4H2,1-2H3/b6-5-","IEPRKVQEAMIZSS-WAYWQWQTSA-N"
"c(c1)coc1","InChI=1S/C4H4O/c1-2-4-5-3-1/h1-4H","YLQBMQCUIZJEEH-UHFFFAOYSA-N"
"COC(=O)CC(C)C","InChI=1S/C6H12O2/c1-5(2)4-6(7)8-3/h5H,4H2,1-3H3","OQAGVSWESNCJJT-UHFFFAOYSA-N"
"[2H]C([2H])([2H])OC(=O)CC(=O)OC([2H])([2H])[2H]","InChI=1S/C5H8O4/c1-8-4(6)3-5(7)9-2/h3H2,1-2H3/i1D3,2D3","BEPAFCGSDWSTEL-WFGJKAKNSA-N"
"CCCCOC(=O)CC","InChI=1S/C7H14O2/c1-3-5-6-9-7(8)4-2/h3-6H2,1-2H3","BTMVHUNTONAYDX-UHFFFAOYSA-N"
"COCC(=O)OC","InChI=1S/C4H8O3/c1-6-3-4(5)7-2/h3H2,1-2H3","QRMHDGWGLNLHMN-UHFFFAOYSA-N"
"CCNc(c1)c(C)ccc1","InChI=1S/C9H13N/c1-3-10-9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3","MWOUGPLLVVEUMM-UHFFFAOYSA-N"
"CCNc(c1)cccc1","InChI=1S/C8H11N/c1-2-9-8-6-4-3-5-7-8/h3-7,9H,2H2,1H3","OJGMBLNIHDZDGS-UHFFFAOYSA-N"
"CCc(c1)c(N)ccc1","InChI=1S/C8H11N/c1-2-7-5-3-4-6-8(7)9/h3-6H,2,9H2,1H3","MLPVBIWIRCKMJV-UHFFFAOYSA-N"
"COC(=O)Cc(c1)cccc1","InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3","CRZQGDNQQAALAY-UHFFFAOYSA-N"
"O=CC=Cc(c1)cccc1","InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+","KJPRLNWUNMBNBZ-QPJJXVBHSA-N"
"CNc(c1)cc(C)cc1","InChI=1S/C8H11N/c1-7-4-3-5-8(6-7)9-2/h3-6,9H,1-2H3","FBGJJTQNZVNEQU-UHFFFAOYSA-N"
"CCc(c1)cc(N)cc1","InChI=1S/C8H11N/c1-2-7-4-3-5-8(9)6-7/h3-6H,2,9H2,1H3","AMKPQMFZCBTTAT-UHFFFAOYSA-N"
"CCc(c1)ccc(N)c1","InChI=1S/C8H11N/c1-2-7-3-5-8(9)6-4-7/h3-6H,2,9H2,1H3","HRXZRAXKKNUKRF-UHFFFAOYSA-N"
"CCNc(c1)cc(C)cc1","InChI=1S/C9H13N/c1-3-10-9-6-4-5-8(2)7-9/h4-7,10H,3H2,1-2H3","GUYMMHOQXYZMJQ-UHFFFAOYSA-N"
"CCNc(c1)ccc(C)c1","InChI=1S/C9H13N/c1-3-10-9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3","AASABFUMCBTXRL-UHFFFAOYSA-N"
"CNc(c1)c(C)ccc1","InChI=1S/C8H11N/c1-7-5-3-4-6-8(7)9-2/h3-6,9H,1-2H3","GUAWMXYQZKVRCW-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(C)OC(=O)C(C)=C","InChI=1S/C7H12O2/c1-5(2)7(8)9-6(3)4/h6H,1H2,2-4H3/i3D3","BOQSSGDQNWEFSX-HPRDVNIFSA-N"
"[2H]C([2H])([2H])C(C([2H])([2H])[2H])OC(C)=O","InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3/i1D3,2D3","JMMWKPVZQRWMSS-WFGJKAKNSA-N"
"CC(=C)C(=O)OC(C)c(c1)cccc1","InChI=1S/C12H14O2/c1-9(2)12(13)14-10(3)11-7-5-4-6-8-11/h4-8,10H,1H2,2-3H3","BQMWZHUIGYNOAL-UHFFFAOYSA-N"
"C=CC(C)=O","InChI=1S/C4H6O/c1-3-4(2)5/h3H,1H2,2H3","FUSUHKVFWTUUBE-UHFFFAOYSA-N"
"CCOC(=O)C=C","InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h3H,1,4H2,2H3","JIGUQPWFLRLWPJ-UHFFFAOYSA-N"
"CCOC(=O)Cc(c1)cccc1","InChI=1S/C10H12O2/c1-2-12-10(11)8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3","DULCUDSUACXJJC-UHFFFAOYSA-N"
"CCOC(=O)C=CC(=O)OCC","InChI=1S/C8H12O4/c1-3-11-7(9)5-6-8(10)12-4-2/h5-6H,3-4H2,1-2H3/b6-5+","IEPRKVQEAMIZSS-AATRIKPKSA-N"
"CC(=O)OCOc(c1)cccc1","InChI=1S/C9H10O3/c1-8(10)11-7-12-9-5-3-2-4-6-9/h2-6H,7H2,1H3","HTZSHXWXQWAYEO-UHFFFAOYSA-N"
"NCCNCCNCCN","InChI=1S/C6H18N4/c7-1-3-9-5-6-10-4-2-8/h9-10H,1-8H2","VILCJCGEZXAXTO-UHFFFAOYSA-N"
"C1=NNC(=N1)NC(=O)C(F)(F)F","InChI=1S/C4H3F3N4O/c5-4(6,7)2(12)10-3-8-1-9-11-3/h1H,(H2,8,9,10,11,12)","YZJAOMRBFRWXNC-UHFFFAOYSA-N"
"O=C(Nn(c1)cnn1)C(F)(F)F","InChI=1S/C4H3F3N4O/c5-4(6,7)3(12)10-11-1-8-9-2-11/h1-2H,(H,10,12)","YTBZSBHBBPVUID-UHFFFAOYSA-N"
"c(c3)cc(s1)c(c3)c(c2)c(ccc2)1","InChI=1S/C12H8S/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8H","IYYZUPMFVPLQIF-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)C(C)c(c1)cccc1","InChI=1S/C14H14O/c1-11(12-5-3-2-4-6-12)13-7-9-14(15)10-8-13/h2-11,15H,1H3","XHASMJXNUHCHBL-UHFFFAOYSA-N"
"COC(=O)c(c1)c(O)c(c2)c(ccc2)c1","InChI=1S/C12H10O3/c1-15-12(14)10-7-6-8-4-2-3-5-9(8)11(10)13/h2-7,13H,1H3","HMIBDRSTVGFJPB-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)C(C)c(c([2H])1)c([2H])c([2H])c([2H])c([2H])1","InChI=1S/C14H14O/c1-11(12-5-3-2-4-6-12)13-7-9-14(15)10-8-13/h2-11,15H,1H3/i2D,3D,4D,5D,6D","XHASMJXNUHCHBL-VIQYUKPQSA-N"
"COC(=O)c(c(OC)1)c(c2)c(ccc2)cc1","InChI=1S/C13H12O3/c1-15-11-8-7-9-5-3-4-6-10(9)12(11)13(14)16-2/h3-8H,1-2H3","BDXGQHHFVPQVAQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)SSc(c1)cccc1","InChI=1S/C12H10S2/c1-3-7-11(8-4-1)13-14-12-9-5-2-6-10-12/h1-10H","GUUVPOWQJOLRAS-UHFFFAOYSA-N"
"O=C(Nn(c1)cnn1)C(F)(F)C(F)(F)F","InChI=1S/C5H3F5N4O/c6-4(7,5(8,9)10)3(15)13-14-1-11-12-2-14/h1-2H,(H,13,15)","OIXIJWYGTNCGQU-UHFFFAOYSA-N"
"[H]C(N=1)=NC(N1)NC(=O)C(F)(F)C(F)(F)F","InChI=1S/C5H3F5N4O/c6-4(7,5(8,9)10)2(15)13-3-11-1-12-14-3/h1,3H,(H,13,15)","SYVBYMQVZXBVAZ-UHFFFAOYSA-N"
"COC(=O)c(c1)c(C(=O)OC)c(c2)c(ccc2)c1","InChI=1S/C14H12O4/c1-17-13(15)11-8-7-9-5-3-4-6-10(9)12(11)14(16)18-2/h3-8H,1-2H3","JGJWEXOAAXEJMW-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C)c(c2)c(O)c(cc2)C(C)c(c1)cccc1","InChI=1S/C22H22O/c1-16(18-10-5-3-6-11-18)20-14-9-15-21(22(20)23)17(2)19-12-7-4-8-13-19/h3-17,23H,1-2H3","NYPMHOYLEBBBGY-UHFFFAOYSA-N"
"[2H]c(c([2H])3)c([2H])c([2H])c(c([2H])3)C(C)c(c2)c(O)c(cc2)C(C)c(c([2H])1)c([2H])c([2H])c([2H])c([2H])1","InChI=1S/C22H22O/c1-16(18-10-5-3-6-11-18)20-14-9-15-21(22(20)23)17(2)19-12-7-4-8-13-19/h3-17,23H,1-2H3/i3D,4D,5D,6D,7D,8D,10D,11D,12D,13D","NYPMHOYLEBBBGY-ZKZWDRQZSA-N"
"c(c4)c(ccc4)C(c(c2)c(c(cc(C(c(c3)cccc3)C)2)C(c(c1)cccc1)C)O)C","InChI=1S/C30H30O/c1-21(24-13-7-4-8-14-24)27-19-28(22(2)25-15-9-5-10-16-25)30(31)29(20-27)23(3)26-17-11-6-12-18-26/h4-23,31H,1-3H3","BYLSIPUARIZAHZ-UHFFFAOYSA-N"
"Oc(c(C(c(c4[2H])c(c(c([2H])c4[2H])[2H])[2H])C)1)c(C(c(c3[2H])c(c(c([2H])c3[2H])[2H])[2H])C)cc(C(c(c2[2H])c(c(c([2H])c([2H])2)[2H])[2H])C)c1","InChI=1S/C30H30O/c1-21(24-13-7-4-8-14-24)27-19-28(22(2)25-15-9-5-10-16-25)30(31)29(20-27)23(3)26-17-11-6-12-18-26/h4-23,31H,1-3H3/i4D,5D,6D,7D,8D,9D,10D,11D,12D,13D,14D,15D,16D,17D,18D","BYLSIPUARIZAHZ-RXLUIHFSSA-N"
"CCCCOc(c1)ccc(c1)C(=O)OC","InChI=1S/C12H16O3/c1-3-4-9-15-11-7-5-10(6-8-11)12(13)14-2/h5-8H,3-4,9H2,1-2H3","PUHCYTHGLBCWEA-UHFFFAOYSA-N"
"COC(=O)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H10O2/c1-14-12(13)11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3","HMRROBKAACRWBP-UHFFFAOYSA-N"
"CCCCCC(C)CCC(=O)OC","InChI=1S/C11H22O2/c1-4-5-6-7-10(2)8-9-11(12)13-3/h10H,4-9H2,1-3H3","GXZVGQNXKJXNBV-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCC(C)C","InChI=1S/C13H26O2/c1-12(2)10-8-6-4-5-7-9-11-13(14)15-3/h12H,4-11H2,1-3H3","XPVCTJYIICVJOE-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCC(C)C","InChI=1S/C14H28O2/c1-13(2)11-9-7-5-4-6-8-10-12-14(15)16-3/h13H,4-12H2,1-3H3","GSRXTORWPQDOOY-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCC(C)C","InChI=1S/C15H30O2/c1-14(2)12-10-8-6-4-5-7-9-11-13-15(16)17-3/h14H,4-13H2,1-3H3","FLESKWMKPOBWDE-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCCC(C)C","InChI=1S/C16H32O2/c1-15(2)13-11-9-7-5-4-6-8-10-12-14-16(17)18-3/h15H,4-14H2,1-3H3","OGGUSDOXMVVCIX-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCCCC(C)C","InChI=1S/C17H34O2/c1-16(2)14-12-10-8-6-4-5-7-9-11-13-15-17(18)19-3/h16H,4-15H2,1-3H3","WAKCWJNDXBPEBP-UHFFFAOYSA-N"
"CC[Sn](CC)(CC)CC","InChI=1S/4C2H5.Sn/c4*1-2;/h4*1H2,2H3;","RWWNQEOPUOCKGR-UHFFFAOYSA-N"
"CCCC[Sn](F)(CCCC)CCCC","InChI=1S/3C4H9.FH.Sn/c3*1-3-4-2;;/h3*1,3-4H2,2H3;1H;/q;;;;+1/p-1","DFNPRTKVCGZMMC-UHFFFAOYSA-M"
"CCCC[Sn](Cl)(CCCC)CCCC","InChI=1S/3C4H9.ClH.Sn/c3*1-3-4-2;;/h3*1,3-4H2,2H3;1H;/q;;;;+1/p-1","GCTFWCDSFPMHHS-UHFFFAOYSA-M"
"CCCC[Sn](CCCC)(CCCC)CCCC","InChI=1S/4C4H9.Sn/c4*1-3-4-2;/h4*1,3-4H2,2H3;","AFCAKJKUYFLYFK-UHFFFAOYSA-N"
"CCCC[Sn](CCCC)(CCCC)OC(C)=O","InChI=1S/3C4H9.C2H4O2.Sn/c3*1-3-4-2;1-2(3)4;/h3*1,3-4H2,2H3;1H3,(H,3,4);/q;;;;+1/p-1","PWBHRVGYSMBMIO-UHFFFAOYSA-M"
"c(c3)ccc(c3)[Sn](Cl)(c(c2)cccc2)c(c1)cccc1","InChI=1S/3C6H5.ClH.Sn/c3*1-2-4-6-5-3-1;;/h3*1-5H;1H;/q;;;;+1/p-1","NJVOZLGKTAPUTQ-UHFFFAOYSA-M"
"c([Sn](c(c4)cccc4)(c(c3)cccc3)c(c2)cccc2)(c1)cccc1","InChI=1S/4C6H5.Sn/c4*1-2-4-6-5-3-1;/h4*1-5H;","CRHIAMBJMSSNNM-UHFFFAOYSA-N"
"COC(=O)CC=CCC(=O)OC","InChI=1S/C8H12O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-4H,5-6H2,1-2H3/b4-3+","CPSQPCGPYWRIPB-ONEGZZNKSA-N"
"COC(=O)C=Cc(c1)cccc1","InChI=1S/C10H10O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-8H,1H3/b8-7+","CCRCUPLGCSFEDV-BQYQJAHWSA-N"
"COC(=O)C(C)=CC=C(C)C(=O)OC","InChI=1S/C10H14O4/c1-7(9(11)13-3)5-6-8(2)10(12)14-4/h5-6H,1-4H3/b7-5+,8-6+","DZQYXTIAUQLOHM-KQQUZDAGSA-N"
"COC(=O)CCCCCCCCCCCCCC(C)C","InChI=1S/C18H36O2/c1-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18(19)20-3/h17H,4-16H2,1-3H3","BNHKXOIJKIMOJH-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCCCCCC(C)C","InChI=1S/C19H38O2/c1-18(2)16-14-12-10-8-6-4-5-7-9-11-13-15-17-19(20)21-3/h18H,4-17H2,1-3H3","KDQIFKKWPMBNOH-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCCCCCCC(C)C","InChI=1S/C20H40O2/c1-19(2)17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20(21)22-3/h19H,4-18H2,1-3H3","MASZVQKLIMRPFY-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCCCCCCCC(C)C","InChI=1S/C21H42O2/c1-20(2)18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-21(22)23-3/h20H,4-19H2,1-3H3","IVHQIMJNEKWLSS-UHFFFAOYSA-N"
"COC(=O)CCCCCCCCCCCCCCCCCC(C)C","InChI=1S/C22H44O2/c1-21(2)19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-22(23)24-3/h21H,4-20H2,1-3H3","CMVPFMWIPGEIMP-UHFFFAOYSA-N"
"CCCCCCC=CCCCCCCCC(=O)OC","InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h8-9H,3-7,10-16H2,1-2H3/b9-8+","IZFGRAGOVZCUFB-CMDGGOBGSA-N"
"CCCCCCC=CCCCCCCCC(=O)OC","InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h8-9H,3-7,10-16H2,1-2H3/b9-8-","IZFGRAGOVZCUFB-HJWRWDBZSA-N"
"CCCCC=CCCCCCCCC(=O)OC","InChI=1S/C15H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17-2/h6-7H,3-5,8-14H2,1-2H3/b7-6-","RWIPSJUSVXDVPB-SREVYHEPSA-N"
"CCCCCC=CCC=CCCCCCCCC(=O)OC","InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11H,3-6,9,12-18H2,1-2H3/b8-7+,11-10+","WTTJVINHCBCLGX-ZDVGBALWSA-N"
"CCCCCC=CCC=CCCCCCCCC(=O)OC","InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11H,3-6,9,12-18H2,1-2H3/b8-7-,11-10-","WTTJVINHCBCLGX-NQLNTKRDSA-N"
"CCC=CCC=CCC=CCCCCCCCC(=O)OC","InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,10-11H,3,6,9,12-18H2,1-2H3/b5-4-,8-7-,11-10-","DVWSXZIHSUZZKJ-YSTUJMKBSA-N"
"CCCCCCCCCCCCCCC=CCCCC(=O)OC","InChI=1S/C21H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h16-17H,3-15,18-20H2,1-2H3/b17-16-","DCELZGFMHKOOJH-MSUUIHNZSA-N"
"CCCCCCCCC=CCCCCCCCCCCCCCC(=O)OC","InChI=1S/C25H48O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27-2/h10-11H,3-9,12-24H2,1-2H3/b11-10+","AINIZSBLAFHZCP-ZHACJKMWSA-N"
"C=CCCCCCCCCC(=O)OC","InChI=1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3H,1,4-11H2,2H3","KISVAASFGZJBCY-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(C)cc1","InChI=1S/C9H10O2/c1-7-4-3-5-8(6-7)9(10)11-2/h3-6H,1-2H3","CPXCDEMFNPKOEF-UHFFFAOYSA-N"
"COC(=O)c(c1)c(C)cc(C)c1","InChI=1S/C10H12O2/c1-7-4-5-9(8(2)6-7)10(11)12-3/h4-6H,1-3H3","QQCLNRPRQRDMCK-UHFFFAOYSA-N"
"COC(=O)c(c1)c(C)ccc(C)1","InChI=1S/C10H12O2/c1-7-4-5-8(2)9(6-7)10(11)12-3/h4-6H,1-3H3","YILVOENZHZWHHK-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(C)c(C)c1","InChI=1S/C10H12O2/c1-7-4-5-9(6-8(7)2)10(11)12-3/h4-6H,1-3H3","PTSSKYUSCIALKU-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(C)cc(C)1","InChI=1S/C10H12O2/c1-7-4-8(2)6-9(5-7)10(11)12-3/h4-6H,1-3H3","PEVXENGLERTHJE-UHFFFAOYSA-N"
"CCCc(c1)ccc(c1)C(=O)OC","InChI=1S/C11H14O2/c1-3-4-9-5-7-10(8-6-9)11(12)13-2/h5-8H,3-4H2,1-2H3","RXFJHVNBEFFCJX-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(c1)C(C)(C)C","InChI=1S/C12H16O2/c1-12(2,3)10-7-5-9(6-8-10)11(13)14-4/h5-8H,1-4H3","UPIJOAFHOIWPLT-UHFFFAOYSA-N"
"CCCCc(c1)ccc(c1)C(=O)OC","InChI=1S/C12H16O2/c1-3-4-5-10-6-8-11(9-7-10)12(13)14-2/h6-9H,3-5H2,1-2H3","XJRYQLPELPLPHZ-UHFFFAOYSA-N"
"CCCCCc(c1)ccc(c1)C(=O)OC","InChI=1S/C13H18O2/c1-3-4-5-6-11-7-9-12(10-8-11)13(14)15-2/h7-10H,3-6H2,1-2H3","STDGBCHZHMQCAE-UHFFFAOYSA-N"
"CCOc(c1)c(ccc1)C(=O)OC","InChI=1S/C10H12O3/c1-3-13-9-7-5-4-6-8(9)10(11)12-2/h4-7H,3H2,1-2H3","QAYQKAPOTVSWLS-UHFFFAOYSA-N"
"COC(=O)C(C1)CCCC1","InChI=1S/C8H14O2/c1-10-8(9)7-5-3-2-4-6-7/h7H,2-6H2,1H3","ZQWPRMPSCMSAJU-UHFFFAOYSA-N"
"COC(=O)C(C(=O)OC)Cc(c1)cccc1","InChI=1S/C12H14O4/c1-15-11(13)10(12(14)16-2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3","ZMYJSOIMFGAQRQ-UHFFFAOYSA-N"
"COC(=O)C(C1)CC=CC1","InChI=1S/C8H12O2/c1-10-8(9)7-5-3-2-4-6-7/h2-3,7H,4-6H2,1H3","IPUNVLFESXFVFH-UHFFFAOYSA-N"
"COC(=O)C(C)c(c1)cccc1","InChI=1S/C10H12O2/c1-8(10(11)12-2)9-6-4-3-5-7-9/h3-8H,1-2H3","DZIQUZJSNSZOCH-UHFFFAOYSA-N"
"COC(=O)CCc(c1)cccc1","InChI=1S/C10H12O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3","RPUSRLKKXPQSGP-UHFFFAOYSA-N"
"COC(=O)C(C1)CCC1","InChI=1S/C7H12O2/c1-9-7(8)6-4-2-3-5-6/h6H,2-5H2,1H3","IIHIJFJSXPDTNO-UHFFFAOYSA-N"
"CCCC(CCC)C(=O)OC","InChI=1S/C9H18O2/c1-4-6-8(7-5-2)9(10)11-3/h8H,4-7H2,1-3H3","WPRYUWYMOZQHIY-UHFFFAOYSA-N"
"COC(=O)CC(C1)CCC1","InChI=1S/C8H14O2/c1-10-8(9)6-7-4-2-3-5-7/h7H,2-6H2,1H3","ILSNISVKFYYCCE-UHFFFAOYSA-N"
"COC(=O)CC(C1)CCCC1","InChI=1S/C9H16O2/c1-11-9(10)7-8-5-3-2-4-6-8/h8H,2-7H2,1H3","IMXBRVLCKXGWSS-UHFFFAOYSA-N"
"COC(=O)Cc(c1)c(ccc1)C(=O)OC","InChI=1S/C11H12O4/c1-14-10(12)7-8-5-3-4-6-9(8)11(13)15-2/h3-6H,7H2,1-2H3","ROMWRJNZSHFGEK-UHFFFAOYSA-N"
"COC(=O)Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C13H12O2/c1-15-13(14)9-11-7-4-6-10-5-2-3-8-12(10)11/h2-8H,9H2,1H3","YGGXZTQSGNFKPJ-UHFFFAOYSA-N"
"COC(=O)C(C1)C(CC=C1)C(=O)OC","InChI=1S/C10H14O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-4,7-8H,5-6H2,1-2H3","DVVAGRMJGUQHLI-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(=O)OC","InChI=1S/C9H10O3/c1-11-8-5-3-7(4-6-8)9(10)12-2/h3-6H,1-2H3","DDIZAANNODHTRB-UHFFFAOYSA-N"
"COC(=O)CCC(C1)CCCC1","InChI=1S/C10H18O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h9H,2-8H2,1H3","PPALFHZGSIENQB-UHFFFAOYSA-N"
"COC(=O)Cc(c1)ccc(C)c1","InChI=1S/C10H12O2/c1-8-3-5-9(6-4-8)7-10(11)12-2/h3-6H,7H2,1-2H3","LSAGWGNECLEVPE-UHFFFAOYSA-N"
"COC(=O)CC(C)(CC)CC(=O)OC","InChI=1S/C10H18O4/c1-5-10(2,6-8(11)13-3)7-9(12)14-4/h5-7H2,1-4H3","MYBLGPBPMJJRAB-UHFFFAOYSA-N"
"OCCSC","InChI=1S/C3H8OS/c1-5-3-2-4/h4H,2-3H2,1H3","WBBPRCNXBQTYLF-UHFFFAOYSA-N"
"COC(=O)C([H])(C1)C(C)(C)C(C)(C1)C(=O)OC","InChI=1S/C12H20O4/c1-11(2)8(9(13)15-4)6-7-12(11,3)10(14)16-5/h8H,6-7H2,1-5H3/t8-,12+/m1/s1","JTQKJWYDOXYYBH-PELKAZGASA-N"
"COC(=O)CC(C(=O)OC)c(c1)cccc1","InChI=1S/C12H14O4/c1-15-11(13)8-10(12(14)16-2)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3","CGVIBFZHFCVINR-UHFFFAOYSA-N"
"COC(=O)CC(=CC(=O)OC)C(=O)OC","InChI=1S/C9H12O6/c1-13-7(10)4-6(9(12)15-3)5-8(11)14-2/h4H,5H2,1-3H3/b6-4+","DZAIBGWGBBQGPZ-GQCTYLIASA-N"
"O=Cc(c1)ccc(c1)C(=O)OC","InChI=1S/C9H8O3/c1-12-9(11)8-4-2-7(6-10)3-5-8/h2-6H,1H3","FEIOASZZURHTHB-UHFFFAOYSA-N"
"COC(=O)C=Cc(c1)ccc(C)c1","InChI=1S/C11H12O2/c1-9-3-5-10(6-4-9)7-8-11(12)13-2/h3-8H,1-2H3/b8-7+","WLJBRXRCJNSDHT-BQYQJAHWSA-N"
"COC(=O)C([H])(C1)C([H])(CCC1)C(=O)OC","InChI=1S/C10H16O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h7-8H,3-6H2,1-2H3/t7-,8+","AIACXWOETVLBIA-OCAPTIKFSA-N"
"COC(=O)C#Cc(c1)cccc1","InChI=1S/C10H8O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-6H,1H3","JFGWPXKGINUNDH-UHFFFAOYSA-N"
"OC(=O)CNC(=O)Cc(c1)cccc1","InChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)","UTYVDVLMYQPLQB-UHFFFAOYSA-N"
"OC(=O)CNC(=O)c(c1)cccc1","InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)","QIAFMBKCNZACKA-UHFFFAOYSA-N"
"OC(=O)CNC(=O)c(c([2H])1)c([2H])c([2H])c([2H])c([2H])1","InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)/i1D,2D,3D,4D,5D","QIAFMBKCNZACKA-RALIUCGRSA-N"
"OC(=O)CNC(=O)c(c1)c(C)ccc1","InChI=1S/C10H11NO3/c1-7-4-2-3-5-8(7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)","YOEBAVRJHRCKRE-UHFFFAOYSA-N"
"OC(=O)CNC(=O)c(c1)cc(C)cc1","InChI=1S/C10H11NO3/c1-7-3-2-4-8(5-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)","YKAKNMHEIJUKEX-UHFFFAOYSA-N"
"OC(=O)CNC(=O)c(c1)ccc(C)c1","InChI=1S/C10H11NO3/c1-7-2-4-8(5-3-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)","NRSCPTLHWVWLLH-UHFFFAOYSA-N"
"C=CC(=O)OC","InChI=1S/C4H6O2/c1-3-4(5)6-2/h3H,1H2,2H3","BAPJBEWLBFYGME-UHFFFAOYSA-N"
"[H]C(C)(N)c(c1)cccc1","InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3/t7-/m1/s1","RQEUFEKYXDPUSK-SSDOTTSWSA-N"
"O=C(C1)C(C)(C2)C(C)(C)C([H])(C2)1","InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10+/m1/s1","DSSYKIVIOFKYAU-XCBNKYQSSA-N"
"CC(C)[Si](C)(C)[Si](C)(C)O[Si](C)(C)[Si](C)(C)C(C)C","InChI=1S/C14H38OSi4/c1-13(2)16(5,6)18(9,10)15-19(11,12)17(7,8)14(3)4/h13-14H,1-12H3","ILTJVKMWYFGWOL-UHFFFAOYSA-N"
"OCc(c1)c(ccc1)C[Si](C)(C)C","InChI=1S/C11H18OSi/c1-13(2,3)9-11-7-5-4-6-10(11)8-12/h4-7,12H,8-9H2,1-3H3","GDBYLQNQAUNHCX-UHFFFAOYSA-N"
"CCCCCC(C)=NC(C)(C)C","InChI=1S/C11H23N/c1-6-7-8-9-10(2)12-11(3,4)5/h6-9H2,1-5H3/b12-10-","MVGGGQZIXGZLBW-BENRWUELSA-N"
"CCCCCCC(C)O[Si](C)(C)C","InChI=1S/C11H26OSi/c1-6-7-8-9-10-11(2)12-13(3,4)5/h11H,6-10H2,1-5H3","UHWVCRDNNJCGLG-UHFFFAOYSA-N"
"CCCCCCCCO[Si](C)(C)C","InChI=1S/C11H26OSi/c1-5-6-7-8-9-10-11-12-13(2,3)4/h5-11H2,1-4H3","CDGIKLPUDRGJQN-UHFFFAOYSA-N"
"CC(=C)C(C)C(=O)c(c1)cccc1","InChI=1S/C12H14O/c1-9(2)10(3)12(13)11-7-5-4-6-8-11/h4-8,10H,1H2,2-3H3","WBQKHEBUULKXGU-UHFFFAOYSA-N"
"C=CCC(OC)C=Cc(c1)cccc1","InChI=1S/C13H16O/c1-3-7-13(14-2)11-10-12-8-5-4-6-9-12/h3-6,8-11,13H,1,7H2,2H3/b11-10+","NDUMBKGCLBBXLU-ZHACJKMWSA-N"
"C=C(Cc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C12H18OSi/c1-11(13-14(2,3)4)10-12-8-6-5-7-9-12/h5-9H,1,10H2,2-4H3","OEHNYSQPYONHIW-UHFFFAOYSA-N"
"COCc(c1)c(ccc1)C[Si](C)(C)C","InChI=1S/C12H20OSi/c1-13-9-11-7-5-6-8-12(11)10-14(2,3)4/h5-8H,9-10H2,1-4H3","UGIPJBGGQSXMIT-UHFFFAOYSA-N"
"CC(=C)CC(C)C(C1)C(=O)CCC1","InChI=1S/C12H20O/c1-9(2)8-10(3)11-6-4-5-7-12(11)13/h10-11H,1,4-8H2,2-3H3","JNHRKKHWPNJMSO-UHFFFAOYSA-N"
"CC(=C)CCC(CCC(C)=O)C(C)=O","InChI=1S/C12H20O2/c1-9(2)5-7-12(11(4)14)8-6-10(3)13/h12H,1,5-8H2,2-4H3","UIPLNRWNRUEEPE-UHFFFAOYSA-N"
"CCCCCC(=C(C)C)O[Si](C)(C)C","InChI=1S/C12H26OSi/c1-7-8-9-10-12(11(2)3)13-14(4,5)6/h7-10H2,1-6H3","XEAQQYZZUGWXNO-UHFFFAOYSA-N"
"CC(=C2)CC(CC(=O)2)c(c1)cccc1","InChI=1S/C13H14O/c1-10-7-12(9-13(14)8-10)11-5-3-2-4-6-11/h2-6,8,12H,7,9H2,1H3","NIWQFOONBVIMGR-UHFFFAOYSA-N"
"C#CCC(CC(C)=O)c(c1)cccc1","InChI=1S/C13H14O/c1-3-7-13(10-11(2)14)12-8-5-4-6-9-12/h1,4-6,8-9,13H,7,10H2,2H3","BYUGDDFTCNVKKD-UHFFFAOYSA-N"
"COC(c(c2)cccc2)C(C1)C(=O)CC1","InChI=1S/C13H16O2/c1-15-13(10-6-3-2-4-7-10)11-8-5-9-12(11)14/h2-4,6-7,11,13H,5,8-9H2,1H3","JECPKECYQZJMRB-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C1)CC(C)(O2)OC(C)(O2)1","InChI=1S/C13H16O3/c1-12-8-11(10-6-4-3-5-7-10)9-13(2,14-12)16-15-12/h3-7,11H,8-9H2,1-2H3","NACUOFJOIXFQJT-UHFFFAOYSA-N"
"CCOC(OCC)CC(=O)c(c1)cccc1","InChI=1S/C13H18O3/c1-3-15-13(16-4-2)10-12(14)11-8-6-5-7-9-11/h5-9,13H,3-4,10H2,1-2H3","DTLKIEUIPAYFLA-UHFFFAOYSA-N"
"CCC(=O)C(C)C(OC)c(c1)cccc1","InChI=1S/C13H18O2/c1-4-12(14)10(2)13(15-3)11-8-6-5-7-9-11/h5-10,13H,4H2,1-3H3","JEAZSOXKLCVEAR-UHFFFAOYSA-N"
"COc(c1)ccc(c1)CC(=C)O[Si](C)(C)C","InChI=1S/C13H20O2Si/c1-11(15-16(3,4)5)10-12-6-8-13(14-2)9-7-12/h6-9H,1,10H2,2-5H3","DUEZNAYVAXALAR-UHFFFAOYSA-N"
"CCCC(C1)C(C2)C(CCC2)=CC(=O)1","InChI=1S/C13H20O/c1-2-5-10-8-12(14)9-11-6-3-4-7-13(10)11/h9-10,13H,2-8H2,1H3","SMSNBMVWICZTAM-UHFFFAOYSA-N"
"CCCC(CC=C)C(C1)C(=O)CCC1","InChI=1S/C13H22O/c1-3-7-11(8-4-2)12-9-5-6-10-13(12)14/h3,11-12H,1,4-10H2,2H3","IFAVPAZDGBNKPQ-UHFFFAOYSA-N"
"CC[Si](CC)(CC)OCc(c1)cccc1","InChI=1S/C13H22OSi/c1-4-15(5-2,6-3)14-12-13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3","PVEFGVHUGAHUHQ-UHFFFAOYSA-N"
"COC(OC)c(c1)c(ccc1)C[Si](C)(C)C","InChI=1S/C13H22O2Si/c1-14-13(15-2)12-9-7-6-8-11(12)10-16(3,4)5/h6-9,13H,10H2,1-5H3","CZUABHFBQIIFGM-UHFFFAOYSA-N"
"C[Si](C)(C)OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C13H26OSi/c1-12(2)10-7-8-13(12,3)11(9-10)14-15(4,5)6/h10-11H,7-9H2,1-6H3","RUVRGUBFCPLVCZ-UHFFFAOYSA-N"
"CC(C1)CC(O[Si](C)(C)C)C(C1)C(C)C","InChI=1S/C13H28OSi/c1-10(2)12-8-7-11(3)9-13(12)14-15(4,5)6/h10-13H,7-9H2,1-6H3","LDWGJYAAQHHQTJ-UHFFFAOYSA-N"
"CCCCCCC(C)O[Si](C)(CC)CC","InChI=1S/C13H30OSi/c1-6-9-10-11-12-13(4)14-15(5,7-2)8-3/h13H,6-12H2,1-5H3","AWUGSFXDDGKRQI-UHFFFAOYSA-N"
"C=C(C2)CC(OC2)CCc(c1)cccc1","InChI=1S/C14H18O/c1-12-9-10-15-14(11-12)8-7-13-5-3-2-4-6-13/h2-6,14H,1,7-11H2","KMJUZEPIVYGWPT-UHFFFAOYSA-N"
"C=CC(=C)CC(O)CCc(c1)cccc1","InChI=1S/C14H18O/c1-3-12(2)11-14(15)10-9-13-7-5-4-6-8-13/h3-8,14-15H,1-2,9-11H2","COBOTNFHQDSRRO-UHFFFAOYSA-N"
"CCCCCC(=O)CCc(c1)cccc1","InChI=1S/C14H20O/c1-2-3-5-10-14(15)12-11-13-8-6-4-7-9-13/h4,6-9H,2-3,5,10-12H2,1H3","PMMNDSRSUDQZCC-UHFFFAOYSA-N"
"CCCCC(C(C)=O)Cc(c1)cccc1","InChI=1S/C14H20O/c1-3-4-10-14(12(2)15)11-13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3","DQQOAEDWHZWPBO-UHFFFAOYSA-N"
"COC(CC(C)C)CC(=O)c(c1)cccc1","InChI=1S/C14H20O2/c1-11(2)9-13(16-3)10-14(15)12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3","BKZPFDYLUSKCEG-UHFFFAOYSA-N"
"CCCCC(OC)CC(=O)c(c1)cccc1","InChI=1S/C14H20O2/c1-3-4-10-13(16-2)11-14(15)12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3","JOWQOLYPYCSOFE-UHFFFAOYSA-N"
"CC(C)=CCCC(=O)C(C1)CC=C(C)C1","InChI=1S/C14H22O/c1-11(2)5-4-6-14(15)13-9-7-12(3)8-10-13/h5,7,13H,4,6,8-10H2,1-3H3","BUSKKOPCEZGTQK-UHFFFAOYSA-N"
"CC(C)=C(Cc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C14H22OSi/c1-12(2)14(15-16(3,4)5)11-13-9-7-6-8-10-13/h6-10H,11H2,1-5H3","WKPXIXBVMCGQPV-UHFFFAOYSA-N"
"C[Si](C)(C)CC(C1)C(C2)(C(=O)CCC2)C(C)1","InChI=1S/C14H26OSi/c1-11-9-12(10-16(2,3)4)14(11)8-6-5-7-13(14)15/h11-12H,5-10H2,1-4H3","WAWKLYQBEDIBDK-UHFFFAOYSA-N"
"C[Si](C)(C)OCc(c1)c(ccc1)C[Si](C)(C)C","InChI=1S/C14H26OSi2/c1-16(2,3)12-14-10-8-7-9-13(14)11-15-17(4,5)6/h7-10H,11-12H2,1-6H3","ICZDVVZHLUFUDE-UHFFFAOYSA-N"
"O=C(C=Cc(c2)cccc2)c(c1)cccc1","InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H/b12-11+","DQFBYFPFKXHELB-VAWYXSNFSA-N"
"COC(C=Cc(c2)cccc2)C(C1)C(=O)CC1","InChI=1S/C15H18O2/c1-17-15(13-8-5-9-14(13)16)11-10-12-6-3-2-4-7-12/h2-4,6-7,10-11,13,15H,5,8-9H2,1H3/b11-10+","HRGKKSYTZKMLOS-ZHACJKMWSA-N"
"CCC(OCc(c2)cccc2)C(C1)C(=O)CC1","InChI=1S/C15H20O2/c1-2-15(13-9-6-10-14(13)16)17-11-12-7-4-3-5-8-12/h3-5,7-8,13,15H,2,6,9-11H2,1H3","JBMYVGJXFWHGTK-UHFFFAOYSA-N"
"O=CCC(c(c1)cccc1)C(C(C)=O)C(OC)OC","InChI=1S/C15H20O4/c1-11(17)14(15(18-2)19-3)13(9-10-16)12-7-5-4-6-8-12/h4-8,10,13-15H,9H2,1-3H3","UBLRDRTVLCTAKO-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(O1)CC(=CC1)C[Si](C)(C)C","InChI=1S/C15H22OSi/c1-17(2,3)12-13-9-10-16-15(11-13)14-7-5-4-6-8-14/h4-9,15H,10-12H2,1-3H3","XZFMEUWLAAFAPN-UHFFFAOYSA-N"
"CC(C)=CCCC(=C)C(C1)CC([H])=C(C)C1","InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,15H,4-5,7,9-11H2,1-3H3","XZRVRYFILCSYSP-UHFFFAOYSA-N"
"CC(=O)CC(C1)C(=O)CCCCCCCCC1","InChI=1S/C15H26O2/c1-13(16)12-14-10-8-6-4-2-3-5-7-9-11-15(14)17/h14H,2-12H2,1H3","GNMCLGGNPWOVOH-UHFFFAOYSA-N"
"COC(CC(=O)c(c2)cccc2)c(c1)cccc1","InChI=1S/C16H16O2/c1-18-16(14-10-6-3-7-11-14)12-15(17)13-8-4-2-5-9-13/h2-11,16H,12H2,1H3","AVZUDRKDFJPJMF-UHFFFAOYSA-N"
"CCCC(C1)C(C2)(C(=O)CCC2)C(C[Si](C)(C)C)1","InChI=1S/C16H30OSi/c1-5-8-13-11-14(12-18(2,3)4)16(13)10-7-6-9-15(16)17/h13-14H,5-12H2,1-4H3","HBGMUTZBIXAHPY-UHFFFAOYSA-N"
"c(c2)ccc(c2)CCC(O1)CC(=CC1)C[Si](C)(C)C","InChI=1S/C17H26OSi/c1-19(2,3)14-16-11-12-18-17(13-16)10-9-15-7-5-4-6-8-15/h4-8,11,17H,9-10,12-14H2,1-3H3","HARHZXXSHAMBPR-UHFFFAOYSA-N"
"C=CC(=C)CC(CCc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C17H26OSi/c1-6-15(2)14-17(18-19(3,4)5)13-12-16-10-8-7-9-11-16/h6-11,17H,1-2,12-14H2,3-5H3","ITNCTDBNPCKRAP-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)C#C[Si](C)(C)C(C)(C)C","InChI=1S/C14H30Si2/c1-13(2,3)15(7,8)11-12-16(9,10)14(4,5)6/h1-10H3","YRUARCSGWDQBNC-UHFFFAOYSA-N"
"CC[Si](C)(C)[Si](C)(C)CC","InChI=1S/C8H22Si2/c1-7-9(3,4)10(5,6)8-2/h7-8H2,1-6H3","VPHDNCJLFNXQQN-UHFFFAOYSA-N"
"Nc(c1)ccc(Br)c1","InChI=1S/C6H6BrN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2","WDFQBORIUYODSI-UHFFFAOYSA-N"
"N#Cc(c1)ccc(N)c1","InChI=1S/C7H6N2/c8-5-6-1-3-7(9)4-2-6/h1-4H,9H2","YBAZINRZQSAIAY-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(cc1C(C)(C)C)C(C)(C)C","InChI=1S/C15H22O2/c1-14(2,3)11-7-10(13(16)17)8-12(9-11)15(4,5)6/h7-9H,1-6H3,(H,16,17)","NCTSLPBQVXUAHR-UHFFFAOYSA-N"
"C[Si](C)(N([Si](C)(C)C(C)(C)C)c(c1)cc(C(C)(C)C)cc(C(C)(C)C)1)C(C)(C)C","InChI=1S/C26H51NSi2/c1-23(2,3)20-17-21(24(4,5)6)19-22(18-20)27(28(13,14)25(7,8)9)29(15,16)26(10,11)12/h17-19H,1-16H3","VITNSGDBOAYRHK-UHFFFAOYSA-N"
"CC(Br)CBr","InChI=1S/C3H6Br2/c1-3(5)2-4/h3H,2H2,1H3","XFNJYAKDBJUJAJ-UHFFFAOYSA-N"
"CC(I)CI","InChI=1S/C3H6I2/c1-3(5)2-4/h3H,2H2,1H3","ISXPOEJSKALLKA-UHFFFAOYSA-N"
"ClCCO[Si](C)(C)C","InChI=1S/C5H13ClOSi/c1-8(2,3)7-5-4-6/h4-5H2,1-3H3","SJIIMFTWFNLSKY-UHFFFAOYSA-N"
"O=CCC(C)CC(C)=O","InChI=1S/C7H12O2/c1-6(3-4-8)5-7(2)9/h4,6H,3,5H2,1-2H3","YSJGFZKUCZEJSW-UHFFFAOYSA-N"
"CCC(C)CC(C)=O","InChI=1S/C7H14O/c1-4-6(2)5-7(3)8/h6H,4-5H2,1-3H3","XUPXMIAWKPTZLZ-UHFFFAOYSA-N"
"O=C(C1)C(C)(C)CCC1","InChI=1S/C8H14O/c1-8(2)6-4-3-5-7(8)9/h3-6H2,1-2H3","KNSPBSQWRKKAPI-UHFFFAOYSA-N"
"CC(C1)C(=O)C(C)CC1","InChI=1S/C8H14O/c1-6-4-3-5-7(2)8(6)9/h6-7H,3-5H2,1-2H3","AILVYPLQKCQNJC-UHFFFAOYSA-N"
"COC(OC)C(C1)C(=O)CC1","InChI=1S/C8H14O3/c1-10-8(11-2)6-4-3-5-7(6)9/h6,8H,3-5H2,1-2H3","BMUJLDCMIRTFHP-UHFFFAOYSA-N"
"CC(=O)Cc(c1)cccc1","InChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3","QCCDLTOVEPVEJK-UHFFFAOYSA-N"
"C=C(C1)CCC(C1)C(C)=O","InChI=1S/C9H14O/c1-7-3-5-9(6-4-7)8(2)10/h9H,1,3-6H2,2H3","FUVYWLRLHOAXFT-UHFFFAOYSA-N"
"Clc(c1)c(ccc1)O[Si](C)(C)C","InChI=1S/C9H13ClOSi/c1-12(2,3)11-9-7-5-4-6-8(9)10/h4-7H,1-3H3","NZLHRQHCIXYIMM-UHFFFAOYSA-N"
"CC(C1)=CCC(C1)C(C)=O","InChI=1S/C9H14O/c1-7-3-5-9(6-4-7)8(2)10/h3,9H,4-6H2,1-2H3","HOBBEYSRFFJETF-UHFFFAOYSA-N"
"C=CCC(OC)C(Br)CCC","InChI=1S/C9H17BrO/c1-4-6-8(10)9(11-3)7-5-2/h5,8-9H,2,4,6-7H2,1,3H3","PFJHYEBEIPVXNR-UHFFFAOYSA-N"
"CCCCC(OC)CC=C","InChI=1S/C9H18O/c1-4-6-8-9(10-3)7-5-2/h5,9H,2,4,6-8H2,1,3H3","IASDJCRPRZHAJM-UHFFFAOYSA-N"
"CCC(=C(C)C)O[Si](C)(C)C","InChI=1S/C9H20OSi/c1-7-9(8(2)3)10-11(4,5)6/h7H2,1-6H3","DYKBJHFIVZAUPC-UHFFFAOYSA-N"
"CCCCCC(=O)O[Si](C)(C)C","InChI=1S/C9H20O2Si/c1-5-6-7-8-9(10)11-12(2,3)4/h5-8H2,1-4H3","CYXNJMDACJPPRR-UHFFFAOYSA-N"
"C[Si](C)(C)CC=C[Si](C)(C)C","InChI=1S/C9H22Si2/c1-10(2,3)8-7-9-11(4,5)6/h7-8H,9H2,1-6H3/b8-7+","SVOLIZOGHWXZQV-BQYQJAHWSA-N"
"COc(c1)ccc(CC(C)=O)c1","InChI=1S/C10H12O2/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6H,7H2,1-2H3","WFWKNGZODAOLEO-UHFFFAOYSA-N"
"CC(=C)C(C)C(=O)c(c1)occ1","InChI=1S/C10H12O2/c1-7(2)8(3)10(11)9-5-4-6-12-9/h4-6,8H,1H2,2-3H3","WGNCXGIIBJVYLT-UHFFFAOYSA-N"
"O=C(C=1)CC(C)(C2)C(CCC2)1","InChI=1S/C10H14O/c1-10-5-3-2-4-8(10)6-9(11)7-10/h6H,2-5,7H2,1H3","HJDKCIOQDUHLEF-UHFFFAOYSA-N"
"CC(=C)C(C1)CC([H])=C(C)C1","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,10H,1,5-7H2,2-3H3","XMGQYMWWDOXHJM-UHFFFAOYSA-N"
"C=CCC(C)(C1)C(=O)CCC1","InChI=1S/C10H16O/c1-3-7-10(2)8-5-4-6-9(10)11/h3H,1,4-8H2,2H3","FGDGJMZVLROUMG-UHFFFAOYSA-N"
"C=CCC(C1)C(=O)C(C)CC1","InChI=1S/C10H16O/c1-3-5-9-7-4-6-8(2)10(9)11/h3,8-9H,1,4-7H2,2H3","AGKHZTYZZUCRAM-UHFFFAOYSA-N"
"c(c1)ccc(c1)CO[Si](C)(C)C","InChI=1S/C10H16OSi/c1-12(2,3)11-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3","AOKMFXQCRBQJOP-UHFFFAOYSA-N"
"CC(=C)C(C)C(=O)C(C)(C)C","InChI=1S/C10H18O/c1-7(2)8(3)9(11)10(4,5)6/h8H,1H2,2-6H3","BBWANVSATBDGOP-UHFFFAOYSA-N"
"CCCCC(OC)CC(C)=C","InChI=1S/C10H20O/c1-5-6-7-10(11-4)8-9(2)3/h10H,2,5-8H2,1,3-4H3","GQKIPQSVWNDERA-UHFFFAOYSA-N"
"CCC(C)CC(=C)O[Si](C)(C)C","InChI=1S/C10H22OSi/c1-7-9(2)8-10(3)11-12(4,5)6/h9H,3,7-8H2,1-2,4-6H3","URNYBCYAAMHBET-UHFFFAOYSA-N"
"[SiH3]OCCCC(C)(C)C(C)(C)C","InChI=1S/C10H24OSi/c1-9(2,3)10(4,5)7-6-8-11-12/h6-8H2,1-5,12H3","REZBYFYIMOZMSY-UHFFFAOYSA-N"
"CC(C)CO[Si](CC)(CC)CC","InChI=1S/C10H24OSi/c1-6-12(7-2,8-3)11-9-10(4)5/h10H,6-9H2,1-5H3","COCSZBCQKMSION-UHFFFAOYSA-N"
"C[Si](C)(C)OCCCCO[Si](C)(C)C","InChI=1S/C10H26O2Si2/c1-13(2,3)11-9-7-8-10-12-14(4,5)6/h7-10H2,1-6H3","ITDZOVTUXDYFSE-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)C","InChI=1S/C10H30Si4/c1-11(2,3)13(7,8)14(9,10)12(4,5)6/h1-10H3","WYNNMDYMPQMXFH-UHFFFAOYSA-N"
"C=CCC(OC)c(c1)cccc1","InChI=1S/C11H14O/c1-3-7-11(12-2)10-8-5-4-6-9-10/h3-6,8-9,11H,1,7H2,2H3","VGXHVTVOEOZVIY-UHFFFAOYSA-N"
"CCCCC(OC)C(C1)C(=O)CC1","InChI=1S/C11H20O2/c1-3-4-8-11(13-2)9-6-5-7-10(9)12/h9,11H,3-8H2,1-2H3","NABMSHMIHYWUPQ-UHFFFAOYSA-N"
"COC(OC)CC(=O)c(c1)cccc1","InChI=1S/C11H14O3/c1-13-11(14-2)8-10(12)9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3","PQNPAOSXSXMRKJ-UHFFFAOYSA-N"
"O=Cc(c1)c(ccc1)C[Si](C)(C)C","InChI=1S/C11H16OSi/c1-13(2,3)9-11-7-5-4-6-10(11)8-12/h4-8H,9H2,1-3H3","JLRRMHMDTHMAND-UHFFFAOYSA-N"
"CC(C)C(C1)C(=O)C(=C)C(C)C1","InChI=1S/C11H18O/c1-7(2)10-6-5-8(3)9(4)11(10)12/h7-8,10H,4-6H2,1-3H3","IRMRWAWQVBGNMC-UHFFFAOYSA-N"
"CC(C)C(=O)Cc(c1)cccc1","InChI=1S/C11H14O/c1-9(2)11(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","ZATIMOAGKJEVGN-UHFFFAOYSA-N"
"C=CCC(C)C(C1)C(=O)CCC1","InChI=1S/C11H18O/c1-3-6-9(2)10-7-4-5-8-11(10)12/h3,9-10H,1,4-8H2,2H3","DRGWHWMMHCDREE-UHFFFAOYSA-N"
"CC(=O)CC(C)C(C1)C(=O)CCC1","InChI=1S/C11H18O2/c1-8(7-9(2)12)10-5-3-4-6-11(10)13/h8,10H,3-7H2,1-2H3","QXEQYZLLHMLPPY-UHFFFAOYSA-N"
"C=CC(=C)CC(OC)CC(C)C","InChI=1S/C11H20O/c1-6-10(4)8-11(12-5)7-9(2)3/h6,9,11H,1,4,7-8H2,2-3,5H3","AYRYNESGTLKBAU-UHFFFAOYSA-N"
"CC(C1)C(CCC1)=NC(C)(C)C","InChI=1S/C11H21N/c1-9-7-5-6-8-10(9)12-11(2,3)4/h9H,5-8H2,1-4H3/b12-10+","KFNAZWBIFXRKJD-ZRDIBKRKSA-N"
"BrCBr","InChI=1S/CH2Br2/c2-1-3/h1H2","FJBFPHVGVWTDIP-UHFFFAOYSA-N"
"CC(C)=O","InChI=1S/C3H6O/c1-3(2)4/h1-2H3","CSCPPACGZOOCGX-UHFFFAOYSA-N"
"CCCCCC","InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3","VLKZOEOYAKHREP-UHFFFAOYSA-N"
"C#C[Si](C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C9H22Si3/c1-9-12(8,10(2,3)4)11(5,6)7/h1H,2-8H3","PWGUZZBESIYXHZ-UHFFFAOYSA-N"
"CC(C)(C)C([H])=C([Si](C)(C)C)[Si](C)(C)Cl","InChI=1S/C11H25ClSi2/c1-11(2,3)9-10(13(4,5)6)14(7,8)12/h9H,1-8H3/b10-9+","DWNGYQWUOSDVAC-MDZDMXLPSA-N"
"c(c2)ccc(c2)[Ge](C)(C)c(c1)cccc1","InChI=1S/C14H16Ge/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3","QTOKZEXKYJMZND-UHFFFAOYSA-N"
"c(c2)ccc(c2)[Si](C)(C)c(c1)cccc1","InChI=1S/C14H16Si/c1-15(2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3","WJKVFIFBAASZJX-UHFFFAOYSA-N"
"c(c1)ccc(c1)C#C[Si](C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C15H26Si3/c1-16(2,3)18(7,17(4,5)6)14-13-15-11-9-8-10-12-15/h8-12H,1-7H3","CLDYVJDWBYFRLX-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)c([Si](C)(C)C)c(c2)c(ccc2)1","InChI=1S/C17H18Si/c1-18(2,3)17-15-10-6-4-8-13(15)12-14-9-5-7-11-16(14)17/h4-12H,1-3H3","BCXUWDHESDSDMJ-UHFFFAOYSA-N"
"C[Si](C)(C)c(c21)c(c3)c(ccc3)c([Si](C)(C)C)c(cccc2)1","InChI=1S/C20H26Si2/c1-21(2,3)19-15-11-7-9-13-17(15)20(22(4,5)6)18-14-10-8-12-16(18)19/h7-14H,1-6H3","BOZCPJYCSHAPRN-UHFFFAOYSA-N"
"SC[Si](C)(C)C","InChI=1S/C4H12SSi/c1-6(2,3)4-5/h5H,4H2,1-3H3","IIYTXTQVIDHSSL-UHFFFAOYSA-N"
"C=CC(=C)CBr","InChI=1S/C5H7Br/c1-3-5(2)4-6/h3H,1-2,4H2","KWEFLUDPRLSSTJ-UHFFFAOYSA-N"
"C=CC(=C)CC(C)O","InChI=1S/C7H12O/c1-4-6(2)5-7(3)8/h4,7-8H,1-2,5H2,3H3","HHQQFJVNLOLQAM-UHFFFAOYSA-N"
"C[Si](C)(C)CC[Si](C)(C)C","InChI=1S/C8H22Si2/c1-9(2,3)7-8-10(4,5)6/h7-8H2,1-6H3","DMKCEJPDZDUPDV-UHFFFAOYSA-N"
"C[Si](C)(C)CSC[Si](C)(C)C","InChI=1S/C8H22SSi2/c1-10(2,3)7-9-8-11(4,5)6/h7-8H2,1-6H3","GISUCMFTNKRCPF-UHFFFAOYSA-N"
"C(C1)C=CC(=C1)O[Si](C)(C)C","InChI=1S/C9H16OSi/c1-11(2,3)10-9-7-5-4-6-8-9/h5,7-8H,4,6H2,1-3H3","WPIRVUXAMPRMAY-UHFFFAOYSA-N"
"O=CCOCc(c1)cccc1","InChI=1S/C9H10O2/c10-6-7-11-8-9-4-2-1-3-5-9/h1-6H,7-8H2","NFNOAHXEQXMCGT-UHFFFAOYSA-N"
"OCCOCc(c1)cccc1","InChI=1S/C9H12O2/c10-6-7-11-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2","CUZKCNWZBXLAJX-UHFFFAOYSA-N"
"C=CCOCc(c1)cccc1","InChI=1S/C10H12O/c1-2-8-11-9-10-6-4-3-5-7-10/h2-7H,1,8-9H2","HUGHWHMUUQNACD-UHFFFAOYSA-N"
"C=CCC(=C)C(O)CC(C)C","InChI=1S/C10H18O/c1-5-6-9(4)10(11)7-8(2)3/h5,8,10-11H,1,4,6-7H2,2-3H3","INNRBDIICBSBPH-UHFFFAOYSA-N"
"CC(C)C(=C(C)C)O[Si](C)(C)C","InChI=1S/C10H22OSi/c1-8(2)10(9(3)4)11-12(5,6)7/h8H,1-7H3","NTNHDIJDGWDRNM-UHFFFAOYSA-N"
"CCCC(C)C(O)CC(=C)C=C","InChI=1S/C11H20O/c1-5-7-10(4)11(12)8-9(3)6-2/h6,10-12H,2-3,5,7-8H2,1,4H3","ILEIVICQNLSORA-UHFFFAOYSA-N"
"C=CC(=C)CC(O)c(c1)cccc1","InChI=1S/C12H14O/c1-3-10(2)9-12(13)11-7-5-4-6-8-11/h3-8,12-13H,1-2,9H2","DRGKXHCIROMRKK-UHFFFAOYSA-N"
"COC(=O)C(C2)CN(C2)Cc(c1)cccc1","InChI=1S/C13H17NO2/c1-16-13(15)12-7-8-14(10-12)9-11-5-3-2-4-6-11/h2-6,12H,7-10H2,1H3","GDWFCUOFVSNTTG-UHFFFAOYSA-N"
"CC(C2)C(=O)C(CC2)Cc(c1)cccc1","InChI=1S/C14H18O/c1-11-6-5-9-13(14(11)15)10-12-7-3-2-4-8-12/h2-4,7-8,11,13H,5-6,9-10H2,1H3/t11-,13+/m1/s1","RADVUEMOCLDJMY-YPMHNXCESA-N"
"c(c2)ccc(c2)CC(C)(C1)C(=O)CCC1","InChI=1S/C14H18O/c1-14(10-6-5-9-13(14)15)11-12-7-3-2-4-8-12/h2-4,7-8H,5-6,9-11H2,1H3","JHMRHFGOPQLVBP-UHFFFAOYSA-N"
"C=C(C2)CC(OC2)COCc(c1)cccc1","InChI=1S/C14H18O2/c1-12-7-8-16-14(9-12)11-15-10-13-5-3-2-4-6-13/h2-6,14H,1,7-11H2","IDIMKXOKGIWVMZ-UHFFFAOYSA-N"
"C=CC(=C)CC(O)COCc(c1)cccc1","InChI=1S/C14H18O2/c1-3-12(2)9-14(15)11-16-10-13-7-5-4-6-8-13/h3-8,14-15H,1-2,9-11H2","JWRUCASEZDOQPK-UHFFFAOYSA-N"
"CCOC(=O)C(C2)CN(C2)Cc(c1)cccc1","InChI=1S/C14H19NO2/c1-2-17-14(16)13-8-9-15(11-13)10-12-6-4-3-5-7-12/h3-7,13H,2,8-11H2,1H3","CYPXEPWPTXKUPL-UHFFFAOYSA-N"
"COC(=O)C(C1)C(C(=O)OC)CN(Cc(c2)cccc2)1","InChI=1S/C15H19NO4/c1-19-14(17)12-9-16(10-13(12)15(18)20-2)8-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3/t12-,13-/m0/s1","JSRVVUSBZJFOJO-STQMWFEESA-N"
"COC(=O)C(C1)C(C(=O)OC)CN(Cc(c2)cccc2)1","InChI=1S/C15H19NO4/c1-19-14(17)12-9-16(10-13(12)15(18)20-2)8-11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3/t12-,13+","JSRVVUSBZJFOJO-BETUJISGSA-N"
"C=CC(=C)CC(O[Si](C)(C)C)c(c1)cccc1","InChI=1S/C15H22OSi/c1-6-13(2)12-15(16-17(3,4)5)14-10-8-7-9-11-14/h6-11,15H,1-2,12H2,3-5H3","XTFVPAAHRMECEV-UHFFFAOYSA-N"
"CC(C1)CC(C)(C)CC1N=C(C2)C(C)CCC2","InChI=1S/C16H29N/c1-12-9-14(11-16(3,4)10-12)17-15-8-6-5-7-13(15)2/h12-14H,5-11H2,1-4H3/b17-15+","QEISLGFRKREVJZ-BMRADRMJSA-N"
"c(c2)ccc(c2)COCC(O1)CC(=CC1)C[Si](C)(C)C","InChI=1S/C17H26O2Si/c1-20(2,3)14-16-9-10-19-17(11-16)13-18-12-15-7-5-4-6-8-15/h4-9,17H,10-14H2,1-3H3","OTXSTMDCYMFJRJ-UHFFFAOYSA-N"
"C=CC(=C)CC(COCc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C17H26O2Si/c1-6-15(2)12-17(19-20(3,4)5)14-18-13-16-10-8-7-9-11-16/h6-11,17H,1-2,12-14H2,3-5H3","IAPWZIJERGMFKY-UHFFFAOYSA-N"
"CC(C4)C(CCC4)=NC(C([H])31)C([H])(C2)CC([H])(CC([H])(C3)2)C1","InChI=1S/C17H27N/c1-11-4-2-3-5-16(11)18-17-14-7-12-6-13(9-14)10-15(17)8-12/h11-15,17H,2-10H2,1H3/b18-16+/t11?,12-,13+,14-,15+,17?","WSEFNHGCDYIOSY-QIXOVXMPSA-N"
"CC(C4)C(CCC4)=NC(C3)(C1)CC([H])(C2)CC([H])(CC([H])23)1","InChI=1S/C17H27N/c1-12-4-2-3-5-16(12)18-17-9-13-6-14(10-17)8-15(7-13)11-17/h12-15H,2-11H2,1H3/b18-16+/t12?,13-,14+,15-,17-","HYDCFZQSWVGFFZ-OZRGJFLCSA-N"
"CC(=O)C(C2)C(CN(Cc(c3)cccc3)2)c(c1)cccc1","InChI=1S/C19H21NO/c1-15(21)18-13-20(12-16-8-4-2-5-9-16)14-19(18)17-10-6-3-7-11-17/h2-11,18-19H,12-14H2,1H3/t18-,19-/m1/s1","XUMMZAHZYIBFES-RTBURBONSA-N"
"CC(O1)CC(=CC1)C[Si](C)(C)C","InChI=1S/C10H20OSi/c1-9-7-10(5-6-11-9)8-12(2,3)4/h5,9H,6-8H2,1-4H3","WOUCLWIGYRWDRJ-UHFFFAOYSA-N"
"","InChI=1S/C7H14OSi/c1-5-7(6-8)9(2,3)4/h5H2,1-4H3","RQSLKPHKSDWYDG-UHFFFAOYSA-N"
"CC=CCO[Si](C)(C)C","InChI=1S/C7H16OSi/c1-5-6-7-8-9(2,3)4/h5-6H,7H2,1-4H3/b6-5+","RQYBDDHHZHXTRM-AATRIKPKSA-N"
"C[Si](C)(C)OC(C)C(C)I","InChI=1S/C7H17IOSi/c1-6(8)7(2)9-10(3,4)5/h6-7H,1-5H3","XZBCZKWFLSEZIK-UHFFFAOYSA-N"
"C(C1)CC(=C1)O[Si](C)(C)C","InChI=1S/C8H16OSi/c1-10(2,3)9-8-6-4-5-7-8/h6H,4-5,7H2,1-3H3","UBMYYGXGMPGCBO-UHFFFAOYSA-N"
"","InChI=1S/C9H18OSi/c1-5-6-7-9(8-10)11(2,3)4/h5-7H2,1-4H3","WWOZYODFTOAQNT-UHFFFAOYSA-N"
"CCCCC(C(O)=O)[Si](C)(C)C","InChI=1S/C9H20O2Si/c1-5-6-7-8(9(10)11)12(2,3)4/h8H,5-7H2,1-4H3,(H,10,11)","YQQCMSGNERDIER-UHFFFAOYSA-N"
"","InChI=1S/C9H20OSi2/c1-7-9(8-10)12(5,6)11(2,3)4/h7H2,1-6H3","FOOSEGCIMSEKQV-UHFFFAOYSA-N"
"CC(=C)C[Si](C)(C)[Si](C)(C)C","InChI=1S/C9H22Si2/c1-9(2)8-11(6,7)10(3,4)5/h1,8H2,2-7H3","ZFYSRCJRMPTMOE-UHFFFAOYSA-N"
"C=CC(=C)CC(O)C=C(C)C","InChI=1S/C10H16O/c1-5-9(4)7-10(11)6-8(2)3/h5-6,10-11H,1,4,7H2,2-3H3","NHMKYUHMPXBMFI-UHFFFAOYSA-N"
"C=CC(=C)CC(O)(CC)CC","InChI=1S/C10H18O/c1-5-9(4)8-10(11,6-2)7-3/h5,11H,1,4,6-8H2,2-3H3","DCURWKJHOAMPCY-UHFFFAOYSA-N"
"c(c1)ccc(c1)O[Si](C)(C)[Si](C)(C)C","InChI=1S/C11H20OSi2/c1-13(2,3)14(4,5)12-11-9-7-6-8-10-11/h6-10H,1-5H3","FSBACNVBMRMBSF-UHFFFAOYSA-N"
"c(c1)ccc(c1)OCC(I)CO[Si](C)(C)C","InChI=1S/C12H19IO2Si/c1-16(2,3)15-10-11(13)9-14-12-7-5-4-6-8-12/h4-8,11H,9-10H2,1-3H3","GMVDFWYKVLJLMT-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O1)C(COC(C)=O)1","InChI=1S/C12H20O3/c1-9(2)6-5-7-12(4)11(15-12)8-14-10(3)13/h6,11H,5,7-8H2,1-4H3","HUUKHKAFVDAFIX-UHFFFAOYSA-N"
"OC(C1)C=CCCCCCCCC1","InChI=1S/C12H22O/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h8,10,12-13H,1-7,9,11H2/b10-8+","HNTAJRDNEDXPDP-CSKARUKUSA-N"
"CCCCC(OC)C(C1)C(=O)CCC1","InChI=1S/C12H22O2/c1-3-4-9-12(14-2)10-7-5-6-8-11(10)13/h10,12H,3-9H2,1-2H3","VETUWLQRWUEGEF-UHFFFAOYSA-N"
"COC(CC(C)C)C(C1)C(=O)CCC1","InChI=1S/C12H22O2/c1-9(2)8-12(14-3)10-6-4-5-7-11(10)13/h9-10,12H,4-8H2,1-3H3","VYNARGPIYFNYEH-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)O[Si](C)(C)C(C)(C)C","InChI=1S/C12H30OSi2/c1-11(2,3)14(7,8)13-15(9,10)12(4,5)6/h1-10H3","FGTJJHCZWOVVNH-UHFFFAOYSA-N"
"C=CC(=C)CC(O)(CC)c(c1)cccc1","InChI=1S/C14H18O/c1-4-12(3)11-14(15,5-2)13-9-7-6-8-10-13/h4,6-10,15H,1,3,5,11H2,2H3","WPSCHDLKCBWLIC-UHFFFAOYSA-N"
"C=CCC(OCC)C=Cc(c1)cccc1","InChI=1S/C14H18O/c1-3-8-14(15-4-2)12-11-13-9-6-5-7-10-13/h3,5-7,9-12,14H,1,4,8H2,2H3/b12-11+","WTTVTGXLZBPQGO-VAWYXSNFSA-N"
"COC(c(c2)cccc2)C(C1)C(=O)CCC1","InChI=1S/C14H18O2/c1-16-14(11-7-3-2-4-8-11)12-9-5-6-10-13(12)15/h2-4,7-8,12,14H,5-6,9-10H2,1H3","LRFLORXTZQEIMB-UHFFFAOYSA-N"
"","InChI=1S/C14H20OSi/c1-6-13(16(3,4)5)14(15-2)12-10-8-7-9-11-12/h7-11,14H,1H2,2-5H3","NDPBSSRBORGJGZ-UHFFFAOYSA-N"
"CN(C)N=C(C1)CCCCCCCCCC1","InChI=1S/C14H28N2/c1-16(2)15-14-12-10-8-6-4-3-5-7-9-11-13-14/h3-13H2,1-2H3","CJCDXLQSYITABD-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)CC(=C(C)C)O[Si](C)(C)C","InChI=1S/C15H24OSi/c1-12(2)15(16-17(4,5)6)11-14-9-7-13(3)8-10-14/h7-10H,11H2,1-6H3","VORDKEHQNNRQAM-UHFFFAOYSA-N"
"CC(C)=CCC=C(C)C(COC(C)=O)O[Si](C)(C)C","InChI=1S/C15H28O3Si/c1-12(2)9-8-10-13(3)15(11-17-14(4)16)18-19(5,6)7/h9-10,15H,8,11H2,1-7H3/b13-10+","UMXASTJSQGQEKV-JLHYYAGUSA-N"
"C(C1)CCCCC(O[Si](C)(C)C)C(I)CCCC1","InChI=1S/C15H31IOSi/c1-18(2,3)17-15-13-11-9-7-5-4-6-8-10-12-14(15)16/h14-15H,4-13H2,1-3H3","VWRHWBFXGSUGKF-UHFFFAOYSA-N"
"C=CC(=C)CC(O[Si](C)(C)C)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C21H26OSi/c1-6-18(2)17-21(22-23(3,4)5,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h6-16H,1-2,17H2,3-5H3","XJINLCNJCGOXLL-UHFFFAOYSA-N"
"[H]C(=C([H])1)c(c3)c(ccc3)C(O[Si](C)(C)C)(C2)C12","InChI=1S/C14H18OSi/c1-16(2,3)15-14-10-12(14)9-8-11-6-4-5-7-13(11)14/h4-9,12H,10H2,1-3H3","NVCXNMKGYXZWTB-UHFFFAOYSA-N"
"C=CC([H])(C)CCC([H])(O)CC(O)=O","InChI=1S/C9H16O3/c1-3-7(2)4-5-8(10)6-9(11)12/h3,7-8,10H,1,4-6H2,2H3,(H,11,12)/t7-,8-/m1/s1","SEQZGKLDVAFWFH-HTQZYQBOSA-N"
"COC(=O)CC(=O)CCC([H])(C)C=C","InChI=1S/C10H16O3/c1-4-8(2)5-6-9(11)7-10(12)13-3/h4,8H,1,5-7H2,2-3H3/t8-/m0/s1","FXNVRMBZSUERST-QMMMGPOBSA-N"
"C=CC([H])(C)CCC(O)C(C)(C)O","InChI=1S/C10H20O2/c1-5-8(2)6-7-9(11)10(3,4)12/h5,8-9,11-12H,1,6-7H2,2-4H3/t8-,9?/m1/s1","SKKRPDNROZIXRQ-VEDVMXKPSA-N"
"COC(=O)CC([H])(CCC(C)=C)O[Si](C)(C)C(C)(C)C","InChI=1S/C15H30O3Si/c1-12(2)9-10-13(11-14(16)17-6)18-19(7,8)15(3,4)5/h13H,1,9-11H2,2-8H3/t13-/m0/s1","YEMXHOTUYCMZCA-ZDUSSCGKSA-N"
"CCOC(=O)CC(O)CCC(C)CO","InChI=1S/C10H20O4/c1-3-14-10(13)6-9(12)5-4-8(2)7-11/h8-9,11-12H,3-7H2,1-2H3","YPCNANLFKWKHGY-UHFFFAOYSA-N"
"COCSCC([H])(C(C)=O)N(COC)S(=O)(=O)c(c1)ccc(C)c1","InChI=1S/C15H23NO5S2/c1-12-5-7-14(8-6-12)23(18,19)16(10-20-3)15(13(2)17)9-22-11-21-4/h5-8,15H,9-11H2,1-4H3/t15-/m0/s1","WUUHDLJAUOYTGW-HNNXBMFYSA-N"
"CC(C)(C)OC(=O)N(C(C)(C)1)C([H])(C(O)=O)CS1","InChI=1S/C11H19NO4S/c1-10(2,3)16-9(15)12-7(8(13)14)6-17-11(12,4)5/h7H,6H2,1-5H3,(H,13,14)/t7-/m0/s1","MYZNHPUWNUGYOV-ZETCQYMHSA-N"
"CC(=C)CCC([H])(CC=C(Br)Br)O[Si](C)(C)C(C)(C)C","InChI=1S/C15H28Br2OSi/c1-12(2)8-9-13(10-11-14(16)17)18-19(6,7)15(3,4)5/h11,13H,1,8-10H2,2-7H3/t13-/m1/s1","FWVRPCYAGGNTIN-CYBMUJFWSA-N"
"COC(=O)CC([H])(CCC([H])(C)CO)O[Si](C)(C)C(C)(C)C","InChI=1S/C15H32O4Si/c1-12(11-16)8-9-13(10-14(17)18-5)19-20(6,7)15(2,3)4/h12-13,16H,8-11H2,1-7H3/t12-,13+/m1/s1","VROGZUFDXZTPLH-OLZOCXBDSA-N"
"C#CCC([H])(CCC(C)=C)O[Si](C)(C)C(C)(C)C","InChI=1S/C15H28OSi/c1-9-10-14(12-11-13(2)3)16-17(7,8)15(4,5)6/h1,14H,2,10-12H2,3-8H3/t14-/m0/s1","GCIMFTUZRIVFQX-AWEZNQCLSA-N"
"CC(=C3)C([H])(C1)C(C3)(C(C)2)C([H])(CC2)C(C)(C)1","InChI=1S/C15H24/c1-10-7-8-15-11(2)5-6-13(15)14(3,4)9-12(10)15/h7,11-13H,5-6,8-9H2,1-4H3/t11-,12-,13+,15?/m0/s1","LWRQYYJLZXHPGU-KIFYNCCSSA-N"
"CC(=C3)C([H])(C1)C(C3)(C(C)2)C([H])(CC2)C(C)(C)1","InChI=1S/C15H24/c1-10-7-8-15-11(2)5-6-13(15)14(3,4)9-12(10)15/h7,11-13H,5-6,8-9H2,1-4H3/t11-,12+,13-,15?/m1/s1","LWRQYYJLZXHPGU-WORDMNGFSA-N"
"[H]C(C1)=C(C)C([H])(C2)C1(C(C)=3)C([H])(CC([H])3)C(C)(C)2","InChI=1S/C15H22/c1-10-7-8-15-11(2)5-6-13(15)14(3,4)9-12(10)15/h5,7,12-13H,6,8-9H2,1-4H3/t12-,13-,15?/m0/s1","PPDDONAZHVVWRL-QNIGDANOSA-N"
"COC(C)(C3)C([H])(C1)C(C3)(C(C)2)C([H])(CC2)C(C)(C)1","InChI=1S/C16H28O/c1-11-6-7-12-14(2,3)10-13-15(4,17-5)8-9-16(11,12)13/h11-13H,6-10H2,1-5H3/t11-,12-,13-,15?,16?/m1/s1","CVNPSGGDEFXAEB-YYVONYOCSA-N"
"COC(C)(C3)C([H])(C1)C(C3)(C(=O)2)C([H])(CC2)C(C)(C)1","InChI=1S/C15H24O2/c1-13(2)9-11-14(3,17-4)7-8-15(11)10(13)5-6-12(15)16/h10-11H,5-9H2,1-4H3/t10-,11-,14?,15?/m0/s1","VXTCXUMTNXUWOH-WZWWUGBPSA-N"
"CC(=C3)C([H])(C1)C(C3)(C(C)(O)2)C([H])(CC2)C(C)(C)1","InChI=1S/C15H24O/c1-10-5-8-15-11(10)9-13(2,3)12(15)6-7-14(15,4)16/h5,11-12,16H,6-9H2,1-4H3/t11-,12-,14-,15?/m0/s1","FNKOBTLLTLYZCA-GHJRKTJFSA-N"
"OCCC(C)(OC)C([H])(C1)C([H])(C(=O)2)C([H])(CC2)C(C)(C)1","InChI=1S/C15H26O3/c1-14(2)9-11(15(3,18-4)7-8-16)13-10(14)5-6-12(13)17/h10-11,13,16H,5-9H2,1-4H3/t10-,11+,13+,15?/m1/s1","JTROQJOPIHBYFP-GXBCUXGNSA-N"
"C=CCC(C)(OC)C([H])(C1)C([H])(C(O3)(OCC3)2)C([H])(CC2)C(C)(C)1","InChI=1S/C18H30O3/c1-6-8-17(4,19-5)14-12-16(2,3)13-7-9-18(15(13)14)20-10-11-21-18/h6,13-15H,1,7-12H2,2-5H3/t13-,14+,15+,17?/m1/s1","GPQVBASQDOISCO-IHDLAIGLSA-N"
"OC(=O)C(C1)C([H])(C(=O)2)C([H])(CC2)C(C)(C)1","InChI=1S/C11H16O3/c1-11(2)5-6(10(13)14)9-7(11)3-4-8(9)12/h6-7,9H,3-5H2,1-2H3,(H,13,14)/t6-,7-,9-/m0/s1","VNKZYSGDHSDEJM-ZKWXMUAHSA-N"
"COC(=O)C([H])(C1)C([H])(C(O3)(OCC3)2)C([H])(CC2)C(C)(C)1","InChI=1S/C14H22O4/c1-13(2)8-9(12(15)16-3)11-10(13)4-5-14(11)17-6-7-18-14/h9-11H,4-8H2,1-3H3/t9-,10-,11-/m0/s1","INVVHQQCLLVADX-DCAQKATOSA-N"
"COC(=O)C([H])(C1)C([H])(C(=O)2)C([H])(CC2)C(C)(C)1","InChI=1S/C12H18O3/c1-12(2)6-7(11(14)15-3)10-8(12)4-5-9(10)13/h7-8,10H,4-6H2,1-3H3/t7-,8+,10+/m1/s1","LREQCMQOLDGAAD-WEDXCCLWSA-N"
"CC(=O)C([H])(C1)C([H])(C(O3)(OCC3)2)C([H])(CC2)C(C)(C)1","InChI=1S/C14H22O3/c1-9(15)10-8-13(2,3)11-4-5-14(12(10)11)16-6-7-17-14/h10-12H,4-8H2,1-3H3/t10-,11-,12-/m1/s1","YPXZNWIYKCDQTL-IJLUTSLNSA-N"
"COC(=O)CC([H])(O)CCC([H])(C)COCc(c1)cccc1","InChI=1S/C16H24O4/c1-13(8-9-15(17)10-16(18)19-2)11-20-12-14-6-4-3-5-7-14/h3-7,13,15,17H,8-12H2,1-2H3/t13-,15+/m0/s1","QVGVKFGXEZCYDP-DZGCQCFKSA-N"
"CCOC(=O)NC([H])(C(C)=O)CSC(C)(C)C","InChI=1S/C11H21NO3S/c1-6-15-10(14)12-9(8(2)13)7-16-11(3,4)5/h9H,6-7H2,1-5H3,(H,12,14)/t9-/m0/s1","BAGLPLXESBBWNF-VIFPVBQESA-N"
"CCOC(=O)CC(=O)CCC([H])(C)COCc(c1)cccc1","InChI=1S/C17H24O4/c1-3-21-17(19)11-16(18)10-9-14(2)12-20-13-15-7-5-4-6-8-15/h4-8,14H,3,9-13H2,1-2H3/t14-/m0/s1","LEEPODDEDSUGBS-AWEZNQCLSA-N"
"Cc(c3)ccc(c3)S(=O)(=O)OCC([H])(O1)C([H])(COS(=O)(=O)c(c2)ccc(C)c2)OC(C)(C)1","InChI=1S/C21H26O8S2/c1-15-5-9-17(10-6-15)30(22,23)26-13-19-20(29-21(3,4)28-19)14-27-31(24,25)18-11-7-16(2)8-12-18/h5-12,19-20H,13-14H2,1-4H3/t19-,20-/m0/s1","KPFDKWNWYAXRNJ-PMACEKPBSA-N"
"COCC([H])(O1)C([H])(COC)OC(C=C)1","InChI=1S/C9H16O4/c1-4-9-12-7(5-10-2)8(13-9)6-11-3/h4,7-9H,1,5-6H2,2-3H3/t7-,8-/m0/s1","PRCMBYCDAYQMTC-YUMQZZPRSA-N"
"COCC([H])(O1)C([H])(COC)OC(CCCl)1","InChI=1S/C9H17ClO4/c1-11-5-7-8(6-12-2)14-9(13-7)3-4-10/h7-9H,3-6H2,1-2H3/t7-,8-/m0/s1","GVJGBRWIWGNQMU-YUMQZZPRSA-N"
"COCC([H])(O1)C([H])(COC)OC(CBr)1","InChI=1S/C8H15BrO4/c1-10-4-6-7(5-11-2)13-8(3-9)12-6/h6-8H,3-5H2,1-2H3/t6-,7-/m0/s1","SUPVKDYNFYJGPT-BQBZGAKWSA-N"
"COCC([H])(O)C([H])(O)COC","InChI=1S/C6H14O4/c1-9-3-5(7)6(8)4-10-2/h5-8H,3-4H2,1-2H3/t5-,6-/m0/s1","QPXJVYUZWDGUBO-WDSKDSINSA-N"
"c(c2)ccc(c2)COCC([H])(O)C([H])(O)COCc(c1)cccc1","InChI=1S/C18H22O4/c19-17(13-21-11-15-7-3-1-4-8-15)18(20)14-22-12-16-9-5-2-6-10-16/h1-10,17-20H,11-14H2/t17-,18-/m0/s1","YAVAVQDYJARRAU-ROUUACIJSA-N"
"COCC([H])(O1)C([H])(COC)OC(C)(C)1","InChI=1S/C9H18O4/c1-9(2)12-7(5-10-3)8(13-9)6-11-4/h7-8H,5-6H2,1-4H3/t7-,8-/m0/s1","KAQOEQVWUJDLKN-YUMQZZPRSA-N"
"OCC([H])(O1)C([H])(CO)OC(C)(C)1","InChI=1S/C7H14O4/c1-7(2)10-5(3-8)6(4-9)11-7/h5-6,8-9H,3-4H2,1-2H3/t5-,6-/m0/s1","INVRLGIKFANLFP-WDSKDSINSA-N"
"COCC([H])(O1)C([H])(COC)OC(C(C)Br)1","InChI=1S/C9H17BrO4/c1-6(10)9-13-7(4-11-2)8(14-9)5-12-3/h6-9H,4-5H2,1-3H3/t6?,7-,8-/m0/s1","LCTPJEBXTXYYCG-ALKRTJFJSA-N"
"COCC([H])(O1)C([H])(COC)OC(=CC)1","InChI=1S/C9H16O4/c1-4-9-12-7(5-10-2)8(13-9)6-11-3/h4,7-8H,5-6H2,1-3H3/t7-,8-/m0/s1","XTCIDCFOYMSRFH-YUMQZZPRSA-N"
"COCC([H])(O1)C([H])(COC)OC(=C)1","InChI=1S/C8H14O4/c1-6-11-7(4-9-2)8(12-6)5-10-3/h7-8H,1,4-5H2,2-3H3/t7-,8-/m0/s1","MADXUPNXPHSEEM-YUMQZZPRSA-N"
"CCOC(=O)C([H])(O1)C([H])(C(=O)OCC)OC(C)(C)1","InChI=1S/C11H18O6/c1-5-14-9(12)7-8(10(13)15-6-2)17-11(3,4)16-7/h7-8H,5-6H2,1-4H3/t7-,8-/m1/s1","MCNKHXZIPATURB-HTQZYQBOSA-N"
"OC(=O)C([H])(C1)NC(=O)S1","InChI=1S/C4H5NO3S/c6-3(7)2-1-9-4(8)5-2/h2H,1H2,(H,5,8)(H,6,7)/t2-/m0/s1","BMLMGCPTLHPWPY-REOHCLBHSA-N"
"OCC([H])(C1)N(C(=O)OC(C)(C)C)C(C)(C)S1","InChI=1S/C11H21NO3S/c1-10(2,3)15-9(14)12-8(6-13)7-16-11(12,4)5/h8,13H,6-7H2,1-5H3/t8-/m1/s1","SCBRLOVJYLTKIS-MRVPVSSYSA-N"
"OC(=O)C([H])(C1)NC(C)(C)S1","InChI=1S/C6H11NO2S/c1-6(2)7-4(3-10-6)5(8)9/h4,7H,3H2,1-2H3,(H,8,9)/t4-/m0/s1","OCQICQZUUHJWGZ-BYPYZUCNSA-N"
"C#CCC([H])(CCC([H])(C)C=C)O[Si](C)(C)C(C)(C)C","InChI=1S/C16H30OSi/c1-9-11-15(13-12-14(3)10-2)17-18(7,8)16(4,5)6/h1,10,14-15H,2,11-13H2,3-8H3/t14-,15+/m1/s1","HQRSOAULAMQNDH-CABCVRRESA-N"
"COC(=O)C(C1)C([H])(C(=O)2)C([H])(CC2)C(C)(C)1","InChI=1S/C12H18O3/c1-12(2)6-7(11(14)15-3)10-8(12)4-5-9(10)13/h7-8,10H,4-6H2,1-3H3/t7-,8-,10-/m0/s1","LREQCMQOLDGAAD-NRPADANISA-N"
"C[Si](C)(C)CI","InChI=1S/C4H11ISi/c1-6(2,3)4-5/h4H2,1-3H3","VZNYXGQMDSRJAL-UHFFFAOYSA-N"
"COC(=O)C#CC(=O)OC","InChI=1S/C6H6O4/c1-9-5(7)3-4-6(8)10-2/h1-2H3","VHILMKFSCRWWIJ-UHFFFAOYSA-N"
"OC(=O)C(C)(C1)C(C)(C)C([H])(C)C1","InChI=1S/C10H18O2/c1-7-5-6-10(4,8(11)12)9(7,2)3/h7H,5-6H2,1-4H3,(H,11,12)/t7-,10+/m1/s1","JDFOIACPOPEQLS-XCBNKYQSSA-N"
"CC(C1)CC(O)C(C1)C(C)C","InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9+,10-/m1/s1","NOOLISFMXDJSKH-KXUCPTDWSA-N"
"CC(=O)C(C)(C1)C(C)(C)C(C)C1","InChI=1S/C11H20O/c1-8-6-7-11(5,9(2)12)10(8,3)4/h8H,6-7H2,1-5H3","RUPLXQJJFFMCOX-UHFFFAOYSA-N"
"CC(C2)CN(C2)Cc(c1)cccc1","InChI=1S/C12H17N/c1-11-7-8-13(9-11)10-12-5-3-2-4-6-12/h2-6,11H,7-10H2,1H3","MJIUUKUNEAAVEV-UHFFFAOYSA-N"
"OCC(C2)CN(C2)Cc(c1)cccc1","InChI=1S/C12H17NO/c14-10-12-6-7-13(9-12)8-11-4-2-1-3-5-11/h1-5,12,14H,6-10H2","QPQQBJDSKDWQMJ-UHFFFAOYSA-N"
"c(c1)ccc(c1)C[Si](C)(C)C","InChI=1S/C10H16Si/c1-11(2,3)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3","MRIWRLGWLMRJIW-UHFFFAOYSA-N"
"COC(=O)C(C1)C(C(=O)OC)CN(CCc(c2)cccc2)1","InChI=1S/C16H21NO4/c1-20-15(18)13-10-17(11-14(13)16(19)21-2)9-8-12-6-4-3-5-7-12/h3-7,13-14H,8-11H2,1-2H3","RMWZNMIFTKZUCP-UHFFFAOYSA-N"
"CC(C)C(C3)CCC(C)(C3)OC(=O)C(C2)CN(C2)Cc(c1)cccc1","InChI=1S/C22H33NO2/c1-17(2)19-9-12-22(3,13-10-19)25-21(24)20-11-14-23(16-20)15-18-7-5-4-6-8-18/h4-8,17,19-20H,9-16H2,1-3H3","ULEFDVPTRAHPIR-UHFFFAOYSA-N"
"CC(C)(O)C(C1)C1","InChI=1S/C6H12O/c1-6(2,7)5-3-4-5/h5,7H,3-4H2,1-2H3","ITQVACMQJLOIDS-UHFFFAOYSA-N"
"CC(C)C(C1)C=CC(=O)C1","InChI=1S/C9H14O/c1-7(2)8-3-5-9(10)6-4-8/h3,5,7-8H,4,6H2,1-2H3","AANMVENRNJYEMK-UHFFFAOYSA-N"
"COC(=O)C(C1)CC(O)C(=C)C1","InChI=1S/C9H14O3/c1-6-3-4-7(5-8(6)10)9(11)12-2/h7-8,10H,1,3-5H2,2H3","XQBZFGGJIWUYCF-UHFFFAOYSA-N"
"C=CC(=O)CCC=C(C)C","InChI=1S/C9H14O/c1-4-9(10)7-5-6-8(2)3/h4,6H,1,5,7H2,2-3H3","FVAZRTUEFHNRTR-UHFFFAOYSA-N"
"CC(C)=CC(=C)O[Si](C)(C)C","InChI=1S/C9H18OSi/c1-8(2)7-9(3)10-11(4,5)6/h7H,3H2,1-2,4-6H3","DKSBCCBPNYPGQP-UHFFFAOYSA-N"
"O=C(C2)C(C1)C(C2)CC(=C1)C[Si](C)(C)C","InChI=1S/C13H22OSi/c1-15(2,3)9-10-4-6-12-11(8-10)5-7-13(12)14/h4,11-12H,5-9H2,1-3H3","HNVXPSNCOVLESZ-UHFFFAOYSA-N"
"O=C(C2)C(C1)C(C2)CC=C(C[Si](C)(C)C)1","InChI=1S/C13H22OSi/c1-15(2,3)9-10-4-5-11-6-7-13(14)12(11)8-10/h4,11-12H,5-9H2,1-3H3","URLCUOXPPURWLW-UHFFFAOYSA-N"
"c(c2)ccc(c2)C=Cc(c1)cccc1","InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H/b12-11+","PJANXHGTPQOBST-VAWYXSNFSA-N"
"CC(C)C(C1)C(C2)C(CC(=C2)C[Si](C)(C)C)C(=O)C1","InChI=1S/C17H30OSi/c1-12(2)14-8-9-17(18)16-10-13(6-7-15(14)16)11-19(3,4)5/h6,12,14-16H,7-11H2,1-5H3","HLPZCWLAJKNQBB-UHFFFAOYSA-N"
"CC(C)C(C1)C(C2)C(CC=C(C[Si](C)(C)C)2)C(=O)C1","InChI=1S/C17H30OSi/c1-12(2)14-8-9-17(18)15-7-6-13(10-16(14)15)11-19(3,4)5/h6,12,14-16H,7-11H2,1-5H3","ROXCJFJOMADILD-UHFFFAOYSA-N"
"CC(C)=CCCC(=O)C(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C17H30OSi/c1-14(2)7-6-8-17(18)16-11-9-15(10-12-16)13-19(3,4)5/h7,9,16H,6,8,10-13H2,1-5H3","LBAPEYHQZIRTRZ-UHFFFAOYSA-N"
"CC(C)C(C1)C(C2)C(CC(=C2)C[Si](C)(C)C)C(=C)C1","InChI=1S/C18H32Si/c1-13(2)16-9-7-14(3)18-11-15(8-10-17(16)18)12-19(4,5)6/h8,13,16-18H,3,7,9-12H2,1-2,4-6H3","UJRQRJJLPSKUKJ-UHFFFAOYSA-N"
"CC(C)C(C1)C(C2)C(CC=C(C[Si](C)(C)C)2)C(=C)C1","InChI=1S/C18H32Si/c1-13(2)16-9-7-14(3)17-10-8-15(11-18(16)17)12-19(4,5)6/h8,13,16-18H,3,7,9-12H2,1-2,4-6H3","MDIMFWRFBWZBBF-UHFFFAOYSA-N"
"CCOC(=O)CCC(=O)OCC","InChI=1S/C8H14O4/c1-3-11-7(9)5-6-8(10)12-4-2/h3-6H2,1-2H3","DKMROQRQHGEIOW-UHFFFAOYSA-N"
"CSC(SC)c(c1)occ1","InChI=1S/C7H10OS2/c1-9-7(10-2)6-4-3-5-8-6/h3-5,7H,1-2H3","MCRPOGXLCLGHDT-UHFFFAOYSA-N"
"C=CCC(=O)c(c1)occ1","InChI=1S/C8H8O2/c1-2-4-7(9)8-5-3-6-10-8/h2-3,5-6H,1,4H2","INHOSYWZGAASRA-UHFFFAOYSA-N"
"COCSc(c1)cccc1","InChI=1S/C8H10OS/c1-9-7-10-8-5-3-2-4-6-8/h2-6H,7H2,1H3","QPXQVNXSQCRWEV-UHFFFAOYSA-N"
"C=CCC(O)c(o1)c([H])c([H])c([H])1","InChI=1S/C8H10O2/c1-2-4-7(9)8-5-3-6-10-8/h2-3,5-7,9H,1,4H2","LCSKPZJIQPMRAV-UHFFFAOYSA-N"
"C=CCC(O)c(c([H])1)c([H])c([H])o1","InChI=1S/C8H10O2/c1-2-3-8(9)7-4-5-10-6-7/h2,4-6,8-9H,1,3H2","YFOVGIPVIZYMST-UHFFFAOYSA-N"
"CC(=O)COc(c1)cccc1","InChI=1S/C9H10O2/c1-8(10)7-11-9-5-3-2-4-6-9/h2-6H,7H2,1H3","QWAVNXZAQASOML-UHFFFAOYSA-N"
"CCOC(=O)CC(C=O)C(=O)OCC","InChI=1S/C9H14O5/c1-3-13-8(11)5-7(6-10)9(12)14-4-2/h6-7H,3-5H2,1-2H3","LHHLYOVYBZWIGM-UHFFFAOYSA-N"
"C=CC(C)(C)C(=O)c(c1)coc1","InChI=1S/C10H12O2/c1-4-10(2,3)9(11)8-5-6-12-7-8/h4-7H,1H2,2-3H3","CJCMABCNODTCIC-UHFFFAOYSA-N"
"CCOC(=O)C(C=O)C(C=O)C(=O)OCC","InChI=1S/C10H14O6/c1-3-15-9(13)7(5-11)8(6-12)10(14)16-4-2/h5-8H,3-4H2,1-2H3","AEISKPJPXBJHSV-UHFFFAOYSA-N"
"c(c1)ccc(c1)SC[Si](C)(C)C","InChI=1S/C10H16SSi/c1-12(2,3)9-11-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3","UOQDIMYVQSHALM-UHFFFAOYSA-N"
"CSC(SC)CCc(c1)cccc1","InChI=1S/C11H16S2/c1-12-11(13-2)9-8-10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3","DOUCNIUISDRCHR-UHFFFAOYSA-N"
"CN(C)C[Si](C)(C)c(c1)cccc1","InChI=1S/C11H19NSi/c1-12(2)10-13(3,4)11-8-6-5-7-9-11/h5-9H,10H2,1-4H3","YWEUYNRHLCXDKJ-UHFFFAOYSA-N"
"c(c1)ccc(c1)CNC[Si](C)(C)C","InChI=1S/C11H19NSi/c1-13(2,3)10-12-9-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3","WECLUYCAWLJMKM-UHFFFAOYSA-N"
"C=CCC(SC)c(c1)ccc(OC)c1","InChI=1S/C12H16OS/c1-4-5-12(14-3)10-6-8-11(13-2)9-7-10/h4,6-9,12H,1,5H2,2-3H3","WEYDOWYVKXIWLV-UHFFFAOYSA-N"
"O=C(COc(c1)cccc1)C[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-15(2,3)10-11(13)9-14-12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3","NRAWMMGVSRRVSR-UHFFFAOYSA-N"
"CC(=O)C(C2)CC(O1)C(C2)(C[Si](C)(C)C)1","InChI=1S/C12H22O2Si/c1-9(13)10-5-6-12(8-15(2,3)4)11(7-10)14-12/h10-11H,5-8H2,1-4H3","SMCFBVDPIWMNCF-UHFFFAOYSA-N"
"COC(=O)C(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C12H22O2Si/c1-14-12(13)11-7-5-10(6-8-11)9-15(2,3)4/h5,11H,6-9H2,1-4H3","DBBWPGOLVKGOEO-UHFFFAOYSA-N"
"CCOC(=O)CC(C(=O)OCC)C(OCC)OCC","InChI=1S/C13H24O6/c1-5-16-11(14)9-10(12(15)17-6-2)13(18-7-3)19-8-4/h10,13H,5-9H2,1-4H3","XKFYOTHOBBFZSE-UHFFFAOYSA-N"
"C=CCC(SC)CCc(c1)cccc1","InChI=1S/C13H18S/c1-3-7-13(14-2)11-10-12-8-5-4-6-9-12/h3-6,8-9,13H,1,7,10-11H2,2H3","QLNCUBLOWMDGLA-UHFFFAOYSA-N"
"O=C(C2)C(C1)C(CC2)CC=C(C[Si](C)(C)C)1","InChI=1S/C14H24OSi/c1-16(2,3)10-11-7-8-12-5-4-6-14(15)13(12)9-11/h7,12-13H,4-6,8-10H2,1-3H3","VTSZSPVMHBJJIS-UHFFFAOYSA-N"
"CC(C)=CCCC(=C)C(C1)CCC(=C)C1","InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,15H,3-5,7-11H2,1-2H3","XMGWPQCLCZIWPP-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(SC)CC(SC)C[Si](C)(C)C","InChI=1S/C16H28OS2Si/c1-17-14-9-7-13(8-10-14)16(19-3)11-15(18-2)12-20(4,5)6/h7-10,15-16H,11-12H2,1-6H3","UBRRIEQBDLWYEF-UHFFFAOYSA-N"
"CC(C)C(C1)C(C2)C(CC=C(C[Si](C)(C)C)2)C(O)(C1)C[Si](C)(C)C","InChI=1S/C21H42OSi2/c1-16(2)18-11-12-21(22,15-24(6,7)8)20-10-9-17(13-19(18)20)14-23(3,4)5/h9,16,18-20,22H,10-15H2,1-8H3","QETFXHFDVNOOAZ-UHFFFAOYSA-N"
"COC(C)CCOC(C)=O","InChI=1S/C7H14O3/c1-6(9-3)4-5-10-7(2)8/h6H,4-5H2,1-3H3","QMYGFTJCQFEDST-UHFFFAOYSA-N"
"COC(C)(C)CCOC(C)=O","InChI=1S/C8H16O3/c1-7(9)11-6-5-8(2,3)10-4/h5-6H2,1-4H3","RYNQKSJRFHJZTK-UHFFFAOYSA-N"
"CC(=O)OCCOc(c1)cccc1","InChI=1S/C10H12O3/c1-9(11)12-7-8-13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3","WHFKYDMBUMLWDA-UHFFFAOYSA-N"
"CCCCCCCCCCCCOC(C)=O","InChI=1S/C14H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h3-13H2,1-2H3","VZWGRQBCURJOMT-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCC(=O)OCC","InChI=1S/C20H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h11-12H,3-10,13-19H2,1-2H3/b12-11-","LVGKNOAMLMIIKO-QXMHVHEDSA-N"
"CC(=O)OCc(c1)occ1","InChI=1S/C7H8O3/c1-6(8)10-5-7-3-2-4-9-7/h2-4H,5H2,1H3","CKOYRRWBOKMNRG-UHFFFAOYSA-N"
"CC(=O)OCC=Cc(c1)cccc1","InChI=1S/C11H12O2/c1-10(12)13-9-5-8-11-6-3-2-4-7-11/h2-8H,9H2,1H3/b8-5+","WJSDHUCWMSHDCR-VMPITWQZSA-N"
"CCCCOC(=O)C=C","InChI=1S/C7H12O2/c1-3-5-6-9-7(8)4-2/h4H,2-3,5-6H2,1H3","CQEYYJKEWSMYFG-UHFFFAOYSA-N"
"C=CC(=O)OCC(C)C","InChI=1S/C7H12O2/c1-4-7(8)9-5-6(2)3/h4,6H,1,5H2,2-3H3","CFVWNXQPGQOHRJ-UHFFFAOYSA-N"
"C=COC(=O)CC","InChI=1S/C5H8O2/c1-3-5(6)7-4-2/h4H,2-3H2,1H3","UIWXSTHGICQLQT-UHFFFAOYSA-N"
"CCC(=O)OC(C1)CCCC1","InChI=1S/C9H16O2/c1-2-9(10)11-8-6-4-3-5-7-8/h8H,2-7H2,1H3","MAMMVUWCKMOLSG-UHFFFAOYSA-N"
"CCC(=O)Oc(c1)cccc1","InChI=1S/C9H10O2/c1-2-9(10)11-8-6-4-3-5-7-8/h3-7H,2H2,1H3","DYUMLJSJISTVPV-UHFFFAOYSA-N"
"CCCC(=O)OC","InChI=1S/C5H10O2/c1-3-4-5(6)7-2/h3-4H2,1-2H3","UUIQMZJEGPQKFD-UHFFFAOYSA-N"
"CCCC(=O)OCC","InChI=1S/C6H12O2/c1-3-5-6(7)8-4-2/h3-5H2,1-2H3","OBNCKNCVKJNDBV-UHFFFAOYSA-N"
"CCCOC(=O)CCC","InChI=1S/C7H14O2/c1-3-5-7(8)9-6-4-2/h3-6H2,1-2H3","HUAZGNHGCJGYNP-UHFFFAOYSA-N"
"CCCC(=O)OC(C)C","InChI=1S/C7H14O2/c1-4-5-7(8)9-6(2)3/h6H,4-5H2,1-3H3","FFOPEPMHKILNIT-UHFFFAOYSA-N"
"CCCC(=O)OCC(C)C","InChI=1S/C8H16O2/c1-4-5-8(9)10-6-7(2)3/h7H,4-6H2,1-3H3","RGFNRWTWDWVHDD-UHFFFAOYSA-N"
"CCCCCOC(=O)CCC","InChI=1S/C9H18O2/c1-3-5-6-8-11-9(10)7-4-2/h3-8H2,1-2H3","CFNJLPHOBMVMNS-UHFFFAOYSA-N"
"CCCC(=O)OCCC(C)C","InChI=1S/C9H18O2/c1-4-5-9(10)11-7-6-8(2)3/h8H,4-7H2,1-3H3","PQLMXFQTAMDXIZ-UHFFFAOYSA-N"
"CCCC(=O)OC=C","InChI=1S/C6H10O2/c1-3-5-6(7)8-4-2/h4H,2-3,5H2,1H3","MEGHWIAOTJPCHQ-UHFFFAOYSA-N"
"CCCC(=O)OC(C1)CCCC1","InChI=1S/C10H18O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h9H,2-8H2,1H3","VZHUBBUZNIULNM-UHFFFAOYSA-N"
"CCCC(=O)OCc(c1)cccc1","InChI=1S/C11H14O2/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3","VONGZNXBKCOUHB-UHFFFAOYSA-N"
"COC(=O)C(C)C","InChI=1S/C5H10O2/c1-4(2)5(6)7-3/h4H,1-3H3","BHIWKHZACMWKOJ-UHFFFAOYSA-N"
"CCOC(=O)C(C)C","InChI=1S/C6H12O2/c1-4-8-6(7)5(2)3/h5H,4H2,1-3H3","WDAXFOBOLVPGLV-UHFFFAOYSA-N"
"CCCOC(=O)C(C)C","InChI=1S/C7H14O2/c1-4-5-9-7(8)6(2)3/h6H,4-5H2,1-3H3","AZFUASHXSOTBNU-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C)C","InChI=1S/C7H14O2/c1-5(2)7(8)9-6(3)4/h5-6H,1-4H3","WVRPFQGZHKZCEB-UHFFFAOYSA-N"
"CCCCOC(=O)C(C)C","InChI=1S/C8H16O2/c1-4-5-6-10-8(9)7(2)3/h7H,4-6H2,1-3H3","JSLCOZYBKYHZNL-UHFFFAOYSA-N"
"CC(C)COC(=O)C(C)C","InChI=1S/C8H16O2/c1-6(2)5-10-8(9)7(3)4/h6-7H,5H2,1-4H3","RXGUIWHIADMCFC-UHFFFAOYSA-N"
"CCNCC","InChI=1S/C4H11N/c1-3-5-4-2/h5H,3-4H2,1-2H3","HPNMFZURTQLUMO-UHFFFAOYSA-N"
"CCCNCC","InChI=1S/C5H13N/c1-3-5-6-4-2/h6H,3-5H2,1-2H3","XCVNDBIXFPGMIW-UHFFFAOYSA-N"
"CCCCNCC","InChI=1S/C6H15N/c1-3-5-6-7-4-2/h7H,3-6H2,1-2H3","QHCCDDQKNUYGNC-UHFFFAOYSA-N"
"CCCNCCC","InChI=1S/C6H15N/c1-3-5-7-6-4-2/h7H,3-6H2,1-2H3","WEHWNAOGRSTTBQ-UHFFFAOYSA-N"
"CC(C)NC(C)C","InChI=1S/C6H15N/c1-5(2)7-6(3)4/h5-7H,1-4H3","UAOMVDZJSHZZME-UHFFFAOYSA-N"
"CC(C)CNCC(C)C","InChI=1S/C8H19N/c1-7(2)5-9-6-8(3)4/h7-9H,5-6H2,1-4H3","NJBCRXCAPCODGX-UHFFFAOYSA-N"
"NC(C1)CCCC1","InChI=1S/C6H13N/c7-6-4-2-1-3-5-6/h6H,1-5,7H2","PAFZNILMFXTMIY-UHFFFAOYSA-N"
"C(C2)Cc(c1)c(N2)ccc1","InChI=1S/C9H11N/c1-2-6-9-8(4-1)5-3-7-10-9/h1-2,4,6,10H,3,5,7H2","LBUJPTNKIBCYBY-UHFFFAOYSA-N"
"CC#N","InChI=1S/C2H3N/c1-2-3/h1H3","WEVYAHXRMPXWCK-UHFFFAOYSA-N"
"CCCC#N","InChI=1S/C4H7N/c1-2-3-4-5/h2-3H2,1H3","KVNRLNFWIYMESJ-UHFFFAOYSA-N"
"N#CC(C)C","InChI=1S/C4H7N/c1-4(2)3-5/h4H,1-2H3","LRDFRRGEGBBSRN-UHFFFAOYSA-N"
"N#Cc(c1)cccc1","InChI=1S/C7H5N/c8-6-7-4-2-1-3-5-7/h1-5H","JFDZBHWFFUWGJE-UHFFFAOYSA-N"
"CCOC(=O)CC(C)=O","InChI=1S/C6H10O3/c1-3-9-6(8)4-5(2)7/h3-4H2,1-2H3","XYIBRDXRRQCHLP-UHFFFAOYSA-N"
"CCCCCC(=O)CC","InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h3-7H2,1-2H3","RHLVCLIPMVJYKS-UHFFFAOYSA-N"
"CCCCCC(=O)CCC","InChI=1S/C9H18O/c1-3-5-6-8-9(10)7-4-2/h3-8H2,1-2H3","TYBCSQFBSWACAA-UHFFFAOYSA-N"
"CCCCC(=O)CCCC","InChI=1S/C9H18O/c1-3-5-7-9(10)8-6-4-2/h3-8H2,1-2H3","WSGCRAOTEDLMFQ-UHFFFAOYSA-N"
"CC(C1)CC(=O)CC1","InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h6H,2-5H2,1H3","UJBOOUHRTQVGRU-UHFFFAOYSA-N"
"CC(C1)CCC(=O)C1","InChI=1S/C7H12O/c1-6-2-4-7(8)5-3-6/h6H,2-5H2,1H3","VGVHNLRUAMRIEW-UHFFFAOYSA-N"
"O=C(C1)CCCCC1","InChI=1S/C7H12O/c8-7-5-3-1-2-4-6-7/h1-6H2","CGZZMOTZOONQIA-UHFFFAOYSA-N"
"O=C(C1)CCCCCC1","InChI=1S/C8H14O/c9-8-6-4-2-1-3-5-7-8/h1-7H2","IIRFCWANHMSDCG-UHFFFAOYSA-N"
"CCCC(=O)OC(=O)CCC","InChI=1S/C8H14O3/c1-3-5-7(9)11-8(10)6-4-2/h3-6H2,1-2H3","YHASWHZGWUONAO-UHFFFAOYSA-N"
"CC(C)C(=O)OC(=O)C(C)C","InChI=1S/C8H14O3/c1-5(2)7(9)11-8(10)6(3)4/h5-6H,1-4H3","LSACYLWPPQLVSM-UHFFFAOYSA-N"
"COC(=O)C([H])(C)NC(=O)C([H])(CC(C)C)NC(=O)C([H])(C(C)C)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C20H36N4O6/c1-10(2)9-15(18(27)22-13(6)20(29)30-8)23-19(28)16(11(3)4)24-17(26)12(5)21-14(7)25/h10-13,15-16H,9H2,1-8H3,(H,21,25)(H,22,27)(H,23,28)(H,24,26)/t12-,13-,15-,16+/m0/s1","IJDVBFIHILPVAM-DARAHFNDSA-N"
"CC(=O)NCC(=O)NC([H])(C(C)C)C(=O)NC([H])(CC(C)C)C(=O)NC([H])(C)C(=O)OC","InChI=1S/C19H34N4O6/c1-10(2)8-14(17(26)21-12(5)19(28)29-7)22-18(27)16(11(3)4)23-15(25)9-20-13(6)24/h10-12,14,16H,8-9H2,1-7H3,(H,20,24)(H,21,26)(H,22,27)(H,23,25)/t12-,14-,16+/m0/s1","LJJHAWVPDHHHQY-DUVNUKRYSA-N"
"CC(=O)C=CC(=C(C)1)C(C)(C)CCC1","InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+","PSQYTAPXSHCGMF-BQYQJAHWSA-N"
"CC(=O)C([H])=C([H])C([H])(C(C)=1)C(C)(C)CCC([H])1","InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+/t12-/m0/s1","UZFLPKAIBPNNCA-GUOLPTJISA-N"
"CC(C)(C1)C(C2)CC(C)(C2)1","InChI=1S/C10H18/c1-9(2)7-10(3)5-4-8(9)6-10/h8H,4-7H2,1-3H3","HINAOCRDJFBYGD-UHFFFAOYSA-N"
"CC(C)(C21)C([2H])([2H])C(C)(CC2)C1","InChI=1S/C10H18/c1-9(2)7-10(3)5-4-8(9)6-10/h8H,4-7H2,1-3H3/i7D2","HINAOCRDJFBYGD-RJSZUWSASA-N"
"OC(C(C)(C)1)C(C)(C2)CC(C2)1","InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3","IAIHUHQCLTYTSF-UHFFFAOYSA-N"
"[2H]OC(C(C)(C)1)C(C)(C2)CC(C2)1","InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3/i11D","IAIHUHQCLTYTSF-WORMITQPSA-N"
"O=C(C(C)(C)1)C(C)(C2)CC(C2)1","InChI=1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3","LHXDLQBQYFFVNW-UHFFFAOYSA-N"
"OC(=O)CC(C1)C(C2)CC(C2)1","InChI=1S/C9H14O2/c10-9(11)5-8-4-6-1-2-7(8)3-6/h6-8H,1-5H2,(H,10,11)","FYHBMPWRHCWNBC-UHFFFAOYSA-N"
"C(C1)C(C=2)CC1C2","InChI=1S/C7H10/c1-2-7-4-3-6(1)5-7/h1-2,6-7H,3-5H2","JFNLZVQOOSMTJK-UHFFFAOYSA-N"
"O=C(C1)C(C2)CC(C2)1","InChI=1S/C7H10O/c8-7-4-5-1-2-6(7)3-5/h5-6H,1-4H2","KPMKEVXVVHNIEY-UHFFFAOYSA-N"
"OC(C1)C(C2)CC(C2)1","InChI=1S/C7H12O/c8-7-4-5-1-2-6(7)3-5/h5-8H,1-4H2/t5?,6?,7-/m1/s1","ZQTYQMYDIHMKQB-KPGICGJXSA-N"
"OC(C1)C(C2)CC(C2)1","InChI=1S/C7H12O/c8-7-4-5-1-2-6(7)3-5/h5-8H,1-4H2","ZQTYQMYDIHMKQB-UHFFFAOYSA-N"
"CC(=O)OC(C1)C(C2)CC(C2)1","InChI=1S/C9H14O2/c1-6(10)11-9-5-7-2-3-8(9)4-7/h7-9H,2-5H2,1H3/t7-,8+,9+/m1/s1","YXNICIBZSREEPY-VGMNWLOBSA-N"
"CC(=O)OC(C1)C(C2)CC(C2)1","InChI=1S/C9H14O2/c1-6(10)11-9-5-7-2-3-8(9)4-7/h7-9H,2-5H2,1H3","YXNICIBZSREEPY-UHFFFAOYSA-N"
"C(C1)C(C2)CC1C2","InChI=1S/C7H12/c1-2-7-4-3-6(1)5-7/h6-7H,1-5H2","UMRZSTCPUPJPOJ-UHFFFAOYSA-N"
"c(c3CCCCc(c4)ccc(N(C)C)c4)c(c(c(c32)cccc2)1)cccc1","InChI=1S/C26H27N/c1-27(2)23-17-15-20(16-18-23)9-3-4-10-21-19-22-11-5-6-12-24(22)26-14-8-7-13-25(21)26/h5-8,11-19H,3-4,9-10H2,1-2H3","OYYMKKODNXXYMP-UHFFFAOYSA-N"
"c(c3CCCCCc(c4)ccc(N(C)C)c4)c(c(c(c32)cccc2)1)cccc1","InChI=1S/C27H29N/c1-28(2)24-18-16-21(17-19-24)10-4-3-5-11-22-20-23-12-6-7-13-25(23)27-15-9-8-14-26(22)27/h6-9,12-20H,3-5,10-11H2,1-2H3","OYVUHPCXVFWFDU-UHFFFAOYSA-N"
"C(CCc(c43)cc(c2c(cccc4)3)cccc2)CCCc(c1)ccc(N(C)C)c1","InChI=1S/C28H31N/c1-29(2)25-19-17-22(18-20-25)11-5-3-4-6-12-23-21-24-13-7-8-14-26(24)28-16-10-9-15-27(23)28/h7-10,13-21H,3-6,11-12H2,1-2H3","DLONDNXNWHFDSQ-UHFFFAOYSA-N"
"c(c43)(cc(c2c(cccc4)3)cccc2)CCCCCCCc(c1)ccc(N(C)C)c1","InChI=1S/C29H33N/c1-30(2)26-20-18-23(19-21-26)12-6-4-3-5-7-13-24-22-25-14-8-9-15-27(25)29-17-11-10-16-28(24)29/h8-11,14-22H,3-7,12-13H2,1-2H3","QPRAFQJUFNWEOQ-UHFFFAOYSA-N"
"C(CCc(c34)cc(c2)c(c(cccc4)3)ccc2)CCCCCc(c1)ccc(N(C)C)c1","InChI=1S/C30H35N/c1-31(2)27-21-19-24(20-22-27)13-7-5-3-4-6-8-14-25-23-26-15-9-10-16-28(26)30-18-12-11-17-29(25)30/h9-12,15-23H,3-8,13-14H2,1-2H3","BRLASFOMUJDYQR-UHFFFAOYSA-N"
"c(c4)c(c(cc4)2)c(c1)c(cc2CCCCCCCCCCc(c3)ccc(c3)N(C)C)ccc1","InChI=1S/C32H39N/c1-33(2)29-23-21-26(22-24-29)15-9-7-5-3-4-6-8-10-16-27-25-28-17-11-12-18-30(28)32-20-14-13-19-31(27)32/h11-14,17-25H,3-10,15-16H2,1-2H3","FMBVLWRHBMDCOL-UHFFFAOYSA-N"
"Cc(c1)c(c3)c(ccc3)c(c2)c(ccc2)1","InChI=1S/C15H12/c1-11-10-12-6-2-3-8-14(12)15-9-5-4-7-13(11)15/h2-10H,1H3","DALBHIYZSZZWBS-UHFFFAOYSA-N"
"CCc(c1)c(c3)c(ccc3)c(c2)c(ccc2)1","InChI=1S/C16H14/c1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16/h3-11H,2H2,1H3","ZWANHXINCHPSIK-UHFFFAOYSA-N"
"COP(=O)(OC)OC","InChI=1S/C3H9O4P/c1-5-8(4,6-2)7-3/h1-3H3","WVLBCYQITXONBZ-UHFFFAOYSA-N"
"COC(=O)C(c21)c(c3)c(ccc3)c(cccc2)1","InChI=1S/C15H12O2/c1-17-15(16)14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14/h2-9,14H,1H3","LQSPZSGFDFRDBS-UHFFFAOYSA-N"
"COC(=O)C(c21)c(c3)c(ccc3)Oc(cccc2)1","InChI=1S/C15H12O3/c1-17-15(16)14-10-6-2-4-8-12(10)18-13-9-5-3-7-11(13)14/h2-9,14H,1H3","RFHABUQANXJNQS-UHFFFAOYSA-N"
"COC(=O)c(c1)c(OC)ccc1","InChI=1S/C9H10O3/c1-11-8-6-4-3-5-7(8)9(10)12-2/h3-6H,1-2H3","PFYHAAAQPNMZHO-UHFFFAOYSA-N"
"COC(=O)c(c1)c(OC)c(c2)c(ccc2)c1","InChI=1S/C13H12O3/c1-15-12-10-6-4-3-5-9(10)7-8-11(12)13(14)16-2/h3-8H,1-2H3","IKYRLYKWULPUNA-UHFFFAOYSA-N"
"COC(=O)c(c(O)1)c(c2)c(ccc2)cc1","InChI=1S/C12H10O3/c1-15-12(14)11-9-5-3-2-4-8(9)6-7-10(11)13/h2-7,13H,1H3","LEENMPKUUNPLHM-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(cc1)N(C)C","InChI=1S/C10H13NO2/c1-11(2)9-6-4-5-8(7-9)10(12)13-3/h4-7H,1-3H3","CABFTHPIDKWPNQ-UHFFFAOYSA-N"
"CC=CC=CC(=O)OC","InChI=1S/C7H10O2/c1-3-4-5-6-7(8)9-2/h3-6H,1-2H3/b4-3+,6-5+","KWKVAGQCDSHWFK-VNKDHWASSA-N"
"COC(=O)CC(C)(C)CC(=O)OC","InChI=1S/C9H16O4/c1-9(2,5-7(10)12-3)6-8(11)13-4/h5-6H2,1-4H3","NPEAPWIQJBAJIO-UHFFFAOYSA-N"
"CCOCCC(=O)OC","InChI=1S/C6H12O3/c1-3-9-5-4-6(7)8-2/h3-5H2,1-2H3","HSDFKDZBJMDHFF-UHFFFAOYSA-N"
"COC(=O)CCCCl","InChI=1S/C5H9ClO2/c1-8-5(7)3-2-4-6/h2-4H2,1H3","ZZUYIRISBMWFMV-UHFFFAOYSA-N"
"COC(=O)C(=C)c(c1)occ1","InChI=1S/C8H8O3/c1-6(8(9)10-2)7-4-3-5-11-7/h3-5H,1H2,2H3","IVLQYNGAWMWRCK-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(N(C)C)c1","InChI=1S/C10H13NO2/c1-11(2)9-6-4-8(5-7-9)10(12)13-3/h4-7H,1-3H3","DBQGARDMYOMOOS-UHFFFAOYSA-N"
"COC(=O)CC(C)Cl","InChI=1S/C5H9ClO2/c1-4(6)3-5(7)8-2/h4H,3H2,1-2H3","HDQHWBXUKZBPDN-UHFFFAOYSA-N"
"CCC(Cl)C(=O)OC","InChI=1S/C5H9ClO2/c1-3-4(6)5(7)8-2/h4H,3H2,1-2H3","BHQQXAOBIZQEGI-UHFFFAOYSA-N"
"COC(=O)C=CC=CC(=O)OC","InChI=1S/C8H10O4/c1-11-7(9)5-3-4-6-8(10)12-2/h3-6H,1-2H3/b5-3+,6-4+","PXYBXMZVYNWQAM-GGWOSOGESA-N"
"COC(=O)c(c1)ccc(Cl)c1","InChI=1S/C8H7ClO2/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3","LXNFVVDCCWUUKC-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(Cl)cc1","InChI=1S/C8H7ClO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3","XRDRKVPNHIWTBX-UHFFFAOYSA-N"
"COC(=O)c(c1)c(Cl)ccc1","InChI=1S/C8H7ClO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3","JAVRNIFMYIJXIE-UHFFFAOYSA-N"
"COC(=O)C1=CC2=CC=CC=C2N1","InChI=1S/C10H9NO2/c1-13-10(12)9-6-7-4-2-3-5-8(7)11-9/h2-6,11H,1H3","NQPIEWBAWBFGOB-UHFFFAOYSA-N"
"COC(=O)Cc(c1)ccc(OC)c1","InChI=1S/C10H12O3/c1-12-9-5-3-8(4-6-9)7-10(11)13-2/h3-6H,7H2,1-2H3","ZQYLDVNTWDEAJI-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(OC)c(OC)c1","InChI=1S/C10H12O4/c1-12-8-5-4-7(10(11)14-3)6-9(8)13-2/h4-6H,1-3H3","BIGQPYZPEWAPBG-UHFFFAOYSA-N"
"COC(=O)c(c1)c(OC)c(OC)cc1","InChI=1S/C10H12O4/c1-12-8-6-4-5-7(9(8)13-2)10(11)14-3/h4-6H,1-3H3","MGLIMPUPAKQITQ-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(OC)cc(OC)1","InChI=1S/C10H12O4/c1-12-8-4-7(10(11)14-3)5-9(6-8)13-2/h4-6H,1-3H3","YXUIOVUOFQKWDM-UHFFFAOYSA-N"
"COC(=O)CCC1=CNC2=CC=CC=C21","InChI=1S/C12H13NO2/c1-15-12(14)7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,13H,6-7H2,1H3","BAYIDMGOQRXHBC-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(Cl)cc(Cl)1","InChI=1S/C8H6Cl2O2/c1-12-8(11)5-2-6(9)4-7(10)3-5/h2-4H,1H3","BTEVDFJXGLQUDS-UHFFFAOYSA-N"
"COC(=O)c(c1)c(Cl)ccc(Cl)1","InChI=1S/C8H6Cl2O2/c1-12-8(11)6-4-5(9)2-3-7(6)10/h2-4H,1H3","SPJQBGGHUDNAIC-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(Cl)c(Cl)c1","InChI=1S/C8H6Cl2O2/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4H,1H3","WICGATIORFSOJL-UHFFFAOYSA-N"
"COC(=O)c(c(Cl)1)c(Cl)ccc1","InChI=1S/C8H6Cl2O2/c1-12-8(11)7-5(9)3-2-4-6(7)10/h2-4H,1H3","HEYGSGDIWJDORA-UHFFFAOYSA-N"
"COC(=O)c(c1)c(Cl)cc(Cl)c1","InChI=1S/C8H6Cl2O2/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4H,1H3","VCRWILYAWSRHBN-UHFFFAOYSA-N"
"COC(=O)c(c1)c(Cl)ccc([N+1]([O-1])=O)1","InChI=1S/C8H6ClNO4/c1-14-8(11)6-4-5(10(12)13)2-3-7(6)9/h2-4H,1H3","VCYWZLGOWNCJNJ-UHFFFAOYSA-N"
"COC(=O)c(c1)c(ccc(Cl)1)[N+1]([O-1])=O","InChI=1S/C8H6ClNO4/c1-14-8(11)6-4-5(9)2-3-7(6)10(12)13/h2-4H,1H3","JGBJHRKCUKTQOE-UHFFFAOYSA-N"
"COC(=O)c(c1)cc([N+1]([O-1])=O)c(Cl)c1","InChI=1S/C8H6ClNO4/c1-14-8(11)5-2-3-6(9)7(4-5)10(12)13/h2-4H,1H3","XRTKWPWDSUNLHS-UHFFFAOYSA-N"
"COC(=O)c(c1)c(Cl)cc(c1)[N+1]([O-1])=O","InChI=1S/C8H6ClNO4/c1-14-8(11)6-3-2-5(10(12)13)4-7(6)9/h2-4H,1H3","PICNSXCJRMYANX-UHFFFAOYSA-N"
"CCCC(CCC)(C(=O)OC)C(=O)OC","InChI=1S/C11H20O4/c1-5-7-11(8-6-2,9(12)14-3)10(13)15-4/h5-8H2,1-4H3","ZFMAHACGDXIMSE-UHFFFAOYSA-N"
"CCCCCCCCC(CCCCCC)C(=O)OC","InChI=1S/C17H34O2/c1-4-6-8-10-11-13-15-16(17(18)19-3)14-12-9-7-5-2/h16H,4-15H2,1-3H3","PBRCCXNUTAGYJI-UHFFFAOYSA-N"
"COC(=O)/C=C/C1=CNC2=CC=CC=C21","InChI=1S/C12H11NO2/c1-15-12(14)7-6-9-8-13-11-5-3-2-4-10(9)11/h2-8,13H,1H3/b7-6+","JKVXFZPEUCTHQO-VOTSOKGWSA-N"
"COC(=O)CCCC1=CNC2=CC=CC=C21","InChI=1S/C13H15NO2/c1-16-13(15)8-4-5-10-9-14-12-7-3-2-6-11(10)12/h2-3,6-7,9,14H,4-5,8H2,1H3","ZEJUFCOACOWDPP-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC=CC(=O)OC","InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h15-16H,3-14H2,1-2H3/b16-15+","ODPLFJYILBATKC-FOCLMDBBSA-N"
"CCCCCCCCC(CCCCCC)C(O)=O","InChI=1S/C16H32O2/c1-3-5-7-9-10-12-14-15(16(17)18)13-11-8-6-4-2/h15H,3-14H2,1-2H3,(H,17,18)","JMOLZNNXZPAGBH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C24H50/c1-3-5-7-9-11-13-15-17-19-21-23-24-22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3","POOSGDOYLQNASK-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C28H58/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3","ZYURHZPYMFLWSH-UHFFFAOYSA-N"
"C(CCCCCCCCCCCCCCCCCCCCCCCCC)CCCC","InChI=1S/C30H62/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-30H2,1-2H3","JXTPJDDICSTXJX-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C19H38O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h3-18H2,1-2H3","HPEUJPJOZXNMSJ-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCC(=O)OC","InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-9,12-18H2,1-2H3/b11-10+","QYDYPVFESGNLHU-ZHACJKMWSA-N"
"CCC=CCC=CCC=CCCCCCCCC(=O)OC","InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,10-11H,3,6,9,12-18H2,1-2H3/b5-4+,8-7+,11-10+","DVWSXZIHSUZZKJ-JSIPCRQOSA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C21H42O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h3-20H2,1-2H3","QGBRLVONZXHAKJ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C23H46O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25-2/h3-22H2,1-2H3","QSQLTHHMFHEFIY-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C25H50O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26)27-2/h3-24H2,1-2H3","XUDJZDNUVZHSKZ-UHFFFAOYSA-N"
"CCCCCCCCCCC(O)C(=O)OC","InChI=1S/C13H26O3/c1-3-4-5-6-7-8-9-10-11-12(14)13(15)16-2/h12,14H,3-11H2,1-2H3","NHEBEMJQYBPWNA-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(O)C(=O)OC","InChI=1S/C15H30O3/c1-3-4-5-6-7-8-9-10-11-12-13-14(16)15(17)18-2/h14,16H,3-13H2,1-2H3","ATFSJSYRBAGGIS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(O)C(=O)OC","InChI=1S/C17H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(18)17(19)20-2/h16,18H,3-15H2,1-2H3","LQZITXGTIYKQBJ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC(O)C(=O)OC","InChI=1S/C19H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(20)19(21)22-2/h18,20H,3-17H2,1-2H3","OUFCLLRNNJZLOX-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCC(O)C(=O)OC","InChI=1S/C21H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(22)21(23)24-2/h20,22H,3-19H2,1-2H3","ILUGNSBVAUHPIN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCC(O)C(=O)OC","InChI=1S/C23H46O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(24)23(25)26-2/h22,24H,3-21H2,1-2H3","KUHHQOLYDNMSJW-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)OC","InChI=1S/C25H50O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(26)25(27)28-2/h24,26H,3-23H2,1-2H3","MSVLAXSCPVNLFM-UHFFFAOYSA-N"
"CCCCCCCC([H])(O[Si](C)(C)C)C([H])(N)CO[Si](C)(C)C","InChI=1S/C16H39NO2Si2/c1-8-9-10-11-12-13-16(19-21(5,6)7)15(17)14-18-20(2,3)4/h15-16H,8-14,17H2,1-7H3/t15-,16+/m0/s1","VAWUXPDWLWBZIW-JKSUJKDBSA-N"
"CCCCCCCCCC([H])(O[Si](C)(C)C)C([H])(N)CO[Si](C)(C)C","InChI=1S/C18H43NO2Si2/c1-8-9-10-11-12-13-14-15-18(21-23(5,6)7)17(19)16-20-22(2,3)4/h17-18H,8-16,19H2,1-7H3/t17-,18+/m0/s1","WSLBFLLKCVEBDX-ZWKOTPCHSA-N"
"CCCCCCCCCCCC([H])(O[Si](C)(C)C)C([H])(N)CO[Si](C)(C)C","InChI=1S/C20H47NO2Si2/c1-8-9-10-11-12-13-14-15-16-17-20(23-25(5,6)7)19(21)18-22-24(2,3)4/h19-20H,8-18,21H2,1-7H3/t19-,20+/m0/s1","JDPBVDIIFKBKPO-VQTJNVASSA-N"
"O=C(NC([H])(CO[Si](C)(C)C)C(O[Si](C)(C)C)(C(=C([H])CCCCCCCCCCCCC)[H])[H])CCCCCCCCCCCCCCC","InChI=1S/C40H83NO3Si2/c1-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39(44-46(6,7)8)38(37-43-45(3,4)5)41-40(42)36-34-32-30-28-26-24-22-20-18-16-14-12-10-2/h33,35,38-39H,9-32,34,36-37H2,1-8H3,(H,41,42)/b35-33+/t38-,39+/m0/s1","IHEIJXJEKHCDTN-GLQCRSEXSA-N"
"CCCCCCCCCCCCCCOCC(COC(C)=O)OC(C)=O","InChI=1S/C21H40O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-21(26-20(3)23)18-25-19(2)22/h21H,4-18H2,1-3H3","UYEQSZIEGZNHSU-UHFFFAOYSA-N"
"CCCCCCCCCCCCC=COCC(COC(C)=O)OC(C)=O","InChI=1S/C21H38O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-24-17-21(26-20(3)23)18-25-19(2)22/h15-16,21H,4-14,17-18H2,1-3H3/b16-15+","QPNZXUZHPNKUSG-FOCLMDBBSA-N"
"CCCCCCCCCCCCCCCCOCC(COC(C)=O)OC(C)=O","InChI=1S/C23H44O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-19-23(28-22(3)25)20-27-21(2)24/h23H,4-20H2,1-3H3","RNBQLCHIPDBXCF-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCOCC(COC(C)=O)OC(C)=O","InChI=1S/C25H48O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-21-25(30-24(3)27)22-29-23(2)26/h25H,4-22H2,1-3H3","CUIQUZLQNGTWHR-UHFFFAOYSA-N"
"","InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1","HVYWMOMLDIMFJA-DPAQBDIFSA-N"
"","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20+,21+,22+,23-,24+,25+,26+,27-/m1/s1","QYIXCDOBOSTCEI-QCYZZNICSA-N"
"","InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18,20,22-26,29H,3,7-8,10-17H2,1-2,4-6H3/t20?,22-,23-,24+,25-,26-,27-,28+/m0/s1","INDVLXYUCBVVKW-FXSBVPLVSA-N"
"","InChI=1S/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,21-22,25-26,31H,9,11-19H2,1-8H3/t21-,22-,25+,26+,28-,29-,30+/m1/s1","CAHGCLMLTWQZNJ-BQNIITSRSA-N"
"","InChI=1S/C30H52O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h20-22,25-26,31H,9-19H2,1-8H3/t21-,22-,25+,26+,28-,29-,30+/m1/s1","MBZYKEVPFYHDOH-BQNIITSRSA-N"
"C(C1)C([H])(C(CCCC(C)C)([H])C)C(C4)(C1([H])C([H])(C(C4)([H])2)CCC(C3)C(C)2CCC(O[Si](C)(C)C)3[H])C","InChI=1S/C30H56OSi/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(31-32(6,7)8)16-18-29(23,4)28(25)17-19-30(26,27)5/h21-28H,9-20H2,1-8H3/t22-,23?,24+,25+,26-,27+,28+,29+,30-/m1/s1","HRLPEXVPNOBUDF-SGCSJPMTSA-N"
"[H]C(C41C)(CCC(=C43)C(C2(C)CC3)(CCC2([H])C([H])(C)CCC=C(C)C)C)C(C(O[Si](C)(C)C)CC1)(C)C","InChI=1S/C33H58OSi/c1-23(2)13-12-14-24(3)25-17-21-33(8)27-15-16-28-30(4,5)29(34-35(9,10)11)19-20-31(28,6)26(27)18-22-32(25,33)7/h13,24-25,28-29H,12,14-22H2,1-11H3/t24-,25+,28-,29-,31+,32+,33-/m0/s1","VUPPLGLOGXZZKA-ZXEXGRMMSA-N"
"CC(C4)(C=3CC(O[Si](C)(C)C)C4)C(C1=CC3)(CCC(C([H])(C([H])(C)C=CC([H])(C)C(C)C)2)(C1([H])CC2)C)[H]","InChI=1S/C31H52OSi/c1-21(2)22(3)10-11-23(4)27-14-15-28-26-13-12-24-20-25(32-33(7,8)9)16-18-30(24,5)29(26)17-19-31(27,28)6/h10-13,21-23,25,27-29H,14-20H2,1-9H3/b11-10+/t22-,23+,25-,27+,28-,29-,30-,31+/m0/s1","OPWXUPLJCANTIU-SCFYJWQTSA-N"
"","InChI=1S/C28H48O/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(29-6)14-16-27(21,4)26(23)15-17-28(24,25)5/h10,19-20,22-26H,7-9,11-18H2,1-6H3/t20-,22+,23+,24-,25+,26+,27+,28-/m1/s1","RCXPTZJNVLDKKV-PXBBAZSNSA-N"
"","InChI=1S/C28H50O/c1-19(2)8-7-9-20(3)24-12-13-25-23-11-10-21-18-22(29-6)14-16-27(21,4)26(23)15-17-28(24,25)5/h19-26H,7-18H2,1-6H3/t20-,21?,22+,23+,24-,25+,26+,27+,28-/m1/s1","FMSSVYNONQQPON-IOESSVONSA-N"
"C(C4)=C(C1)C(C(C34[H])([H])CCC(C32[H])(C(CC2)(C(CCC(=CC)C(C)C)([H])C)[H])C)(CCC1OC)C","InChI=1S/C30H50O/c1-8-22(20(2)3)10-9-21(4)26-13-14-27-25-12-11-23-19-24(31-7)15-17-29(23,5)28(25)16-18-30(26,27)6/h8,11,20-21,24-28H,9-10,12-19H2,1-7H3/b22-8+/t21-,24+,25+,26-,27+,28+,29+,30-/m1/s1","GSKFDRGPRSWWDC-FTKWHHHFSA-N"
"CC(C4(C(CCC([H])(C(C)C)CC)([H])C)[H])(C1)C(CC4)(C(C3)(C(C(C2)(C(=C3[H])CC(C2)(OC)[H])C)(C1)[H])[H])[H]","InChI=1S/C30H52O/c1-8-22(20(2)3)10-9-21(4)26-13-14-27-25-12-11-23-19-24(31-7)15-17-29(23,5)28(25)16-18-30(26,27)6/h11,20-22,24-28H,8-10,12-19H2,1-7H3/t21-,22-,24+,25+,26-,27+,28+,29+,30-/m1/s1","LOUBEXGURAKLSL-VHZNKUSHSA-N"
"","InChI=1S/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,20-21,23,25-29H,8,12-19H2,1-7H3/b10-9+/t21-,23-,25+,26+,27-,28+,29+,30+,31-/m1/s1","IZEUIYYDWBKERE-ZRODXFKISA-N"
"CC(C4([H])C([H])(C)CCCC(C)C)(C([H])1CC4)CCC(C(C)32)(C([H])(CC=C2CC(OC(C)=O)(CC3)[H])1)[H]","InChI=1S/C29H48O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-20,23-27H,7-9,11-18H2,1-6H3/t20-,23+,24+,25-,26+,27+,28+,29-/m1/s1","XUGISPSHIFXEHZ-VEVYEIKRSA-N"
"CC(C4([H])C([H])(C)CCCC(C)C)(C([H])1CC4)CCC(C(C)32)(C([H])(CCC2CC(OC(C)=O)(CC3)[H])1)[H]","InChI=1S/C29H50O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-20,22-27H,7-18H2,1-6H3/t20-,22?,23+,24+,25-,26+,27+,28+,29-/m1/s1","PHLIUSDPFOUISN-AQHAWAMTSA-N"
"C(C)(=O)OC(C4)CC(C3(C)C4)=CCC(C([H])23)(C(C1)([H])C(CC2)(C(C1)C(C)CCC(=CC)C(C)C)C)[H]","InChI=1S/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h8,11,20-21,25-29H,9-10,12-19H2,1-7H3/b23-8-/t21-,25+,26+,27-,28+,29+,30+,31-/m1/s1","UKVGAWCNOIELAQ-VXFIQSPPSA-N"
"CON=C(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)c(c2)c(cc(O[Si](C)(C)C)c2)C1","InChI=1S/C22H33NO2Si/c1-22-13-12-18-17-9-7-16(25-26(3,4)5)14-15(17)6-8-19(18)20(22)10-11-21(22)23-24-2/h7,9,14,18-20H,6,8,10-13H2,1-5H3/b23-21-/t18-,19-,20+,22+/m1/s1","GIUGKXYPAYLRPS-AFLCNQENSA-N"
"","InChI=1S/C24H40O2Si2/c1-24-15-14-20-19-11-9-18(25-27(2,3)4)16-17(19)8-10-21(20)22(24)12-13-23(24)26-28(5,6)7/h9,11,16,20-23H,8,10,12-15H2,1-7H3/t20-,21-,22+,23-,24+/m1/s1","WJUROLKZHWTVGC-SJSRKZJXSA-N"
"","InChI=1S/C24H40O2Si2/c1-24-15-14-20-19-11-9-18(25-27(2,3)4)16-17(19)8-10-21(20)22(24)12-13-23(24)26-28(5,6)7/h9,11,16,20-23H,8,10,12-15H2,1-7H3/t20-,21-,22+,23+,24+/m1/s1","WJUROLKZHWTVGC-DJCPXJLLSA-N"
"CON=C(C4)C=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(C(C)=NOC)C1","InChI=1S/C23H36N2O2/c1-15(24-26-4)19-8-9-20-18-7-6-16-14-17(25-27-5)10-12-22(16,2)21(18)11-13-23(19,20)3/h14,18-21H,6-13H2,1-5H3/b24-15+,25-17-/t18-,19+,20-,21-,22-,23+/m0/s1","WCBFSBXYZBTGBQ-PTUKXLOHSA-N"
"O=C(O[Si](C)(C)C)C([H])(C)O[Si](C)(C)C","InChI=1S/C9H22O3Si2/c1-8(11-13(2,3)4)9(10)12-14(5,6)7/h8H,1-7H3/t8-/m0/s1","HXRGKEOWDNVHPA-QMMMGPOBSA-N"
"O=C(O[Si](C)(C)C)c(c1)cccc1","InChI=1S/C10H14O2Si/c1-13(2,3)12-10(11)9-7-5-4-6-8-9/h4-8H,1-3H3","VFFKJOXNCSJSAQ-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)C(C)C(=O)O[Si](C)(C)C","InChI=1S/C10H22O4Si2/c1-8(9(11)13-15(2,3)4)10(12)14-16(5,6)7/h8H,1-7H3","LJDAAXOEMCESSS-UHFFFAOYSA-N"
"O=C(C1)N([Si](C)(C)C)C([H])(C1)C(=O)O[Si](C)(C)C","InChI=1S/C11H23NO3Si2/c1-16(2,3)12-9(7-8-10(12)13)11(14)15-17(4,5)6/h9H,7-8H2,1-6H3/t9-/m1/s1","QACGFKAUSXGLCU-SECBINFHSA-N"
"C[Si](C)(C)Nc(c1)cc(cc1)O[Si](C)(C)C","InChI=1S/C12H23NOSi2/c1-15(2,3)13-11-8-7-9-12(10-11)14-16(4,5)6/h7-10,13H,1-6H3","NHNXAJMLVIRGCE-UHFFFAOYSA-N"
"CC(CC(=O)O[Si](C)(C)C)CC(=O)O[Si](C)(C)C","InChI=1S/C12H26O4Si2/c1-10(8-11(13)15-17(2,3)4)9-12(14)16-18(5,6)7/h10H,8-9H2,1-7H3","JOPZTTHKNFWHFT-UHFFFAOYSA-N"
"CC(CCC(=O)O[Si](C)(C)C)CC(=O)O[Si](C)(C)C","InChI=1S/C13H28O4Si2/c1-11(10-13(15)17-19(5,6)7)8-9-12(14)16-18(2,3)4/h11H,8-10H2,1-7H3","IDHDZCKJOKHATB-UHFFFAOYSA-N"
"COc(c1)c(ccc1C(O[Si](C)(C)C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C18H34O5Si3/c1-20-16-13-14(11-12-15(16)21-24(2,3)4)17(22-25(5,6)7)18(19)23-26(8,9)10/h11-13,17H,1-10H3","QGOJNGYLGCWPKN-UHFFFAOYSA-N"
"O=C(CCc(c1)cc(O[Si](C)(C)C)c(c1)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C18H34O4Si3/c1-23(2,3)20-16-12-10-15(14-17(16)21-24(4,5)6)11-13-18(19)22-25(7,8)9/h10,12,14H,11,13H2,1-9H3","DJVNRWGQENHJMA-UHFFFAOYSA-N"
"CCCCOP(=O)(OCCCC)C(CCC)NC(=O)C(F)(F)F","InChI=1S/C14H27F3NO4P/c1-4-7-10-21-23(20,22-11-8-5-2)12(9-6-3)18-13(19)14(15,16)17/h12H,4-11H2,1-3H3,(H,18,19)","HFNKBZCZJNNGKI-UHFFFAOYSA-N"
"CCCCOP(=O)(OCCCC)C(C)NC(=O)C(F)(F)F","InChI=1S/C12H23F3NO4P/c1-4-6-8-19-21(18,20-9-7-5-2)10(3)16-11(17)12(13,14)15/h10H,4-9H2,1-3H3,(H,16,17)","KXEFGAZWYZRDOU-UHFFFAOYSA-N"
"CCCCOP(=O)(OCCCC)CCN(C)C(=O)C(F)(F)F","InChI=1S/C13H25F3NO4P/c1-4-6-9-20-22(19,21-10-7-5-2)11-8-17(3)12(18)13(14,15)16/h4-11H2,1-3H3","ZXYLUWVQGVTPHW-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)OC","InChI=1S/C15H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(16)17-2/h3-14H2,1-2H3","ZAZKJZBWRNNLDS-UHFFFAOYSA-N"
"CCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C16H34O3Si/c1-6-7-8-9-10-11-12-13-14-15(16(17)18-2)19-20(3,4)5/h15H,6-14H2,1-5H3","PHPBKGTVQKCOSS-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C18H38O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17(18(19)20-2)21-22(3,4)5/h17H,6-16H2,1-5H3","MTVNRDDQMNKJFO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C","InChI=1S/C20H42O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20(21)22-2)23-24(3,4)5/h19H,6-18H2,1-5H3","ISYKTPYDGSSZAA-UHFFFAOYSA-N"
"","InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1","HCXVJBMSMIARIN-PHZDYDNGSA-N"
"C(C(C4)C(C3)(C)C(C4)([H])C(C2([H])C3)(CC=C(C12C)CC(CC1)O[Si](C)(C)C)[H])(CCCC(C)C)C","InChI=1S/C30H54OSi/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(31-32(6,7)8)16-18-29(23,4)28(25)17-19-30(26,27)5/h12,21-22,24-28H,9-11,13-20H2,1-8H3/t22-,24?,25+,26-,27+,28+,29+,30-/m1/s1","CBVJJGRSRFXUPK-HBOBSPHKSA-N"
"","InChI=1S/C31H54OSi/c1-21(2)22(3)10-11-23(4)27-14-15-28-26-13-12-24-20-25(32-33(7,8)9)16-18-30(24,5)29(26)17-19-31(27,28)6/h12,21,23,25-29H,3,10-11,13-20H2,1-2,4-9H3/t23-,25+,26+,27-,28+,29+,30+,31-/m1/s1","HHNSXGBDYOSLLW-BWVDWJPHSA-N"
"","InChI=1S/C32H56OSi/c1-10-24(22(2)3)12-11-23(4)28-15-16-29-27-14-13-25-21-26(33-34(7,8)9)17-19-31(25,5)30(27)18-20-32(28,29)6/h10,13,22-23,26-30H,11-12,14-21H2,1-9H3/b24-10-/t23-,26+,27+,28-,29+,30+,31+,32-/m1/s1","LPZCEKQSHGYQRN-AAFSFRDQSA-N"
"C(C32[H])(C(C4)([H])C(C([H])(C4)C([H])(C)C=CC(CC)([H])C(C)C)(C)CC3)(CC=C(C21C)CC(CC1)(O[Si](C)(C)C)[H])[H]","InChI=1S/C32H56OSi/c1-10-24(22(2)3)12-11-23(4)28-15-16-29-27-14-13-25-21-26(33-34(7,8)9)17-19-31(25,5)30(27)18-20-32(28,29)6/h11-13,22-24,26-30H,10,14-21H2,1-9H3/b12-11+/t23-,24-,26+,27+,28-,29+,30+,31+,32-/m1/s1","SZLWSWKRZSAHBC-MZXORBNVSA-N"
"C(C([H])41)(CCC([H])(C([H])42)C(C)(C3)C(CC(C3)O[Si](C)(C)C)=CC2)(C)C(CC1)C(CCC([H])(C(C)C)CC)C","InChI=1S/C32H58OSi/c1-10-24(22(2)3)12-11-23(4)28-15-16-29-27-14-13-25-21-26(33-34(7,8)9)17-19-31(25,5)30(27)18-20-32(28,29)6/h13,22-24,26-30H,10-12,14-21H2,1-9H3/t23-,24-,26?,27+,28-,29+,30+,31+,32-/m1/s1","XEWVATFZTBNDCF-JVZNPHIBSA-N"
"CON=C(C4)C([H])=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)(C(C)=NOC)C1","InChI=1S/C23H36N2O3/c1-15(24-27-4)23(26)13-10-20-18-7-6-16-14-17(25-28-5)8-11-21(16,2)19(18)9-12-22(20,23)3/h14,18-20,26H,6-13H2,1-5H3/b24-15+,25-17-/t18-,19+,20+,21+,22+,23+/m1/s1","FTLBXAHUQAJCNR-QGMZBMPISA-N"
"C[Si](C)(C)OCC(O[Si](C)(C)C)COP(=O)(O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C15H41O6PSi4/c1-23(2,3)18-14-15(19-24(4,5)6)13-17-22(16,20-25(7,8)9)21-26(10,11)12/h15H,13-14H2,1-12H3","OSNKBCBCOYHYNF-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)Cc(c1)c(c2)c(ccc2)n1[Si](C)(C)C","InChI=1S/C16H25NO2Si2/c1-20(2,3)17-12-13(11-16(18)19-21(4,5)6)14-9-7-8-10-15(14)17/h7-10,12H,11H2,1-6H3","WKJCHYMUOINQGJ-UHFFFAOYSA-N"
"O=C(OC(COC(=O)CCCCCCCCCCCCCCC)COC(C)=O)CCCCCCCCCCCCCCC","InChI=1S/C37H70O6/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-36(39)42-33-35(32-41-34(3)38)43-37(40)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h35H,4-33H2,1-3H3","YHNCVLUVISTFCT-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc(C(C)=O)3)Sc(cccc2)1","InChI=1S/C19H22N2OS/c1-14(22)15-9-10-19-17(13-15)21(12-6-11-20(2)3)16-7-4-5-8-18(16)23-19/h4-5,7-10,13H,6,11-12H2,1-3H3","NOSIYYJFMPDDSA-UHFFFAOYSA-N"
"OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(C(F)(F)F)3)Sc(cccc2)1","InChI=1S/C22H26F3N3OS/c23-22(24,25)17-6-7-21-19(16-17)28(18-4-1-2-5-20(18)30-21)9-3-8-26-10-12-27(13-11-26)14-15-29/h1-2,4-7,16,29H,3,8-15H2","PLDUPXSUYLZYBN-UHFFFAOYSA-N"
"N#Cc(c4)cc(c(c4)1)N(CCCN(C3)CCC(O)C3)c(c2)c(ccc2)S1","InChI=1S/C21H23N3OS/c22-15-16-6-7-21-19(14-16)24(18-4-1-2-5-20(18)26-21)11-3-10-23-12-8-17(25)9-13-23/h1-2,4-7,14,17,25H,3,8-13H2","LUALIOATIOESLM-UHFFFAOYSA-N"
"OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C21H26ClN3OS/c22-17-6-7-21-19(16-17)25(18-4-1-2-5-20(18)27-21)9-3-8-23-10-12-24(13-11-23)14-15-26/h1-2,4-7,16,26H,3,8-15H2","RGCVKNLCSQQDEP-UHFFFAOYSA-N"
"NC(=O)C(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C21H24ClN3OS/c22-16-6-7-20-18(14-16)25(17-4-1-2-5-19(17)27-20)11-3-10-24-12-8-15(9-13-24)21(23)26/h1-2,4-7,14-15H,3,8-13H2,(H2,23,26)","OSJJYEUEJRVVOD-UHFFFAOYSA-N"
"CN(C)CC(N(C)C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C19H25N3S/c1-20(2)13-15(21(3)4)14-22-16-9-5-7-11-18(16)23-19-12-8-6-10-17(19)22/h5-12,15H,13-14H2,1-4H3","YZQNFFLGIYEXMM-UHFFFAOYSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc(OC)3)Sc(cccc2)1","InChI=1S/C19H24N2OS/c1-14(12-20(2)3)13-21-16-7-5-6-8-18(16)23-19-10-9-15(22-4)11-17(19)21/h5-11,14H,12-13H2,1-4H3","VRQVVMDWGGWHTJ-UHFFFAOYSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C18H22N2S/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)21-18-11-7-5-9-16(18)20/h4-11,14H,12-13H2,1-3H3","ZZHLYYDVIOPZBE-UHFFFAOYSA-N"
"CN(C)C(C)CC(C(=O)CC)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C21H27NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3","USSIQXCVUWKGNF-UHFFFAOYSA-N"
"C(C3)CCN(C3)C(C2)(CCCC2)c(c1)cccc1","InChI=1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2","JTJMJGYZQZDUJJ-UHFFFAOYSA-N"
"CN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc3S(=O)(=O)N(C)C)Sc(cccc2)1","InChI=1S/C22H30N4O2S2/c1-23(2)30(27,28)18-9-10-22-20(17-18)26(19-7-4-5-8-21(19)29-22)12-6-11-25-15-13-24(3)14-16-25/h4-5,7-10,17H,6,11-16H2,1-3H3","VZYCZNZBPPHOFY-UHFFFAOYSA-N"
"COC(=O)C([H])(C([H])(OC(=O)c(c3)cccc3)1)C([H])(C2)N(C)C([H])(C2)C1","InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1","ZPUCINDJVBIVPJ-LJISPDSOSA-N"
"CCCC(C)C(CC=C)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C12H18N2O3/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)","KQPKPCNLIDLUMF-UHFFFAOYSA-N"
"C(C(c(c4)cccc4)(c(c3)cccc3)CCN(C1)CCC(C(OCC)=O)(c(c2)cccc2)C1)#N","InChI=1S/C30H32N2O2/c1-2-34-28(33)29(25-12-6-3-7-13-25)18-21-32(22-19-29)23-20-30(24-31,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17H,2,18-23H2,1H3","HYPPXZBJBPSRLK-UHFFFAOYSA-N"
"[Na]OS(=O)(=O)CN(C)C(=C(C)1)C(=O)N(c(c2)cccc2)N(C)1","InChI=1S/C13H17N3O4S.Na/c1-10-12(14(2)9-21(18,19)20)13(17)16(15(10)3)11-7-5-4-6-8-11;/h4-8H,9H2,1-3H3,(H,18,19,20);/q;+1/p-1","DJGAAPFSPWAYTJ-UHFFFAOYSA-M"
"CN(C4)CC(=C(C4)1)C(c(c3)cccc3)c(c2)c(ccc2)1","InChI=1S/C19H19N/c1-20-12-11-16-15-9-5-6-10-17(15)19(18(16)13-20)14-7-3-2-4-8-14/h2-10,19H,11-13H2,1H3","ISFHAYSTHMVOJR-UHFFFAOYSA-N"
"CCC(=O)OC(C2)(C(C)CN(C)C2)c(c1)cccc1","InChI=1S/C16H23NO2/c1-4-15(18)19-16(14-8-6-5-7-9-14)10-11-17(3)12-13(16)2/h5-9,13H,4,10-12H2,1-3H3","UVAZQQHAVMNMHE-UHFFFAOYSA-N"
"CN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C20H24ClN3S/c1-22-11-13-23(14-12-22)9-4-10-24-17-5-2-3-6-19(17)25-20-8-7-16(21)15-18(20)24/h2-3,5-8,15H,4,9-14H2,1H3","WIKYUJGCLQQFNW-UHFFFAOYSA-N"
"CC(=O)NC(=O)NC(=O)C(Br)(CC)CC","InChI=1S/C9H15BrN2O3/c1-4-9(10,5-2)7(14)12-8(15)11-6(3)13/h4-5H2,1-3H3,(H2,11,12,13,14,15)","SAZUGELZHZOXHB-UHFFFAOYSA-N"
"CC(=O)Nc(c2)ccc(c2)OC(=O)c(c1)c(O)ccc1","InChI=1S/C15H13NO4/c1-10(17)16-11-6-8-12(9-7-11)20-15(19)13-4-2-3-5-14(13)18/h2-9,18H,1H3,(H,16,17)","TWIIVLKQFJBFPW-UHFFFAOYSA-N"
"CN(C)CCN(Cc(c2)csc2)c(c1)nccc1","InChI=1S/C14H19N3S/c1-16(2)8-9-17(11-13-6-10-18-12-13)14-5-3-4-7-15-14/h3-7,10,12H,8-9,11H2,1-2H3","RCGYDFVCAAKKNG-UHFFFAOYSA-N"
"ClCC(N1)N(C)S(=O)(=O)c(c2)c1cc(Cl)c2S(N)(=O)=O","InChI=1S/C9H11Cl2N3O4S2/c1-14-9(4-10)13-6-2-5(11)7(19(12,15)16)3-8(6)20(14,17)18/h2-3,9,13H,4H2,1H3,(H2,12,15,16)","CESYKOGBSMNBPD-UHFFFAOYSA-N"
"CCC(C(=O)2)(C(=O)NCN2)c(c1)cccc1","InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)","DQMZLTXERSFNPB-UHFFFAOYSA-N"
"CCC(C(=O)2)(C(=O)NC(=O)N2)c(c1)cccc1","InChI=1S/C12H12N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h3-7H,2H2,1H3,(H2,13,14,15,16,17)","DDBREPKUVSBGFI-UHFFFAOYSA-N"
"C=CCC(C(C)CC)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C11H16N2O3/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16)","BJVVMKUXKQHWJK-UHFFFAOYSA-N"
"CCN(CC)CCOC(=O)C(C2)(CCC2)c(c1)cccc1","InChI=1S/C18H27NO2/c1-3-19(4-2)14-15-21-17(20)18(12-8-9-13-18)16-10-6-5-7-11-16/h5-7,10-11H,3-4,8-9,12-15H2,1-2H3","OFAIGZWCDGNZGT-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)C(CC)(C1)C(=O)NC(=O)C1","InChI=1S/C13H16N2O2/c1-2-13(8-7-11(16)15-12(13)17)9-3-5-10(14)6-4-9/h3-6H,2,7-8,14H2,1H3,(H,15,16,17)","ROBVIMPUHSLWNV-UHFFFAOYSA-N"
"O=C(CCNNC(=O)c(c2)ccnc2)NCc(c1)cccc1","InChI=1S/C16H18N4O2/c21-15(18-12-13-4-2-1-3-5-13)8-11-19-20-16(22)14-6-9-17-10-7-14/h1-7,9-10,19H,8,11-12H2,(H,18,21)(H,20,22)","NOIIUHRQUVNIDD-UHFFFAOYSA-N"
"O=C(N3)NC(C(=O)3)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H12N2O2/c18-13-15(17-14(19)16-13,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19)","CXOFVDLJLONNDW-UHFFFAOYSA-N"
"CCC(C(=O)2)(C(=O)NC(=O)N2)C(C1)=CCCC1","InChI=1S/C12H16N2O3/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16/h6H,2-5,7H2,1H3,(H2,13,14,15,16,17)","WTYGAUXICFETTC-UHFFFAOYSA-N"
"CCC(C(=O)1)(c(c2)cccc2)C(=O)N(C)C(=O)N1","InChI=1S/C13H14N2O3/c1-3-13(9-7-5-4-6-8-9)10(16)14-12(18)15(2)11(13)17/h4-8H,3H2,1-2H3,(H,14,16,18)","ALARQZQTBTVLJV-UHFFFAOYSA-N"
"CCCCC(CC)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C10H16N2O3/c1-3-5-6-10(4-2)7(13)11-9(15)12-8(10)14/h3-6H2,1-2H3,(H2,11,12,13,14,15)","STDBAQMTJLUMFW-UHFFFAOYSA-N"
"C=CCC(C(C)C)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C10H14N2O3/c1-4-5-10(6(2)3)7(13)11-9(15)12-8(10)14/h4,6H,1,5H2,2-3H3,(H2,11,12,13,14,15)","UORJNBVJVRLXMQ-UHFFFAOYSA-N"
"O=C(N2)N(C)C(=O)C(C)(C(=O)2)C(C1)=CCCC1","InChI=1S/C12H16N2O3/c1-12(8-6-4-3-5-7-8)9(15)13-11(17)14(2)10(12)16/h6H,3-5,7H2,1-2H3,(H,13,15,17)","UYXAWHWODHRRMR-UHFFFAOYSA-N"
"CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=CC=CC=C45)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC","InChI=1S/C32H38N2O8/c1-37-24-12-17(13-25(38-2)29(24)39-3)31(35)42-26-14-18-16-34-11-10-20-19-8-6-7-9-22(19)33-28(20)23(34)15-21(18)27(30(26)40-4)32(36)41-5/h6-9,12-13,18,21,23,26-27,30,33H,10-11,14-16H2,1-5H3/t18-,21+,23-,26-,27+,30+/m1/s1","CVBMAZKKCSYWQR-WCGOZPBSSA-N"
"CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C","InChI=1S/C20H25N3O/c1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19(15)13(11-21-17)10-18(16)22(3)12-14/h6-9,11,14,18,21H,4-5,10,12H2,1-3H3/t14-,18-/m1/s1","VAYOSLLFUXYJDT-RDTXWAMCSA-N"
"NCCc(c1)cc(OC)c(OC)c(OC)1","InChI=1S/C11H17NO3/c1-13-9-6-8(4-5-12)7-10(14-2)11(9)15-3/h6-7H,4-5,12H2,1-3H3","RHCSKNNOAZULRK-UHFFFAOYSA-N"
"COc(c1)c(C)cc(OC)c(CC(C)N)1","InChI=1S/C12H19NO2/c1-8-5-12(15-4)10(6-9(2)13)7-11(8)14-3/h5,7,9H,6,13H2,1-4H3","NTJQREUGJKIARY-UHFFFAOYSA-N"
"CN(C)CCC1=CNC2=C1C(=CC=C2)OP(=O)(O)O","InChI=1S/C12H17N2O4P/c1-14(2)7-6-9-8-13-10-4-3-5-11(12(9)10)18-19(15,16)17/h3-5,8,13H,6-7H2,1-2H3,(H2,15,16,17)","QVDSEJDULKLHCG-UHFFFAOYSA-N"
"COc(c1)cc(CC(C)N)c(OC)c1","InChI=1S/C11H17NO2/c1-8(12)6-9-7-10(13-2)4-5-11(9)14-3/h4-5,7-8H,6,12H2,1-3H3","LATVFYDIBMDBSY-UHFFFAOYSA-N"
"O=C(N1)N(C)c(n2)c(n(C)c2)C(=O)1","InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)","YAPQBXQYLJRXSA-UHFFFAOYSA-N"
"COc(c3)cc(c(CC(O)=O)1)c(c3)n(C(=O)c(c2)ccc(Cl)c2)c(C)1","InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)","CGIGDMFJXJATDK-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)N(C(C)=1)C(=O)c(c2)c(ccc2)N1","InChI=1S/C16H14N2O/c1-11-7-3-6-10-15(11)18-12(2)17-14-9-5-4-8-13(14)16(18)19/h3-10H,1-2H3","JEYCTXHKTXCGPB-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N2)c(c1)cccc1","InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)","ADIMAYPTOBDMTL-UHFFFAOYSA-N"
"COc(c5)c(O1)c(c(c5)3)C(C4)(C=2C(N(C)C4)C3)C([H])(C(OC)=CC2)1","InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18+,19+/m1/s1","FQXXSQDCDRQNQE-VMDGZTHMSA-N"
"CN(C)CCc(c1)c(CC(=O)c(c3)c(C(O)=O)c(OC)c(OC)c3)c(OC)c(O2)c(OC2)1","InChI=1S/C23H27NO8/c1-24(2)9-8-13-10-18-22(32-12-31-18)20(29-4)15(13)11-16(25)14-6-7-17(28-3)21(30-5)19(14)23(26)27/h6-7,10H,8-9,11-12H2,1-5H3,(H,26,27)","DEXMFYZAHXMZNM-UHFFFAOYSA-N"
"COc(c5)c(OC)c(C(=O)4)c(c5)C([H])(O4)C([H])(N(C)3)c(c(CC3)1)c(OC)c(O2)c(OC2)c1","InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3/t17-,18+/m1/s1","AKNNEGZIBPJZJG-MSOLQXFVSA-N"
"COc(c3)c(OC)cc(c3)Cc(n2)c(c1)c(cc2)cc(OC)c(OC)1","InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3","XQYZDYMELSJDRZ-UHFFFAOYSA-N"
"CC(=C2)CCC(C(C(=C)CC2)1)C(C)(C)C1","InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6-","NPNUFJAVOOONJE-WDZFZDKYSA-N"
"C=C(C2)C([H])(C3)C([H])(C([H])(C)C3)C([H])(C(C)(C)1)C([H])(C2)1","InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h10-14H,1,5-8H2,2-4H3/t10-,11-,12-,13-,14-/m1/s1","ITYNGVSTWVVPIC-DHGKCCLASA-N"
"CC(C)=CCCC(C)(C21)C(C(C)=CC2)C1","InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6-7,13-14H,5,8-10H2,1-4H3","YMBFCQPIMVLNIU-UHFFFAOYSA-N"
"CC(C)=CCCC(=C)C([H])(C1)CC([H])=C(C)C1","InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,15H,4-5,7,9-11H2,1-3H3/t15-/m1/s1","XZRVRYFILCSYSP-OAHLLOKOSA-N"
"CC(C)C(C1)C([H])(C=2)C([H])(CCC(C)2)C(=C)C1","InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13-15H,4-8H2,1-3H3/t13-,14-,15-/m0/s1","WRHGORWNJGOVQY-KKUMJFAQSA-N"
"CC(C2)=CC([H])(C(C2)=1)C([H])(C(C)C)CCC(C)1","InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13,15H,5-8H2,1-4H3/t13-,15-/m0/s1","FUCYIEXQVQJBKY-ZFWWWQNUSA-N"
"CC(=C3)C(C1)C(C)(C)C(C2)C(C3)(C(C)C2)1","InChI=1S/C15H24/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h7,11-13H,5-6,8-9H2,1-4H3","IRAQOCYXUMOFCW-UHFFFAOYSA-N"
"CC(C)C([H])(C2)C([H])(C([H])31)C(CC([H])=C(C)3)(C([H])(C)C2)1","InChI=1S/C15H24/c1-9(2)12-6-5-11(4)15-8-7-10(3)13(15)14(12)15/h7,9,11-14H,5-6,8H2,1-4H3/t11-,12+,13+,14-,15?/m1/s1","XUEHVOLRMXNRKQ-GVLTWOEFSA-N"
"CC(C)C([H])(C2)C([H])(C([H])31)C(CCC(=C)3)(C([H])(C)C2)1","InChI=1S/C15H24/c1-9(2)12-6-5-11(4)15-8-7-10(3)13(15)14(12)15/h9,11-14H,3,5-8H2,1-2,4H3/t11-,12+,13+,14-,15?/m1/s1","FSRZGYRCMPZNJF-GVLTWOEFSA-N"
"CC(C)C(C1)C(C=2)C(=CCC(C)2)C(C)C1","InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h7,9-10,12-13,15H,5-6,8H2,1-4H3","JUQGWBAOQUBVFP-UHFFFAOYSA-N"
"CC(C)=C(C1)CC([H])(C(C)=C)C(C)(C=C)C1","InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,14H,1,4,8-10H2,2-3,5-6H3/t14-,15+/m0/s1","BQSLMQNYHVFRDT-LSDHHAIUSA-N"
"CC(C)C(C1)=CC([H])(C(C)=C)C(C)(C=C)C1","InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,10-11,14H,1,4,8-9H2,2-3,5-6H3/t14-,15+/m1/s1","MXDMETWAEGIFOE-CABCVRRESA-N"
"CC(=C)C(C1)CC(C)(C(C)2)C(=CCC2)C1","InChI=1S/C15H24/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h7,12-13H,1,5-6,8-10H2,2-4H3/t12-,13+,15+/m0/s1","QEBNYNLSCGVZOH-GZBFAFLISA-N"
"C=CC(C)=C([H])CC([H])=C(C)CCC=C(C)C","InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9-10,12H,1,7-8,11H2,2-5H3/b14-10-,15-12-","CXENHBSYCFFKJS-LOQWIJHWSA-N"
"CC(=C)C([H])(C1)CC(C([H])(C)2)=C(CC2)C([H])(C)C1","InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h11-13H,1,5-9H2,2-4H3/t11-,12-,13+/m0/s1","ADIDQIZBYUABQK-RWMBFGLXSA-N"
"CC(=C)C([H])(C2)CC([H])(C1=C(C)C2)C([H])(C)CC1","InChI=1S/C15H24/c1-10(2)13-7-5-11(3)14-8-6-12(4)15(14)9-13/h12-13,15H,1,5-9H2,2-4H3/t12-,13+,15-/m0/s1","YHAJBLWYOIUHHM-GUTXKFCHSA-N"
"CC(C3)=C(C([H])(C3)2)C([H])(C(C)(C)1)C([H])(CCC([H])(C)2)1","InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h9,11-12,14H,5-8H2,1-4H3/t9-,11-,12-,14-/m1/s1","SPCXZDDGSGTVAW-XIDUGBJDSA-N"
"C=C(C3)C([H])(C([H])(C3)2)C([H])(C(C)(C)1)C([H])(CCC([H])(C)2)1","InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h9,11-14H,2,5-8H2,1,3-4H3/t9-,11-,12-,13-,14-/m1/s1","IRCZVRWQUNZGSH-DKTYCGPESA-N"
"CC(C2)=C([H])C([H])(C(C)(C)1)C([H])(C2)C(=C)CCC1","InChI=1S/C15H24/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h10,13-14H,2,5-9H2,1,3-4H3/t13-,14-/m0/s1","ZJSIKVDEOWWVEH-KBPBESRZSA-N"
"CC(C2)=C([H])C([H])(C(C2)=1)C(C)(C)CCCC(C)1","InChI=1S/C15H24/c1-11-7-8-13-12(2)6-5-9-15(3,4)14(13)10-11/h10,14H,5-9H2,1-4H3/t14-/m0/s1","LCOSCMLXPAQCLQ-AWEZNQCLSA-N"
"[H]C(C1)=C(C)CC([H])=C([H])C(C)(C)CC([H])=C(C)C1","InChI=1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6+,13-7+,14-10+","FAMPSKZZVDUYOS-HRGUGZIWSA-N"
"CC(C)(C2)C(C31)C(CC3)C(C)(CC2)C(=C)1","InChI=1S/C15H24/c1-10-11-6-7-12-13(11)14(2,3)8-5-9-15(10,12)4/h11-13H,1,5-9H2,2-4H3/t11?,12?,13-,15+/m0/s1","PDSNLYSELAIEBU-NSOJWWLLSA-N"
"CC(C)C(C1)C([H])(C=2)C([H])(CCC(C)2)C(=C)C1","InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h9-10,13-15H,4-8H2,1-3H3/t13-,14-,15+/m0/s1","WRHGORWNJGOVQY-SOUVJXGZSA-N"
"[H]C(C)(C3)C(C1)=C(C3)C(C)(C2)C(C)(C)C([H])(C2)1","InChI=1S/C15H24/c1-10-5-6-13-12(10)9-11-7-8-15(13,4)14(11,2)3/h10-11H,5-9H2,1-4H3/t10-,11+,15-/m0/s1","CSKINCSXMLCMAR-RWSFTLGLSA-N"
"CC(C)=CCCC(C)(C32)C(C)(C(C3)1)C(C2)1","InChI=1S/C15H24/c1-10(2)6-5-7-14(3)11-8-12-13(9-11)15(12,14)4/h6,11-13H,5,7-9H2,1-4H3","KWFJIXPIFLVMPM-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(C(=C)1)C(C2)CC(C2)1","InChI=1S/C15H24/c1-11(2)6-5-9-15(4)12(3)13-7-8-14(15)10-13/h6,13-14H,3,5,7-10H2,1-2,4H3/t13-,14+,15+/m1/s1","PGBNIHXXFQBCPU-ILXRZTDVSA-N"
"CC(C)=CCCC(C)(C(=C)1)C([H])(C2)CC([H])(C2)1","InChI=1S/C15H24/c1-11(2)6-5-9-15(4)12(3)13-7-8-14(15)10-13/h6,13-14H,3,5,7-10H2,1-2,4H3/t13-,14+,15-/m1/s1","PGBNIHXXFQBCPU-QLFBSQMISA-N"
"CC(C)(C3)C(C2)(C1)C(=CC3)C(C)(C)C([H])(C2)1","InChI=1S/C15H24/c1-13(2)8-5-6-12-14(3,4)11-7-9-15(12,13)10-11/h6,11H,5,7-10H2,1-4H3/t11-,15-/m0/s1","CQUAYTJDLQBXCQ-NHYWBVRUSA-N"
"C=C(C2)CC([H])(C([H])(C(C)C)1)C([H])(C2)C(=C)CC1","InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h10,13-15H,3-9H2,1-2H3/t13-,14+,15-/m0/s1","NOLWRMQDWRAODO-ZNMIVQPWSA-N"
"[H]C(C2)=C(C)CCC([H])(C(C)(C)1)C([H])(C(=C)C2)C1","InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6-/t13-,14-/m1/s1","NPNUFJAVOOONJE-FLFDDASRSA-N"
"CC(=C)C([H])(C1)CC([H])(C(=C)2)C(C)(CCC2)C1","InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h13-14H,1,3,5-10H2,2,4H3/t13-,14+,15-/m1/s1","YOVSPTNQHMDJAG-QLFBSQMISA-N"
"CC(C3)(C2)CC(CC3)(C=1)C([H])(C2)C(C)(C)C1","InChI=1S/C15H24/c1-13(2)9-10-15-7-4-6-14(3,11-15)8-5-12(13)15/h9-10,12H,4-8,11H2,1-3H3/t12-,14+,15-/m0/s1","MKZIRHIVARSBHI-CFVMTHIKSA-N"
"CC(C)=CCC=C(C)C(C1)CC=C(C)C1","InChI=1S/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6-8,15H,5,9-11H2,1-4H3/b14-7-","YHBUQBJHSRGZNF-AUWJEWJLSA-N"
"CC(C)=CCCC(C)(C([H])21)C([H])(C(=C)CC2)C1","InChI=1S/C15H24/c1-11(2)6-5-9-15(4)13-8-7-12(3)14(15)10-13/h6,13-14H,3,5,7-10H2,1-2,4H3/t13-,14-,15-/m0/s1","DGZBGCMPRYFWFF-KKUMJFAQSA-N"
"C=CC(C)(C1)C([H])(C(C)=C)CC([H])(C(C)=C)C1","InChI=1S/C15H24/c1-7-15(6)9-8-13(11(2)3)10-14(15)12(4)5/h7,13-14H,1-2,4,8-10H2,3,5-6H3/t13-,14+,15-/m1/s1","OPFTUNCRGUEPRZ-QLFBSQMISA-N"
"[H]C(C2)=C(C)CCC(C(C(=C)C2)1)C(C)(C)C1","InChI=1S/C15H24/c1-11-6-5-7-12(2)13-10-15(3,4)14(13)9-8-11/h6,13-14H,2,5,7-10H2,1,3-4H3/b11-6-","NPNUFJAVOOONJE-WDZFZDKYSA-N"
"CC(C4([H])C(C=CC([H])(CC)C(C)C)([H])C)(C([H])3CC4)CCC(C([H])23)([H])C(C)(C1=CC2)CCC(C1)=O","InChI=1S/C29H46O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,24-27H,7,11-18H2,1-6H3/b9-8+/t20-,21-,24+,25-,26+,27+,28+,29-/m1/s1","XWDAKKDQJHVMKG-LPJPOILFSA-N"
"COc(c1)c(O)cc(C)c1","InChI=1S/C8H10O2/c1-6-3-4-8(10-2)7(9)5-6/h3-5,9H,1-2H3","IFNDEOYXGHGERA-UHFFFAOYSA-N"
"O=Cc(c1)c(C)cc(O)c(OC)1","InChI=1S/C9H10O3/c1-6-3-8(11)9(12-2)4-7(6)5-10/h3-5,11H,1-2H3","MNMCHJAOXXQRID-UHFFFAOYSA-N"
"O=Cc(c1)c(C)c(C=O)c(O)c(OC)1","InChI=1S/C10H10O4/c1-6-7(4-11)3-9(14-2)10(13)8(6)5-12/h3-5,13H,1-2H3","VYOUKKOYZOVDCQ-UHFFFAOYSA-N"
"OCCOc(c1)cccc1","InChI=1S/C8H10O2/c9-6-7-10-8-4-2-1-3-5-8/h1-5,9H,6-7H2","QCDWFXQBSFUVSP-UHFFFAOYSA-N"
"CCOc(c1)c(O)c(C=O)cc1","InChI=1S/C9H10O3/c1-2-12-8-5-3-4-7(6-10)9(8)11/h3-6,11H,2H2,1H3","OFQBYHLLIJGMNP-UHFFFAOYSA-N"
"CCOc(c1)c(O)ccc(C=O)1","InChI=1S/C9H10O3/c1-2-12-9-5-7(6-10)3-4-8(9)11/h3-6,11H,2H2,1H3","CBOQJANXLMLOSS-UHFFFAOYSA-N"
"CCOc(c1)c(O)c(C=O)cc(C=O)1","InChI=1S/C10H10O4/c1-2-14-9-4-7(5-11)3-8(6-12)10(9)13/h3-6,13H,2H2,1H3","WQWNVPGJVKVZDH-UHFFFAOYSA-N"
"NC(=O)NC(N1)C(=O)NC(=O)1","InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)","POJWUDADGALRAB-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)C(N1)C(=O)NC(=O)1","InChI=1S/C9H8N2O3/c12-6-3-1-5(2-4-6)7-8(13)11-9(14)10-7/h1-4,7,12H,(H2,10,11,13,14)","UMTNMIARZPDSDI-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)Oc(c1)ccc(O)c1","InChI=1S/C12H10O3/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8,13-14H","NZGQHKSLKRFZFL-UHFFFAOYSA-N"
"N#CC(O)c(c1)c(O)c(OC)cc1","InChI=1S/C9H9NO3/c1-13-8-4-2-3-6(9(8)12)7(11)5-10/h2-4,7,11-12H,1H3","DDYGYEKJAPMJTE-UHFFFAOYSA-N"
"N#CC(O)c(c1)cc(OC)c(O)c1","InChI=1S/C9H9NO3/c1-13-9-4-6(8(12)5-10)2-3-7(9)11/h2-4,8,11-12H,1H3","VHGYYIXSLHYRBH-UHFFFAOYSA-N"
"Clc(c2)cc(Cl)c(c2)C(=O)Oc(n(C)1)c([H])c(C)n1","InChI=1S/C12H10Cl2N2O2/c1-7-5-11(16(2)15-7)18-12(17)9-4-3-8(13)6-10(9)14/h3-6H,1-2H3","QOOMYIRZXFVVFH-UHFFFAOYSA-N"
"CON=O","InChI=1S/CH3NO2/c1-4-2-3/h1H3","BLLFVUPNHCTMSV-UHFFFAOYSA-N"
"CCC(C1)OC(=O)C1","InChI=1S/C6H10O2/c1-2-5-3-4-6(7)8-5/h5H,2-4H2,1H3","JBFHTYHTHYHCDJ-UHFFFAOYSA-N"
"COc(c1)c(O)c(cc1)C(O)C(O)=O","InChI=1S/C9H10O5/c1-14-6-4-2-3-5(7(6)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)","SYMPFBURZFGXAS-UHFFFAOYSA-N"
"Clc(c1)ccc(c1)SC(F)(F)F","InChI=1S/C7H4ClF3S/c8-5-1-3-6(4-2-5)12-7(9,10)11/h1-4H","ATFBQTUDGRJCNB-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCC","InChI=1S/C11H22O2/c1-3-5-6-7-8-9-10-11(12)13-4-2/h3-10H2,1-2H3","BYEVBITUADOIGY-UHFFFAOYSA-N"
"CCCCCCCC(C1)OC(=O)C1","InChI=1S/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3","PHXATPHONSXBIL-UHFFFAOYSA-N"
"COc(c(=O)1)c(OC)c(=O)c(C)c1","InChI=1S/C9H10O4/c1-5-4-6(10)8(12-2)9(13-3)7(5)11/h4H,1-3H3","UIXPTCZPFCVOQF-UHFFFAOYSA-N"
"NCCCCCCCCCCCCN","InChI=1S/C12H28N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-14H2","QFTYSVGGYOXFRQ-UHFFFAOYSA-N"
"NCCCCCCCCCCCC#N","InChI=1S/C12H24N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-11,13H2","BVJKISUCBKDPOW-UHFFFAOYSA-N"
"N#CCCCCCCCCCCC#N","InChI=1S/C12H20N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-10H2","AVQYXBDAZWIFTO-UHFFFAOYSA-N"
"CCCCCCCCC#N","InChI=1S/C9H17N/c1-2-3-4-5-6-7-8-9-10/h2-8H2,1H3","PLZZPPHAMDJOSR-UHFFFAOYSA-N"
"CCCCCCCCCCC#N","InChI=1S/C11H21N/c1-2-3-4-5-6-7-8-9-10-11-12/h2-10H2,1H3","SZKKNEOUHLFYNA-UHFFFAOYSA-N"
"CC(C)(C)OOC(C)(C)C","InChI=1S/C8H18O2/c1-7(2,3)9-10-8(4,5)6/h1-6H3","LSXWFXONGKSEMY-UHFFFAOYSA-N"
"N#CCC#N","InChI=1S/C3H2N2/c4-2-1-3-5/h1H2","CUONGYYJJVDODC-UHFFFAOYSA-N"
"N#CCCC#N","InChI=1S/C4H4N2/c5-3-1-2-4-6/h1-2H2","IAHFWCOBPZCAEA-UHFFFAOYSA-N"
"Clc(c3)cc(n2)c(c3)c(nc2)Nc(c1)cccc1","InChI=1S/C14H10ClN3/c15-10-6-7-12-13(8-10)16-9-17-14(12)18-11-4-2-1-3-5-11/h1-9H,(H,16,17,18)","GZLRRAAMOVHEKU-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(Cl)c(O)c1","InChI=1S/C8H7ClO3/c9-6-3-5(4-8(11)12)1-2-7(6)10/h1-3,10H,4H2,(H,11,12)","IYTUKSIOQKTZEG-UHFFFAOYSA-N"
"CCOC(=O)CCC(=O)OC","InChI=1S/C7H12O4/c1-3-11-7(9)5-4-6(8)10-2/h3-5H2,1-2H3","HXXRQBBSGZDQNP-UHFFFAOYSA-N"
"Nc(c1)c(Cl)cc(Cl)c1","InChI=1S/C6H5Cl2N/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2","KQCMTOWTPBNWDB-UHFFFAOYSA-N"
"O=c(o2)c(c(Cl)1)c(c(=O)2)c(Cl)c(Cl)c(Cl)1","InChI=1S/C8Cl4O3/c9-3-1-2(8(14)15-7(1)13)4(10)6(12)5(3)11","AUHHYELHRWCWEZ-UHFFFAOYSA-N"
"O=C(C1)CCC(=O)C1","InChI=1S/C6H8O2/c7-5-1-2-6(8)4-3-5/h1-4H2","DCZFGQYXRKMVFG-UHFFFAOYSA-N"
"OC(C1)CCC(O)C1","InChI=1S/C6H12O2/c7-5-1-2-6(8)4-3-5/h5-8H,1-4H2","VKONPUDBRVKQLM-UHFFFAOYSA-N"
"N#CCCOCCC#N","InChI=1S/C6H8N2O/c7-3-1-5-9-6-2-4-8/h1-2,5-6H2","BCGCCTGNWPKXJL-UHFFFAOYSA-N"
"C=CC(N)=O","InChI=1S/C3H5NO/c1-2-3(4)5/h2H,1H2,(H2,4,5)","HRPVXLWXLXDGHG-UHFFFAOYSA-N"
"N#CCCO","InChI=1S/C3H5NO/c4-2-1-3-5/h5H,1,3H2","WSGYTJNNHPZFKR-UHFFFAOYSA-N"
"C(C1)CCCCCNCCCCC1","InChI=1S/C12H25N/c1-2-4-6-8-10-12-13-11-9-7-5-3-1/h13H,1-12H2","UFADJPZTTUWZMP-UHFFFAOYSA-N"
"CCCCC(=C1)C(=O)CC1","InChI=1S/C9H14O/c1-2-3-5-8-6-4-7-9(8)10/h6H,2-5,7H2,1H3","LQANWSYLRLMKDX-UHFFFAOYSA-N"
"O=Cc(c1)cc(OC)c(OC)c(OC)1","InChI=1S/C10H12O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-6H,1-3H3","OPHQOIGEOHXOGX-UHFFFAOYSA-N"
"COC(=O)CC(C)C(=O)OC","InChI=1S/C7H12O4/c1-5(7(9)11-3)4-6(8)10-2/h5H,4H2,1-3H3","NFOQJNGQQXICBY-UHFFFAOYSA-N"
"CC=CCC(=O)OC","InChI=1S/C6H10O2/c1-3-4-5-6(7)8-2/h3-4H,5H2,1-2H3/b4-3+","KJALUUCEMMPKAC-ONEGZZNKSA-N"
"CC(=O)Oc(c1)c(ccc1)[N+1]([O-1])=O","InChI=1S/C8H7NO4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3","MRCKRGSNLOHYRA-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C8H7NO4/c1-6(10)13-8-4-2-3-7(5-8)9(11)12/h2-5H,1H3","HRMRLUUZPLAPAS-UHFFFAOYSA-N"
"CC(=O)Oc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C8H7NO4/c1-6(10)13-8-4-2-7(3-5-8)9(11)12/h2-5H,1H3","QAUUDNIGJSLPSX-UHFFFAOYSA-N"
"N#CCCNCCC#N","InChI=1S/C6H9N3/c7-3-1-5-9-6-2-4-8/h9H,1-2,5-6H2","SBAJRGRUGUQKAF-UHFFFAOYSA-N"
"NC(=O)Cc(c1)ccc(O)c1","InChI=1S/C8H9NO2/c9-8(11)5-6-1-3-7(10)4-2-6/h1-4,10H,5H2,(H2,9,11)","YBPAYPRLUDCSEY-UHFFFAOYSA-N"
"COC(=O)C(=NO)C(=O)OC","InChI=1S/C5H7NO5/c1-10-4(7)3(6-9)5(8)11-2/h9H,1-2H3","GLFGXQYUPFIXJV-UHFFFAOYSA-N"
"COC(=O)C=NO","InChI=1S/C3H5NO3/c1-7-3(5)2-4-6/h2,6H,1H3/b4-2+","FOOPJRSDKYBEGG-DUXPYHPUSA-N"
"COC(=O)CC=CC(=O)OC","InChI=1S/C7H10O4/c1-10-6(8)4-3-5-7(9)11-2/h3-4H,5H2,1-2H3/b4-3+","SKCGFFOFYXLNCG-ONEGZZNKSA-N"
"N#CC(=O)OC","InChI=1S/C3H3NO2/c1-6-3(5)2-4/h1H3","OBWFJXLKRAFEDI-UHFFFAOYSA-N"
"NCCCCCCCCCCCC(N)=O","InChI=1S/C12H26N2O/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h1-11,13H2,(H2,14,15)","SNNMLPUQKZGXOJ-UHFFFAOYSA-N"
"NCCc(c1)cc(OC)c(OC)c1","InChI=1S/C10H15NO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5-6,11H2,1-2H3","ANOUKFYBOAKOIR-UHFFFAOYSA-N"
"NCCc(c1)cccc1","InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2","BHHGXPLMPWCGHP-UHFFFAOYSA-N"
"OCCN(CC)CC","InChI=1S/C6H15NO/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3","BFSVOASYOCHEOV-UHFFFAOYSA-N"
"CCN(CC)N=O","InChI=1S/C4H10N2O/c1-3-6(4-2)5-7/h3-4H2,1-2H3","WBNQDOYYEUMPFS-UHFFFAOYSA-N"
"COC(=O)c(c1)c(C(=O)OC)c(O)cc1","InChI=1S/C10H10O5/c1-14-9(12)6-4-3-5-7(11)8(6)10(13)15-2/h3-5,11H,1-2H3","BQGDDMMXPRJQHZ-UHFFFAOYSA-N"
"Clc(c2)cc(n1)c(c2)c(Cl)nc1","InChI=1S/C8H4Cl2N2/c9-5-1-2-6-7(3-5)11-4-12-8(6)10/h1-4H","FDPHWQSGEWRZOL-UHFFFAOYSA-N"
"Oc(n2)c(c1)c(nc2)cc(Cl)c1","InChI=1S/C8H5ClN2O/c9-5-1-2-6-7(3-5)10-4-11-8(6)12/h1-4H,(H,10,11,12)","PMLONMIODRHERC-UHFFFAOYSA-N"
"O=C(N=1)Cc(c2)c(ccc2)C1","InChI=1S/C9H7NO/c11-9-5-7-3-1-2-4-8(7)6-10-9/h1-4,6H,5H2","SAAKIDBWTMIZGV-UHFFFAOYSA-N"
"O=C(C1)OCCOC(=O)CCCCCCCCCC1","InChI=1S/C15H26O4/c16-14-10-8-6-4-2-1-3-5-7-9-11-15(17)19-13-12-18-14/h1-13H2","XRHCAGNSDHCHFJ-UHFFFAOYSA-N"
"O=Cc(c1)cc(OC)c(OC(C)=O)c1","InChI=1S/C10H10O4/c1-7(12)14-9-4-3-8(6-11)5-10(9)13-2/h3-6H,1-2H3","PZSJOBKRSVRODF-UHFFFAOYSA-N"
"Nc(c1)onc1","InChI=1S/C3H4N2O/c4-3-1-2-5-6-3/h1-2H,4H2","IAXWZYXUKABJAN-UHFFFAOYSA-N"
"OCC(=O)NCc(c1)cccc1","InChI=1S/C9H11NO2/c11-7-9(12)10-6-8-4-2-1-3-5-8/h1-5,11H,6-7H2,(H,10,12)","GUDMTEGDXVJZEE-UHFFFAOYSA-N"
"N#CC(C)O","InChI=1S/C3H5NO/c1-3(5)2-4/h3,5H,1H3","WOFDVDFSGLBFAC-UHFFFAOYSA-N"
"CCON=O","InChI=1S/C2H5NO2/c1-2-5-3-4/h2H2,1H3","QQZWEECEMNQSTG-UHFFFAOYSA-N"
"CCOC(C)OCC","InChI=1S/C6H14O2/c1-4-7-6(3)8-5-2/h6H,4-5H2,1-3H3","DHKHKXVYLBGOIT-UHFFFAOYSA-N"
"O=NN(C(C2)CCCC2)C(C1)CCCC1","InChI=1S/C12H22N2O/c15-13-14(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-12H,1-10H2","CYMNKXLBEMEABS-UHFFFAOYSA-N"
"O=C(C1)N(C)C(=O)C1","InChI=1S/C5H7NO2/c1-6-4(7)2-3-5(6)8/h2-3H2,1H3","KYEACNNYFNZCST-UHFFFAOYSA-N"
"Cc(n1)nc(N)cc1","InChI=1S/C5H7N3/c1-4-7-3-2-5(6)8-4/h2-3H,1H3,(H2,6,7,8)","GKVDLTTVBNOGNJ-UHFFFAOYSA-N"
"N#Cc(c1)c(N)nc(C)n1","InChI=1S/C6H6N4/c1-4-9-3-5(2-7)6(8)10-4/h3H,1H3,(H2,8,9,10)","YBPNIILOUYAGIF-UHFFFAOYSA-N"
"C(C1)CCNCC1","InChI=1S/C6H13N/c1-2-4-6-7-5-3-1/h7H,1-6H2","ZSIQJIWKELUFRJ-UHFFFAOYSA-N"
"CCCCC(O1)C(C)CC(=O)1","InChI=1S/C9H16O2/c1-3-4-5-8-7(2)6-9(10)11-8/h7-8H,3-6H2,1-2H3","WNVCMFHPRIBNCW-UHFFFAOYSA-N"
"CC(=O)C(C1)C(=O)OCC1","InChI=1S/C7H10O3/c1-5(8)6-3-2-4-10-7(6)9/h6H,2-4H2,1H3","DRBJCTHMAXSQQA-UHFFFAOYSA-N"
"CSC(=S)Nc(c1)cccc1","InChI=1S/C8H9NS2/c1-11-8(10)9-7-5-3-2-4-6-7/h2-6H,1H3,(H,9,10)","MOOSRNWDPWTOBF-UHFFFAOYSA-N"
"N#CCC(OC)(OC)OC","InChI=1S/C6H11NO3/c1-8-6(9-2,10-3)4-5-7/h4H2,1-3H3","IPJDXQYLAATRJK-UHFFFAOYSA-N"
"CCCCOC(=O)C(OCCCC)OCCCC","InChI=1S/C14H28O4/c1-4-7-10-16-13(15)14(17-11-8-5-2)18-12-9-6-3/h14H,4-12H2,1-3H3","LEQXXBBCRATLPW-UHFFFAOYSA-N"
"COC(=O)CCOC(=O)CCC(=O)OCCC(=O)OC","InChI=1S/C12H18O8/c1-17-9(13)5-7-19-11(15)3-4-12(16)20-8-6-10(14)18-2/h3-8H2,1-2H3","MFPWNUOPWVCQGS-UHFFFAOYSA-N"
"CCOC(=O)CCOC(=O)CCC(=O)OCCC(=O)OCC","InChI=1S/C14H22O8/c1-3-19-13(17)7-9-21-11(15)5-6-12(16)22-10-8-14(18)20-4-2/h3-10H2,1-2H3","YEVXRUJBEXBWIO-UHFFFAOYSA-N"
"OCC(O)C(=C)C(O)=O","InChI=1S/C5H8O4/c1-3(5(8)9)4(7)2-6/h4,6-7H,1-2H2,(H,8,9)","OIWJREZAJZVGQN-UHFFFAOYSA-N"
"CN(C21)C(C(C3)C(CC3)2)1","InChI=1S/C8H13N/c1-9-7-5-3-2-4-6(5)8(7)9/h5-8H,2-4H2,1H3","MIDDZYMFLRWZCN-UHFFFAOYSA-N"
"CN(C2)CC(C31)C(C(CC3)2)1","InChI=1S/C9H15N/c1-10-4-6-2-3-7-8(5-10)9(6)7/h6-9H,2-5H2,1H3","NGRFQLAXUCEPJX-UHFFFAOYSA-N"
"","InChI=1S/C27H47NO/c1-17-5-10-25(28-16-17)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h17-25,28-29H,5-16H2,1-4H3/t17-,18-,19-,20-,21-,22+,23-,24-,25+,26-,27+/m0/s1","ITXLZVVZOJDDNX-ZBOQGUEPSA-N"
"","InChI=1S/C27H45NO/c1-17-5-10-25(28-16-17)18(2)22-8-9-23-21-7-6-19-15-20(29)11-13-26(19,3)24(21)12-14-27(22,23)4/h6,17-18,20-25,28-29H,5,7-16H2,1-4H3/t17-,18-,20-,21-,22+,23-,24-,25+,26-,27+/m0/s1","SWTXHUUBYZNDAJ-OWJFKGPJSA-N"
"c(c2)ccc(c2)c(n1)c(O)c(Cl)s1","InChI=1S/C9H6ClNOS/c10-9-8(12)7(11-13-9)6-4-2-1-3-5-6/h1-5,12H","OCQBHHUDBUQVRY-UHFFFAOYSA-N"
"N#Cc(c(Cl)2)c(ns2)c(c1)cccc1","InChI=1S/C10H5ClN2S/c11-10-8(6-12)9(13-14-10)7-4-2-1-3-5-7/h1-5H","XVZHEHJRVLCBAM-UHFFFAOYSA-N"
"FC(N(F)1)(N(F)1)N(F)F","InChI=1S/CF5N3/c2-1(7(3)4)8(5)9(1)6","PDDMXPBDIOWPPF-UHFFFAOYSA-N"
"FC(F)(N(F)1)N(F)1","InChI=1S/CF4N2/c2-1(3)6(4)7(1)5","GYVBIRZKBSLKBA-UHFFFAOYSA-N"
"C(=N\F)(\F)/N(F)F.C(=N\F)(\F)/N(F)F","InChI=1S/2CF4N2/c2*2-1(6-3)7(4)5/b2*6-1+","SMRRSJDMBDWJJY-YHQTUERDSA-N"
"c(C2C(CCCCCC)([H])O)(c4=O)c(c(o4)=O)CC(C([H])(O)C(C3)(OC(=O)C=C3)[H])([H])Cc(c(C([H])(O)2)1)c(oc1=O)=O","InChI=1S/C26H30O11/c1-2-3-4-5-7-15(27)20-18-13(23(31)36-25(18)33)10-12(21(29)16-8-6-9-17(28)35-16)11-14-19(22(20)30)26(34)37-24(14)32/h6,9,12,15-16,20-22,27,29-30H,2-5,7-8,10-11H2,1H3/t12-,15+,16-,20?,21-,22?/m0/s1","ZJTBTDVZNGBSNG-WTFOXLIOSA-N"
"O=c(o4)c(C3C(CCCCCC)OC(C)=O)c(c4=O)CC(Cc(c(=O)2)c(C3OC(C)=O)c(o2)=O)C(OC(C)=O)C(C1)OC(C=C1)=O","InChI=1S/C32H36O14/c1-5-6-7-8-10-21(41-15(2)33)26-24-19(29(37)45-31(24)39)13-18(27(42-16(3)34)22-11-9-12-23(36)44-22)14-20-25(28(26)43-17(4)35)32(40)46-30(20)38/h9,12,18,21-22,26-28H,5-8,10-11,13-14H2,1-4H3","RLPCKDQGNOVADL-UHFFFAOYSA-N"
"CC(=O)OCC([H])(O1)C([H])(OC(C)=O)C=C(OC(C)=O)C([H])(OC(C)=O)1","InChI=1S/C14H18O9/c1-7(15)19-6-13-11(20-8(2)16)5-12(21-9(3)17)14(23-13)22-10(4)18/h5,11,13-14H,6H2,1-4H3/t11-,13+,14-/m0/s1","SSPYOUYEPYQDLN-YUTCNCBUSA-N"
"CC(=O)OCC(O1)C(OC(C)=O)C(C=C1)OC(C)=O","InChI=1S/C12H16O7/c1-7(13)17-6-11-12(19-9(3)15)10(4-5-16-11)18-8(2)14/h4-5,10-12H,6H2,1-3H3/t10-,11-,12+/m1/s1","LLPWGHLVUPBSLP-UTUOFQBUSA-N"
"CC(=O)OCC([H])(O1)CC([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(COC(C)=O)1","InChI=1S/C15H22O9/c1-8(16)20-6-12-5-13(22-10(3)18)15(23-11(4)19)14(24-12)7-21-9(2)17/h12-15H,5-7H2,1-4H3/t12-,13-,14-,15+/m1/s1","BWUOHRDTHUBKLA-TUVASFSCSA-N"
"CC(=O)OCC([H])(O1)CC([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(COC(C)=O)1","InChI=1S/C15H22O9/c1-8(16)20-6-12-5-13(22-10(3)18)15(23-11(4)19)14(24-12)7-21-9(2)17/h12-15H,5-7H2,1-4H3/t12-,13+,14+,15-/m0/s1","BWUOHRDTHUBKLA-YJNKXOJESA-N"
"CC(=O)OCC([H])(O1)C([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(COC(C)=O)1","InChI=1S/C17H24O11/c1-8(18)23-6-13-15(25-10(3)20)17(27-12(5)22)16(26-11(4)21)14(28-13)7-24-9(2)19/h13-17H,6-7H2,1-5H3","NSESSVVOVAHLTQ-UHFFFAOYSA-N"
"CC(=O)OCC([H])(O1)C([H])(OC(C)=O)C([H])(COC(C)=O)C([H])(OC(C)=O)C([H])(OC(C)=O)1","InChI=1S/C17H24O11/c1-8(18)23-6-13-15(25-10(3)20)14(7-24-9(2)19)28-17(27-12(5)22)16(13)26-11(4)21/h13-17H,6-7H2,1-5H3","SPFFTHPLMGMUFQ-UHFFFAOYSA-N"
"O=C(C4)CC([H])(C3)C(C)(C4)C([H])(C1)C([H])(C3)C([H])(C2)C(C)(C=C2)C1","InChI=1S/C19H28O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h3,9,13,15-17H,4-8,10-12H2,1-2H3/t13-,15-,16-,17-,18-,19-/m0/s1","HFVMLYAGWXSTQI-QYXZOKGRSA-N"
"CCC=CCCCCCCCC(=O)OC","InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h4-5H,3,6-12H2,1-2H3/b5-4+","DUWQEMMRMJGHSA-SNAWJCMRSA-N"
"c(c3)ccc(c3)C(=O)c(n2)oc(n2)c(c1)cccc1","InChI=1S/C15H10N2O2/c18-13(11-7-3-1-4-8-11)15-17-16-14(19-15)12-9-5-2-6-10-12/h1-10H","BQDNZODZBRVPBU-UHFFFAOYSA-N"
"NNC(=O)C(O)C(Cl)(Cl)Cl","InChI=1S/C3H5Cl3N2O2/c4-3(5,6)1(9)2(10)8-7/h1,9H,7H2,(H,8,10)","WCOCRIXTXPYJAI-UHFFFAOYSA-N"
"c(c1C(C(C(=O)OCC)=2)(OCC)Oc(c4)c(ccc4)C2c(c3)cccc3)cccc1","InChI=1S/C26H24O4/c1-3-28-25(27)24-23(19-13-7-5-8-14-19)21-17-11-12-18-22(21)30-26(24,29-4-2)20-15-9-6-10-16-20/h5-18H,3-4H2,1-2H3","CCRDIEHZFWQCPL-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(=O)C(C(=O)1)=C(c(c3)cccc3)c(c2)c(ccc2)O1","InChI=1S/C22H14O3/c23-21(16-11-5-2-6-12-16)20-19(15-9-3-1-4-10-15)17-13-7-8-14-18(17)25-22(20)24/h1-14H","FMCKKHCHCKODSJ-UHFFFAOYSA-N"
"c(C(c(c6)cccc6)(O5)C(=C(c(c54)cccc4)c(c3)cccc3)C(=O)c(c2)cccc2)(c1)cccc1","InChI=1S/C34H24O2/c35-33(26-17-7-2-8-18-26)32-31(25-15-5-1-6-16-25)29-23-13-14-24-30(29)36-34(32,27-19-9-3-10-20-27)28-21-11-4-12-22-28/h1-24H","BPNPQNDAJUARLM-UHFFFAOYSA-N"
"O=C(c(c5)cccc5)C(=C(c(c4)cccc4)1)C(c(c3)cccc3)(Oc(c2)c1ccc2)OCC","InChI=1S/C30H24O3/c1-2-32-30(24-18-10-5-11-19-24)28(29(31)23-16-8-4-9-17-23)27(22-14-6-3-7-15-22)25-20-12-13-21-26(25)33-30/h3-21H,2H2,1H3","UAUAFLCFXLLLHQ-UHFFFAOYSA-N"
"c(c3)ccc(c3)C=C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H16/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-16H","MKYQPGPNVYRMHI-UHFFFAOYSA-N"
"Brc(c3)cc(cc3)C=C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H15Br/c21-19-13-7-8-16(14-19)15-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H","RVJZCZBYXHDMCE-UHFFFAOYSA-N"
"Brc(c3)ccc(c3)C=C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H15Br/c21-19-13-11-16(12-14-19)15-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-15H","HUCFDUOIMSRYAA-UHFFFAOYSA-N"
"Clc(c3)c(ccc3)C=C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H15Cl/c21-20-14-8-7-13-18(20)15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15H","YZDVFBGTWSQJAO-UHFFFAOYSA-N"
"Clc(c3)cc(cc3)C=C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H15Cl/c21-19-13-7-8-16(14-19)15-20(17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15H","OWOPOOCVXXJSLJ-UHFFFAOYSA-N"
"Clc(c3)ccc(c3)C=C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H15Cl/c21-19-13-11-16(12-14-19)15-20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-15H","NWPFYBDLRQXMNQ-UHFFFAOYSA-N"
"CC(C)(C)Sc(c1)ccnc1","InChI=1S/C9H13NS/c1-9(2,3)11-8-4-6-10-7-5-8/h4-7H,1-3H3","ZEROTOAVTDOIRS-UHFFFAOYSA-N"
"CC(C)(C)SCc(c1)ccnc1","InChI=1S/C10H15NS/c1-10(2,3)12-8-9-4-6-11-7-5-9/h4-7H,8H2,1-3H3","JNZPQVNBWRBPEQ-UHFFFAOYSA-N"
"CC(=O)Oc(c1)ccnc1","InChI=1S/C7H7NO2/c1-6(9)10-7-2-4-8-5-3-7/h2-5H,1H3","PTZQTYADHHANGW-UHFFFAOYSA-N"
"CC(C)(C)Sc(c1)nccc1","InChI=1S/C9H13NS/c1-9(2,3)11-8-6-4-5-7-10-8/h4-7H,1-3H3","CZTNOVDJLZJTSA-UHFFFAOYSA-N"
"CC(C)(C)Sc(c1)cncc1","InChI=1S/C9H13NS/c1-9(2,3)11-8-5-4-6-10-7-8/h4-7H,1-3H3","OMPJHXLULXOAFP-UHFFFAOYSA-N"
"CSc(c1)nccc1","InChI=1S/C6H7NS/c1-8-6-4-2-3-5-7-6/h2-5H,1H3","VLQBSKLZRSUMTJ-UHFFFAOYSA-N"
"CSc(c1)cncc1","InChI=1S/C6H7NS/c1-8-6-3-2-4-7-5-6/h2-5H,1H3","AULOGPOZBOCNSX-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(C)ccn1","InChI=1S/C8H9NO2/c1-6-3-4-9-5-8(6)11-7(2)10/h3-5H,1-2H3","JLIFSYCXGJGLGE-UHFFFAOYSA-N"
"CC(=O)OCc(c1)ccnc1","InChI=1S/C8H9NO2/c1-7(10)11-6-8-2-4-9-5-3-8/h2-5H,6H2,1H3","ZGXKOLGDFWQRMM-UHFFFAOYSA-N"
"Cc(c1)cc(nc1)SC(C)(C)C","InChI=1S/C10H15NS/c1-8-5-6-11-9(7-8)12-10(2,3)4/h5-7H,1-4H3","UMFTWNMVMWXPBI-UHFFFAOYSA-N"
"Cc(c1)c(cnc1)SC(C)(C)C","InChI=1S/C10H15NS/c1-8-5-6-11-7-9(8)12-10(2,3)4/h5-7H,1-4H3","WPQGKFHEPSYERL-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(nc1)SC(C)(C)C","InChI=1S/C13H21NS/c1-12(2,3)10-7-8-14-11(9-10)15-13(4,5)6/h7-9H,1-6H3","XBWSTVPXZTUJJG-UHFFFAOYSA-N"
"CC(C)(C)Sc(c1)c(ccn1)C(C)(C)C","InChI=1S/C13H21NS/c1-12(2,3)10-7-8-14-9-11(10)15-13(4,5)6/h7-9H,1-6H3","IHFTTWBCVPSHEW-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)c(cnc1)SC(C)(C)C","InChI=1S/C15H17NS/c1-15(2,3)17-14-11-16-10-9-13(14)12-7-5-4-6-8-12/h4-11H,1-3H3","NQZOBJGIRUYUQQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)cc(nc1)SC(C)(C)C","InChI=1S/C15H17NS/c1-15(2,3)17-14-11-13(9-10-16-14)12-7-5-4-6-8-12/h4-11H,1-3H3","HNHHBGRUVWBLMN-UHFFFAOYSA-N"
"CC(=O)OCc(c1)nccc1","InChI=1S/C8H9NO2/c1-7(10)11-6-8-4-2-3-5-9-8/h2-5H,6H2,1H3","KEYZUMLVDCHSTP-UHFFFAOYSA-N"
"Cc(c1)nc(cc1)SC(C)(C)C","InChI=1S/C10H15NS/c1-8-6-5-7-9(11-8)12-10(2,3)4/h5-7H,1-4H3","ZLPUWUHNQZOJNU-UHFFFAOYSA-N"
"Cc(c1)ncc(c1)SC(C)(C)C","InChI=1S/C10H15NS/c1-8-5-6-9(7-11-8)12-10(2,3)4/h5-7H,1-4H3","JKXJDOBWRNBBMA-UHFFFAOYSA-N"
"CC(C)(C)SCc(c1)nccc1","InChI=1S/C10H15NS/c1-10(2,3)12-8-9-6-4-5-7-11-9/h4-7H,8H2,1-3H3","MUYGHECDSGHWQJ-UHFFFAOYSA-N"
"Cc(c1)c(ncc1)SC(C)(C)C","InChI=1S/C10H15NS/c1-8-6-5-7-11-9(8)12-10(2,3)4/h5-7H,1-4H3","CPVCTMVHEUAOFT-UHFFFAOYSA-N"
"Cc(c1)cnc(c1)SC(C)(C)C","InChI=1S/C10H15NS/c1-8-5-6-9(11-7-8)12-10(2,3)4/h5-7H,1-4H3","OUDGLQWZPAJMRA-UHFFFAOYSA-N"
"Cc(c1)cc(cn1)SC(C)(C)C","InChI=1S/C10H15NS/c1-8-5-9(7-11-6-8)12-10(2,3)4/h5-7H,1-4H3","ASCYFBRLXRDIQH-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(n1)SC(C)(C)C","InChI=1S/C11H17NS/c1-8-6-9(2)10(12-7-8)13-11(3,4)5/h6-7H,1-5H3","OOGFLLOHRHJKAE-UHFFFAOYSA-N"
"CC(=O)OCc(c1)c(C)cnc1","InChI=1S/C9H11NO2/c1-7-5-10-4-3-9(7)6-12-8(2)11/h3-5H,6H2,1-2H3","CEWMIVBWLKCOMW-UHFFFAOYSA-N"
"Cc(c1)c(C)c(nc1)SC(C)(C)C","InChI=1S/C11H17NS/c1-8-6-7-12-10(9(8)2)13-11(3,4)5/h6-7H,1-5H3","YGAKHQXVFBXRLH-UHFFFAOYSA-N"
"Cc(c1)c(C)cc(n1)SC(C)(C)C","InChI=1S/C11H17NS/c1-8-6-10(12-7-9(8)2)13-11(3,4)5/h6-7H,1-5H3","BWBRWDDRRDAUJY-UHFFFAOYSA-N"
"Cc(c1)c(C)c(cn1)SC(C)(C)C","InChI=1S/C11H17NS/c1-8-6-12-7-10(9(8)2)13-11(3,4)5/h6-7H,1-5H3","NKEYQJJYGCIRKM-UHFFFAOYSA-N"
"Cc(c1)c(ccn1)CSC(C)(C)C","InChI=1S/C11H17NS/c1-9-7-12-6-5-10(9)8-13-11(2,3)4/h5-7H,8H2,1-4H3","XFHWIZOKZFCTND-UHFFFAOYSA-N"
"Cc(c1)nc(cc1)CSC(C)(C)C","InChI=1S/C11H17NS/c1-9-6-5-7-10(12-9)8-13-11(2,3)4/h5-7H,8H2,1-4H3","OBBGLTSIKZVHGI-UHFFFAOYSA-N"
"CC(=O)OC(C1SC(C)(C)C)N(C(C)=O)C(C=C1)SC(C)(C)C","InChI=1S/C17H29NO3S2/c1-11(19)18-14(23-17(6,7)8)10-9-13(22-16(3,4)5)15(18)21-12(2)20/h9-10,13-15H,1-8H3","IOHLVQTYRUVVRZ-UHFFFAOYSA-N"
"CC(=O)OC(C(SC)1)N(C(C)=O)C(SC)C=C1","InChI=1S/C11H17NO3S2/c1-7(13)12-10(17-4)6-5-9(16-3)11(12)15-8(2)14/h5-6,9-11H,1-4H3","XAZHRGHFTLBESJ-UHFFFAOYSA-N"
"CC(=O)OC(C(SC(C)(C)C)1)N(C(C)=O)C(SC(C)(C)C)C=C(C)1","InChI=1S/C18H31NO3S2/c1-11-10-14(23-17(4,5)6)19(12(2)20)16(22-13(3)21)15(11)24-18(7,8)9/h10,14-16H,1-9H3","ZIBQZACYDHZNNM-UHFFFAOYSA-N"
"CC(C)(C)SC(C([H])=1)N(C(C)=O)C(SC(C)(C)C)C(SC(C)(C)C)C(C(C)(C)C)1","InChI=1S/C23H43NOS3/c1-15(25)24-17(26-21(5,6)7)14-16(20(2,3)4)18(27-22(8,9)10)19(24)28-23(11,12)13/h14,17-19H,1-13H3","ZBWZKEOLLOJBAI-UHFFFAOYSA-N"
"CC(=O)OC(N(C(C)=O)1)C(SC(C)(C)C)C(C(C)(C)C)=CC(SC(C)(C)C)1","InChI=1S/C21H37NO3S2/c1-13(23)22-16(26-20(6,7)8)12-15(19(3,4)5)17(27-21(9,10)11)18(22)25-14(2)24/h12,16-18H,1-11H3","HVGSPMLKOZDGFJ-UHFFFAOYSA-N"
"CC(=O)OC(N(C(C)=O)1)C(SC(C)(C)C)C(c(c2)cccc2)=CC(SC(C)(C)C)1","InChI=1S/C23H33NO3S2/c1-15(25)24-19(28-22(3,4)5)14-18(17-12-10-9-11-13-17)20(29-23(6,7)8)21(24)27-16(2)26/h9-14,19-21H,1-8H3","ZWFZFSUFGXNYAX-UHFFFAOYSA-N"
"O(c(c4)c(c3)c(c(OCc(c5)cccc5)c4)cc(c32)cccc2)Cc(c1)cccc1","InChI=1S/C28H22O2/c1-3-9-21(10-4-1)19-29-27-15-16-28(30-20-22-11-5-2-6-12-22)26-18-24-14-8-7-13-23(24)17-25(26)27/h1-18H,19-20H2","IJSJUDGKWZUAIX-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C14H9NO2/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H","LSIKFJXEYJIZNB-UHFFFAOYSA-N"
"CC(C)(C)CSSCC(C)(C)C","InChI=1S/C10H22S2/c1-9(2,3)7-11-12-8-10(4,5)6/h7-8H2,1-6H3","SEZZRXXPRCBINH-UHFFFAOYSA-N"
"CC(C)CSSCC(C)C","InChI=1S/C8H18S2/c1-7(2)5-9-10-6-8(3)4/h7-8H,5-6H2,1-4H3","ONJROLGQWMBXAP-UHFFFAOYSA-N"
"COc(c4)c(c1)c(c(OC)c4)c(c(c3)cccc3)c(c2)c(ccc2)1","InChI=1S/C22H18O2/c1-23-19-12-13-20(24-2)22-18(19)14-16-10-6-7-11-17(16)21(22)15-8-4-3-5-9-15/h3-14H,1-2H3","JISXOXZUVGEHIC-UHFFFAOYSA-N"
"O=Cc(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C15H10O/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-10H","YMNKUHIVVMFOFO-UHFFFAOYSA-N"
"O=Cc(c21)c(c4)c(ccc4)c(c(c3)cccc3)c(cccc2)1","InChI=1S/C21H14O/c22-14-20-16-10-4-6-12-18(16)21(15-8-2-1-3-9-15)19-13-7-5-11-17(19)20/h1-14H","AMMCMWLZICOPDI-UHFFFAOYSA-N"
"COc(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C15H12O/c1-16-15-13-8-4-2-6-11(13)10-12-7-3-5-9-14(12)15/h2-10H,1H3","DVRKZTKTNYRYLF-UHFFFAOYSA-N"
"c(c1NC)ccc(c(c(c5)cccc5)2)c1c(c(c4)cccc4)c(c3)c(ccc3)2","InChI=1S/C27H21N/c1-28-24-18-10-17-23-25(19-11-4-2-5-12-19)21-15-8-9-16-22(21)26(27(23)24)20-13-6-3-7-14-20/h2-18,28H,1H3","SMBONASSNFDWML-UHFFFAOYSA-N"
"COc(c1)c(c2)c(cc(c3)c(ccc3)2)c(OC)c1","InChI=1S/C16H14O2/c1-17-15-7-8-16(18-2)14-10-12-6-4-3-5-11(12)9-13(14)15/h3-10H,1-2H3","YCTBFSAWJWMRGO-UHFFFAOYSA-N"
"C=CC(Cl)CCl","InChI=1S/C4H6Cl2/c1-2-4(6)3-5/h2,4H,1,3H2","XVEASTGLHPVZNA-UHFFFAOYSA-N"
"CCC(C)(Cl)Cl","InChI=1S/C4H8Cl2/c1-3-4(2,5)6/h3H2,1-2H3","BSRTYNDWQXVCKR-UHFFFAOYSA-N"
"CC(=O)C(Cl)Cl","InChI=1S/C3H4Cl2O/c1-2(6)3(4)5/h3H,1H3","CSVFWMMPUJDVKH-UHFFFAOYSA-N"
"CCCC(Cl)CCl","InChI=1S/C5H10Cl2/c1-2-3-5(7)4-6/h5H,2-4H2,1H3","PPLBPDUKNRCHGG-UHFFFAOYSA-N"
"ClCCCC(C)Cl","InChI=1S/C5H10Cl2/c1-5(7)3-2-4-6/h5H,2-4H2,1H3","IJZUPZAYWWVHIO-UHFFFAOYSA-N"
"CCCC(C)(Cl)Cl","InChI=1S/C5H10Cl2/c1-3-4-5(2,6)7/h3-4H2,1-2H3","MNXVHBFCELLVBA-UHFFFAOYSA-N"
"CC(Cl)CC(C)Cl","InChI=1S/C5H10Cl2/c1-4(6)3-5(2)7/h4-5H,3H2,1-2H3","DYGOBGYJRRKFEN-UHFFFAOYSA-N"
"FC(Cl)C(Cl)Cl","InChI=1S/C2H2Cl3F/c3-1(4)2(5)6/h1-2H","ORMSTDJYMPIZAO-UHFFFAOYSA-N"
"ClC=C(Cl)C=C(Cl)Cl","InChI=1S/C4H2Cl4/c5-2-3(6)1-4(7)8/h1-2H/b3-2-","XTSDMNIRVUOODR-IHWYPQMZSA-N"
"ClCC(Cl)C(Cl)CCl","InChI=1S/C4H6Cl4/c5-1-3(7)4(8)2-6/h3-4H,1-2H2","IXZVKECRTHXEEW-UHFFFAOYSA-N"
"FC(F)(F)C=C(Cl)C(F)(F)F","InChI=1S/C4HClF6/c5-2(4(9,10)11)1-3(6,7)8/h1H/b2-1-","JRENXZBKMHPULY-UPHRSURJSA-N"
"FC(F)(F)C=C(Cl)C(F)(F)Cl","InChI=1S/C4HCl2F5/c5-2(4(6,10)11)1-3(7,8)9/h1H/b2-1-","SXAFZSJBIOXONF-UPHRSURJSA-N"
"FC(C(F)(F)F)=C(Cl)C(F)(F)F","InChI=1S/C4ClF7/c5-1(3(7,8)9)2(6)4(10,11)12/b2-1-","WZCQDYGWGDYQNC-UPHRSURJSA-N"
"FC(F)(F)C(Cl)=C(Cl)C(F)(F)F","InChI=1S/C4Cl2F6/c5-1(3(7,8)9)2(6)4(10,11)12/b2-1-","XDIDQEGAKCWQQP-UPHRSURJSA-N"
"ClC(Cl)=CC(Cl)(Cl)C(Cl)Cl","InChI=1S/C4H2Cl6/c5-2(6)1-4(9,10)3(7)8/h1,3H","ABMSWFCHXPNDHQ-UHFFFAOYSA-N"
"c([Si](c(c(F)4)c(F)c(F)c(F)c(F)4)(c(c(F)3)c(F)c(F)c(F)c(F)3)c(c(F)2)c(F)c(F)c(F)c(F)2)(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C24F20Si/c25-1-5(29)13(37)21(14(38)6(1)30)45(22-15(39)7(31)2(26)8(32)16(22)40,23-17(41)9(33)3(27)10(34)18(23)42)24-19(43)11(35)4(28)12(36)20(24)44","PVEYHXXYHXDHBS-UHFFFAOYSA-N"
"Fc(c(F)3)c(F)c(F)c(c(F)3)C(O)(c(c(F)2)c(F)c(F)c(F)c(F)2)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C19HF15O/c20-4-1(5(21)11(27)16(32)10(4)26)19(35,2-6(22)12(28)17(33)13(29)7(2)23)3-8(24)14(30)18(34)15(31)9(3)25/h35H","DEXNEWGHWDRTJC-UHFFFAOYSA-N"
"Fc(c(F)2)c(F)c(F)c(c(F)2)C(=O)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C13F10O/c14-3-1(4(15)8(19)11(22)7(3)18)13(24)2-5(16)9(20)12(23)10(21)6(2)17","WWQLXRAKBJVNCC-UHFFFAOYSA-N"
"CN(C)CCOC(c(c2)cccc2)c(c1)ccc(Br)c1","InChI=1S/C17H20BrNO/c1-19(2)12-13-20-17(14-6-4-3-5-7-14)15-8-10-16(18)11-9-15/h3-11,17H,12-13H2,1-2H3","NUNIWXHYABYXKF-UHFFFAOYSA-N"
"CN(C)CCC(c(c2)nccc2)c(c1)ccc(Cl)c1","InChI=1S/C16H19ClN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3","SOYKEARSMXGVTM-UHFFFAOYSA-N"
"CN(C3)CCN(C3)C(c(c2)cccc2)c(c1)ccc(Cl)c1","InChI=1S/C18H21ClN2/c1-20-11-13-21(14-12-20)18(15-5-3-2-4-6-15)16-7-9-17(19)10-8-16/h2-10,18H,11-14H2,1H3","WFNAKBGANONZEQ-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)C(=C([H])CN(C2)CCC2)c(c1)nccc1","InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3/b18-11+","CBEQULMOCCWAQT-WOJGMQOQSA-N"
"C(C3)N(CCN(Cc(c4)ccc(c4)C(C)(C)C)3)C(c(c2)cccc2)c(c1)ccc(c1)Cl","InChI=1S/C28H33ClN2/c1-28(2,3)25-13-9-22(10-14-25)21-30-17-19-31(20-18-30)27(23-7-5-4-6-8-23)24-11-15-26(29)16-12-24/h4-16,27H,17-21H2,1-3H3","MOYGZHXDRJNJEP-UHFFFAOYSA-N"
"OCCOCCN(C3)CCN(C3)C(c(c2)cccc2)c(c1)ccc(Cl)c1","InChI=1S/C21H27ClN2O2/c22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-9,21,25H,10-17H2","ZQDWXGKKHFNSQK-UHFFFAOYSA-N"
"CN(C)CCOC(c(c2)nccc2)c(c1)ccc(Cl)c1","InChI=1S/C16H19ClN2O/c1-19(2)11-12-20-16(15-5-3-4-10-18-15)13-6-8-14(17)9-7-13/h3-10,16H,11-12H2,1-2H3","OJFSXZCBGQGRNV-UHFFFAOYSA-N"
"C(C3)CCN(C3)CCC(O)(C(C2)CCC2)c(c1)cccc1","InChI=1S/C19H29NO/c21-19(18-11-5-6-12-18,17-9-3-1-4-10-17)13-16-20-14-7-2-8-15-20/h1,3-4,9-10,18,21H,2,5-8,11-16H2","SWRUZBWLEWHWRI-UHFFFAOYSA-N"
"CN(C3)CCN(C3)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C18H22N2/c1-19-12-14-20(15-13-19)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3","UVKZSORBKUEBAZ-UHFFFAOYSA-N"
"CN(C3)CCC(C3)OC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C19H23NO/c1-20-14-12-18(13-15-20)21-19(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-19H,12-15H2,1H3","OWQUZNMMYNAXSL-UHFFFAOYSA-N"
"CN(C)CCOC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3","ZZVUWRFHKOJYTH-UHFFFAOYSA-N"
"Cc(c4)cc(cc4)CN(C3)CCN(C3)C(c(c2)cccc2)c(c1)ccc(Cl)c1","InChI=1S/C25H27ClN2/c1-20-6-5-7-21(18-20)19-27-14-16-28(17-15-27)25(22-8-3-2-4-9-22)23-10-12-24(26)13-11-23/h2-13,18,25H,14-17,19H2,1H3","OCJYIGYOJCODJL-UHFFFAOYSA-N"
"CCCCSc(c2)ccc(c2)C(SCCN(C)C)c(c1)cccc1","InChI=1S/C21H29NS2/c1-4-5-16-23-20-13-11-19(12-14-20)21(24-17-15-22(2)3)18-9-7-6-8-10-18/h6-14,21H,4-5,15-17H2,1-3H3","IZLPZXSZLLELBJ-UHFFFAOYSA-N"
"OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(C(C)=O)3)Sc(cccc2)1","InChI=1S/C23H29N3O2S/c1-18(28)19-7-8-23-21(17-19)26(20-5-2-3-6-22(20)29-23)10-4-9-24-11-13-25(14-12-24)15-16-27/h2-3,5-8,17,27H,4,9-16H2,1H3","WNTYBHLDCKXEOT-UHFFFAOYSA-N"
"C(C4)CN(C4)CCN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C18H20N2S/c1-3-9-17-15(7-1)20(14-13-19-11-5-6-12-19)16-8-2-4-10-18(16)21-17/h1-4,7-10H,5-6,11-14H2","KJKJUXGEMYCCJN-UHFFFAOYSA-N"
"c(c7)cc(c(c7)1)N(C(=O)5)C([H])(C([H])42)C(C6)1C([H])(N3C6)CC([H])(C(=CCOC([H])(C5)4)C3)2","InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1","QMGVPVSNSZLJIA-FVWCLLPLSA-N"
"CCCCCCCCC=CCCCCCCCC(O)=O","InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-","ZQPPMHVWECSIRJ-KTKRTIGZSA-N"
"CN(C4)CCC(C4)CN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C19H22N2S/c1-20-12-10-15(11-13-20)14-21-16-6-2-4-8-18(16)22-19-9-5-3-7-17(19)21/h2-9,15H,10-14H2,1H3","DLAKWHKNGHJWKA-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC","InChI=1S/C22H42O4/c1-3-5-7-9-11-15-19-25-21(23)17-13-14-18-22(24)26-20-16-12-10-8-6-4-2/h3-20H2,1-2H3","NEHDRDVHPTWWFG-UHFFFAOYSA-N"
"NC(=O)NC(=O)C(Br)(CC)CC","InChI=1S/C7H13BrN2O2/c1-3-7(8,4-2)5(11)10-6(9)12/h3-4H2,1-2H3,(H3,9,10,11,12)","OPNPQXLQERQBBV-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(ccc1)C(O)=O","InChI=1S/C9H8O4/c1-6(10)13-8-5-3-2-4-7(8)9(11)12/h2-5H,1H3,(H,11,12)","BSYNRYMUTXBXSQ-UHFFFAOYSA-N"
"CCN(CC)CCN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C18H22N2S/c1-3-19(4-2)13-14-20-15-9-5-7-11-17(15)21-18-12-8-6-10-16(18)20/h5-12H,3-4,13-14H2,1-2H3","LURMIKVZJSMXQE-UHFFFAOYSA-N"
"c(c4)ccc(c4)CCN(C3)C(C1)C(C)C(C)(C3)c(c2)c(ccc(O)2)1","InChI=1S/C22H27NO/c1-16-21-14-18-8-9-19(24)15-20(18)22(16,2)11-13-23(21)12-10-17-6-4-3-5-7-17/h3-9,15-16,21,24H,10-14H2,1-2H3/t16-,21+,22+/m1/s1","ZQHYKVKNPWDQSL-XGRCMKMKSA-N"
"O=C(O1)Nc(c2)c(ccc(Cl)2)1","InChI=1S/C7H4ClNO2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)","TZFWDZFKRBELIQ-UHFFFAOYSA-N"
"C=CCC(CC=C)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C10H12N2O3/c1-3-5-10(6-4-2)7(13)11-9(15)12-8(10)14/h3-4H,1-2,5-6H2,(H2,11,12,13,14,15)","FDQGNLOWMMVRQL-UHFFFAOYSA-N"
"CCOC(=O)C(C2)(CCN(C)C2)c(c1)cccc1","InChI=1S/C15H21NO2/c1-3-18-14(17)15(9-11-16(2)12-10-15)13-7-5-4-6-8-13/h4-8H,3,9-12H2,1-2H3","XADCESSVHJOZHK-UHFFFAOYSA-N"
"CCCCC(C(=O)1)C(=O)N(c(c3)ccc(O)c3)N(c(c2)cccc2)1","InChI=1S/C19H20N2O3/c1-2-3-9-17-18(23)20(14-7-5-4-6-8-14)21(19(17)24)15-10-12-16(22)13-11-15/h4-8,10-13,17,22H,2-3,9H2,1H3","HFHZKZSRXITVMK-UHFFFAOYSA-N"
"CCC(=C([H])C)C(=O)NC(N)=O","InChI=1S/C7H12N2O2/c1-3-5(4-2)6(10)9-7(8)11/h3H,4H2,1-2H3,(H3,8,9,10,11)/b5-3-","QCUPYFTWJOZAOB-HYXAFXHYSA-N"
"CN1C(S(=O)(=O)CCC1=O)C2=CC=C(C=C2)Cl","InChI=1S/C11H12ClNO3S/c1-13-10(14)6-7-17(15,16)11(13)8-2-4-9(12)5-3-8/h2-5,11H,6-7H2,1H3","WEQAYVWKMWHEJO-UHFFFAOYSA-N"
"COc(c2)c(ccc2)OCC(C1)OC(=O)N1","InChI=1S/C11H13NO4/c1-14-9-4-2-3-5-10(9)15-7-8-6-12-11(13)16-8/h2-5,8H,6-7H2,1H3,(H,12,13)","ZMNSRFNUONFLSP-UHFFFAOYSA-N"
"C#CC(C1)(CCCC1)OC(N)=O","InChI=1S/C9H13NO2/c1-2-9(12-8(10)11)6-4-3-5-7-9/h1H,3-7H2,(H2,10,11)","GXRZIMHKGDIBEW-UHFFFAOYSA-N"
"CCOC(=O)C(C2)(CCN(CCCNc(c3)cccc3)C2)c(c1)cccc1","InChI=1S/C23H30N2O2/c1-2-27-22(26)23(20-10-5-3-6-11-20)14-18-25(19-15-23)17-9-16-24-21-12-7-4-8-13-21/h3-8,10-13,24H,2,9,14-19H2,1H3","PXXKIYPSXYFATG-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc(OC)3)Sc(cccc2)1","InChI=1S/C18H22N2OS/c1-19(2)11-6-12-20-15-7-4-5-8-17(15)22-18-10-9-14(21-3)13-16(18)20/h4-5,7-10,13H,6,11-12H2,1-3H3","BRABPYPSZVCCLR-UHFFFAOYSA-N"
"CN(C)CCOC(=O)C(c(c2)cccc2)C(O)(C1)CCC1","InChI=1S/C17H25NO3/c1-18(2)12-13-21-16(19)15(14-8-4-3-5-9-14)17(20)10-6-7-11-17/h3-5,8-9,15,20H,6-7,10-13H2,1-2H3","SKYSRIRYMSLOIN-UHFFFAOYSA-N"
"CCN(CC)C(C)C(=O)c(c1)cccc1","InChI=1S/C13H19NO/c1-4-14(5-2)11(3)13(15)12-9-7-6-8-10-12/h6-11H,4-5H2,1-3H3","XXEPPPIWZFICOJ-UHFFFAOYSA-N"
"CCC(CC)(C(=O)1)C(=O)N(C)C(=O)N1","InChI=1S/C9H14N2O3/c1-4-9(5-2)6(12)10-8(14)11(3)7(9)13/h4-5H2,1-3H3,(H,10,12,14)","FWJKNZONDWOGMI-UHFFFAOYSA-N"
"CN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(C(F)(F)F)3)Sc(cccc2)1","InChI=1S/C21H24F3N3S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3","ZEWQUBUPAILYHI-UHFFFAOYSA-N"
"COC(C(=O)3)=C(OC)c(c(O3)1)c(OC)c(c2)c(oc2)c1","InChI=1S/C14H12O6/c1-16-11-7-4-5-19-8(7)6-9-10(11)12(17-2)13(18-3)14(15)20-9/h4-6H,1-3H3","SHOQQSABOUVQLJ-UHFFFAOYSA-N"
"COC(C(=O)3)=C(OC)c(c1)c(O3)c(OC)c(o2)c(cc2)1","InChI=1S/C14H12O6/c1-16-10-8-6-7-4-5-19-9(7)12(17-2)11(8)20-14(15)13(10)18-3/h4-6H,1-3H3","NGCYDEYEPDYBIX-UHFFFAOYSA-N"
"COC(C(=O)3)=C(OC)c(c1)c(O3)cc(o2)c(cc2)1","InChI=1S/C13H10O5/c1-15-11-8-5-7-3-4-17-9(7)6-10(8)18-13(14)12(11)16-2/h3-6H,1-2H3","NYELECLICIMRBA-UHFFFAOYSA-N"
"C=CC(C)(C)OC(=C(OC)3)c(c(OC(=O)3)1)c(OC)c(c2)c(oc2)c1","InChI=1S/C18H18O6/c1-6-18(2,3)24-15-13-12(23-17(19)16(15)21-5)9-11-10(7-8-22-11)14(13)20-4/h6-9H,1H2,2-5H3","CJRBHIKORKDQEC-UHFFFAOYSA-N"
"[2H]C([2H])([2H])OC(C(=O)3)=C(OC)c(c(O3)1)c(OC)c(c2)c(oc2)c1","InChI=1S/C14H12O6/c1-16-11-7-4-5-19-8(7)6-9-10(11)12(17-2)13(18-3)14(15)20-9/h4-6H,1-3H3/i3D3","SHOQQSABOUVQLJ-HPRDVNIFSA-N"
"COC(=C(O)3)c(c(OC(=O)3)1)c(OC)c(c2)c(oc2)c1","InChI=1S/C13H10O6/c1-16-11-6-3-4-18-7(6)5-8-9(11)12(17-2)10(14)13(15)19-8/h3-5,14H,1-2H3","APULTQVAACQYFJ-UHFFFAOYSA-N"
"COC(C(=O)3)=C(O)c(c1)c(O3)cc(o2)c(cc2)1","InChI=1S/C12H8O5/c1-15-11-10(13)7-4-6-2-3-16-8(6)5-9(7)17-12(11)14/h2-5,13H,1H3","DSWVVCVDHBZKEH-UHFFFAOYSA-N"
"COC(=C3)c(c1)c(OC(=O)3)cc(o2)c(cc2)1","InChI=1S/C12H8O4/c1-14-10-6-12(13)16-11-5-9-7(2-3-15-9)4-8(10)11/h2-6H,1H3","IFBJMRYEEKIECT-UHFFFAOYSA-N"
"COC(=C3)c(c1)c(OC(=O)3)cc(O2)c(CC2)1","InChI=1S/C12H10O4/c1-14-10-6-12(13)16-11-5-9-7(2-3-15-9)4-8(10)11/h4-6H,2-3H2,1H3","ZPMOZEGREMLNLM-UHFFFAOYSA-N"
"COC(C(=O)3)=C(OC)c(c1)c(O3)cc(O2)c(CC2)1","InChI=1S/C13H12O5/c1-15-11-8-5-7-3-4-17-9(7)6-10(8)18-13(14)12(11)16-2/h5-6H,3-4H2,1-2H3","ALFYPNXHSPCORY-UHFFFAOYSA-N"
"CCOC(=C(OC)3)c(c1)c(OC(=O)3)cc(o2)c(cc2)1","InChI=1S/C14H12O5/c1-3-17-12-9-6-8-4-5-18-10(8)7-11(9)19-14(15)13(12)16-2/h4-7H,3H2,1-2H3","MZSNYYYDROMEOG-UHFFFAOYSA-N"
"COC(C(=O)3)=C(O)c(c1)c(O3)cc(O2)c(CC2)1","InChI=1S/C12H10O5/c1-15-11-10(13)7-4-6-2-3-16-8(6)5-9(7)17-12(11)14/h4-5,13H,2-3H2,1H3","BOAPVINLXIYMQC-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C(OC)=CC(=O)1","InChI=1S/C11H10O4/c1-13-7-3-4-8-9(14-2)6-11(12)15-10(8)5-7/h3-6H,1-2H3","UOOULHJCQCLGGT-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C=C(OC)C(=O)1","InChI=1S/C11H10O4/c1-13-8-4-3-7-5-10(14-2)11(12)15-9(7)6-8/h3-6H,1-2H3","IAFJNCMUCQDWCR-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C(OC)=C(OC)C(=O)1","InChI=1S/C12H12O5/c1-14-7-4-5-8-9(6-7)17-12(13)11(16-3)10(8)15-2/h4-6H,1-3H3","AYMSWLVOSROJFX-UHFFFAOYSA-N"
"COc(c4)cc(O3)c(c4)C([H])(O1)C([H])(C3)c(c2)c(cc(OC)c2)1","InChI=1S/C17H16O4/c1-18-10-4-6-13-15(7-10)20-9-14-12-5-3-11(19-2)8-16(12)21-17(13)14/h3-8,14,17H,9H2,1-2H3/t14-,17-/m0/s1","VPGIGLKLCFOWDN-YOEHRIQHSA-N"
"COc(c5)cc(O4)c(c5)C([H])(O1)C([H])(C4)c(c2)c(cc(O3)c(OC3)2)1","InChI=1S/C17H14O5/c1-18-9-2-3-10-13(4-9)19-7-12-11-5-15-16(21-8-20-15)6-14(11)22-17(10)12/h2-6,12,17H,7-8H2,1H3/t12-,17-/m0/s1","YLZYAUCOYZKLMA-SJCJKPOMSA-N"
"Oc(c5)cc(O4)c(c5)C([H])(O1)C([H])(C4)c(c2)c(c(O3)c(OC3)c2)1","InChI=1S/C16H12O5/c17-8-1-2-10-13(5-8)18-6-11-9-3-4-12-16(20-7-19-12)15(9)21-14(10)11/h1-5,11,14,17H,6-7H2/t11-,14-/m0/s1","SMEBAXWPNGCZEO-FZMZJTMJSA-N"
"COc(c5)c(OC)c(O4)c(c5)C([H])(O1)C([H])(C4)c(c2)c(cc(O3)c(OC3)2)1","InChI=1S/C18H16O6/c1-19-12-4-3-9-16-11(7-21-17(9)18(12)20-2)10-5-14-15(23-8-22-14)6-13(10)24-16/h3-6,11,16H,7-8H2,1-2H3/t11-,16-/m0/s1","FNOOADLKGGWRGC-ZBEGNZNMSA-N"
"CC(=O)Oc(c5)cc(O4)c(c5)C([H])(O1)C([H])(C4)c(c2)c(c(O3)c(OC3)c2)1","InChI=1S/C18H14O6/c1-9(19)23-10-2-3-12-15(6-10)20-7-13-11-4-5-14-18(22-8-21-14)17(11)24-16(12)13/h2-6,13,16H,7-8H2,1H3/t13-,16-/m0/s1","GLQXTNUEWAAYKI-BBRMVZONSA-N"
"COc(c4)cc(O3)c(c4)C([H])(O1)C([H])(C3)c(c2)c(cc(OC)c(OC)2)1","InChI=1S/C18H18O5/c1-19-10-4-5-11-14(6-10)22-9-13-12-7-16(20-2)17(21-3)8-15(12)23-18(11)13/h4-8,13,18H,9H2,1-3H3/t13-,18-/m0/s1","RTGGRWVCSFXHGP-UGSOOPFHSA-N"
"COc(c4)c(OC)c(O3)c(c4)C([H])(O1)C([H])(C3)c(c2)c(cc(OC)c(OC)2)1","InChI=1S/C19H20O6/c1-20-13-6-5-10-17-12(9-24-18(10)19(13)23-4)11-7-15(21-2)16(22-3)8-14(11)25-17/h5-8,12,17H,9H2,1-4H3/t12-,17-/m0/s1","CXAHVSULOPDCJX-SJCJKPOMSA-N"
"COc(c4)cc(O3)c(c4)C([H])(O1)C([H])(C3)c(c2)c(c(OC)c(OC)c2)1","InChI=1S/C18H18O5/c1-19-10-4-5-12-15(8-10)22-9-13-11-6-7-14(20-2)18(21-3)17(11)23-16(12)13/h4-8,13,16H,9H2,1-3H3/t13-,16-/m0/s1","RFFNFQZKHNKOPO-BBRMVZONSA-N"
"CCCCOC(=O)c(c1)cccc1","InChI=1S/C11H14O2/c1-2-3-9-13-11(12)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3","XSIFPSYPOVKYCO-UHFFFAOYSA-N"
"CCOc(c1)ccc(NC(C)=O)c1","InChI=1S/C10H13NO2/c1-3-13-10-6-4-9(5-7-10)11-8(2)12/h4-7H,3H2,1-2H3,(H,11,12)","CPJSUEIXXCENMM-UHFFFAOYSA-N"
"CC(C)CCC(CC)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C11H18N2O3/c1-4-11(6-5-7(2)3)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)","VIROVYVQCGLCII-UHFFFAOYSA-N"
"CC(=C2)N(C)N(C(=O)2)c(c1)cccc1","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3","VEQOALNAAJBPNY-UHFFFAOYSA-N"
"CCC(CC)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C8H12N2O3/c1-3-8(4-2)5(11)9-7(13)10-6(8)12/h3-4H2,1-2H3,(H2,9,10,11,12,13)","FTOAOBMCPZCFFF-UHFFFAOYSA-N"
"C=CCC(CC(C)C)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C11H16N2O3/c1-4-5-11(6-7(2)3)8(14)12-10(16)13-9(11)15/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16)","UZVHFVZFNXBMQJ-UHFFFAOYSA-N"
"Cn(c2)c(C(=O)1)c(n2)N(C)C(=O)N(C)1","InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3","RYYVLZVUVIJVGH-UHFFFAOYSA-N"
"CNC(C2)=Nc(c3)c(cc(Cl)c3)C(=[N+1]([O-1])2)c(c1)cccc1","InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19)","ANTSCNMPPGJYLG-UHFFFAOYSA-N"
"CCN(CC)CCCC(C)Nc(c2)c(c1)c(nc2)cc(Cl)c1","InChI=1S/C18H26ClN3/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21)","WHTVZRBIWZFKQO-UHFFFAOYSA-N"
"CN(C5)C(C3)C([H])(C=4)C(C5)(C(C(O)C4)1)c(c23)c(c(O)cc(C)2)O1","InChI=1S/C18H21NO3/c1-9-7-14(21)16-15-10(9)8-12-11-3-4-13(20)17(22-16)18(11,15)5-6-19(12)2/h3-4,7,11-13,17,20-21H,5-6,8H2,1-2H3/t11-,12?,13-,17-,18-/m0/s1","VULIEHRIVFMVDQ-OJHGLTBHSA-N"
"CCC(=O)OC(Cc(c2)cccc2)(C(C)CN(C)C)c(c1)cccc1","InChI=1S/C22H29NO2/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19/h6-15,18H,5,16-17H2,1-4H3/t18-,22+/m1/s1","XLMALTXPSGQGBX-GCJKJVERSA-N"
"Clc(c2)cc(C=1c(c3)cccc3)c(c2)N(C)C(=O)CN1","InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3","AAOVKJBEBIDNHE-UHFFFAOYSA-N"
"CCC(C2)(C(=O)NC(=O)C2)c(c1)cccc1","InChI=1S/C13H15NO2/c1-2-13(10-6-4-3-5-7-10)9-8-11(15)14-12(13)16/h3-7H,2,8-9H2,1H3,(H,14,15,16)","JMBQKKAJIKAWKF-UHFFFAOYSA-N"
"CCC(C(=O)2)(C(=O)NC(=O)N2)C(C1)=CCCCC1","InChI=1S/C13H18N2O3/c1-2-13(9-7-5-3-4-6-8-9)10(16)14-12(18)15-11(13)17/h7H,2-6,8H2,1H3,(H2,14,15,16,17,18)","PAZQYDJGLKSCSI-UHFFFAOYSA-N"
"CCCCCCC(CC)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C12H20N2O3/c1-3-5-6-7-8-12(4-2)9(15)13-11(17)14-10(12)16/h3-8H2,1-2H3,(H2,13,14,15,16,17)","PSTVHRSUNBSVIJ-UHFFFAOYSA-N"
"CNC([H])(C)Cc(c1)cccc1","InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m1/s1","MYWUZJCMWCOHBA-SECBINFHSA-N"
"COC(=O)C(C(C2)NCCC2)c(c1)cccc1","InChI=1S/C14H19NO2/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3","DUGOZIWVEXMGBE-UHFFFAOYSA-N"
"CCCC(C)C(CC)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C11H18N2O3/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)","WEXRUCMBJFQVBZ-UHFFFAOYSA-N"
"CN(C)C(C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C17H20N2S/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19/h4-11,13H,12H2,1-3H3","PWWVAXIEGOYWEE-UHFFFAOYSA-N"
"CCc(n2)c(c(N)nc(N)2)c(c1)ccc(Cl)c1","InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17)","WKSAUQYGYAYLPV-UHFFFAOYSA-N"
"OCC([H])(c(c4)cccc4)C(=O)OC([H])(C2)CC([H])(N(C)3)C([H])(O1)C([H])1C([H])23","InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11-,12-,13?,14?,15-,16+/m0/s1","STECJAGHUSJQJN-SWQPNFBYSA-N"
"Nc(c2)ccc(c2)S(=O)(=O)Nc(c1)nccc1","InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)","GECHUMIMRBOMGK-UHFFFAOYSA-N"
"CCCC(C)C(CC=C)(C(=O)1)C(=O)NC(=S)N1","InChI=1S/C12H18N2O2S/c1-4-6-8(3)12(7-5-2)9(15)13-11(17)14-10(12)16/h5,8H,2,4,6-7H2,1,3H3,(H2,13,14,15,16,17)","XLOMZPUITCYLMJ-UHFFFAOYSA-N"
"Nc(n3)nc(n1)c(c(N)3)nc(c(c2)cccc2)c(N)1","InChI=1S/C12H11N7/c13-9-7(6-4-2-1-3-5-6)16-8-10(14)18-12(15)19-11(8)17-9/h1-5H,(H6,13,14,15,17,18,19)","FNYLWPVRPXGIIP-UHFFFAOYSA-N"
"CN(C)CCN(Cc(c2)cccc2)c(c1)nccc1","InChI=1S/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3","UFLGIAIHIAPJJC-UHFFFAOYSA-N"
"Nc(o1)nc(c2)c(ccc(Cl)2)1","InChI=1S/C7H5ClN2O/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10)","YGCODSQDUUUKIV-UHFFFAOYSA-N"
"c(c41)cc(cc(CC(C4)(C2)Cc(c3)c(ccc3C(=O)CCCC)2)1)C(=O)CCCC","InChI=1S/C27H32O2/c1-3-5-7-25(28)19-9-11-21-15-27(17-23(21)13-19)16-22-12-10-20(14-24(22)18-27)26(29)8-6-4-2/h9-14H,3-8,15-18H2,1-2H3","MWGQFSREBUQPGD-UHFFFAOYSA-N"
"Nc(c1)nccc1","InChI=1S/C5H6N2/c6-5-3-1-2-4-7-5/h1-4H,(H2,6,7)","ICSNLGPSRYBMBD-UHFFFAOYSA-N"
"OC(=O)c(c1)cccc1","InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)","WPYMKLBDIGXBTP-UHFFFAOYSA-N"
"COC(=O)c(c1)c(O)cc(N)c1","InChI=1S/C8H9NO3/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4,10H,9H2,1H3","QQOXBFUTRLDXDP-UHFFFAOYSA-N"
"O=C(C=1)C=COC1","InChI=1S/C5H4O2/c6-5-1-3-7-4-2-5/h1-4H","CVQUWLDCFXOXEN-UHFFFAOYSA-N"
"CC(=C1)OC(C)=CC(=O)1","InChI=1S/C7H8O2/c1-5-3-7(8)4-6(2)9-5/h3-4H,1-2H3","VSYFZULSKMFUJJ-UHFFFAOYSA-N"
"CC(=C1)C(=O)C(C)=CO1","InChI=1S/C7H8O2/c1-5-3-9-4-6(2)7(5)8/h3-4H,1-2H3","TYNBCLRVUQVAEV-UHFFFAOYSA-N"
"COC(=C1)OC(C)=CC(=O)1","InChI=1S/C7H8O3/c1-5-3-6(8)4-7(9-2)10-5/h3-4H,1-2H3","SGHBBBQKUYEJPS-UHFFFAOYSA-N"
"COC(=C2)OC(=CC(=O)2)c(c1)cccc1","InChI=1S/C12H10O3/c1-14-12-8-10(13)7-11(15-12)9-5-3-2-4-6-9/h2-8H,1H3","FONPQIXOLUNZEO-UHFFFAOYSA-N"
"OCC(O1)=CC(=O)C(O)=C1","InChI=1S/C6H6O4/c7-2-4-1-5(8)6(9)3-10-4/h1,3,7,9H,2H2","BEJNERDRQOWKJM-UHFFFAOYSA-N"
"c(c2)ccc(c2)Oc(c1)nccc1","InChI=1S/C11H9NO/c1-2-6-10(7-3-1)13-11-8-4-5-9-12-11/h1-9H","MEAAWTRWNWSLPF-UHFFFAOYSA-N"
"Cc(c2)cc(cc2)Oc(c1)nccc1","InChI=1S/C12H11NO/c1-10-5-4-6-11(9-10)14-12-7-2-3-8-13-12/h2-9H,1H3","OAWUVCPIXULPNA-UHFFFAOYSA-N"
"Cc(c2)c(ccc2)Oc(c1)nccc1","InChI=1S/C12H11NO/c1-10-6-2-3-7-11(10)14-12-8-4-5-9-13-12/h2-9H,1H3","JSESVCSCPLOCRY-UHFFFAOYSA-N"
"CC(=C3)C(=O)c(c(O3)1)c(c2)c(ccc2)cc1","InChI=1S/C14H10O2/c1-9-8-16-12-7-6-10-4-2-3-5-11(10)13(12)14(9)15/h2-8H,1H3","QKXPXHGARVWXOW-UHFFFAOYSA-N"
"COc(c3)cc(c1)c(c3)cc(C(=O)2)c(OC(C)=C2)1","InChI=1S/C15H12O3/c1-9-5-14(16)13-7-10-3-4-12(17-2)6-11(10)8-15(13)18-9/h3-8H,1-2H3","SZNVNGQSAXUMDC-UHFFFAOYSA-N"
"COc(c3)cc(c1)c(c3)c(C(=O)2)c(OC=C(C)2)c1","InChI=1S/C15H12O3/c1-9-8-18-13-6-3-10-7-11(17-2)4-5-12(10)14(13)15(9)16/h3-8H,1-2H3","GMQHWDJLIRKNAG-UHFFFAOYSA-N"
"COc(c1)c(C(=O)3)c(OC(C)=C3)c(c2)c(ccc2)1","InChI=1S/C15H12O3/c1-9-7-12(16)14-13(17-2)8-10-5-3-4-6-11(10)15(14)18-9/h3-8H,1-2H3","LKTYFWWDJDOZRH-UHFFFAOYSA-N"
"COc(c21)c(OC)c(C(=O)3)c(OC(C)=C3)c(cccc2)1","InChI=1S/C16H14O4/c1-9-8-12(17)13-14(20-9)10-6-4-5-7-11(10)15(18-2)16(13)19-3/h4-8H,1-3H3","CXGBFFFTAHFALN-UHFFFAOYSA-N"
"CC(=C1)Oc(c2)c(cc(c3)c(ccc3)2)C(=O)1","InChI=1S/C14H10O2/c1-9-6-13(15)12-7-10-4-2-3-5-11(10)8-14(12)16-9/h2-8H,1H3","SWQVFJKTDLQTHJ-UHFFFAOYSA-N"
"CC(=C3)Oc(c1C(=O)3)c(c2)c(ccc2)cc1","InChI=1S/C14H10O2/c1-9-8-13(15)12-7-6-10-4-2-3-5-11(10)14(12)16-9/h2-8H,1H3","HSULZQNMIJZSHG-UHFFFAOYSA-N"
"CC(=O)C(=C(C)3)C(=O)c(c1)c(O3)c(c2)c(ccc2)c1","InChI=1S/C16H12O3/c1-9(17)14-10(2)19-16-12-6-4-3-5-11(12)7-8-13(16)15(14)18/h3-8H,1-2H3","XMJJVPKEAYWZAP-UHFFFAOYSA-N"
"CCCCC(CCCC)(C(=O)OCC)C(=O)OCC","InChI=1S/C15H28O4/c1-5-9-11-15(12-10-6-2,13(16)18-7-3)14(17)19-8-4/h5-12H2,1-4H3","WHKKUUPZLWUOIW-UHFFFAOYSA-N"
"CCCCC(C(=O)OCC)C(=O)OCC","InChI=1S/C11H20O4/c1-4-7-8-9(10(12)14-5-2)11(13)15-6-3/h9H,4-8H2,1-3H3","RPNFNBGRHCUORR-UHFFFAOYSA-N"
"CCCCC(CCCC)C(=O)OC","InChI=1S/C11H22O2/c1-4-6-8-10(9-7-5-2)11(12)13-3/h10H,4-9H2,1-3H3","AZTDAGYTELUSHF-UHFFFAOYSA-N"
"CCCCCC(=O)OC","InChI=1S/C7H14O2/c1-3-4-5-6-7(8)9-2/h3-6H2,1-2H3","NUKZAGXMHTUAFE-UHFFFAOYSA-N"
"CCCC(CCC)(C(=O)1)C(=O)CC(C)(C)C1","InChI=1S/C14H24O2/c1-5-7-14(8-6-2)11(15)9-13(3,4)10-12(14)16/h5-10H2,1-4H3","DFHLDDAIXQRSNN-UHFFFAOYSA-N"
"CCCC(C(=O)1)C(=O)CC(C)(C)C1","InChI=1S/C11H18O2/c1-4-5-8-9(12)6-11(2,3)7-10(8)13/h8H,4-7H2,1-3H3","KLQDATMPJJSEHG-UHFFFAOYSA-N"
"CC(=C1)OC(=O)C(Br)=C(C)1","InChI=1S/C7H7BrO2/c1-4-3-5(2)10-7(9)6(4)8/h3H,1-2H3","PCJLUGUBXDBHFL-UHFFFAOYSA-N"
"N#Cc(c1)[n+1]([O-1])c(c2)c(ccc2)c1","InChI=1S/C10H6N2O/c11-7-9-6-5-8-3-1-2-4-10(8)12(9)13/h1-6H","YJBFQJVBKTVFOW-UHFFFAOYSA-N"
"N#CC(O1)=Nc(c2)c(ccc2)C=C1","InChI=1S/C10H6N2O/c11-7-10-12-9-4-2-1-3-8(9)5-6-13-10/h1-6H","UCCKBAPZOKCNRY-UHFFFAOYSA-N"
"N#Cc(c1)nc(c2)c(ccc2)c1","InChI=1S/C10H6N2/c11-7-9-6-5-8-3-1-2-4-10(8)12-9/h1-6H","WDXARTMCIRVMAE-UHFFFAOYSA-N"
"Cc(n1)c(C)c(C)o1","InChI=1S/C6H9NO/c1-4-5(2)7-8-6(4)3/h1-3H3","MGHKWBQZEBMFOH-UHFFFAOYSA-N"
"OCc(c(C)1)c(C)on1","InChI=1S/C6H9NO2/c1-4-6(3-8)5(2)9-7-4/h8H,3H2,1-2H3","JISPGFYJPXGNBY-UHFFFAOYSA-N"
"O=C(C2)C(CCC2)Cc(c(C)1)c(C)on1","InChI=1S/C12H17NO2/c1-8-11(9(2)15-13-8)7-10-5-3-4-6-12(10)14/h10H,3-7H2,1-2H3","OJARMPVCHPMKQI-UHFFFAOYSA-N"
"CC(=O)CC(=O)CCc(c(C)1)c(C)on1","InChI=1S/C11H15NO3/c1-7(13)6-10(14)4-5-11-8(2)12-15-9(11)3/h4-6H2,1-3H3","WNVHQAUBCONYFK-UHFFFAOYSA-N"
"Cc(n3)c(c(C)o3)CC(C1)C(=O)c(c2)c(ccc2)C1","InChI=1S/C16H17NO2/c1-10-15(11(2)19-17-10)9-13-8-7-12-5-3-4-6-14(12)16(13)18/h3-6,13H,7-9H2,1-2H3","ZOWAUHGAZHGGNP-UHFFFAOYSA-N"
"CCOC(=O)C(C(C)=O)Cc(c(C)1)c(C)on1","InChI=1S/C12H17NO4/c1-5-16-12(15)11(8(3)14)6-10-7(2)13-17-9(10)4/h11H,5-6H2,1-4H3","FIBMBTXPEDJQQP-UHFFFAOYSA-N"
"CCCCCCCC(=O)C(C(=O)3)=C(C=1)C(C)(O3)C(=O)C(=C2)C(C=C(C=CC)O2)1","InChI=1S/C23H26O5/c1-4-6-7-8-9-11-19(24)20-18-13-15-12-16(10-5-2)27-14-17(15)21(25)23(18,3)28-22(20)26/h5,10,12-14H,4,6-9,11H2,1-3H3/b10-5+/t23-/m1/s1","IIPVSGPTPPURBD-HAOIVFDCSA-N"
"CCCCCCCC(=O)Cc(c1)c(C)c(OC)c(c2)c(cc(C=CC)n2)1","InChI=1S/C23H31NO2/c1-5-7-8-9-10-12-21(25)15-18-13-19-14-20(11-6-2)24-16-22(19)23(26-4)17(18)3/h6,11,13-14,16H,5,7-10,12,15H2,1-4H3/b11-6+","UGZSQZOGEOKORF-IZZDOVSWSA-N"
"CN(C)C(=C(C)1)C(=O)N(c(c2)cccc2)N(C)1","InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3","RMMXTBMQSGEXHJ-UHFFFAOYSA-N"
"CNC(=C(C)1)C(=O)N(c(c2)cccc2)N(C)1","InChI=1S/C12H15N3O/c1-9-11(13-2)12(16)15(14(9)3)10-7-5-4-6-8-10/h4-8,13H,1-3H3","JILCEWWZTBBOFS-UHFFFAOYSA-N"
"CCOP(=O)(OCC)OP(=O)(OCC)OCC","InChI=1S/C8H20O7P2/c1-5-11-16(9,12-6-2)15-17(10,13-7-3)14-8-4/h5-8H2,1-4H3","IDCBOTIENDVCBQ-UHFFFAOYSA-N"
"[C@@H]1([C@@H]([C@@H]([C@H]([C@@H]([C@@H]1Cl)Cl)Cl)Cl)Cl)Cl","InChI=1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3-,4+,5+,6+","JLYXXMFPNIAWKQ-GNIYUCBRSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)OP(=S)(OC)OC","InChI=1S/C8H10NO5PS/c1-12-15(16,13-2)14-8-5-3-7(4-6-8)9(10)11/h3-6H,1-2H3","RLBIQVVOMOPOHC-UHFFFAOYSA-N"
"CCS(=O)CCSP(=O)(OC)OC","InChI=1S/C6H15O4PS2/c1-4-13(8)6-5-12-11(7,9-2)10-3/h4-6H2,1-3H3","PMCVMORKVPSKHZ-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(n2)cc(o2)c(c1)cccc1","InChI=1S/C15H11NO/c1-3-7-12(8-4-1)14-11-15(17-16-14)13-9-5-2-6-10-13/h1-11H","HECRDSFKLUVCAY-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)C(N=1)C(c(c2)cccc2)1","InChI=1S/C15H11NO/c17-15(12-9-5-2-6-10-12)14-13(16-14)11-7-3-1-4-8-11/h1-10,14H","CQDPFIXVXYMXCT-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c2)oc(n2)c(c1)cccc1","InChI=1S/C15H11NO/c1-3-7-12(8-4-1)14-11-16-15(17-14)13-9-5-2-6-10-13/h1-11H","CNRNYORZJGVOSY-UHFFFAOYSA-N"
"Nc(n2)nc(s1)c(c2)nc(SC)1","InChI=1S/C6H6N4S2/c1-11-6-9-3-2-8-5(7)10-4(3)12-6/h2H,1H3,(H2,7,8,10)","AUXBHVTXXUIPHQ-UHFFFAOYSA-N"
"CCSc(n1)sc(n2)c(cnc(N)2)1","InChI=1S/C7H8N4S2/c1-2-12-7-10-4-3-9-6(8)11-5(4)13-7/h3H,2H2,1H3,(H2,8,9,11)","RBRDDQHNUZADPQ-UHFFFAOYSA-N"
"CCCSc(n1)sc(n2)c(cnc(N)2)1","InChI=1S/C8H10N4S2/c1-2-3-13-8-11-5-4-10-7(9)12-6(5)14-8/h4H,2-3H2,1H3,(H2,9,10,12)","YZKZVPLTCSHXIP-UHFFFAOYSA-N"
"CCCCSc(n1)sc(n2)c(cnc(N)2)1","InChI=1S/C9H12N4S2/c1-2-3-4-14-9-12-6-5-11-8(10)13-7(6)15-9/h5H,2-4H2,1H3,(H2,10,11,13)","PRKGQDKIJIYSBY-UHFFFAOYSA-N"
"CC(N1)=NCC1","InChI=1S/C4H8N2/c1-4-5-2-3-6-4/h2-3H2,1H3,(H,5,6)","VWSLLSXLURJCDF-UHFFFAOYSA-N"
"CCC(N1)=NCC1","InChI=1S/C5H10N2/c1-2-5-6-3-4-7-5/h2-4H2,1H3,(H,6,7)","QUPKCFBHJFNUEW-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C(N1)=NCC1","InChI=1S/C10H12N2O/c1-13-9-4-2-8(3-5-9)10-11-6-7-12-10/h2-5H,6-7H2,1H3,(H,11,12)","LPRQSQCAHSRGRZ-UHFFFAOYSA-N"
"c(c2)ccc(c2)CC(N1)=NCC1","InChI=1S/C10H12N2/c1-2-4-9(5-3-1)8-10-11-6-7-12-10/h1-5H,6-8H2,(H,11,12)","JIVZKJJQOZQXQB-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(N1)=NCC1","InChI=1S/C20H40N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-21-18-19-22-20/h2-19H2,1H3,(H,21,22)","NCVGSSQICKMAIA-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(N1)=NCC1","InChI=1S/C9H10N2/c1-2-4-8(5-3-1)9-10-6-7-11-9/h1-5H,6-7H2,(H,10,11)","BKCCAYLNRIRKDJ-UHFFFAOYSA-N"
"CCCCCCCCCCCC(N1)=NCC1","InChI=1S/C14H28N2/c1-2-3-4-5-6-7-8-9-10-11-14-15-12-13-16-14/h2-13H2,1H3,(H,15,16)","FQHUDZKKDCTQET-UHFFFAOYSA-N"
"CC(C1)N=C(C)N1","InChI=1S/C5H10N2/c1-4-3-6-5(2)7-4/h4H,3H2,1-2H3,(H,6,7)","DIHAURBCYGTGCV-UHFFFAOYSA-N"
"CCC(N1)=NC(C)C1","InChI=1S/C6H12N2/c1-3-6-7-4-5(2)8-6/h5H,3-4H2,1-2H3,(H,7,8)","SHYARJUKNREDGB-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(N)c1","InChI=1S/C6H5N3O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H,7H2","LXQOQPGNCGEELI-UHFFFAOYSA-N"
"CNc(c1)c([N+1]([O-1])=O)cc(c1)[N+1]([O-1])=O","InChI=1S/C7H7N3O4/c1-8-6-3-2-5(9(11)12)4-7(6)10(13)14/h2-4,8H,1H3","IQEJEZOCXWJNKR-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc([N+1]([O-1])=O)c(c2)Oc(c1)c([N+1]([O-1])=O)cc([N+1]([O-1])=O)c1","InChI=1S/C12H6N4O9/c17-13(18)7-1-3-11(9(5-7)15(21)22)25-12-4-2-8(14(19)20)6-10(12)16(23)24/h1-6H","WGAXJEXVOSVLFY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(F)c1","InChI=1S/C6H3FN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H","LOTKRQAVGJMPNV-UHFFFAOYSA-N"
"CCCN(CCC)c(c1)c([N+1]([O-1])=O)cc([N+1]([O-1])=O)c1","InChI=1S/C12H17N3O4/c1-3-7-13(8-4-2)11-6-5-10(14(16)17)9-12(11)15(18)19/h5-6,9H,3-4,7-8H2,1-2H3","OFXCRXLTJJLOIB-UHFFFAOYSA-N"
"CN(C)c(c1)c([N+1]([O-1])=O)cc(c1)[N+1]([O-1])=O","InChI=1S/C8H9N3O4/c1-9(2)7-4-3-6(10(12)13)5-8(7)11(14)15/h3-5H,1-2H3","HJFZYZBHIAWDEO-UHFFFAOYSA-N"
"CCCCNc(c1)c([N+1]([O-1])=O)cc([N+1]([O-1])=O)c1","InChI=1S/C10H13N3O4/c1-2-3-6-11-9-5-4-8(12(14)15)7-10(9)13(16)17/h4-5,7,11H,2-3,6H2,1H3","XFLMVRNRVDULNK-UHFFFAOYSA-N"
"CCNc(c1)c([N+1]([O-1])=O)cc(c1)[N+1]([O-1])=O","InChI=1S/C8H9N3O4/c1-2-9-7-4-3-6(10(12)13)5-8(7)11(14)15/h3-5,9H,2H2,1H3","YYOUTZBUOQBAAE-UHFFFAOYSA-N"
"CCCNc(c1)c([N+1]([O-1])=O)cc(c1)[N+1]([O-1])=O","InChI=1S/C9H11N3O4/c1-2-5-10-8-4-3-7(11(13)14)6-9(8)12(15)16/h3-4,6,10H,2,5H2,1H3","VTYSAZUSTIWCND-UHFFFAOYSA-N"
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"CC(C)CNc(c1)c([N+1]([O-1])=O)cc([N+1]([O-1])=O)c1","InChI=1S/C10H13N3O4/c1-7(2)6-11-9-4-3-8(12(14)15)5-10(9)13(16)17/h3-5,7,11H,6H2,1-2H3","HYHCZHIKPLOGQR-UHFFFAOYSA-N"
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"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(c1)NC(C)(C)C","InChI=1S/C10H13N3O4/c1-10(2,3)11-8-5-4-7(12(14)15)6-9(8)13(16)17/h4-6,11H,1-3H3","CLAAAWAMIUWEGS-UHFFFAOYSA-N"
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"O=NN(CC(C)C)CC(C)C","InChI=1S/C8H18N2O/c1-7(2)5-10(9-11)6-8(3)4/h7-8H,5-6H2,1-4H3","XLZCLFRMPCBSDI-UHFFFAOYSA-N"
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"O=NN(C1)CCCC1","InChI=1S/C5H10N2O/c8-6-7-4-2-1-3-5-7/h1-5H2","UWSDONTXWQOZFN-UHFFFAOYSA-N"
"CCNS(=O)(=O)c(c1)ccc(C)c1","InChI=1S/C9H13NO2S/c1-3-10-13(11,12)9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3","OHPZPBNDOVQJMH-UHFFFAOYSA-N"
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"Cc(c2)ccc(c2)S(=O)(=O)NC(C1)CCCC1","InChI=1S/C13H19NO2S/c1-11-7-9-13(10-8-11)17(15,16)14-12-5-3-2-4-6-12/h7-10,12,14H,2-6H2,1H3","DKYVVNLWACXMDW-UHFFFAOYSA-N"
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"c(c3NC(=O)c(c4)cccc4)(cccc3)SSc(c1NC(=O)c(c2)cccc2)cccc1","InChI=1S/C26H20N2O2S2/c29-25(19-11-3-1-4-12-19)27-21-15-7-9-17-23(21)31-32-24-18-10-8-16-22(24)28-26(30)20-13-5-2-6-14-20/h1-18H,(H,27,29)(H,28,30)","ZHMIOPLMFZVSHY-UHFFFAOYSA-N"
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"c(c3)ccc(c3)OC(=O)c(c2)c(ccc2)C(=O)Oc(c1)cccc1","InChI=1S/C20H14O4/c21-19(23-15-9-3-1-4-10-15)17-13-7-8-14-18(17)20(22)24-16-11-5-2-6-12-16/h1-14H","DWNAQMUDCDVSLT-UHFFFAOYSA-N"
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"COCCOC(=O)c(c1)c(ccc1)C(=O)OCCOC","InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3","HSUIVCLOAAJSRE-UHFFFAOYSA-N"
"CCOCCOC(=O)c(c1)c(ccc1)C(=O)OCCOCC","InChI=1S/C16H22O6/c1-3-19-9-11-21-15(17)13-7-5-6-8-14(13)16(18)22-12-10-20-4-2/h5-8H,3-4,9-12H2,1-2H3","RMKYMNRQXYPJHL-UHFFFAOYSA-N"
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"OCC(COC(C)=O)OC(C)=O","InChI=1S/C7H12O5/c1-5(9)11-4-7(3-8)12-6(2)10/h7-8H,3-4H2,1-2H3","UXDDRFCJKNROTO-UHFFFAOYSA-N"
"CC(=O)OCC(COC(C)=O)OC(C)=O","InChI=1S/C9H14O6/c1-6(10)13-4-9(15-8(3)12)5-14-7(2)11/h9H,4-5H2,1-3H3","URAYPUMNDPQOKB-UHFFFAOYSA-N"
"CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC","InChI=1S/C15H26O6/c1-4-7-13(16)19-10-12(21-15(18)9-6-3)11-20-14(17)8-5-2/h12H,4-11H2,1-3H3","UYXTWWCETRIEDR-UHFFFAOYSA-N"
"CCCCOCCOCCOCCCC","InChI=1S/C12H26O3/c1-3-5-7-13-9-11-15-12-10-14-8-6-4-2/h3-12H2,1-2H3","KZVBBTZJMSWGTK-UHFFFAOYSA-N"
"Cc(c1)cc(COCc(c2)cc(C)cc(C)2)cc(C)1","InChI=1S/C18H22O/c1-13-5-14(2)8-17(7-13)11-19-12-18-9-15(3)6-16(4)10-18/h5-10H,11-12H2,1-4H3","DKOAVTNIQCNCKQ-UHFFFAOYSA-N"
"CCCC[Sn](CCCC)(O1)OC(=O)C=CC(=O)1","InChI=1S/C4H4O4.2C4H9.Sn/c5-3(6)1-2-4(7)8;2*1-3-4-2;/h1-2H,(H,5,6)(H,7,8);2*1,3-4H2,2H3;/q;;;+2/p-2/b2-1-;;;","ZBBLRPRYYSJUCZ-GRHBHMESSA-L"
"CCCC[Sn](OC(CCCCCCCCCCC)=O)(OC(CCCCCCCCCCC)=O)CCCC","InChI=1S/2C12H24O2.2C4H9.Sn/c2*1-2-3-4-5-6-7-8-9-10-11-12(13)14;2*1-3-4-2;/h2*2-11H2,1H3,(H,13,14);2*1,3-4H2,2H3;/q;;;;+2/p-2","UKLDJPRMSDWDSL-UHFFFAOYSA-L"
"CCCCOP(=O)(OCCCC)OCCCC","InChI=1S/C12H27O4P/c1-4-7-10-14-17(13,15-11-8-5-2)16-12-9-6-3/h4-12H2,1-3H3","STCOOQWBFONSKY-UHFFFAOYSA-N"
"CC(Cl)OP(=O)(OC(C)Cl)OC(C)Cl","InChI=1S/C6H12Cl3O4P/c1-4(7)11-14(10,12-5(2)8)13-6(3)9/h4-6H,1-3H3","DMUDPMBKQJNINF-UHFFFAOYSA-N"
"c(c3)ccc(c3)OP(=O)(Oc(c2)cccc2)Oc(c1)cccc1","InChI=1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H","XZZNDPSIHUTMOC-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)OP(=O)(Oc(c2)cccc2)Oc(c1)cccc1","InChI=1S/C19H17O4P/c1-16-12-14-19(15-13-16)23-24(20,21-17-8-4-2-5-9-17)22-18-10-6-3-7-11-18/h2-15H,1H3","OJUZRFGUKHQNJX-UHFFFAOYSA-N"
"CCOC(=O)COC(=O)c(c1)c(ccc1)C(=O)OC","InChI=1S/C13H14O6/c1-3-18-11(14)8-19-13(16)10-7-5-4-6-9(10)12(15)17-2/h4-7H,3,8H2,1-2H3","OYMDOVKIWFMTAW-UHFFFAOYSA-N"
"CCOC(=O)COC(=O)c(c1)c(ccc1)C(=O)OCC","InChI=1S/C14H16O6/c1-3-18-12(15)9-20-14(17)11-8-6-5-7-10(11)13(16)19-4-2/h5-8H,3-4,9H2,1-2H3","PZBLUWVMZMXIKZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)OC(C)C","InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(18)19-16(2)3/h16H,4-15H2,1-3H3","AXISYYRBXTVTFY-UHFFFAOYSA-N"
"COC(=O)C(C)(C3)C([H])(C1)C(C)(CC3)C([H])(C2)C(C=C(C(C)C)C2)=C1","InChI=1S/C21H32O2/c1-14(2)15-7-9-17-16(13-15)8-10-18-20(17,3)11-6-12-21(18,4)19(22)23-5/h8,13-14,17-18H,6-7,9-12H2,1-5H3/t17-,18+,20+,21+/m0/s1","OVXRPXGVKBHGQO-UYWIDEMCSA-N"
"CCCCC(CC)COC(=O)CCCCCCCC(=O)OCC(CC)CCCC","InChI=1S/C25H48O4/c1-5-9-16-22(7-3)20-28-24(26)18-14-12-11-13-15-19-25(27)29-21-23(8-4)17-10-6-2/h22-23H,5-21H2,1-4H3","ZDWGXBPVPXVXMQ-UHFFFAOYSA-N"
"CCCOC(=O)CCC(=O)OCCC","InChI=1S/C10H18O4/c1-3-7-13-9(11)5-6-10(12)14-8-4-2/h3-8H2,1-2H3","SZHZCPHKDJWHNG-UHFFFAOYSA-N"
"CCCCOC(=O)CCC(=O)OCCCC","InChI=1S/C12H22O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h3-10H2,1-2H3","YUXIBTJKHLUKBD-UHFFFAOYSA-N"
"CCCCOC(=O)C(O)C(O)C(=O)OCCCC","InChI=1S/C12H22O6/c1-3-5-7-17-11(15)9(13)10(14)12(16)18-8-6-4-2/h9-10,13-14H,3-8H2,1-2H3","PCYQQSKDZQTOQG-UHFFFAOYSA-N"
"c(c3)ccc(c3)NC(Nc(c2)cccc2)=Nc(c1)cccc1","InChI=1S/C19H17N3/c1-4-10-16(11-5-1)20-19(21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H,(H2,20,21,22)","FUPAJKKAHDLPAZ-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OCCCC","InChI=1S/C16H32O2/c1-3-5-7-8-9-10-11-12-13-14-16(17)18-15-6-4-2/h3-15H2,1-2H3","NDKYEUQMPZIGFN-UHFFFAOYSA-N"
"CCOC(=O)CCCCC(=O)OCC","InChI=1S/C10H18O4/c1-3-13-9(11)7-5-6-8-10(12)14-4-2/h3-8H2,1-2H3","VIZORQUEIQEFRT-UHFFFAOYSA-N"
"CCCOC(=O)CCCCC(=O)OCCC","InChI=1S/C12H22O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h3-10H2,1-2H3","NKOUWLLFHNBUDW-UHFFFAOYSA-N"
"CC(C)COC(=O)CCCCC(=O)OCC(C)C","InChI=1S/C14H26O4/c1-11(2)9-17-13(15)7-5-6-8-14(16)18-10-12(3)4/h11-12H,5-10H2,1-4H3","RDOFJDLLWVCMRU-UHFFFAOYSA-N"
"CCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCC","InChI=1S/C26H50O4/c1-3-5-7-9-11-13-15-19-23-29-25(27)21-17-18-22-26(28)30-24-20-16-14-12-10-8-6-4-2/h3-24H2,1-2H3","HCQHIEGYGGJLJU-UHFFFAOYSA-N"
"CC(C)CCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC(C)C","InChI=1S/C26H50O4/c1-23(2)17-11-7-5-9-15-21-29-25(27)19-13-14-20-26(28)30-22-16-10-6-8-12-18-24(3)4/h23-24H,5-22H2,1-4H3","YKGYQYOQRGPFTO-UHFFFAOYSA-N"
"CCCCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC","InChI=1S/C24H46O4/c1-3-5-7-9-11-12-14-18-22-28-24(26)20-16-15-19-23(25)27-21-17-13-10-8-6-4-2/h3-22H2,1-2H3","NWSGBTCJMJADLE-UHFFFAOYSA-N"
"CCOCCOC(=O)CCCCC(=O)OCCOCC","InChI=1S/C14H26O6/c1-3-17-9-11-19-13(15)7-5-6-8-14(16)20-12-10-18-4-2/h3-12H2,1-2H3","NJEMMCIKSMMBDM-UHFFFAOYSA-N"
"CCCCOCCOCCOC(=O)CCCCC(=O)OCCOCCOCCCC","InChI=1S/C22H42O8/c1-3-5-11-25-13-15-27-17-19-29-21(23)9-7-8-10-22(24)30-20-18-28-16-14-26-12-6-4-2/h3-20H2,1-2H3","SCABKEBYDRTODC-UHFFFAOYSA-N"
"CCCCOC(=O)C=CC(=O)OCCCC","InChI=1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7-","JBSLOWBPDRZSMB-FPLPWBNLSA-N"
"CCCCC(CC)COC(=O)C=CC(=O)OCC(CC)CCCC","InChI=1S/C20H36O4/c1-5-9-11-17(7-3)15-23-19(21)13-14-20(22)24-16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16H2,1-4H3/b14-13-","ROPXFXOUUANXRR-YPKPFQOOSA-N"
"COC(=O)CC(=C)C(=O)OC","InChI=1S/C7H10O4/c1-5(7(9)11-3)4-6(8)10-2/h1,4H2,2-3H3","ZWWQRMFIZFPUAA-UHFFFAOYSA-N"
"CCCCOC(=O)C=CC(=O)OCCCC","InChI=1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+","JBSLOWBPDRZSMB-BQYQJAHWSA-N"
"CCCCOC(=O)OCCCC","InChI=1S/C9H18O3/c1-3-5-7-11-9(10)12-8-6-4-2/h3-8H2,1-2H3","QLVWOKQMDLQXNN-UHFFFAOYSA-N"
"CC(C1)OC(=O)O1","InChI=1S/C4H6O3/c1-3-2-6-4(5)7-3/h3H,2H2,1H3","RUOJZAUFBMNUDX-UHFFFAOYSA-N"
"Cc(c2)c(C)cc(c2)C(C)c(c1)cccc1","InChI=1S/C16H18/c1-12-9-10-16(11-13(12)2)14(3)15-7-5-4-6-8-15/h4-11,14H,1-3H3","FLWSNJAEMMOZJG-UHFFFAOYSA-N"
"CC(C)c(c2)cc(c1)c(c2)c(cc1)C(C)C","InChI=1S/C16H20/c1-11(2)13-8-9-16-14(10-13)6-5-7-15(16)12(3)4/h5-12H,1-4H3","GQHUSRBBMNYHIF-UHFFFAOYSA-N"
"O=c(c21)c(c3)c(ccc3)c(=O)c(cccc2)1","InChI=1S/C14H8O2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H","RZVHIXYEVGDQDX-UHFFFAOYSA-N"
"c(c4)cc(c(=O)1)c(c4)c(c3)c(c2cc3)c(ccc2)1","InChI=1S/C17H10O/c18-17-14-8-2-1-7-12(14)13-9-3-5-11-6-4-10-15(17)16(11)13/h1-10H","HUKPVYBUJRAUAG-UHFFFAOYSA-N"
"Cl[C@@H]1[C@@H](Cl)[C@H](Cl)[C@@H](Cl)[C@H](Cl)[C@H]1Cl","InChI=1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3+,4+,5-,6-","JLYXXMFPNIAWKQ-CDRYSYESSA-N"
"Oc(c2)c(ccc2)c(c1)c(O)ccc1","InChI=1S/C12H10O2/c13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14/h1-8,13-14H","IMHDGJOMLMDPJN-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c(Cl)1)c(Cl)c(Cl)c(Cl)c(Cl)1","InChI=1S/C6Cl5NO2/c7-1-2(8)4(10)6(12(13)14)5(11)3(1)9","LKPLKUMXSAEKID-UHFFFAOYSA-N"
"CSc(n1)sc(c2)c(ccc2)1","InChI=1S/C8H7NS2/c1-10-8-9-6-4-2-3-5-7(6)11-8/h2-5H,1H3","UTBVIMLZIRIFFR-UHFFFAOYSA-N"
"O=Cc(c1)cccc1","InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H","HUMNYLRZRPPJDN-UHFFFAOYSA-N"
"Cc(c1)cccc1","InChI=1S/C7H8/c1-7-5-3-2-4-6-7/h2-6H,1H3","YXFVVABEGXRONW-UHFFFAOYSA-N"
"CCCCC(CC)CO","InChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3","YIWUKEYIRIRTPP-UHFFFAOYSA-N"
"ClC(Cl)Br","InChI=1S/CHBrCl2/c2-1(3)4/h1H","FMWLUWPQPKEARP-UHFFFAOYSA-N"
"ClCBr","InChI=1S/CH2BrCl/c2-1-3/h1H2","JPOXNPPZZKNXOV-UHFFFAOYSA-N"
"ClC(Br)Br","InChI=1S/CHBr2Cl/c2-1(3)4/h1H","GATVIKZLVQHOMN-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc([N+1]([O-1])=O)c(c2)N(C1)CCC1","InChI=1S/C10H11N3O4/c14-12(15)8-3-4-9(10(7-8)13(16)17)11-5-1-2-6-11/h3-4,7H,1-2,5-6H2","ARCUVLVHQWONDY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc([N+1]([O-1])=O)c(c2)N(C1)CCCC1","InChI=1S/C11H13N3O4/c15-13(16)9-4-5-10(11(8-9)14(17)18)12-6-2-1-3-7-12/h4-5,8H,1-3,6-7H2","MPGYUYKSTWTQFS-UHFFFAOYSA-N"
"[H]C(O)(C4)CC([H])(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18-,19-/m0/s1","QGXBDMJGAMFCBF-HLUDHZFRSA-N"
"","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19-,20-,21+,22+,23-,24+,25+,26+,27-/m1/s1","QYIXCDOBOSTCEI-NWKZBHTNSA-N"
"O=C(C4)C=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)C1","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1","MUMGGOZAMZWBJJ-DYKIIFRCSA-N"
"O=C(C4)C=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(C(C)=O)C1","InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3/t16-,17+,18-,19-,20-,21+/m0/s1","RJKFOVLPORLFTN-LEKSSAKUSA-N"
"Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)C(O)1","InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13-,14-,15+,16-,17+,18+/m1/s1","PROQIPRRNZUXQM-ZXXIGWHRSA-N"
"Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C([H])(O)C1","InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1","VOXZDWNPVJITMN-ZBRFXRBCSA-N"
"CCCCOc(n1)cc(C(=O)NCCN(CC)CC)c(c2)c(ccc2)1","InChI=1S/C20H29N3O2/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h8-11,15H,4-7,12-14H2,1-3H3,(H,21,24)","PUFQVTATUTYEAL-UHFFFAOYSA-N"
"CCOc(n1)cc(C(=O)NCCN(CC)CC)c(c2)c(ccc2)1","InChI=1S/C18H25N3O2/c1-4-21(5-2)12-11-19-18(22)15-13-17(23-6-3)20-16-10-8-7-9-14(15)16/h7-10,13H,4-6,11-12H2,1-3H3,(H,19,22)","NMBXOBPJWHSZCO-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(c2)c(ccc2)nc(O[Si](C)(C)C)1","InChI=1S/C19H29N3O2Si/c1-6-22(7-2)13-12-20-19(23)16-14-18(24-25(3,4)5)21-17-11-9-8-10-15(16)17/h8-11,14H,6-7,12-13H2,1-5H3,(H,20,23)","MJQLDLNVBAOPAW-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(c2)c(ccc2)nc(Cl)1","InChI=1S/C16H20ClN3O/c1-3-20(4-2)10-9-18-16(21)13-11-15(17)19-14-8-6-5-7-12(13)14/h5-8,11H,3-4,9-10H2,1-2H3,(H,18,21)","WZBLJANCSMJDSS-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(c2)c(ccc2)nc(OCCCC)1","InChI=1S/C18H25N3O2/c1-3-5-12-23-17-13-15(18(22)20-11-10-19-4-2)14-8-6-7-9-16(14)21-17/h6-9,13,19H,3-5,10-12H2,1-2H3,(H,20,22)","PSROMGJLHUTGHE-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(c2)c(ccc2)nc(OCCC(C)O)1","InChI=1S/C18H25N3O3/c1-3-19-9-10-20-18(23)15-12-17(24-11-8-13(2)22)21-16-7-5-4-6-14(15)16/h4-7,12-13,19,22H,3,8-11H2,1-2H3,(H,20,23)","MBWJSJFBWIRQEQ-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(c2)c(ccc2)nc(O[Si](C)(C)C)1","InChI=1S/C17H25N3O2Si/c1-5-18-10-11-19-17(21)14-12-16(22-23(2,3)4)20-15-9-7-6-8-13(14)15/h6-9,12,18H,5,10-11H2,1-4H3,(H,19,21)","SCAUGGDEILNVST-UHFFFAOYSA-N"
"CCCCOc(n1)cc(C(=O)O[Si](C)(C)C)c(c2)c(ccc2)1","InChI=1S/C17H23NO3Si/c1-5-6-11-20-16-12-14(17(19)21-22(2,3)4)13-9-7-8-10-15(13)18-16/h7-10,12H,5-6,11H2,1-4H3","GUBMDNNJMZCTQQ-UHFFFAOYSA-N"
"CC(CCOc(n1)cc(C(=O)O[Si](C)(C)C)c(c2)c(ccc2)1)O[Si](C)(C)C","InChI=1S/C20H31NO4Si2/c1-15(24-26(2,3)4)12-13-23-19-14-17(20(22)25-27(5,6)7)16-10-8-9-11-18(16)21-19/h8-11,14-15H,12-13H2,1-7H3","RUDZPUSGGWKIGJ-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(c2)c(ccc2)nc(O[Si](C)(C)C)1","InChI=1S/C16H23NO3Si2/c1-21(2,3)19-15-11-13(16(18)20-22(4,5)6)12-9-7-8-10-14(12)17-15/h7-11H,1-6H3","ROWXXGUOJZLXAJ-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c2)c(c1)c(nc(O[Si](C)(C)C)2)c(cc1)O[Si](C)(C)C","InChI=1S/C19H31NO4Si3/c1-25(2,3)22-16-12-10-11-14-15(19(21)24-27(7,8)9)13-17(20-18(14)16)23-26(4,5)6/h10-13H,1-9H3","SKPPDKJSRKVMFU-UHFFFAOYSA-N"
"C[Si](C)(C)Oc(c2)cc(c(c2)1)c(cc(O[Si](C)(C)C)n1)C(=O)O[Si](C)(C)C","InChI=1S/C19H31NO4Si3/c1-25(2,3)22-14-10-11-17-15(12-14)16(19(21)24-27(7,8)9)13-18(20-17)23-26(4,5)6/h10-13H,1-9H3","JAIUCUSYTGVAEL-UHFFFAOYSA-N"
"OCCOc(n1)cc(C(=O)NCCN(CC)CC)c(c2)c(ccc2)1","InChI=1S/C18H25N3O3/c1-3-21(4-2)10-9-19-18(23)15-13-17(24-12-11-22)20-16-8-6-5-7-14(15)16/h5-8,13,22H,3-4,9-12H2,1-2H3,(H,19,23)","NUSFSWUAKIFAFP-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(c2)c(ccc2)nc(OCCO[Si](C)(C)C)1","InChI=1S/C21H33N3O3Si/c1-6-24(7-2)13-12-22-21(25)18-16-20(26-14-15-27-28(3,4)5)23-19-11-9-8-10-17(18)19/h8-11,16H,6-7,12-15H2,1-5H3,(H,22,25)","AJACVAVGZVQFMW-UHFFFAOYSA-N"
"CCCCOc(n1)cc(C(=O)NCC(=O)O[Si](C)(C)C)c(c2)c(ccc2)1","InChI=1S/C19H26N2O4Si/c1-5-6-11-24-17-12-15(14-9-7-8-10-16(14)21-17)19(23)20-13-18(22)25-26(2,3)4/h7-10,12H,5-6,11,13H2,1-4H3,(H,20,23)","YTNKPXRQPXGIER-UHFFFAOYSA-N"
"CC=CCOc(n1)cc(C(=O)NCCN(CC)CC)c(c2)c(ccc2)1","InChI=1S/C20H27N3O2/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h4,7-11,15H,5-6,12-14H2,1-3H3,(H,21,24)/b7-4+","DVLAYBXTANLAEG-QPJJXVBHSA-N"
"C[Si](C)(C)OCCOc(n1)cc(C(=O)O[Si](C)(C)C)c(c2)c(ccc2)1","InChI=1S/C18H27NO4Si2/c1-24(2,3)22-12-11-21-17-13-15(18(20)23-25(4,5)6)14-9-7-8-10-16(14)19-17/h7-10,13H,11-12H2,1-6H3","XWXBKOJNZXYWMJ-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(c2)c(ccc2)nc(OCCO[Si](C)(C)C)1","InChI=1S/C19H29N3O3Si/c1-5-20-10-11-21-19(23)16-14-18(24-12-13-25-26(2,3)4)22-17-9-7-6-8-15(16)17/h6-9,14,20H,5,10-13H2,1-4H3,(H,21,23)","JMQSVWRKEVQTTL-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(c2)c(ccc2)nc(OCCC(C)O)1","InChI=1S/C20H29N3O3/c1-4-23(5-2)12-11-21-20(25)17-14-19(26-13-10-15(3)24)22-18-9-7-6-8-16(17)18/h6-9,14-15,24H,4-5,10-13H2,1-3H3,(H,21,25)","SVJDEAGGTCVUHT-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(c2)c(ccc2)nc(OCCC(C)O[Si](C)(C)C)1","InChI=1S/C23H37N3O3Si/c1-7-26(8-2)15-14-24-23(27)20-17-22(25-21-12-10-9-11-19(20)21)28-16-13-18(3)29-30(4,5)6/h9-12,17-18H,7-8,13-16H2,1-6H3,(H,24,27)","ZCHLJRNADMBXGB-UHFFFAOYSA-N"
"C(C(COc(n2)cc(C(=O)NCCN(CC)CC)c(c21)cccc1)O[Si](C)(C)C)(C)O[Si](C)(C)C","InChI=1S/C26H45N3O4Si2/c1-10-29(11-2)17-16-27-26(30)22-18-25(28-23-15-13-12-14-21(22)23)31-19-24(33-35(7,8)9)20(3)32-34(4,5)6/h12-15,18,20,24H,10-11,16-17,19H2,1-9H3,(H,27,30)","LUCHTGRLVSVSLX-UHFFFAOYSA-N"
"CCCCOc(c1)ccc(OCCCN(C2)CCOC2)c1","InChI=1S/C17H27NO3/c1-2-3-12-20-16-5-7-17(8-6-16)21-13-4-9-18-10-14-19-15-11-18/h5-8H,2-4,9-15H2,1H3","DQKXQSGTHWVTAD-UHFFFAOYSA-N"
"OCCOc(c1)ccc(OCCCN(C2)CCOC2)c1","InChI=1S/C15H23NO4/c17-9-13-20-15-4-2-14(3-5-15)19-10-1-6-16-7-11-18-12-8-16/h2-5,17H,1,6-13H2","AJMKKWOIWUKPSD-UHFFFAOYSA-N"
"O(C2)CCN(C2)CCCOc(c1)ccc(OCCO[Si](C)(C)C)c1","InChI=1S/C18H31NO4Si/c1-24(2,3)23-16-15-22-18-7-5-17(6-8-18)21-12-4-9-19-10-13-20-14-11-19/h5-8H,4,9-16H2,1-3H3","YSCKLAUVHVINBE-UHFFFAOYSA-N"
"CC(O)CCOc(c1)ccc(OCCCN(C2)CCOC2)c1","InChI=1S/C17H27NO4/c1-15(19)7-12-22-17-5-3-16(4-6-17)21-11-2-8-18-9-13-20-14-10-18/h3-6,15,19H,2,7-14H2,1H3","RVXDPUFIEQVQMR-UHFFFAOYSA-N"
"CC(CCOc(c1)ccc(OCCCN(C2)CCOC2)c1)O[Si](C)(C)C","InChI=1S/C20H35NO4Si/c1-18(25-26(2,3)4)10-15-24-20-8-6-19(7-9-20)23-14-5-11-21-12-16-22-17-13-21/h6-9,18H,5,10-17H2,1-4H3","UXHVINVQGHCDOD-UHFFFAOYSA-N"
"Oc(c1)ccc(OCCCN(C2)CCOC2)c1","InChI=1S/C13H19NO3/c15-12-2-4-13(5-3-12)17-9-1-6-14-7-10-16-11-8-14/h2-5,15H,1,6-11H2","JWSOLKAMUAXNCD-UHFFFAOYSA-N"
"O(C2)CCN(C2)CCCOc(c1)ccc(c1)O[Si](C)(C)C","InChI=1S/C16H27NO3Si/c1-21(2,3)20-16-7-5-15(6-8-16)19-12-4-9-17-10-13-18-14-11-17/h5-8H,4,9-14H2,1-3H3","MNWGELCESYMHPL-UHFFFAOYSA-N"
"CCCCOc(n1)c(ccc1)C(=O)NCCN(CC)CC","InChI=1S/C16H27N3O2/c1-4-7-13-21-16-14(9-8-10-18-16)15(20)17-11-12-19(5-2)6-3/h8-10H,4-7,11-13H2,1-3H3,(H,17,20)","MCMNJFUSJFHDPX-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(ncc1)O[Si](C)(C)C","InChI=1S/C15H27N3O2Si/c1-6-18(7-2)12-11-16-14(19)13-9-8-10-17-15(13)20-21(3,4)5/h8-10H,6-7,11-12H2,1-5H3,(H,16,19)","OXMNPDIRTXEBRF-UHFFFAOYSA-N"
"CCCCOc(n1)c(ccc1)C(=O)O[Si](C)(C)C","InChI=1S/C13H21NO3Si/c1-5-6-10-16-12-11(8-7-9-14-12)13(15)17-18(2,3)4/h7-9H,5-6,10H2,1-4H3","PIXNUPDJTPLSOH-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(OCCC(C)O)ncc1","InChI=1S/C16H27N3O3/c1-4-19(5-2)11-10-17-15(21)14-7-6-9-18-16(14)22-12-8-13(3)20/h6-7,9,13,20H,4-5,8,10-12H2,1-3H3,(H,17,21)","NPSIJBTYSVKEIW-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(ncc1)OCCC(C)O[Si](C)(C)C","InChI=1S/C19H35N3O3Si/c1-7-22(8-2)14-13-20-18(23)17-10-9-12-21-19(17)24-15-11-16(3)25-26(4,5)6/h9-10,12,16H,7-8,11,13-15H2,1-6H3,(H,20,23)","BDJQRJCOQPHHIS-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(OCCCC)ncc1","InChI=1S/C14H23N3O2/c1-3-5-11-19-14-12(7-6-8-17-14)13(18)16-10-9-15-4-2/h6-8,15H,3-5,9-11H2,1-2H3,(H,16,18)","PBIINRGYZAHZCD-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(ncc1)OCC(O)C(C)O","InChI=1S/C16H27N3O4/c1-4-19(5-2)10-9-17-15(22)13-7-6-8-18-16(13)23-11-14(21)12(3)20/h6-8,12,14,20-21H,4-5,9-11H2,1-3H3,(H,17,22)","MKGNZJFTXMZFGI-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(OCCC(C)O)ncc1","InChI=1S/C14H23N3O3/c1-3-15-8-9-16-13(19)12-5-4-7-17-14(12)20-10-6-11(2)18/h4-5,7,11,15,18H,3,6,8-10H2,1-2H3,(H,16,19)","PHNJIUFRGJLMNR-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(ncc1)OCCC(C)O[Si](C)(C)C","InChI=1S/C17H31N3O3Si/c1-6-18-11-12-19-16(21)15-8-7-10-20-17(15)22-13-9-14(2)23-24(3,4)5/h7-8,10,14,18H,6,9,11-13H2,1-5H3,(H,19,21)","SBKJOILZHNBVDY-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(ncc1)OCC(O[Si](C)(C)C)C(C)O[Si](C)(C)C","InChI=1S/C20H39N3O4Si2/c1-9-21-13-14-22-19(24)17-11-10-12-23-20(17)25-15-18(27-29(6,7)8)16(2)26-28(3,4)5/h10-12,16,18,21H,9,13-15H2,1-8H3,(H,22,24)","SDZUBCAOQBBQTL-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(ncc1)OCC(O[Si](C)(C)C)C(C)O[Si](C)(C)C","InChI=1S/C22H43N3O4Si2/c1-10-25(11-2)16-15-23-21(26)19-13-12-14-24-22(19)27-17-20(29-31(7,8)9)18(3)28-30(4,5)6/h12-14,18,20H,10-11,15-17H2,1-9H3,(H,23,26)","XICRCYLRBRTKBZ-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)C(=O)OC(C1)CCCC1","InChI=1S/C13H17NO2/c14-11-8-6-10(7-9-11)13(15)16-12-4-2-1-3-5-12/h6-9,12H,1-5,14H2","OVZZSSYVRJEJQF-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(NC(C)=O)c1","InChI=1S/C10H11NO3/c1-7(12)11-9-5-3-8(4-6-9)10(13)14-2/h3-6H,1-2H3,(H,11,12)","QKWTXJSLAZKYGV-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C11H13NO4/c1-2-3-8-16-11(13)9-4-6-10(7-5-9)12(14)15/h4-7H,2-3,8H2,1H3","DVTGVOHTTDVRJF-UHFFFAOYSA-N"
"C(CCC(C)C)C(C([H])(C12C)CCC(C([H])(C4)C([H])(C(C)(C3=C4)CCC(O[Si](C)(C)C)C3)CC2)([H])1)([H])C","InChI=1S/C30H54OSi/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(31-32(6,7)8)16-18-29(23,4)28(25)17-19-30(26,27)5/h12,21-22,24-28H,9-11,13-20H2,1-8H3/t22-,24?,25+,26-,27+,28+,29+,30-/m1/s1","CBVJJGRSRFXUPK-HBOBSPHKSA-N"
"C(OC([H])(C4)CC(C3(C4)C)=CCC([H])(C23[H])C([H])(C1(CC2)C)CCC(C(CCCC(C)C)([H])C)1[H])(=O)CCCCCCCCCCCCCCCCC","InChI=1S/C45H80O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-43(46)47-38-30-32-44(5)37(34-38)26-27-39-41-29-28-40(36(4)24-22-23-35(2)3)45(41,6)33-31-42(39)44/h26,35-36,38-42H,7-25,27-34H2,1-6H3/t36-,38+,39+,40-,41+,42+,44+,45-/m1/s1","XHRPOTDGOASDJS-XNTGVSEISA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)C(=O)OC(C1)CCCC1","InChI=1S/C13H15NO4/c15-13(18-12-4-2-1-3-5-12)10-6-8-11(9-7-10)14(16)17/h6-9,12H,1-5H2","SXERGDOODBLTMY-UHFFFAOYSA-N"
"[N-1]=[N+1]=Nc(c2)ccc(c2)C(=O)OC(C1)CCCC1","InChI=1S/C13H15N3O2/c14-16-15-11-8-6-10(7-9-11)13(17)18-12-4-2-1-3-5-12/h6-9,12H,1-5H2","BNVZXSYEQNAJCR-UHFFFAOYSA-N"
"CCCCOc(n1)cc(C(=O)NCCN(C)C)c(c2)c(ccc2)1","InChI=1S/C18H25N3O2/c1-4-5-12-23-17-13-15(18(22)19-10-11-21(2)3)14-8-6-7-9-16(14)20-17/h6-9,13H,4-5,10-12H2,1-3H3,(H,19,22)","KYNYSWROWCUJRS-UHFFFAOYSA-N"
"CN(C)CCNC(=O)c(c1)c(c2)c(ccc2)nc(OCCC(C)O)1","InChI=1S/C18H25N3O3/c1-13(22)8-11-24-17-12-15(18(23)19-9-10-21(2)3)14-6-4-5-7-16(14)20-17/h4-7,12-13,22H,8-11H2,1-3H3,(H,19,23)","BWJOZZXBMMBITB-UHFFFAOYSA-N"
"OCCOc(n1)cc(C(=O)NCCN(C)C)c(c2)c(ccc2)1","InChI=1S/C16H21N3O3/c1-19(2)8-7-17-16(21)13-11-15(22-10-9-20)18-14-6-4-3-5-12(13)14/h3-6,11,20H,7-10H2,1-2H3,(H,17,21)","UYTCDZVOYWTYNZ-UHFFFAOYSA-N"
"CN(C)CCNC(=O)c(c1)c(c2)c(ccc2)nc(OCC(O[Si](C)(C)C)C(C)O[Si](C)(C)C)1","InChI=1S/C24H41N3O4Si2/c1-18(30-32(4,5)6)22(31-33(7,8)9)17-29-23-16-20(24(28)25-14-15-27(2)3)19-12-10-11-13-21(19)26-23/h10-13,16,18,22H,14-15,17H2,1-9H3,(H,25,28)","WVAMKKJBMWUNGL-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)ccc(Cl)c1","InChI=1S/C13H19ClN2O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10H2,1-2H3,(H,15,17)","SGQXWVJTZCWVBO-UHFFFAOYSA-N"
"OCCCN(C1)CCOC1","InChI=1S/C7H15NO2/c9-5-1-2-8-3-6-10-7-4-8/h9H,1-7H2","VZKSLWJLGAGPIU-UHFFFAOYSA-N"
"O(C1)CCN(C1)CCCO[Si](C)(C)C","InChI=1S/C10H23NO2Si/c1-14(2,3)13-8-4-5-11-6-9-12-10-7-11/h4-10H2,1-3H3","QQPKVMLRAUKZFK-UHFFFAOYSA-N"
"CN(C2)C(CC2)c(c1)cncc1","InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3","SNICXCGAKADSCV-UHFFFAOYSA-N"
"O=C(C2)N(C)C(C2)c(c1)cncc1","InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3","UIKROCXWUNQSPJ-UHFFFAOYSA-N"
"CCCCOc(c1)nc(c2)c(ccc2)c1","InChI=1S/C13H15NO/c1-2-3-10-15-13-9-8-11-6-4-5-7-12(11)14-13/h4-9H,2-3,10H2,1H3","HCSMVOFDAVUSSV-UHFFFAOYSA-N"
"CCCCOc(c1)ccc(O)c1","InChI=1S/C10H14O2/c1-2-3-8-12-10-6-4-9(11)5-7-10/h4-7,11H,2-3,8H2,1H3","MBGGFXOXUIDRJD-UHFFFAOYSA-N"
"CCCCOc(c1)ccc(c1)O[Si](C)(C)C","InChI=1S/C13H22O2Si/c1-5-6-11-14-12-7-9-13(10-8-12)15-16(2,3)4/h7-10H,5-6,11H2,1-4H3","MXEOZHAENXZTNR-UHFFFAOYSA-N"
"COC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)cccc1","InChI=1S/C17H16O3/c1-12(17(19)20-2)14-9-6-10-15(11-14)16(18)13-7-4-3-5-8-13/h3-12H,1-2H3","BIOCOYIPJQMGTN-UHFFFAOYSA-N"
"COC(=O)C(CC)c(c2)cc(cc2)C(=O)c(c1)cccc1","InChI=1S/C18H18O3/c1-3-16(18(20)21-2)14-10-7-11-15(12-14)17(19)13-8-5-4-6-9-13/h4-12,16H,3H2,1-2H3","GHPPUPSJPYEIDF-UHFFFAOYSA-N"
"COC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)cc(OC)cc1","InChI=1S/C18H18O4/c1-12(18(20)22-3)13-6-4-7-14(10-13)17(19)15-8-5-9-16(11-15)21-2/h4-12H,1-3H3","RSKJLVJQVNOJIJ-UHFFFAOYSA-N"
"COC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)cc(O)cc1","InChI=1S/C17H16O4/c1-11(17(20)21-2)12-5-3-6-13(9-12)16(19)14-7-4-8-15(18)10-14/h3-11,18H,1-2H3","JJKBMVXFVHMUKK-UHFFFAOYSA-N"
"COC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)ccc(OC)c1","InChI=1S/C18H18O4/c1-12(18(20)22-3)14-5-4-6-15(11-14)17(19)13-7-9-16(21-2)10-8-13/h4-12H,1-3H3","UZTIWYLOPRWPKU-UHFFFAOYSA-N"
"COC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)ccc(O)c1","InChI=1S/C17H16O4/c1-11(17(20)21-2)13-4-3-5-14(10-13)16(19)12-6-8-15(18)9-7-12/h3-11,18H,1-2H3","HUEPRCAJXIOEHP-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)ccc(c1)O[Si](C)(C)C","InChI=1S/C22H30O4Si2/c1-16(22(24)26-28(5,6)7)18-9-8-10-19(15-18)21(23)17-11-13-20(14-12-17)25-27(2,3)4/h8-16H,1-7H3","HOGVZPPYMQWJGJ-UHFFFAOYSA-N"
"COP(=S)(OC)OC","InChI=1S/C3H9O3PS/c1-4-7(8,5-2)6-3/h1-3H3","XWSLYQXUTWUIKM-UHFFFAOYSA-N"
"COC(=O)CSP(=S)(OC)OC","InChI=1S/C5H11O4PS2/c1-7-5(6)4-12-10(11,8-2)9-3/h4H2,1-3H3","PLZVCZLWZIJPPO-UHFFFAOYSA-N"
"Nc(c1)ccc(Cl)c1","InChI=1S/C6H6ClN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2","QSNSCYSYFYORTR-UHFFFAOYSA-N"
"c(c2)cc(O1)c(c2)OC1","InChI=1S/C7H6O2/c1-2-4-7-6(3-1)8-5-9-7/h1-4H,5H2","FTNJQNQLEGKTGD-UHFFFAOYSA-N"
"O=CN(C)c(c2)c(cc(Cl)c2)C(=O)c(c1)c(Cl)ccc1","InChI=1S/C15H11Cl2NO2/c1-18(9-19)14-7-6-10(16)8-12(14)15(20)11-4-2-3-5-13(11)17/h2-9H,1H3","OCVBHBHJZKOSNY-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N2)c(c1)c(Cl)ccc1","InChI=1S/C15H10Cl2N2O2/c16-8-5-6-12-10(7-8)13(19-15(21)14(20)18-12)9-3-1-2-4-11(9)17/h1-7,15,21H,(H,18,20)","DIWRORZWFLOCLC-UHFFFAOYSA-N"
"CC(=O)Nc(c2)c(cc(Cl)c2)C(=O)c(c1)c(Cl)ccc1","InChI=1S/C15H11Cl2NO2/c1-9(19)18-14-7-6-10(16)8-12(14)15(20)11-4-2-3-5-13(11)17/h2-8H,1H3,(H,18,19)","UFFQVZHDIPJFDP-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)2)C(=NCC(=O)N(C)2)c(c1)c(Cl)ccc1","InChI=1S/C16H12Cl2N2O/c1-20-14-7-6-10(17)8-12(14)16(19-9-15(20)21)11-4-2-3-5-13(11)18/h2-8H,9H2,1H3","VPAYQWRBBOGGPY-UHFFFAOYSA-N"
"O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)c(Cl)ccc1","InChI=1S/C15H10Cl2N2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)","CHIFCDOIPRCHCF-UHFFFAOYSA-N"
"COC(=O)C(=O)N(C)c(c2)c(cc(Cl)c2)C(=O)c(c1)c(Cl)ccc1","InChI=1S/C17H13Cl2NO4/c1-20(16(22)17(23)24-2)14-8-7-10(18)9-12(14)15(21)11-5-3-4-6-13(11)19/h3-9H,1-2H3","HRMRDHIZIZBJTI-UHFFFAOYSA-N"
"OC(=O)Cc(c1)ccc(O)c1","InChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)","XQXPVVBIMDBYFF-UHFFFAOYSA-N"
"Oc(c1)ccc(c1)C(O)=O","InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)","FJKROLUGYXJWQN-UHFFFAOYSA-N"
"CC(=O)c(c1)cc(Br)cc1","InChI=1S/C8H7BrO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,1H3","JYAQYXOVOHJRCS-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2","InChI=1S/C14H11N/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-10,15H","KLLLJCACIRKBDT-UHFFFAOYSA-N"
"COc(c1)c(O)ccc1","InChI=1S/C7H8O2/c1-9-7-5-3-2-4-6(7)8/h2-5,8H,1H3","LHGVFZTZFXWLCP-UHFFFAOYSA-N"
"COC(=O)Cc(c1)ccc(O)c1","InChI=1S/C9H10O3/c1-12-9(11)6-7-2-4-8(10)5-3-7/h2-5,10H,6H2,1H3","XGDZEDRBLVIUMX-UHFFFAOYSA-N"
"CCc(c2)cc(cc2)Oc(c1)cccc1","InChI=1S/C14H14O/c1-2-12-7-6-10-14(11-12)15-13-8-4-3-5-9-13/h3-11H,2H2,1H3","OOOMPLNDUPMWLO-UHFFFAOYSA-N"
"OC(=O)Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H10O2/c13-12(14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2,(H,13,14)","PRPINYUDVPFIRX-UHFFFAOYSA-N"
"CC(C1)O1","InChI=1S/C3H6O/c1-3-2-4-3/h3H,2H2,1H3","GOOHAUXETOMSMM-UHFFFAOYSA-N"
"ON=C(C1)CCCC1","InChI=1S/C6H11NO/c8-7-6-4-2-1-3-5-6/h8H,1-5H2","VEZUQRBDRNJBJY-UHFFFAOYSA-N"
"OC(=O)C(O)c(c1)cccc1","InChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)","IWYDHOAUDWTVEP-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)c(c1)ccc(O)c1","InChI=1S/C12H10O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,13-14H","VCCBEIPGXKNHFW-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)c(c1)cccc1","InChI=1S/C12H10O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9,13H","YXVFYQXJAXKLAK-UHFFFAOYSA-N"
"O=C(C4)C([H])=C(C3)C([H])(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C([H])(O)C1","InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1","NPAGDVCDWIYMMC-IZPLOLCNSA-N"
"c(c(C(C)(C)C)4)c(cc(C(C)(C)C)c4O)Cc(c(C)1)c(C)c(Cc(c3)cc(C(C)(C)C)c(c3C(C)(C)C)O)c(C)c(Cc(c2)cc(C(C)(C)C)c(c2C(C)(C)C)O)1","InChI=1S/C54H78O3/c1-31-37(22-34-25-40(49(4,5)6)46(55)41(26-34)50(7,8)9)32(2)39(24-36-29-44(53(16,17)18)48(57)45(30-36)54(19,20)21)33(3)38(31)23-35-27-42(51(10,11)12)47(56)43(28-35)52(13,14)15/h25-30,55-57H,22-24H2,1-21H3","VSAWBBYYMBQKIK-UHFFFAOYSA-N"
"S(CCCCCCCC)c(n2)nc(nc(SCCCCCCCC)2)Nc(c1)cc(c(O)c1C(C)(C)C)C(C)(C)C","InChI=1S/C33H56N4OS2/c1-9-11-13-15-17-19-21-39-30-35-29(36-31(37-30)40-22-20-18-16-14-12-10-2)34-25-23-26(32(3,4)5)28(38)27(24-25)33(6,7)8/h23-24,38H,9-22H2,1-8H3,(H,34,35,36,37)","QRLSTWVLSWCGBT-UHFFFAOYSA-N"
"C(CCCCCCCCCOC(=O)CCc(c1)cc(c(c1C(C)(C)C)O)C(C)(C)C)CCCCCCCC","InChI=1S/C35H62O3/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-38-32(36)25-24-29-27-30(34(2,3)4)33(37)31(28-29)35(5,6)7/h27-28,37H,8-26H2,1-7H3","SSDSCDGVMJFTEQ-UHFFFAOYSA-N"
"NC(=O)N=NC(N)=O","InChI=1S/C2H4N4O2/c3-1(7)5-6-2(4)8/h(H2,3,7)(H2,4,8)/b6-5+","XOZUGNYVDXMRKW-AATRIKPKSA-N"
"C(CCCCNC(CCc(c2)cc(C(C)(C)C)c(O)c(C(C)(C)C)2)=O)CNC(CCc(c1)cc(C(C)(C)C)c(O)c(C(C)(C)C)1)=O","InChI=1S/C40H64N2O4/c1-37(2,3)29-23-27(24-30(35(29)45)38(4,5)6)17-19-33(43)41-21-15-13-14-16-22-42-34(44)20-18-28-25-31(39(7,8)9)36(46)32(26-28)40(10,11)12/h23-26,45-46H,13-22H2,1-12H3,(H,41,43)(H,42,44)","OKOBUGCCXMIKDM-UHFFFAOYSA-N"
"c(Cc(c2)cc(c(c2C(C)(C)C)O)C(C)(C)C)(c1)cc(c(c1C(C)(C)C)O)C(C)(C)C","InChI=1S/C29H44O2/c1-26(2,3)20-14-18(15-21(24(20)30)27(4,5)6)13-19-16-22(28(7,8)9)25(31)23(17-19)29(10,11)12/h14-17,30-31H,13H2,1-12H3","MDWVSAYEQPLWMX-UHFFFAOYSA-N"
"Cc(c1)c(O)cc(c(C(CC(C)c(c3)c(C)cc(c3C(C)(C)C)O)c(c2)c(C)cc(O)c(C(C)(C)C)2)1)C(C)(C)C","InChI=1S/C37H52O3/c1-21(25-18-30(36(8,9)10)33(39)16-22(25)2)14-27(26-19-31(37(11,12)13)34(40)17-23(26)3)28-15-24(4)32(38)20-29(28)35(5,6)7/h15-21,27,38-40H,14H2,1-13H3","WIDXGWNAHCYPJN-UHFFFAOYSA-N"
"Cc(c1)cc(C(C)(C)C)c(O)c1Cc(c2)c(O)c(cc(C)2)C(C)(C)C","InChI=1S/C23H32O2/c1-14-9-16(20(24)18(11-14)22(3,4)5)13-17-10-15(2)12-19(21(17)25)23(6,7)8/h9-12,24-25H,13H2,1-8H3","KGRVJHAUYBGFFP-UHFFFAOYSA-N"
"Oc(c2)c(cc(c(C)2)Sc(c(C)1)cc(c(O)c1)C(C)(C)C)C(C)(C)C","InChI=1S/C22H30O2S/c1-13-9-17(23)15(21(3,4)5)11-19(13)25-20-12-16(22(6,7)8)18(24)10-14(20)2/h9-12,23-24H,1-8H3","HXIQYSLFEXIOAV-UHFFFAOYSA-N"
"c(c2O)c(c(cc(C(C)(C)C)2)C(c(c1)c(cc(c(C(C)(C)C)1)O)C)CCC)C","InChI=1S/C26H38O2/c1-10-11-18(19-14-21(25(4,5)6)23(27)12-16(19)2)20-15-22(26(7,8)9)24(28)13-17(20)3/h12-15,18,27-28H,10-11H2,1-9H3","PFANXOISJYKQRP-UHFFFAOYSA-N"
"OCc(c1)cc(C(C)(C)C)c(O)c1C(C)(C)C","InChI=1S/C15H24O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-8,16-17H,9H2,1-6H3","HNURKXXMYARGAY-UHFFFAOYSA-N"
"CN(C)Cc(c1)cc(C(C)(C)C)c(O)c1C(C)(C)C","InChI=1S/C17H29NO/c1-16(2,3)13-9-12(11-18(7)8)10-14(15(13)19)17(4,5)6/h9-10,19H,11H2,1-8H3","VMZVBRIIHDRYGK-UHFFFAOYSA-N"
"O(C(=O)CCc(c2)cc(c(c2C(C)(C)C)O)C(C)(C)C)CCCCCCOC(=O)CCc(c1)cc(c(c1C(C)(C)C)O)C(C)(C)C","InChI=1S/C40H62O6/c1-37(2,3)29-23-27(24-30(35(29)43)38(4,5)6)17-19-33(41)45-21-15-13-14-16-22-46-34(42)20-18-28-25-31(39(7,8)9)36(44)32(26-28)40(10,11)12/h23-26,43-44H,13-22H2,1-12H3","ZVVFVKJZNVSANF-UHFFFAOYSA-N"
"C(CCCCCCCOC(=O)CCSCCC(=O)OCCCCCCCCCCCC)CCCC","InChI=1S/C30H58O4S/c1-3-5-7-9-11-13-15-17-19-21-25-33-29(31)23-27-35-28-24-30(32)34-26-22-20-18-16-14-12-10-8-6-4-2/h3-28H2,1-2H3","GHKOFFNLGXMVNJ-UHFFFAOYSA-N"
"C(OC(CCSCCC(OCCCCCCCCCCCCCC)=O)=O)CCCCCCCCCCCCC","InChI=1S/C34H66O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-29-37-33(35)27-31-39-32-28-34(36)38-30-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3","LVEOKSIILWWVEO-UHFFFAOYSA-N"
"C(CCCCCCCCCCCCOC(=O)CCSCCC(OCCCCCCCCCCCCCCCCCC)=O)CCCCC","InChI=1S/C42H82O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37-45-41(43)35-39-47-40-36-42(44)46-38-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3","PWWSSIYVTQUJQQ-UHFFFAOYSA-N"
"C(C(OC(C2)CC(NC2(C)C)(C)C)=O)CCCCCCCC(OC(C1)CC(NC1(C)C)(C)C)=O","InChI=1S/C28H52N2O4/c1-25(2)17-21(18-26(3,4)29-25)33-23(31)15-13-11-9-10-12-14-16-24(32)34-22-19-27(5,6)30-28(7,8)20-22/h21-22,29-30H,9-20H2,1-8H3","XITRBUPOXXBIJN-UHFFFAOYSA-N"
"CCCCCCCCOc(c2)cc(O)c(c2)C(=O)c(c1)cccc1","InChI=1S/C21H26O3/c1-2-3-4-5-6-10-15-24-18-13-14-19(20(22)16-18)21(23)17-11-8-7-9-12-17/h7-9,11-14,16,22H,2-6,10,15H2,1H3","QUAMTGJKVDWJEQ-UHFFFAOYSA-N"
"Clc(c3)cc(n1)c(c3)nn1c(c2)c(O)c(cc(C(C)(C)C)2)C(C)(C)C","InChI=1S/C20H24ClN3O/c1-19(2,3)12-9-14(20(4,5)6)18(25)17(10-12)24-22-15-8-7-13(21)11-16(15)23-24/h7-11,25H,1-6H3","UWSMKYBKUPAEJQ-UHFFFAOYSA-N"
"Clc(c3)cc(n1)c(c3)nn1c(c2)c(O)c(cc(C)2)C(C)(C)C","InChI=1S/C17H18ClN3O/c1-10-7-12(17(2,3)4)16(22)15(8-10)21-19-13-6-5-11(18)9-14(13)20-21/h5-9,22H,1-4H3","OCWYEMOEOGEQAN-UHFFFAOYSA-N"
"CCCCCCCCCCCCOc(c2)cc(O)c(c2)C(=O)c(c1)cccc1","InChI=1S/C25H34O3/c1-2-3-4-5-6-7-8-9-10-14-19-28-22-17-18-23(24(26)20-22)25(27)21-15-12-11-13-16-21/h11-13,15-18,20,26H,2-10,14,19H2,1H3","ARVUDIQYNJVQIW-UHFFFAOYSA-N"
"CCCCCc(c3)cc(c(O)c(CCCCC)3)n(n1)nc(c2)c(ccc2)1","InChI=1S/C22H29N3O/c1-3-5-7-11-17-15-18(12-8-6-4-2)22(26)21(16-17)25-23-19-13-9-10-14-20(19)24-25/h9-10,13-16,26H,3-8,11-12H2,1-2H3","CYCYSJGJOIJFEP-UHFFFAOYSA-N"
"COc(c2)cc(O)c(c2)C(=O)c(c1)c(O)ccc1","InChI=1S/C14H12O4/c1-18-9-6-7-11(13(16)8-9)14(17)10-4-2-3-5-12(10)15/h2-8,15-16H,1H3","MEZZCSHVIGVWFI-UHFFFAOYSA-N"
"C=CC(=O)NCOCc(c1)cc(C(C)(C)C)c(O)c1C(C)(C)C","InChI=1S/C19H29NO3/c1-8-16(21)20-12-23-11-13-9-14(18(2,3)4)17(22)15(10-13)19(5,6)7/h8-10,22H,1,11-12H2,2-7H3,(H,20,21)","QLARJGZMKICHSE-UHFFFAOYSA-N"
"CC(C)(C)c(c1)c(O)cc(C(C)(C)C)c(O)1","InChI=1S/C14H22O2/c1-13(2,3)9-7-12(16)10(8-11(9)15)14(4,5)6/h7-8,15-16H,1-6H3","JZODKRWQWUWGCD-UHFFFAOYSA-N"
"CCCCCCCCCc(c1)ccc(O)c1","InChI=1S/C15H24O/c1-2-3-4-5-6-7-8-9-14-10-12-15(16)13-11-14/h10-13,16H,2-9H2,1H3","IGFHQQFPSIBGKE-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCC(N)=O","InChI=1S/C18H35NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H2,19,20)/b10-9-","FATBGEAMYMYZAF-KTKRTIGZSA-N"
"CC(=C)C(=O)OCC(O)CNc(c2)ccc(c2)Nc(c1)cccc1","InChI=1S/C19H22N2O3/c1-14(2)19(23)24-13-18(22)12-20-15-8-10-17(11-9-15)21-16-6-4-3-5-7-16/h3-11,18,20-22H,1,12-13H2,2H3","JYSSGQITKNFRQE-UHFFFAOYSA-N"
"CCC(C)C(C1)CCC(O)C1","InChI=1S/C10H20O/c1-3-8(2)9-4-6-10(11)7-5-9/h8-11H,3-7H2,1-2H3","NSMFWUVWJSHYTR-UHFFFAOYSA-N"
"CC(C1)CC(C)(C)CC(O)1","InChI=1S/C9H18O/c1-7-4-8(10)6-9(2,3)5-7/h7-8,10H,4-6H2,1-3H3","BRRVXFOKWJKTGG-UHFFFAOYSA-N"
"CCC(C)C(C1)C(O)CCC1","InChI=1S/C10H20O/c1-3-8(2)9-6-4-5-7-10(9)11/h8-11H,3-7H2,1-2H3","HSTMKGFYRGMMOF-UHFFFAOYSA-N"
"OC(C1)C(CCC1)C(C)(C)C","InChI=1S/C10H20O/c1-10(2,3)8-6-4-5-7-9(8)11/h8-9,11H,4-7H2,1-3H3","DLTWBMHADAJAAZ-UHFFFAOYSA-N"
"OC(C1)CCC(C1)C(C)(C)C","InChI=1S/C10H20O/c1-10(2,3)8-4-6-9(11)7-5-8/h8-9,11H,4-7H2,1-3H3","CCOQPGVQAWPUPE-UHFFFAOYSA-N"
"CC(C1)CCC(O)C1","InChI=1S/C7H14O/c1-6-2-4-7(8)5-3-6/h6-8H,2-5H2,1H3","MQWCXKGKQLNYQG-UHFFFAOYSA-N"
"CC(C1)CC(O)CC1","InChI=1S/C7H14O/c1-6-3-2-4-7(8)5-6/h6-8H,2-5H2,1H3","HTSABYAWKQAHBT-UHFFFAOYSA-N"
"OCC(C1)CCC1","InChI=1S/C6H12O/c7-5-6-3-1-2-4-6/h6-7H,1-5H2","ISQVBYGGNVVVHB-UHFFFAOYSA-N"
"CC(C1)C(O)C(O)C1","InChI=1S/C6H12O2/c1-4-2-3-5(7)6(4)8/h4-8H,2-3H2,1H3","KANFKJUPLALTDB-UHFFFAOYSA-N"
"CCCCNC(C1)CCCC1","InChI=1S/C10H21N/c1-2-3-9-11-10-7-5-4-6-8-10/h10-11H,2-9H2,1H3","VXXLEXCQCSPKFI-UHFFFAOYSA-N"
"NCCCNC(C1)CCCC1","InChI=1S/C9H20N2/c10-7-4-8-11-9-5-2-1-3-6-9/h9,11H,1-8,10H2","ITZPOSYADVYECJ-UHFFFAOYSA-N"
"NC(C1)C(N)CCC1","InChI=1S/C6H14N2/c7-5-3-1-2-4-6(5)8/h5-6H,1-4,7-8H2","SSJXIUAHEKJCMH-UHFFFAOYSA-N"
"NC(C1)CC(N)CC1","InChI=1S/C6H14N2/c7-5-2-1-3-6(8)4-5/h5-6H,1-4,7-8H2","GEQHKFFSPGPGLN-UHFFFAOYSA-N"
"CNC(C1)CCCC1","InChI=1S/C7H15N/c1-8-7-5-3-2-4-6-7/h7-8H,2-6H2,1H3","XTUVJUMINZSXGF-UHFFFAOYSA-N"
"CN(C)C(C1)CCCC1","InChI=1S/C8H17N/c1-9(2)8-6-4-3-5-7-8/h8H,3-7H2,1-2H3","SVYKKECYCPFKGB-UHFFFAOYSA-N"
"CCNC(C1)CCCC1","InChI=1S/C8H17N/c1-2-9-8-6-4-3-5-7-8/h8-9H,2-7H2,1H3","AGVKXDPPPSLISR-UHFFFAOYSA-N"
"CCCC(O)(C1)CCCC1","InChI=1S/C9H18O/c1-2-6-9(10)7-4-3-5-8-9/h10H,2-8H2,1H3","PYLPYOPJKOJRNP-UHFFFAOYSA-N"
"CC(C)C(C1)C(O)CCC1","InChI=1S/C9H18O/c1-7(2)8-5-3-4-6-9(8)10/h7-10H,3-6H2,1-2H3","IXVGVVQGNQZQGD-UHFFFAOYSA-N"
"c(c2)ccc(c2)c(c1)c(Cl)ccc1","InChI=1S/C12H9Cl/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H","LAXBNTIAOJWAOP-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)c(c1)cccc1","InChI=1S/C12H9Cl/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H","FPWNLURCHDRMHC-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)c(c1)ccc(Cl)c1","InChI=1S/C12H8Cl2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H","YTBRNEUEFCNVHC-UHFFFAOYSA-N"
"Clc(c1)c(Cl)c(Cl)cc1","InChI=1S/C6H3Cl3/c7-4-2-1-3-5(8)6(4)9/h1-3H","RELMFMZEBKVZJC-UHFFFAOYSA-N"
"Clc(c1)cc(Cl)cc(Cl)1","InChI=1S/C6H3Cl3/c7-4-1-5(8)3-6(9)2-4/h1-3H","XKEFYDZQGKAQCN-UHFFFAOYSA-N"
"Clc(c1)c(Cl)c(Cl)c(Cl)c1","InChI=1S/C6H2Cl4/c7-3-1-2-4(8)6(10)5(3)9/h1-2H","GBDZXPJXOMHESU-UHFFFAOYSA-N"
"Clc(c1)cc(Cl)c(Cl)c(Cl)1","InChI=1S/C6H2Cl4/c7-3-1-4(8)6(10)5(9)2-3/h1-2H","QZYNWJQFTJXIRN-UHFFFAOYSA-N"
"Clc(c1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C6H2Cl4/c7-3-1-4(8)6(10)2-5(3)9/h1-2H","JHBKHLUZVFWLAG-UHFFFAOYSA-N"
"OCC(C1)C(C)CCC1","InChI=1S/C8H16O/c1-7-4-2-3-5-8(7)6-9/h7-9H,2-6H2,1H3","NIDINIHOPRFWFJ-UHFFFAOYSA-N"
"OCC(C1)CCCC1","InChI=1S/C7H14O/c8-6-7-4-2-1-3-5-7/h7-8H,1-6H2","VSSAZBXXNIABDN-UHFFFAOYSA-N"
"OC(C1)C(O)C(O)C(O)C(O)1","InChI=1S/C6H12O5/c7-2-1-3(8)5(10)6(11)4(2)9/h2-11H,1H2","IMPKVMRTXBRHRB-UHFFFAOYSA-N"
"CCCCCC(C1)CCC(O)C1","InChI=1S/C11H22O/c1-2-3-4-5-10-6-8-11(12)9-7-10/h10-12H,2-9H2,1H3","VHWGPISIUNUREA-UHFFFAOYSA-N"
"OC(C1)C(O)CC(O)C(O)1","InChI=1S/C6H12O4/c7-3-1-4(8)6(10)2-5(3)9/h3-10H,1-2H2","RDIDGZFQASQXBU-UHFFFAOYSA-N"
"OC(C1)CC(O)C(O)C(O)1","InChI=1S/C6H12O4/c7-3-1-4(8)6(10)5(9)2-3/h3-10H,1-2H2","SNGBOMOBDFAYFR-UHFFFAOYSA-N"
"OC(C1)C(O)C(O)CC1","InChI=1S/C6H12O3/c7-4-2-1-3-5(8)6(4)9/h4-9H,1-3H2","IZSANPWSFUSNMY-UHFFFAOYSA-N"
"OC(C1)CC(O)CC(O)1","InChI=1S/C6H12O3/c7-4-1-5(8)3-6(9)2-4/h4-9H,1-3H2","FSDSKERRNURGGO-UHFFFAOYSA-N"
"[H]C(O)(C1)CCC([H])(O)C1","InChI=1S/C6H12O2/c7-5-1-2-6(8)4-3-5/h5-8H,1-4H2/t5-,6+","VKONPUDBRVKQLM-OLQVQODUSA-N"
"OC(C1)C(O)CCC1","InChI=1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6-/m1/s1","PFURGBBHAOXLIO-PHDIDXHHSA-N"
"[H]C(O)(C1)C([H])(O)CCC1","InChI=1S/C6H12O2/c7-5-3-1-2-4-6(5)8/h5-8H,1-4H2/t5-,6+","PFURGBBHAOXLIO-OLQVQODUSA-N"
"OC(C1)CC(O)CC1","InChI=1S/C6H12O2/c7-5-2-1-3-6(8)4-5/h5-8H,1-4H2","RLMGYIOTPQVQJR-UHFFFAOYSA-N"
"Oc(c1)ccc(O)c1","InChI=1S/C6H6O2/c7-5-1-2-6(8)4-3-5/h1-4,7-8H","QIGBRXMKCJKVMJ-UHFFFAOYSA-N"
"Cc(c1)sc(C(F)(F)F)c1C(F)(F)F","InChI=1S/C7H4F6S/c1-3-2-4(6(8,9)10)5(14-3)7(11,12)13/h2H,1H3","WCVINHVYPRPSFZ-UHFFFAOYSA-N"
"CC(C)(C)C(C2)(C1)C(C(C)(C)C)(C(=O)C(C)(C)2)1","InChI=1S/C16H28O/c1-12(2,3)15-9-14(7,8)11(17)16(15,10-15)13(4,5)6/h9-10H2,1-8H3","BPSOBKPRRBSNAW-UHFFFAOYSA-N"
"CC(C)(C)C(=O)C(C(C(C)(C)C)=1)C(C(C)(C)C)1","InChI=1S/C16H28O/c1-14(2,3)11-10(12(11)15(4,5)6)13(17)16(7,8)9/h10H,1-9H3","SBJOZYNYYAHDOF-UHFFFAOYSA-N"
"CC(C)(C)C(=O)C(C=1)C(C(C)(C)C)1","InChI=1S/C12H20O/c1-11(2,3)9-7-8(9)10(13)12(4,5)6/h7-8H,1-6H3","NQCHIAZTRFTROO-UHFFFAOYSA-N"
"","InChI=1S/C12H20O/c1-11(2,3)9-7-8-10(13)12(4,5)6/h8-9H,1-6H3","KZKKQILWANYRQG-UHFFFAOYSA-N"
"O=C(OCc(c2)cccc2)C(=O)OCc(c1)cccc1","InChI=1S/C16H14O4/c17-15(19-11-13-7-3-1-4-8-13)16(18)20-12-14-9-5-2-6-10-14/h1-10H,11-12H2","ZYZXGWGQYNTGAU-UHFFFAOYSA-N"
"CCOC(=O)NC(CCl)NC(=O)OCC","InChI=1S/C8H15ClN2O4/c1-3-14-7(12)10-6(5-9)11-8(13)15-4-2/h6H,3-5H2,1-2H3,(H,10,12)(H,11,13)","OLRNDYNRSCMVDO-UHFFFAOYSA-N"
"COC(=O)C(C2)=CCc(c(C)1)c(CC(C)=CC2)oc1","InChI=1S/C16H20O3/c1-11-5-4-6-13(16(17)18-3)7-8-14-12(2)10-19-15(14)9-11/h5,7,10H,4,6,8-9H2,1-3H3/b11-5-,13-7-","JTPNVTVKRKPGBJ-ISWNZBHVSA-N"
"COC(=O)C(=C)C(C1)C(C)(C=C)Cc(o2)c(c(C)c2)1","InChI=1S/C16H20O3/c1-6-16(4)8-14-12(10(2)9-19-14)7-13(16)11(3)15(17)18-5/h6,9,13H,1,3,7-8H2,2,4-5H3","CBYBNMGGKHNBFX-UHFFFAOYSA-N"
"COC(=O)C(=C)C(C1)C(C)(C=C)CC(O2)C(=C(C)C(=O)2)1","InChI=1S/C16H20O4/c1-6-16(4)8-13-11(9(2)15(18)20-13)7-12(16)10(3)14(17)19-5/h6,12-13H,1,3,7-8H2,2,4-5H3","ODNZGWQSPYLHGS-UHFFFAOYSA-N"
"C(C(C)41)(C)(CCC4(C(CCCC(C)C)([H])C)[H])C(C2O)=C(C(C3)(C)C(C(C)(C)C(OC(C)=O)C3)([H])C2)CC1","InChI=1S/C32H54O3/c1-20(2)11-10-12-21(3)23-13-18-32(9)28-24(14-17-31(23,32)8)30(7)16-15-27(35-22(4)33)29(5,6)26(30)19-25(28)34/h20-21,23,25-27,34H,10-19H2,1-9H3/t21-,23-,25-,26+,27+,30-,31-,32+/m1/s1","UWOQKGAEHGZLFX-WNCKTOKXSA-N"
"C(C5)C(C(C)(C(C([H])(C)CCCC(C)C)5[H])4)(C)C(C(O3)2C3C4)=CCC([H])(C21C)C(C)(C)C(OC(C)=O)CC1","InChI=1S/C32H52O3/c1-20(2)11-10-12-21(3)23-15-17-29(7)25-14-13-24-28(5,6)26(34-22(4)33)16-18-30(24,8)32(25)27(35-32)19-31(23,29)9/h14,20-21,23-24,26-27H,10-13,15-19H2,1-9H3/t21-,23+,24-,26-,27+,29-,30-,31+,32-/m0/s1","WBVPTPVVVFOMLB-RFVVZGPLSA-N"
"COC(=O)C(=C(C(=O)OC)1)C(F)(C(F)=2)C(F)(F)C(F)(C(F)2)1","InChI=1S/C11H6F6O4/c1-20-7(18)3-4(8(19)21-2)10(15)6(13)5(12)9(3,14)11(10,16)17/h1-2H3","QVUKIUJGFLOLQI-UHFFFAOYSA-N"
"FC(=C(F)1)C(F)(C2)C(F)(F)C(F)(C2)1","InChI=1S/C7H4F6/c8-3-4(9)6(11)2-1-5(3,10)7(6,12)13/h1-2H2","WOQNGFSORPSJFQ-UHFFFAOYSA-N"
"[H]C(=C([H])1)C(F)(C(F)=2)C(F)(F)C(F)1C(F)2","InChI=1S/C7H2F6/c8-3-4(9)6(11)2-1-5(3,10)7(6,12)13/h1-2H","BFEDHPALJLSLEE-UHFFFAOYSA-N"
"C=CC(C1)C(F)(C(F)=2)C(F)(F)C(F)1C(F)2","InChI=1S/C9H6F6/c1-2-4-3-7(12)5(10)6(11)8(4,13)9(7,14)15/h2,4H,1,3H2","JIQFYEPIIGAPMW-UHFFFAOYSA-N"
"COCCCOC","InChI=1S/C5H12O2/c1-6-4-3-5-7-2/h3-5H2,1-2H3","UUAMLBIYJDPGFU-UHFFFAOYSA-N"
"COCCCCOC","InChI=1S/C6H14O2/c1-7-5-3-4-6-8-2/h3-6H2,1-2H3","HMCUNLUHTBHKTB-UHFFFAOYSA-N"
"COCCCCCOC","InChI=1S/C7H16O2/c1-8-6-4-3-5-7-9-2/h3-7H2,1-2H3","NFCBHIFOKVDBCJ-UHFFFAOYSA-N"
"COCCCCCCOC","InChI=1S/C8H18O2/c1-9-7-5-3-4-6-8-10-2/h3-8H2,1-2H3","GZHQUHIMIVEQFV-UHFFFAOYSA-N"
"CCCC(OC)C(CC)COC","InChI=1S/C10H22O2/c1-5-7-10(12-4)9(6-2)8-11-3/h9-10H,5-8H2,1-4H3","PZFVTDFJRNRTJH-UHFFFAOYSA-N"
"COCCC(OC)COC","InChI=1S/C7H16O3/c1-8-5-4-7(10-3)6-9-2/h7H,4-6H2,1-3H3","CWLPBGQUGHLPBK-UHFFFAOYSA-N"
"COCC(OC)COC","InChI=1S/C6H14O3/c1-7-4-6(9-3)5-8-2/h6H,4-5H2,1-3H3","CAYMIAFKNJGSOR-UHFFFAOYSA-N"
"COCC(OC)C(CC)OC","InChI=1S/C8H18O3/c1-5-7(10-3)8(11-4)6-9-2/h7-8H,5-6H2,1-4H3","HURIHJCELQOCMD-UHFFFAOYSA-N"
"CCCC(OC)C(OC)COC","InChI=1S/C9H20O3/c1-5-6-8(11-3)9(12-4)7-10-2/h8-9H,5-7H2,1-4H3","CYRZKNXBEJFRKM-UHFFFAOYSA-N"
"COCC(OC)C(OC)c(c1)cccc1","InChI=1S/C12H18O3/c1-13-9-11(14-2)12(15-3)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1-3H3","RTHWDOKITCVVIH-UHFFFAOYSA-N"
"COCC(OC)C(OC)COC","InChI=1S/C8H18O4/c1-9-5-7(11-3)8(12-4)6-10-2/h7-8H,5-6H2,1-4H3","UOTINMFZLVZNEW-UHFFFAOYSA-N"
"COCC(C)(C)COC","InChI=1S/C7H16O2/c1-7(2,5-8-3)6-9-4/h5-6H2,1-4H3","GZNWHBOGFCHVSF-UHFFFAOYSA-N"
"COCC(C)(COC)COC","InChI=1S/C8H18O3/c1-8(5-9-2,6-10-3)7-11-4/h5-7H2,1-4H3","PTOOVEFBMMTMJP-UHFFFAOYSA-N"
"COCC(C)(COC)COC(C)=O","InChI=1S/C9H18O4/c1-8(10)13-7-9(2,5-11-3)6-12-4/h5-7H2,1-4H3","HIBCUKYWRFTDQF-UHFFFAOYSA-N"
"COCC(C)(CO)COC","InChI=1S/C7H16O3/c1-7(4-8,5-9-2)6-10-3/h8H,4-6H2,1-3H3","GJDPWHURBFNYAV-UHFFFAOYSA-N"
"COCC(C)(CCl)COC","InChI=1S/C7H15ClO2/c1-7(4-8,5-9-2)6-10-3/h4-6H2,1-3H3","IMIQLFOMUCVFRE-UHFFFAOYSA-N"
"COCC(COC)(COC)COC","InChI=1S/C9H20O4/c1-10-5-9(6-11-2,7-12-3)8-13-4/h5-8H2,1-4H3","MBXZBSXAFUVONM-UHFFFAOYSA-N"
"COCC(CO)(COC)COC","InChI=1S/C8H18O4/c1-10-5-8(4-9,6-11-2)7-12-3/h9H,4-7H2,1-3H3","RNDZFNZUJTYGES-UHFFFAOYSA-N"
"COCC(OC)C(OC)Cc(c1)cccc1","InChI=1S/C13H20O3/c1-14-10-13(16-3)12(15-2)9-11-7-5-4-6-8-11/h4-8,12-13H,9-10H2,1-3H3","FHCHDXHCFQCZKI-UHFFFAOYSA-N"
"O=C(N2)NC(=O)C(C)(C(=O)2)c(c1)cccc1","InChI=1S/C11H10N2O3/c1-11(7-5-3-2-4-6-7)8(14)12-10(16)13-9(11)15/h2-6H,1H3,(H2,12,13,14,15,16)","LSAOZCAKUIANSQ-UHFFFAOYSA-N"
"Cl[B](Cl)c(c1)cccc1","InChI=1S/C6H5BCl2/c8-7(9)6-4-2-1-3-5-6/h1-5H","NCQDQONETMHUMY-UHFFFAOYSA-N"
"CCO[B](OCC)OCC","InChI=1S/C6H15BO3/c1-4-8-7(9-5-2)10-6-3/h4-6H2,1-3H3","AJSTXXYNEIHPMD-UHFFFAOYSA-N"
"CCCO[B](OCCC)OCCC","InChI=1S/C9H21BO3/c1-4-7-11-10(12-8-5-2)13-9-6-3/h4-9H2,1-3H3","LTEHWCSSIHAVOQ-UHFFFAOYSA-N"
"CCCCO[B](OCCCC)OCCCC","InChI=1S/C12H27BO3/c1-4-7-10-14-13(15-11-8-5-2)16-12-9-6-3/h4-12H2,1-3H3","LGQXXHMEBUOXRP-UHFFFAOYSA-N"
"CCOC(=O)COC(C)C","InChI=1S/C7H14O3/c1-4-9-7(8)5-10-6(2)3/h6H,4-5H2,1-3H3","JECQALZMHMNOLO-UHFFFAOYSA-N"
"CC(C)OCC(=O)OC(C)C","InChI=1S/C8H16O3/c1-6(2)10-5-8(9)11-7(3)4/h6-7H,5H2,1-4H3","IPIPONKOIUEBFX-UHFFFAOYSA-N"
"CCOCC(=O)OC(C)C","InChI=1S/C7H14O3/c1-4-9-5-7(8)10-6(2)3/h6H,4-5H2,1-3H3","MAIDELXMDKJUOK-UHFFFAOYSA-N"
"CCCC(O)C(=O)OCC","InChI=1S/C7H14O3/c1-3-5-6(8)7(9)10-4-2/h6,8H,3-5H2,1-2H3","MQGTZMCASHTGBJ-UHFFFAOYSA-N"
"FC(F)(F)C(C(F)(F)F)(C(F)(F)1)C(F)(F)C(F)(F)C(F)(F)1","InChI=1S/C7F14/c8-2(9)1(6(16,17)18,7(19,20)21)3(10,11)5(14,15)4(2,12)13","CIWUYWQUYMZILR-UHFFFAOYSA-N"
"CC(Cl)=CCc(c1)cccc1","InChI=1S/C10H11Cl/c1-9(11)7-8-10-5-3-2-4-6-10/h2-7H,8H2,1H3/b9-7+","BMKFTLGOMZXRQC-VQHVLOKHSA-N"
"CC=C(Cl)Cc(c1)cccc1","InChI=1S/C10H11Cl/c1-2-10(11)8-9-6-4-3-5-7-9/h2-7H,8H2,1H3/b10-2-","NKGAPYOBDADCJM-SGAXSIHGSA-N"
"COc(c3)c(OC)c(C(=O)2)c(c3)OC(=C2)c(c(OC)1)c(OC)ccc1","InChI=1S/C19H18O6/c1-21-12-6-5-7-13(22-2)18(12)16-10-11(20)17-14(25-16)8-9-15(23-3)19(17)24-4/h5-10H,1-4H3","PBQMALAAFQMDSP-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C1)=CC(C2)N(C)C(C2)1","InChI=1S/C14H17N/c1-15-13-7-8-14(15)10-12(9-13)11-5-3-2-4-6-11/h2-6,9,13-14H,7-8,10H2,1H3","UXLXGUFVIVPRHL-UHFFFAOYSA-N"
"CCOC","InChI=1S/C3H8O/c1-3-4-2/h3H2,1-2H3","XOBKSJJDNFUZPF-UHFFFAOYSA-N"
"CCCOC","InChI=1S/C4H10O/c1-3-4-5-2/h3-4H2,1-2H3","VNKYTQGIUYNRMY-UHFFFAOYSA-N"
"CCCCOC","InChI=1S/C5H12O/c1-3-4-5-6-2/h3-5H2,1-2H3","CXBDYQVECUFKRK-UHFFFAOYSA-N"
"O=COC=C(C)CCC(=C(C)1)C(C)(C)CCC1","InChI=1S/C15H24O2/c1-12(10-17-11-16)7-8-14-13(2)6-5-9-15(14,3)4/h10-11H,5-9H2,1-4H3/b12-10+","MJURCEOLOMHLAX-ZRDIBKRKSA-N"
"O=CC(C)CCC(=C(C)1)C(C)(C)CCC1","InChI=1S/C14H24O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h10-11H,5-9H2,1-4H3","MXNVWZZDDFIWHW-UHFFFAOYSA-N"
"O=CC(C=O)C=O","InChI=1S/C4H4O3/c5-1-4(2-6)3-7/h1-4H","WRWNFZAKUHZONV-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)NC(=O)c(c1)ccc(Cl)c1","InChI=1S/C13H9Cl2NO/c14-10-3-1-9(2-4-10)13(17)16-12-7-5-11(15)6-8-12/h1-8H,(H,16,17)","WXARQXZZFOCDNR-UHFFFAOYSA-N"
"CCN(CC)OCc(c1)c(c2)c(ccc2)cc1","InChI=1S/C15H19NO/c1-3-16(4-2)17-12-14-10-7-9-13-8-5-6-11-15(13)14/h5-11H,3-4,12H2,1-2H3","PWPXKEMSFNDICZ-UHFFFAOYSA-N"
"CCCCCCON","InChI=1S/C6H15NO/c1-2-3-4-5-6-8-7/h2-7H2,1H3","AIPBDRLFQKUETL-UHFFFAOYSA-N"
"CNOC","InChI=1S/C2H7NO/c1-3-4-2/h3H,1-2H3","KRKPYFLIYNGWTE-UHFFFAOYSA-N"
"NOCc(c1)cccc1","InChI=1S/C7H9NO/c8-9-6-7-4-2-1-3-5-7/h1-5H,6,8H2","XYEOALKITRFCJJ-UHFFFAOYSA-N"
"CCCCCCCCCCON","InChI=1S/C10H23NO/c1-2-3-4-5-6-7-8-9-10-12-11/h2-11H2,1H3","MQNAOOIFODUDES-UHFFFAOYSA-N"
"CCCCCON","InChI=1S/C5H13NO/c1-2-3-4-5-7-6/h2-6H2,1H3","VBPVZDFRUFVPDV-UHFFFAOYSA-N"
"CCOC(=N)c(c1)cccc1","InChI=1S/C9H11NO/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7,10H,2H2,1H3","CQBWPUJYGMSGDU-UHFFFAOYSA-N"
"OCC(O)COc(c1)c(c2)c(ccc2)cc1","InChI=1S/C13H14O3/c14-8-11(15)9-16-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11,14-15H,8-9H2","BYNNMWGWFIGTIC-UHFFFAOYSA-N"
"O=CC=COc(c1)ccc(NC(=O)CC)c1","InChI=1S/C12H13NO3/c1-2-12(15)13-10-4-6-11(7-5-10)16-9-3-8-14/h3-9H,2H2,1H3,(H,13,15)/b9-3+","CCIBQOHCLWDWLC-YCRREMRBSA-N"
"COc(c1)cc(cc(OC)1)C(O)CC(C)C","InChI=1S/C13H20O3/c1-9(2)5-13(14)10-6-11(15-3)8-12(7-10)16-4/h6-9,13-14H,5H2,1-4H3","VPSDZUQXYSKOSD-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CCC(=O)O","InChI=1S/C11H11NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6H2,(H,13,14)","GOLXRNDWAUTYKT-UHFFFAOYSA-N"
"CCC(=N3)Nc(n1)c(c32)c(cc(OC)n2)c(C#N)c(OC)1","InChI=1S/C14H13N5O2/c1-4-9-16-12-11-7(5-10(18-12)20-2)8(6-15)14(21-3)19-13(11)17-9/h5H,4H2,1-3H3,(H,16,17,18,19)","GIOFSPUTCGTLTN-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)c(c1)ccc(Cl)c1","InChI=1S/C12H9ClO/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,14H","ICVFJPSNAUMFCW-UHFFFAOYSA-N"
"CC(=O)C(=O)Nc(c1)c(ccc1)C(N)=O","InChI=1S/C10H10N2O3/c1-6(13)10(15)12-8-5-3-2-4-7(8)9(11)14/h2-5H,1H3,(H2,11,14)(H,12,15)","RRSJLGLCJLRXGJ-UHFFFAOYSA-N"
"NOCc(c3)cc(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C15H13NO/c16-17-10-11-5-8-15-13(9-11)7-6-12-3-1-2-4-14(12)15/h1-9H,10,16H2","YZCZVWNSIVMVPL-UHFFFAOYSA-N"
"NOCc(c1)cc(c2)c(ccc2)c1","InChI=1S/C11H11NO/c12-13-8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7H,8,12H2","GXTAOFNGYSNNEY-UHFFFAOYSA-N"
"NOCCC(C)C","InChI=1S/C5H13NO/c1-5(2)3-4-7-6/h5H,3-4,6H2,1-2H3","PXWPXXJVCQOIPH-UHFFFAOYSA-N"
"NOCC(C)C","InChI=1S/C4H11NO/c1-4(2)3-6-5/h4H,3,5H2,1-2H3","RUMFZCKCISCDMG-UHFFFAOYSA-N"
"COC(=N3)NC(N=C(OC)3)=C(C([H])=2)C(=C([H])C([H])2)c(n1)nc(OC)nc(OC)1","InChI=1S/C15H16N6O4/c1-22-12-16-10(17-13(20-12)23-2)8-6-5-7-9(8)11-18-14(24-3)21-15(19-11)25-4/h5-7H,1-4H3,(H,16,17,20)","SKVANFQHFJNODI-UHFFFAOYSA-N"
"COC(=O)C(C1)=C([H])CC(C1)C(C)CC(=O)C=C(C)C","InChI=1S/C16H24O3/c1-11(2)9-15(17)10-12(3)13-5-7-14(8-6-13)16(18)19-4/h7,9,12-13H,5-6,8,10H2,1-4H3","DEMNMQDWPCIOLA-UHFFFAOYSA-N"
"CN(C)CCC1=CNC2=C1C(=CC=C2)O","InChI=1S/C12H16N2O/c1-14(2)7-6-9-8-13-10-4-3-5-11(15)12(9)10/h3-5,8,13,15H,6-7H2,1-2H3","SPCIYGNTAMCTRO-UHFFFAOYSA-N"
"CCN(CC)C(=O)C([H])(C4)C([H])=C(c31)C([H])(N(C)4)Cc(c([H])2)c(c(ccc3)n(C)2)1","InChI=1S/C21H27N3O/c1-5-24(6-2)21(25)15-10-17-16-8-7-9-18-20(16)14(12-22(18)3)11-19(17)23(4)13-15/h7-10,12,15,19H,5-6,11,13H2,1-4H3/t15-,19-/m1/s1","VQZYKSWQIQANKB-DNVCBOLYSA-N"
"CCN(CC)C(=O)[C@H]1CN([C@@H]2CC3=C(NC4=CC=CC(=C34)C2=C1)Br)C","InChI=1S/C20H24BrN3O/c1-4-24(5-2)20(25)12-9-14-13-7-6-8-16-18(13)15(19(21)22-16)10-17(14)23(3)11-12/h6-9,12,17,22H,4-5,10-11H2,1-3H3/t12-,17-/m1/s1","VKRAXSZEDRWLAG-SJKOYZFVSA-N"
"CCNC(=O)[C@H]1CN([C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1)C","InChI=1S/C18H21N3O/c1-3-19-18(22)12-7-14-13-5-4-6-15-17(13)11(9-20-15)8-16(14)21(2)10-12/h4-7,9,12,16,20H,3,8,10H2,1-2H3,(H,19,22)/t12-,16-/m1/s1","VEBWTGYUIBTVNR-MLGOLLRUSA-N"
"CN(C)CCC1=CNC2=CC=CC=C21","InChI=1S/C12H16N2/c1-14(2)8-7-10-9-13-12-6-4-3-5-11(10)12/h3-6,9,13H,7-8H2,1-2H3","DMULVCHRPCFFGV-UHFFFAOYSA-N"
"CCN(CC)C(=O)C([H])(C4)C([H])=C(c31)C([H])(N(C)4)Cc(c([H])2)c(c(ccc3)n(C(C)=O)2)1","InChI=1S/C22H27N3O2/c1-5-24(6-2)22(27)16-10-18-17-8-7-9-19-21(17)15(13-25(19)14(3)26)11-20(18)23(4)12-16/h7-10,13,16,20H,5-6,11-12H2,1-4H3/t16-,20-/m1/s1","FJOWXGYLIWJFCH-OXQOHEQNSA-N"
"CC(=O)c(c1)ccc(F)c1","InChI=1S/C8H7FO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3","ZDPAWHACYDRYIW-UHFFFAOYSA-N"
"CCC(=O)c(c1)ccc(F)c1","InChI=1S/C9H9FO/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3","QIJNVLLXIIPXQT-UHFFFAOYSA-N"
"FCCCC(=O)c(c1)cccc1","InChI=1S/C10H11FO/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2","RKNNOFFPYRLSNO-UHFFFAOYSA-N"
"ClCCCC(=O)c(c1)cccc1","InChI=1S/C10H11ClO/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2","GHEFQKHLHFXSBR-UHFFFAOYSA-N"
"CCC(=O)c(c1)ccc(Br)c1","InChI=1S/C9H9BrO/c1-2-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3","UOMOSYFPKGQIKI-UHFFFAOYSA-N"
"BrCCCC(=O)c(c1)cccc1","InChI=1S/C10H11BrO/c11-8-4-7-10(12)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2","AUWYVCBOBIRRGR-UHFFFAOYSA-N"
"CO[C@H]1[C@@H](C[C@@H]2CN3CCC4=C([C@H]3C[C@@H]2[C@@H]1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC","InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1","QEVHRUUCFGRFIF-MDEJGZGSSA-N"
"CCCCOC(=O)c(c1)c(c2)c(ccc2)nc(OCCCC)1","InChI=1S/C18H23NO3/c1-3-5-11-21-17-13-15(18(20)22-12-6-4-2)14-9-7-8-10-16(14)19-17/h7-10,13H,3-6,11-12H2,1-2H3","ZPIBVASLHDCEHZ-UHFFFAOYSA-N"
"Clc(n1)cc(C(=O)O[Si](C)(C)C)c(c2)c(ccc2)1","InChI=1S/C13H14ClNO2Si/c1-18(2,3)17-13(16)10-8-12(14)15-11-7-5-4-6-9(10)11/h4-8H,1-3H3","MORQHBTVDFFDEI-UHFFFAOYSA-N"
"CCNCCNC(=O)c(c1)c(c3)c(ccc3)nc(OCC(O2)C(C)O[B](CCCC)2)1","InChI=1S/C22H32BN3O4/c1-4-6-11-23-29-16(3)20(30-23)15-28-21-14-18(22(27)25-13-12-24-5-2)17-9-7-8-10-19(17)26-21/h7-10,14,16,20,24H,4-6,11-13,15H2,1-3H3,(H,25,27)","GHZZZVNLNBHYSZ-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(ncc1)O[Si](C)(C)C","InChI=1S/C12H21NO3Si2/c1-17(2,3)15-11-10(8-7-9-13-11)12(14)16-18(4,5)6/h7-9H,1-6H3","IQHYPUXARVMFPP-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(NC(C)=O)c1","InChI=1S/C11H13NO3/c1-3-15-11(14)9-4-6-10(7-5-9)12-8(2)13/h4-7H,3H2,1-2H3,(H,12,13)","NHLOBHNRBWKNIO-UHFFFAOYSA-N"
"ClCCCN(C1)CCOC1","InChI=1S/C7H14ClNO/c8-2-1-3-9-4-6-10-7-5-9/h1-7H2","PIAZYBLGBSMNLX-UHFFFAOYSA-N"
"Fc(c(F)3)c(F)c(F)c(c(F)3)P(=S)(c(c(F)2)c(F)c(F)c(F)c(F)2)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C18F15PS/c19-1-4(22)10(28)16(11(29)5(1)23)34(35,17-12(30)6(24)2(20)7(25)13(17)31)18-14(32)8(26)3(21)9(27)15(18)33","ZKXAGCHSURXSAS-UHFFFAOYSA-N"
"Fc(c(F)3)c(F)c(F)c(c(F)3)P(=O)(c(c(F)2)c(F)c(F)c(F)c(F)2)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C18F15OP/c19-1-4(22)10(28)16(11(29)5(1)23)35(34,17-12(30)6(24)2(20)7(25)13(17)31)18-14(32)8(26)3(21)9(27)15(18)33","VDVWCGGZSOUZCE-UHFFFAOYSA-N"
"Fc(c(F)3)c(F)c(F)c(c(F)3)P(Cl)(Cl)(c(c(F)2)c(F)c(F)c(F)c(F)2)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C18Cl2F15P/c19-36(20,16-10(30)4(24)1(21)5(25)11(16)31,17-12(32)6(26)2(22)7(27)13(17)33)18-14(34)8(28)3(23)9(29)15(18)35","XJPPVPFQBRXUCW-UHFFFAOYSA-N"
"Fc(c(F)1)c(F)c(F)c(c(F)1)[Si](C)(C)C","InChI=1S/C9H9F5Si/c1-15(2,3)9-7(13)5(11)4(10)6(12)8(9)14/h1-3H3","GABHTFORECKGBB-UHFFFAOYSA-N"
"C[Si](C)(C)c(c(Cl)1)c(Cl)c(Cl)c(Cl)c(Cl)1","InChI=1S/C9H9Cl5Si/c1-15(2,3)9-7(13)5(11)4(10)6(12)8(9)14/h1-3H3","FMGLKJDUWUUBBK-UHFFFAOYSA-N"
"C=CCC(C(=O)2)(C(=O)NC(=O)N2)c(c1)cccc1","InChI=1S/C13H12N2O3/c1-2-8-13(9-6-4-3-5-7-9)10(16)14-12(18)15-11(13)17/h2-7H,1,8H2,(H2,14,15,16,17,18)","WOIGZSBYKGQJGL-UHFFFAOYSA-N"
"OCC(O)COc(c1)c(C)ccc1","InChI=1S/C10H14O3/c1-8-4-2-3-5-10(8)13-7-9(12)6-11/h2-5,9,11-12H,6-7H2,1H3","JWDYCNIAQWPBHD-UHFFFAOYSA-N"
"CN(C4)CC(C4)CN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C18H20N2S/c1-19-11-10-14(12-19)13-20-15-6-2-4-8-17(15)21-18-9-5-3-7-16(18)20/h2-9,14H,10-13H2,1H3","HTMIBDQKFHUPSX-UHFFFAOYSA-N"
"CSc(c4)cc(c(c4)1)N(CCC(C3)N(C)CCC3)c(c2)c(ccc2)S1","InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3","KLBQZWRITKRQQV-UHFFFAOYSA-N"
"CCC(N1)(c(c2)cccc2)C(=O)N(C)C(=O)1","InChI=1S/C12H14N2O2/c1-3-12(9-7-5-4-6-8-9)10(15)14(2)11(16)13-12/h4-8H,3H2,1-2H3,(H,13,16)","GMHKMTDVRCWUDX-UHFFFAOYSA-N"
"CC(=O)NC(=C(C)1)C(=O)N(c(c2)cccc2)N(C)1","InChI=1S/C13H15N3O2/c1-9-12(14-10(2)17)13(18)16(15(9)3)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,17)","OIAGWXKSCXPNNZ-UHFFFAOYSA-N"
"CCC(CC)(C(=O)1)C(=O)C(C)CN1","InChI=1S/C10H17NO2/c1-4-10(5-2)8(12)7(3)6-11-9(10)13/h7H,4-6H2,1-3H3,(H,11,13)","SIDLZWOQUZRBRU-UHFFFAOYSA-N"
"CC(O)CC(C)C(CC)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C11H18N2O4/c1-4-11(6(2)5-7(3)14)8(15)12-10(17)13-9(11)16/h6-7,14H,4-5H2,1-3H3,(H2,12,13,15,16,17)","XYOPMDJVSWQZTM-UHFFFAOYSA-N"
"O=C(C1)N(C)C(=O)C1c(c2)cccc2","InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3","WLWFNJKHKGIJNW-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(cc(OC(C)=O)c(Cl)3)Sc(cccc2)1","InChI=1S/C19H21ClN2O2S/c1-13(23)24-17-12-19-16(11-14(17)20)22(10-6-9-21(2)3)15-7-4-5-8-18(15)25-19/h4-5,7-8,11-12H,6,9-10H2,1-3H3","AUESYCHQJPBGKQ-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc(OC(C)=O)3)Sc(ccc(Cl)c2)1","InChI=1S/C19H21ClN2O2S/c1-13(23)24-15-6-8-19-17(12-15)22(10-4-9-21(2)3)16-11-14(20)5-7-18(16)25-19/h5-8,11-12H,4,9-10H2,1-3H3","TZMZNKUSKYOABO-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(cc(O)c(Cl)3)Sc(cccc2)1","InChI=1S/C17H19ClN2OS/c1-19(2)8-5-9-20-13-6-3-4-7-16(13)22-17-11-15(21)12(18)10-14(17)20/h3-4,6-7,10-11,21H,5,8-9H2,1-2H3","SOUCXKDIHOVGPW-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(ccc(O)c2)1","InChI=1S/C17H19ClN2OS/c1-19(2)8-3-9-20-14-10-12(18)4-6-16(14)22-17-7-5-13(21)11-15(17)20/h4-7,10-11,21H,3,8-9H2,1-2H3","UBUDVAYGFVRZCO-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C17H20N2S/c1-18(2)12-7-13-19-14-8-3-5-10-16(14)20-17-11-6-4-9-15(17)19/h3-6,8-11H,7,12-13H2,1-2H3","ZGUGWUXLJSTTMA-UHFFFAOYSA-N"
"CCC(=O)c(c3)cc(c(c3)1)N(CC(C)N(C)C)c(c2)c(ccc2)S1","InChI=1S/C20H24N2OS/c1-5-18(23)15-10-11-20-17(12-15)22(13-14(2)21(3)4)16-8-6-7-9-19(16)24-20/h6-12,14H,5,13H2,1-4H3","UVOIBTBFPOZKGP-UHFFFAOYSA-N"
"c(c3)ccc(c3)CN(CC(N2)=NCC2)c(c1)cccc1","InChI=1S/C17H19N3/c1-3-7-15(8-4-1)13-20(14-17-18-11-12-19-17)16-9-5-2-6-10-16/h1-10H,11-14H2,(H,18,19)","REYFJDPCWQRWAA-UHFFFAOYSA-N"
"CC(=O)OCCCc(c1)cccc1","InChI=1S/C11H14O2/c1-10(12)13-9-5-8-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3","JRJGKUTZNBZHNK-UHFFFAOYSA-N"
"CCC(=O)OC(Cc(c2)cccc2)(c(c1)cccc1)C([H])(C)CN(C)C","InChI=1S/C22H29NO2/c1-5-21(24)25-22(18(2)17-23(3)4,20-14-10-7-11-15-20)16-19-12-8-6-9-13-19/h6-15,18H,5,16-17H2,1-4H3/t18-,22+/m1/s1","XLMALTXPSGQGBX-GCJKJVERSA-N"
"[H]C(=C(C)1)C(=O)N(c(c2)cccc2)N(C)1","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3","VEQOALNAAJBPNY-UHFFFAOYSA-N"
"CN(C)CCN(Cc(c2)ccc(OC)c2)c(n1)nccc1","InChI=1S/C16H22N4O/c1-19(2)11-12-20(16-17-9-4-10-18-16)13-14-5-7-15(21-3)8-6-14/h4-10H,11-13H2,1-3H3","GULNIHOSWFYMRN-UHFFFAOYSA-N"
"CCOC(=O)C(C2)(CCN(CCc(c3)ccc(N)c3)C2)c(c1)cccc1","InChI=1S/C22H28N2O2/c1-2-26-21(25)22(19-6-4-3-5-7-19)13-16-24(17-14-22)15-12-18-8-10-20(23)11-9-18/h3-11H,2,12-17,23H2,1H3","LKYQLAWMNBFNJT-UHFFFAOYSA-N"
"CCN(CC)C(C)CN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C19H24N2S/c1-4-20(5-2)15(3)14-21-16-10-6-8-12-18(16)22-19-13-9-7-11-17(19)21/h6-13,15H,4-5,14H2,1-3H3","CDOZDBSBBXSXLB-UHFFFAOYSA-N"
"NNCCc(c1)cccc1","InChI=1S/C8H12N2/c9-10-7-6-8-4-2-1-3-5-8/h1-5,10H,6-7,9H2","RMUCZJUITONUFY-UHFFFAOYSA-N"
"Clc(c4)ccc(c4)Cn(c(CN(C3)CCC3)1)c(c2)c(ccc2)n1","InChI=1S/C19H20ClN3/c20-16-9-7-15(8-10-16)13-23-18-6-2-1-5-17(18)21-19(23)14-22-11-3-4-12-22/h1-2,5-10H,3-4,11-14H2","CJXAEXPPLWQRFR-UHFFFAOYSA-N"
"Clc(c1)ccc(c1)C(C)(O)C(C)(C)O","InChI=1S/C11H15ClO2/c1-10(2,13)11(3,14)8-4-6-9(12)7-5-8/h4-7,13-14H,1-3H3","HTYIXCKSEQQCJO-UHFFFAOYSA-N"
"CC(N2)C(OCC2)c(c1)cccc1","InChI=1S/C11H15NO/c1-9-11(13-8-7-12-9)10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3","OOBHFESNSZDWIU-UHFFFAOYSA-N"
"Clc(c3)ccc(c3)CC(=CCN(C2)CCC2)c(c1)cccc1","InChI=1S/C20H22ClN/c21-20-10-8-17(9-11-20)16-19(18-6-2-1-3-7-18)12-15-22-13-4-5-14-22/h1-3,6-12H,4-5,13-16H2/b19-12-","WDYYVNNRTDZKAZ-UNOMPAQXSA-N"
"Cc(o2)cc(n2)C(=O)NNCc(c1)cccc1","InChI=1S/C12H13N3O2/c1-9-7-11(15-17-9)12(16)14-13-8-10-5-3-2-4-6-10/h2-7,13H,8H2,1H3,(H,14,16)","XKFPYPQQHFEXRZ-UHFFFAOYSA-N"
"CN(C)CCC=C(c21)c(c3)c(ccc3)CCc(cccc2)1","InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3","KRMDCWKBEZIMAB-UHFFFAOYSA-N"
"CNCCCN(c21)c(c3)c(ccc3)CCc(cccc2)1","InChI=1S/C18H22N2/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20/h2-5,7-10,19H,6,11-14H2,1H3","HCYAFALTSJYZDH-UHFFFAOYSA-N"
"N(C3)CCC(C3)C(O)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C18H21NO/c20-18(15-7-3-1-4-8-15,16-9-5-2-6-10-16)17-11-13-19-14-12-17/h1-10,17,19-20H,11-14H2","ZMISODWVFHHWNR-UHFFFAOYSA-N"
"CC(=O)OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C23H28ClN3O2S/c1-18(28)29-16-15-26-13-11-25(12-14-26)9-4-10-27-20-5-2-3-6-22(20)30-23-8-7-19(24)17-21(23)27/h2-3,5-8,17H,4,9-16H2,1H3","AIUHRQHVWSUTGJ-UHFFFAOYSA-N"
"CNCCC=C(c21)c(c3)c(ccc3)CCc(cccc2)1","InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-11,20H,6,12-14H2,1H3","PHVGLTMQBUFIQQ-UHFFFAOYSA-N"
"OC(CNc(c2)nccc2)c(c1)cccc1","InChI=1S/C13H14N2O/c16-12(11-6-2-1-3-7-11)10-15-13-8-4-5-9-14-13/h1-9,12,16H,10H2,(H,14,15)","ZEAJXCPGHPJVNP-UHFFFAOYSA-N"
"CN(C)CCOc(c2)c(ccc2)Cc(c1)cccc1","InChI=1S/C17H21NO/c1-18(2)12-13-19-17-11-7-6-10-16(17)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3","IZRPKIZLIFYYKR-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(c(c3)cccc3)OC([H])(C1)CC([H])(C2)N(C)C([H])(C2)1","InChI=1S/C21H25NO/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18-21H,12-15H2,1H3/t18-,19+,20-","GIJXKZJWITVLHI-ACDBMABISA-N"
"CCC(C(C)C)(C(=O)1)C(=O)NC(=O)N1","InChI=1S/C9H14N2O3/c1-4-9(5(2)3)6(12)10-8(14)11-7(9)13/h5H,4H2,1-3H3,(H2,10,11,12,13,14)","HHLXJTDUHFBYAU-UHFFFAOYSA-N"
"CN(C)CCN(Cc(c2)scc2)c(c1)nccc1","InChI=1S/C14H19N3S/c1-16(2)9-10-17(12-13-6-5-11-18-13)14-7-3-4-8-15-14/h3-8,11H,9-10,12H2,1-2H3","HNJJXZKZRAWDPF-UHFFFAOYSA-N"
"CN(C)CCN(Cc(c2)sc(Cl)c2)c(c1)nccc1","InChI=1S/C14H18ClN3S/c1-17(2)9-10-18(14-5-3-4-8-16-14)11-12-6-7-13(15)19-12/h3-8H,9-11H2,1-2H3","XAEXSWVTEJHRMH-UHFFFAOYSA-N"
"CCOC(=O)C(C2)(CCN(C)CC2)c(c1)cccc1","InChI=1S/C16H23NO2/c1-3-19-15(18)16(14-8-5-4-6-9-14)10-7-12-17(2)13-11-16/h4-6,8-9H,3,7,10-13H2,1-2H3","WGJHHMKQBWSQIY-UHFFFAOYSA-N"
"CCC(C)(CC)OC(N)=O","InChI=1S/C7H15NO2/c1-4-7(3,5-2)10-6(8)9/h4-5H2,1-3H3,(H2,8,9)","SLWGJZPKHAXZQL-UHFFFAOYSA-N"
"CCC(C)C(C)(COC(N)=O)COC(N)=O","InChI=1S/C10H20N2O4/c1-4-7(2)10(3,5-15-8(11)13)6-16-9(12)14/h7H,4-6H2,1-3H3,(H2,11,13)(H2,12,14)","LEROTMJVBFSIMP-UHFFFAOYSA-N"
"CCCC(C)(COC(N)=O)COC(N)=O","InChI=1S/C9H18N2O4/c1-3-4-9(2,5-14-7(10)12)6-15-8(11)13/h3-6H2,1-2H3,(H2,10,12)(H2,11,13)","NPPQSCRMBWNHMW-UHFFFAOYSA-N"
"CN1C2=C(C(=O)N(C1=O)C)NC(=N2)Cl.CN(C)CCOC(C1=CC=CC=C1)C2=CC=CC=C2","InChI=1S/C17H21NO.C7H7ClN4O2/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16;1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h3-12,17H,13-14H2,1-2H3;1-2H3,(H,9,10)","NFLLKCVHYJRNRH-UHFFFAOYSA-N"
"CCOC(=O)c(c2)c(ccc2)OC(=O)Oc(c1)c(ccc1)C(=O)OCC","InChI=1S/C19H18O7/c1-3-23-17(20)13-9-5-7-11-15(13)25-19(22)26-16-12-8-6-10-14(16)18(21)24-4-2/h5-12H,3-4H2,1-2H3","QWWLHNFYJSCNGD-UHFFFAOYSA-N"
"CCCC(C)(COC(N)=O)COC(=O)NC(C)C","InChI=1S/C12H24N2O4/c1-5-6-12(4,7-17-10(13)15)8-18-11(16)14-9(2)3/h9H,5-8H2,1-4H3,(H2,13,15)(H,14,16)","OFZCIYFFPZCNJE-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc3)CCc(cccc2)1","InChI=1S/C19H24N2/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21/h3-6,8-11H,7,12-15H2,1-2H3","BCGWQEUPMDMJNV-UHFFFAOYSA-N"
"CCN(C(=O)2)C(=O)C(N2)c(c1)cccc1","InChI=1S/C11H12N2O2/c1-2-13-10(14)9(12-11(13)15)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,12,15)","SZQIFWWUIBRPBZ-UHFFFAOYSA-N"
"Fc(c(F)2)c(F)c(F)c(c(F)2)P(Cl)(Cl)(Cl)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C12Cl3F10P/c13-26(14,15,11-7(22)3(18)1(16)4(19)8(11)23)12-9(24)5(20)2(17)6(21)10(12)25","MHJWEVPELOAYIK-UHFFFAOYSA-N"
"ON=C(C1)CCC1","InChI=1S/C5H9NO/c7-6-5-3-1-2-4-5/h7H,1-4H2","YGNXYFLJZILPEK-UHFFFAOYSA-N"
"CN(C1)C(=O)CCCC1","InChI=1S/C7H13NO/c1-8-6-4-2-3-5-7(8)9/h2-6H2,1H3","ZWXPDGCFMMFNRW-UHFFFAOYSA-N"
"O=C(C1)NCCCC1","InChI=1S/C6H11NO/c8-6-4-2-1-3-5-7-6/h1-5H2,(H,7,8)","JBKVHLHDHHXQEQ-UHFFFAOYSA-N"
"ON=C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C13H11NO/c15-14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,15H","DNYZBFWKVMKMRM-UHFFFAOYSA-N"
"NC(C2)CCC(C2)CC(C1)CCC(N)C1","InChI=1S/C13H26N2/c14-12-5-1-10(2-6-12)9-11-3-7-13(15)8-4-11/h10-13H,1-9,14-15H2","DZIHTWJGPDVSGE-UHFFFAOYSA-N"
"OCCOCCO","InChI=1S/C4H10O3/c5-1-3-7-4-2-6/h5-6H,1-4H2","MTHSVFCYNBDYFN-UHFFFAOYSA-N"
"OCCOCCOCCO","InChI=1S/C6H14O4/c7-1-3-9-5-6-10-4-2-8/h7-8H,1-6H2","ZIBGPFATKBEMQZ-UHFFFAOYSA-N"
"OC(=O)C(O)=O","InChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)","MUBZPKHOEPUJKR-UHFFFAOYSA-N"
"OC(=O)CC(O)=O","InChI=1S/C3H4O4/c4-2(5)1-3(6)7/h1H2,(H,4,5)(H,6,7)","OFOBLEOULBTSOW-UHFFFAOYSA-N"
"OC(=O)CCC(O)=O","InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)","KDYFGRWQOYBRFD-UHFFFAOYSA-N"
"OC(=O)CCCC(O)=O","InChI=1S/C5H8O4/c6-4(7)2-1-3-5(8)9/h1-3H2,(H,6,7)(H,8,9)","JFCQEDHGNNZCLN-UHFFFAOYSA-N"
"OC(=O)CCCCC(O)=O","InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)","WNLRTRBMVRJNCN-UHFFFAOYSA-N"
"OC(=O)CCCCCC(O)=O","InChI=1S/C7H12O4/c8-6(9)4-2-1-3-5-7(10)11/h1-5H2,(H,8,9)(H,10,11)","WLJVNTCWHIRURA-UHFFFAOYSA-N"
"COC","InChI=1S/C2H6O/c1-3-2/h1-2H3","LCGLNKUTAGEVQW-UHFFFAOYSA-N"
"CCOCC","InChI=1S/C4H10O/c1-3-5-4-2/h3-4H2,1-2H3","RTZKZFJDLAIYFH-UHFFFAOYSA-N"
"COCC(C)C","InChI=1S/C5H12O/c1-5(2)4-6-3/h5H,4H2,1-3H3","ZYVYEJXMYBUCMN-UHFFFAOYSA-N"
"CCC(C)OC","InChI=1S/C5H12O/c1-4-5(2)6-3/h5H,4H2,1-3H3","FVNIMHIOIXPIQT-UHFFFAOYSA-N"
"COC(C)(C)C","InChI=1S/C5H12O/c1-5(2,3)6-4/h1-4H3","BZLVMXJERCGZMT-UHFFFAOYSA-N"
"CCCCCOC","InChI=1S/C6H14O/c1-3-4-5-6-7-2/h3-6H2,1-2H3","DBUJFULDVAZULB-UHFFFAOYSA-N"
"COCCC(C)C","InChI=1S/C6H14O/c1-6(2)4-5-7-3/h6H,4-5H2,1-3H3","ZQAYBCWERYRAMF-UHFFFAOYSA-N"
"CCCCOCC","InChI=1S/C6H14O/c1-3-5-6-7-4-2/h3-6H2,1-2H3","PZHIWRCQKBBTOW-UHFFFAOYSA-N"
"CCOCC(C)C","InChI=1S/C6H14O/c1-4-7-5-6(2)3/h6H,4-5H2,1-3H3","RQUBQBFVDOLUKC-UHFFFAOYSA-N"
"CCOC(C)CC","InChI=1S/C6H14O/c1-4-6(3)7-5-2/h6H,4-5H2,1-3H3","VSCUCHUDCLERMY-UHFFFAOYSA-N"
"CCOC(C)(C)C","InChI=1S/C6H14O/c1-5-7-6(2,3)4/h5H2,1-4H3","NUMQCACRALPSHD-UHFFFAOYSA-N"
"CCCCOCCC","InChI=1S/C7H16O/c1-3-5-7-8-6-4-2/h3-7H2,1-2H3","YGZQJYIITOMTMD-UHFFFAOYSA-N"
"CCC(C)OC(C)CC","InChI=1S/C8H18O/c1-5-7(3)9-8(4)6-2/h7-8H,5-6H2,1-4H3","HHBZZTKMMLDNDN-UHFFFAOYSA-N"
"CC(C)COC(C)(C)C","InChI=1S/C8H18O/c1-7(2)6-9-8(3,4)5/h7H,6H2,1-5H3","UPOMCDPCTBJJDA-UHFFFAOYSA-N"
"CCCCOCCC(C)C","InChI=1S/C9H20O/c1-4-5-7-10-8-6-9(2)3/h9H,4-8H2,1-3H3","NMLLTHLOSVNFMY-UHFFFAOYSA-N"
"CCCCCCCCCOC","InChI=1S/C10H22O/c1-3-4-5-6-7-8-9-10-11-2/h3-10H2,1-2H3","BRIKTKRHROTQFO-UHFFFAOYSA-N"
"CCCCCOCCCCC","InChI=1S/C10H22O/c1-3-5-7-9-11-10-8-6-4-2/h3-10H2,1-2H3","AOPDRZXCEAKHHW-UHFFFAOYSA-N"
"CCOC(C)C","InChI=1S/C5H12O/c1-4-6-5(2)3/h5H,4H2,1-3H3","XSJVWZAETSBXKU-UHFFFAOYSA-N"
"COC(C)C","InChI=1S/C4H10O/c1-4(2)5-3/h4H,1-3H3","RMGHERXMTMUMMV-UHFFFAOYSA-N"
"Cc(c1)nccc1","InChI=1S/C6H7N/c1-6-4-2-3-5-7-6/h2-5H,1H3","BSKHPKMHTQYZBB-UHFFFAOYSA-N"
"Cc(c1)ccnc1","InChI=1S/C6H7N/c1-6-2-4-7-5-3-6/h2-5H,1H3","FKNQCJSGGFJEIZ-UHFFFAOYSA-N"
"Cc(c1)cc(C)nc1","InChI=1S/C7H9N/c1-6-3-4-8-7(2)5-6/h3-5H,1-2H3","JYYNAJVZFGKDEQ-UHFFFAOYSA-N"
"Cc(c1)cnc(C)c1","InChI=1S/C7H9N/c1-6-3-4-7(2)8-5-6/h3-5H,1-2H3","XWKFPIODWVPXLX-UHFFFAOYSA-N"
"Cc(c1)nc(C)cc1","InChI=1S/C7H9N/c1-6-4-3-5-7(2)8-6/h3-5H,1-2H3","OISVCGZHLKNMSJ-UHFFFAOYSA-N"
"Cc(c1)c(C)cnc1","InChI=1S/C7H9N/c1-6-3-4-8-5-7(6)2/h3-5H,1-2H3","NURQLCJSMXZBPC-UHFFFAOYSA-N"
"CCc(c1)nccc1","InChI=1S/C7H9N/c1-2-7-5-3-4-6-8-7/h3-6H,2H2,1H3","NRGGMCIBEHEAIL-UHFFFAOYSA-N"
"CCc(c1)cncc1","InChI=1S/C7H9N/c1-2-7-4-3-5-8-6-7/h3-6H,2H2,1H3","MFEIKQPHQINPRI-UHFFFAOYSA-N"
"CCc(c1)ccnc1","InChI=1S/C7H9N/c1-2-7-3-5-8-6-4-7/h3-6H,2H2,1H3","VJXRKZJMGVSXPX-UHFFFAOYSA-N"
"Cc(c1)c(C)ncc1","InChI=1S/C7H9N/c1-6-4-3-5-8-7(6)2/h3-5H,1-2H3","HPYNZHMRTTWQTB-UHFFFAOYSA-N"
"Cc(c1)cc(C)cn1","InChI=1S/C7H9N/c1-6-3-7(2)5-8-4-6/h3-5H,1-2H3","HWWYDZCSSYKIAD-UHFFFAOYSA-N"
"CCCc(c1)nccc1","InChI=1S/C8H11N/c1-2-5-8-6-3-4-7-9-8/h3-4,6-7H,2,5H2,1H3","OIALIKXMLIAOSN-UHFFFAOYSA-N"
"CC(C)c(c1)ccnc1","InChI=1S/C8H11N/c1-7(2)8-3-5-9-6-4-8/h3-7H,1-2H3","FRGXNJWEDDQLFH-UHFFFAOYSA-N"
"CCc(c1)cnc(C)c1","InChI=1S/C8H11N/c1-3-8-5-4-7(2)9-6-8/h4-6H,3H2,1-2H3","NTSLROIKFLNUIJ-UHFFFAOYSA-N"
"CCc(c1)nc(C)cc1","InChI=1S/C8H11N/c1-3-8-6-4-5-7(2)9-8/h4-6H,3H2,1-2H3","SFSXNVBMAODLGN-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(C)n1","InChI=1S/C8H11N/c1-6-4-7(2)8(3)9-5-6/h4-5H,1-3H3","GFYHSKONPJXCDE-UHFFFAOYSA-N"
"Cc(c1)nc(C)c(C)c1","InChI=1S/C8H11N/c1-6-4-5-7(2)9-8(6)3/h4-5H,1-3H3","UTBIMNXEDGNJFE-UHFFFAOYSA-N"
"Cc(c1)cc(C)nc(C)1","InChI=1S/C8H11N/c1-6-4-7(2)9-8(3)5-6/h4-5H,1-3H3","BWZVCCNYKMEVEX-UHFFFAOYSA-N"
"CCCCc(c1)nccc1","InChI=1S/C9H13N/c1-2-3-6-9-7-4-5-8-10-9/h4-5,7-8H,2-3,6H2,1H3","ADSOSINJPNKUJK-UHFFFAOYSA-N"
"CCC(C)c(c1)nccc1","InChI=1S/C9H13N/c1-3-8(2)9-6-4-5-7-10-9/h4-8H,3H2,1-2H3","YRVJJJKVAKFOJV-UHFFFAOYSA-N"
"CCc(c1)c(C)nc(C)c1","InChI=1S/C9H13N/c1-4-9-6-5-7(2)10-8(9)3/h5-6H,4H2,1-3H3","VSLXJOHTVOZTNF-UHFFFAOYSA-N"
"CCc(c1)nc(C)cc(C)1","InChI=1S/C9H13N/c1-4-9-6-7(2)5-8(3)10-9/h5-6H,4H2,1-3H3","ODLZIUFTNFTGIN-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)CC(CC(=O)O[Si](C)(C)C)(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C18H40O7Si4/c1-26(2,3)22-15(19)13-18(25-29(10,11)12,17(21)24-28(7,8)9)14-16(20)23-27(4,5)6/h13-14H2,1-12H3","VFGAVMGYDWDESE-UHFFFAOYSA-N"
"CCCC(O1)C(CC)(C(N)=O)1","InChI=1S/C8H15NO2/c1-3-5-6-8(4-2,11-6)7(9)10/h6H,3-5H2,1-2H3,(H2,9,10)","WBLPIVIXQOFTPQ-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)Oc(c1)nccc1","InChI=1S/C12H11NO/c1-10-5-7-11(8-6-10)14-12-4-2-3-9-13-12/h2-9H,1H3","VTFYAGUKTYQNPT-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC","InChI=1S/C20H40O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h3-19H2,1-2H3","MVLVMROFTAUDAG-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OCC","InChI=1S/C18H36O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h3-17H2,1-2H3","XIRNKXNNONJFQO-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=O)c(c1)cc(cc1)C(C)C(=O)O[Si](C)(C)C","InChI=1S/C19H22O3Si/c1-14(19(21)22-23(2,3)4)16-11-8-12-17(13-16)18(20)15-9-6-5-7-10-15/h5-14H,1-4H3","QLYRBMOIASOCGV-UHFFFAOYSA-N"
"CCC(C(=O)O[Si](C)(C)C)c(c2)cc(cc2)C(=O)c(c1)cccc1","InChI=1S/C20H24O3Si/c1-5-18(20(22)23-24(2,3)4)16-12-9-13-17(14-16)19(21)15-10-7-6-8-11-15/h6-14,18H,5H2,1-4H3","JQIFIOTUXJLGDG-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)C(C)c(c2)cc(cc2)C(=O)c(c1)cc(cc1)O[Si](C)(C)C","InChI=1S/C22H30O4Si2/c1-16(22(24)26-28(5,6)7)17-10-8-11-18(14-17)21(23)19-12-9-13-20(15-19)25-27(2,3)4/h8-16H,1-7H3","CWGGLWSMNLIFJI-UHFFFAOYSA-N"
"O(C)C(=O)C(C6)(C1(C(C)C(C)C6)[H])CCC(C(C)52)(C(=CCC2(C(C(CC5)([H])3)(CC(C(O4)([H])C3(COC4(C)C)C)([H])O)C)[H])1)C","InChI=1S/C34H54O5/c1-20-12-15-34(28(36)37-9)17-16-32(7)22(26(34)21(20)2)10-11-25-30(5)18-23(35)27-31(6,19-38-29(3,4)39-27)24(30)13-14-33(25,32)8/h10,20-21,23-27,35H,11-19H2,1-9H3/t20-,21+,23-,24-,25-,26+,27+,30+,31+,32-,33-,34+/m1/s1","VAIJHUIHWZDTEZ-TWXGOCSMSA-N"
"COCCC(C)OC","InChI=1S/C6H14O2/c1-6(8-3)4-5-7-2/h6H,4-5H2,1-3H3","JCRQEORWPZVZJP-UHFFFAOYSA-N"
"CCc(c1)cc(C)nc(C)1","InChI=1S/C9H13N/c1-4-9-5-7(2)10-8(3)6-9/h5-6H,4H2,1-3H3","YFCLFEIWFHJNFU-UHFFFAOYSA-N"
"CCCCCc(c1)nccc1","InChI=1S/C10H15N/c1-2-3-4-7-10-8-5-6-9-11-10/h5-6,8-9H,2-4,7H2,1H3","HSDXVAOHEOSTFZ-UHFFFAOYSA-N"
"CCCCCc(c1)ccnc1","InChI=1S/C10H15N/c1-2-3-4-5-10-6-8-11-9-7-10/h6-9H,2-5H2,1H3","ABJVUPUJUGBUMM-UHFFFAOYSA-N"
"CCCCCCc(c1)nccc1","InChI=1S/C11H17N/c1-2-3-4-5-8-11-9-6-7-10-12-11/h6-7,9-10H,2-5,8H2,1H3","NZLJDTKLZIMONR-UHFFFAOYSA-N"
"CCCCCCC(C)(C1)OC(=O)C1","InChI=1S/C11H20O2/c1-3-4-5-6-8-11(2)9-7-10(12)13-11/h3-9H2,1-2H3","ALWUKGXLBSQSMA-UHFFFAOYSA-N"
"O=C(C1)OCCCC1","InChI=1S/C6H10O2/c7-6-4-2-1-3-5-8-6/h1-5H2","PAPBSGBWRJIAAV-UHFFFAOYSA-N"
"CC(C1)OC(=O)1","InChI=1S/C4H6O2/c1-3-2-4(5)6-3/h3H,2H2,1H3","GSCLMSFRWBPUSK-UHFFFAOYSA-N"
"CN(C)c(c1)cccc1","InChI=1S/C8H11N/c1-9(2)8-6-4-3-5-7-8/h3-7H,1-2H3","JLTDJTHDQAWBAV-UHFFFAOYSA-N"
"CCCCc(c1)ccc(N)c1","InChI=1S/C10H15N/c1-2-3-4-9-5-7-10(11)8-6-9/h5-8H,2-4,11H2,1H3","OGIQUQKNJJTLSZ-UHFFFAOYSA-N"
"CCCCNc(c1)cccc1","InChI=1S/C10H15N/c1-2-3-9-11-10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3","VSHTWPWTCXQLQN-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(c1)N(C)C","InChI=1S/C10H15N/c1-8-5-6-10(11(3)4)9(2)7-8/h5-7H,1-4H3","DZXAIYQRCQALGE-UHFFFAOYSA-N"
"NCCN","InChI=1S/C2H8N2/c3-1-2-4/h1-4H2","PIICEJLVQHRZGT-UHFFFAOYSA-N"
"NCCCN","InChI=1S/C3H10N2/c4-2-1-3-5/h1-5H2","XFNJVJPLKCPIBV-UHFFFAOYSA-N"
"NCC(C)N","InChI=1S/C3H10N2/c1-3(5)2-4/h3H,2,4-5H2,1H3","AOHJOMMDDJHIJH-UHFFFAOYSA-N"
"NCCCCN","InChI=1S/C4H12N2/c5-3-1-2-4-6/h1-6H2","KIDHWZJUCRJVML-UHFFFAOYSA-N"
"CCCCC#N","InChI=1S/C5H9N/c1-2-3-4-5-6/h2-4H2,1H3","RFFFKMOABOFIDF-UHFFFAOYSA-N"
"CCCCCC#N","InChI=1S/C6H11N/c1-2-3-4-5-6-7/h2-5H2,1H3","AILKHAQXUAOOFU-UHFFFAOYSA-N"
"N#CCCC(C)C","InChI=1S/C6H11N/c1-6(2)4-3-5-7/h6H,3-4H2,1-2H3","DUJMVKJJUANUMQ-UHFFFAOYSA-N"
"CCCCCCC#N","InChI=1S/C7H13N/c1-2-3-4-5-6-7-8/h2-6H2,1H3","SDAXRHHPNYTELL-UHFFFAOYSA-N"
"CCOC(=O)C(=O)OCC","InChI=1S/C6H10O4/c1-3-9-5(7)6(8)10-4-2/h3-4H2,1-2H3","WYACBZDAHNBPPB-UHFFFAOYSA-N"
"CCOC(=O)CC(=O)OCC","InChI=1S/C7H12O4/c1-3-10-6(8)5-7(9)11-4-2/h3-5H2,1-2H3","IYXGSMUGOJNHAZ-UHFFFAOYSA-N"
"COc(c1)cc(O)cc1","InChI=1S/C7H8O2/c1-9-7-4-2-3-6(8)5-7/h2-5,8H,1H3","ASHGTJPOSUFTGB-UHFFFAOYSA-N"
"COc(c1)ccc(O)c1","InChI=1S/C7H8O2/c1-9-7-4-2-6(8)3-5-7/h2-5,8H,1H3","NWVVVBRKAWDGAB-UHFFFAOYSA-N"
"CCOc(c1)ccc(O)c1","InChI=1S/C8H10O2/c1-2-10-8-5-3-7(9)4-6-8/h3-6,9H,2H2,1H3","LKVFCSWBKOVHAH-UHFFFAOYSA-N"
"CCN(C)c(c1)cccc1","InChI=1S/C9H13N/c1-3-10(2)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3","PPHQUIPUBYPZLD-UHFFFAOYSA-N"
"CCOc(c1)cccc1","InChI=1S/C8H10O/c1-2-9-8-6-4-3-5-7-8/h3-7H,2H2,1H3","DLRJIFUOBPOJNS-UHFFFAOYSA-N"
"CCCOc(c1)cccc1","InChI=1S/C9H12O/c1-2-8-10-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3","DSNYFFJTZPIKFZ-UHFFFAOYSA-N"
"CCOc(c1)c(C)ccc1","InChI=1S/C9H12O/c1-3-10-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3","JWMKUKRBNODZFA-UHFFFAOYSA-N"
"CCOc(c1)cc(C)cc1","InChI=1S/C9H12O/c1-3-10-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3","UALKQROXOHJHFG-UHFFFAOYSA-N"
"CCOc(c1)ccc(C)c1","InChI=1S/C9H12O/c1-3-10-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3","WSWPHHNIHLTAHB-UHFFFAOYSA-N"
"CCCCOc(c1)cccc1","InChI=1S/C10H14O/c1-2-3-9-11-10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3","YFNONBGXNFCTMM-UHFFFAOYSA-N"
"CC(C)(C)Oc(c1)cccc1","InChI=1S/C10H14O/c1-10(2,3)11-9-7-5-4-6-8-9/h4-8H,1-3H3","PNKZBZPLRKCVLI-UHFFFAOYSA-N"
"CCCc(c1)ccc(OC)c1","InChI=1S/C10H14O/c1-3-4-9-5-7-10(11-2)8-6-9/h5-8H,3-4H2,1-2H3","KBHWKXNXTURZCD-UHFFFAOYSA-N"
"COc(c1)ccc(C(C)C)c1","InChI=1S/C10H14O/c1-8(2)9-4-6-10(11-3)7-5-9/h4-8H,1-3H3","JULZQKLZSNOEEJ-UHFFFAOYSA-N"
"CCOC(C)c(c1)cccc1","InChI=1S/C10H14O/c1-3-11-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3","MVTKJCAAJPVUHJ-UHFFFAOYSA-N"
"CCc(c1)c(O)ccc1","InChI=1S/C8H10O/c1-2-7-5-3-4-6-8(7)9/h3-6,9H,2H2,1H3","IXQGCWUGDFDQMF-UHFFFAOYSA-N"
"CCc(c1)cc(O)cc1","InChI=1S/C8H10O/c1-2-7-4-3-5-8(9)6-7/h3-6,9H,2H2,1H3","HMNKTRSOROOSPP-UHFFFAOYSA-N"
"CCc(c1)ccc(O)c1","InChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3","HXDOZKJGKXYMEW-UHFFFAOYSA-N"
"CCCOc(c1)ccc(O)c1","InChI=1S/C9H12O2/c1-2-7-11-9-5-3-8(10)4-6-9/h3-6,10H,2,7H2,1H3","KIIIPQXXLVCCQP-UHFFFAOYSA-N"
"CC(C)c(c1)c(O)ccc1","InChI=1S/C9H12O/c1-7(2)8-5-3-4-6-9(8)10/h3-7,10H,1-2H3","CRBJBYGJVIBWIY-UHFFFAOYSA-N"
"CC(C)c(c1)ccc(O)c1","InChI=1S/C9H12O/c1-7(2)8-3-5-9(10)6-4-8/h3-7,10H,1-2H3","YQUQWHNMBPIWGK-UHFFFAOYSA-N"
"CCc(c1)cc(C)c(O)c1","InChI=1S/C9H12O/c1-3-8-4-5-9(10)7(2)6-8/h4-6,10H,3H2,1-2H3","QDQMEHXIUFCIGR-UHFFFAOYSA-N"
"CCc(c1)c(O)cc(C)c1","InChI=1S/C9H12O/c1-3-8-5-4-7(2)6-9(8)10/h4-6,10H,3H2,1-2H3","LTRVUFFOMIUCPJ-UHFFFAOYSA-N"
"CCc(c1)c(O)ccc(C)1","InChI=1S/C9H12O/c1-3-8-6-7(2)4-5-9(8)10/h4-6,10H,3H2,1-2H3","AVVVXUXMKWPKAJ-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(O)c(C)1","InChI=1S/C9H12O/c1-6-4-7(2)9(10)8(3)5-6/h4-5,10H,1-3H3","BPRYUXCVCCNUFE-UHFFFAOYSA-N"
"OC(=O)C=CC(O)=O","InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1-","VZCYOOQTPOCHFL-UPHRSURJSA-N"
"C(=C/C(=O)O)\C(=O)O","InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1+","VZCYOOQTPOCHFL-OWOJBTEDSA-N"
"O=Cc(c1)c(OC)ccc1","InChI=1S/C8H8O2/c1-10-8-5-3-2-4-7(8)6-9/h2-6H,1H3","PKZJLOCLABXVMC-UHFFFAOYSA-N"
"O=Cc(c1)cc(OC)cc1","InChI=1S/C8H8O2/c1-10-8-4-2-3-7(5-8)6-9/h2-6H,1H3","WMPDAIZRQDCGFH-UHFFFAOYSA-N"
"COc(c1)c(ccc1)OC(C)(C)C","InChI=1S/C11H16O2/c1-11(2,3)13-10-8-6-5-7-9(10)12-4/h5-8H,1-4H3","ZNBPFNPUNMLSMD-UHFFFAOYSA-N"
"CCOc(c1)ccc(OCC)c1","InChI=1S/C10H14O2/c1-3-11-9-5-7-10(8-6-9)12-4-2/h5-8H,3-4H2,1-2H3","VWGNFIQXBYRDCH-UHFFFAOYSA-N"
"Oc(c1)c(O)cc(c1)C(C)(C)C","InChI=1S/C10H14O2/c1-10(2,3)7-4-5-8(11)9(12)6-7/h4-6,11-12H,1-3H3","XESZUVZBAMCAEJ-UHFFFAOYSA-N"
"COc(c1)c(OC)ccc1","InChI=1S/C8H10O2/c1-9-7-5-3-4-6-8(7)10-2/h3-6H,1-2H3","ABDKAPXRBAPSQN-UHFFFAOYSA-N"
"Cc(c1)c(O)cc(C)c(O)1","InChI=1S/C8H10O2/c1-5-3-8(10)6(2)4-7(5)9/h3-4,9-10H,1-2H3","GPASWZHHWPVSRG-UHFFFAOYSA-N"
"Cc(c1)c(O)c(O)cc1","InChI=1S/C7H8O2/c1-5-3-2-4-6(8)7(5)9/h2-4,8-9H,1H3","PGSWEKYNAOWQDF-UHFFFAOYSA-N"
"Cc(c1)cc(O)cc(O)1","InChI=1S/C7H8O2/c1-5-2-6(8)4-7(9)3-5/h2-4,8-9H,1H3","OIPPWFOQEKKFEE-UHFFFAOYSA-N"
"Oc(c1)cc(C)c(O)c1","InChI=1S/C7H8O2/c1-5-4-6(8)2-3-7(5)9/h2-4,8-9H,1H3","CNHDIAIOKMXOLK-UHFFFAOYSA-N"
"CCC(C)c(c1)ccc(O)c1","InChI=1S/C10H14O/c1-3-8(2)9-4-6-10(11)7-5-9/h4-8,11H,3H2,1-2H3","ZUTYZAFDFLLILI-UHFFFAOYSA-N"
"Oc(c1)ccc(c1)C(C)(C)C","InChI=1S/C10H14O/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3","QHPQWRBYOIRBIT-UHFFFAOYSA-N"
"Oc(c1)c(ccc1)C(C)(C)C","InChI=1S/C10H14O/c1-10(2,3)8-6-4-5-7-9(8)11/h4-7,11H,1-3H3","WJQOZHYUIDYNHM-UHFFFAOYSA-N"
"CCC(C)c(c1)c(O)ccc1","InChI=1S/C10H14O/c1-3-8(2)9-6-4-5-7-10(9)11/h4-8,11H,3H2,1-2H3","NGFPWHGISWUQOI-UHFFFAOYSA-N"
"Oc(c1)cc(cc1)C(C)(C)C","InChI=1S/C10H14O/c1-10(2,3)8-5-4-6-9(11)7-8/h4-7,11H,1-3H3","CYEKUDPFXBLGHH-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O","InChI=1S/C12H13NO2/c14-12(15)7-3-4-9-8-13-11-6-2-1-5-10(9)11/h1-2,5-6,8,13H,3-4,7H2,(H,14,15)","JTEDVYBZBROSJT-UHFFFAOYSA-N"
"CNc(c2)c(cc(Cl)c2)C(=O)c(c1)cccc1","InChI=1S/C14H12ClNO/c1-16-13-8-7-11(15)9-12(13)14(17)10-5-3-2-4-6-10/h2-9,16H,1H3","WPNMLCMTDCANOZ-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)2)C(=NC(=O)N2)c(c1)c(Cl)ccc1","InChI=1S/C14H8Cl2N2O/c15-8-5-6-12-10(7-8)13(18-14(19)17-12)9-3-1-2-4-11(9)16/h1-7H,(H,17,18,19)","FIKXZQLWVRAQOA-UHFFFAOYSA-N"
"COC(N=1)C(=O)N(C)c(c3)c(cc(Cl)c3)C1c(c2)c(Cl)ccc2","InChI=1S/C17H14Cl2N2O2/c1-21-14-8-7-10(18)9-12(14)15(20-16(23-2)17(21)22)11-5-3-4-6-13(11)19/h3-9,16H,1-2H3","NUPVEWMVMAZQIC-UHFFFAOYSA-N"
"CC(=O)c(c2)cc(cc2)Oc(c1)cccc1","InChI=1S/C14H12O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h2-10H,1H3","FZCDBGYCFVKRDV-UHFFFAOYSA-N"
"c(c2)ccc(c2)Oc(c1)cc(cc1)C(C)Br","InChI=1S/C14H13BrO/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h2-11H,1H3","NAFPHJPIASZFMX-UHFFFAOYSA-N"
"CC(O)c(c2)cc(cc2)Oc(c1)cccc1","InChI=1S/C14H14O2/c1-11(15)12-6-5-9-14(10-12)16-13-7-3-2-4-8-13/h2-11,15H,1H3","MYWBBBSIAHHXJK-UHFFFAOYSA-N"
"N#CC(C)c(c2)cc(cc2)Oc(c1)cccc1","InChI=1S/C15H13NO/c1-12(11-16)13-6-5-9-15(10-13)17-14-7-3-2-4-8-14/h2-10,12H,1H3","JSCONFOVXYGOST-UHFFFAOYSA-N"
"CN(C)C(=O)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C16H17NO/c1-17(2)16(18)15(13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12,15H,1-2H3","QAHFOPIILNICLA-UHFFFAOYSA-N"
"O=C(C=2)Oc(c1)c(C2)cc(O)c(O)1","InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H","ILEDWLMCKZNDJK-UHFFFAOYSA-N"
"COc(c1)c(O)cc(C=2)c(OC(=O)C2)1","InChI=1S/C10H8O4/c1-13-9-5-8-6(4-7(9)11)2-3-10(12)14-8/h2-5,11H,1H3","SYTYLPHCLSSCOJ-UHFFFAOYSA-N"
"CC(C)Nc(n1)nc(SC)nc(NC(C)C)1","InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)","AAEVYOVXGOFMJO-UHFFFAOYSA-N"
"Nc(c1)c(ccc1)S(O)(=O)=O","InChI=1S/C6H7NO3S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,7H2,(H,8,9,10)","ZMCHBSMFKQYNKA-UHFFFAOYSA-N"
"c(c3)ccc(c3)P(=S)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C18H15PS/c20-19(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H","VYNGFCUGSYEOOZ-UHFFFAOYSA-N"
"NC(=O)c(c1)ncc(O)n1","InChI=1S/C5H5N3O2/c6-5(10)3-1-8-4(9)2-7-3/h1-2H,(H2,6,10)(H,8,9)","XENWQEOTDAQROM-UHFFFAOYSA-N"
"COC(=O)c(c1)ncc(Cl)n1","InChI=1S/C6H5ClN2O2/c1-11-6(10)4-2-9-5(7)3-8-4/h2-3H,1H3","CVVMLRFXZPKILB-UHFFFAOYSA-N"
"COC(=O)c(n1)c(O)ncc1","InChI=1S/C6H6N2O3/c1-11-6(10)4-5(9)8-3-2-7-4/h2-3H,1H3,(H,8,9)","YVUBNSIFWJGXBQ-UHFFFAOYSA-N"
"OC(=O)C(C)c(c1)c(O)ccc(Oc(c2)cccc2)1","InChI=1S/C15H14O4/c1-10(15(17)18)13-9-12(7-8-14(13)16)19-11-5-3-2-4-6-11/h2-10,16H,1H3,(H,17,18)","ODOHKZJBBNHRRM-UHFFFAOYSA-N"
"O=C(C=1)C=CN(O)C1","InChI=1S/C5H5NO2/c7-5-1-3-6(8)4-2-5/h1-4,8H","NCDOCXYTOYFYHI-UHFFFAOYSA-N"
"OC(=O)C(C)(C)Oc(c1)ccc(Cl)c1","InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)","TXCGAZHTZHNUAI-UHFFFAOYSA-N"
"C=Cc(c2)cc(cc2)Oc(c1)cccc1","InChI=1S/C14H12O/c1-2-12-7-6-10-14(11-12)15-13-8-4-3-5-9-13/h2-11H,1H2","QDCUAHOXDLTZCU-UHFFFAOYSA-N"
"COc(c4)cc(c(c4)1)C(C3)(C2)C([H])(CCC3)C(N(C)C2)C1","InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15-,17+,18+/m0/s1","MKXZASYAUGDDCJ-CGTJXYLNSA-N"
"[H]C(C2)=C([H])CC(C2)(C(O)=O)C(C1)CCOC1","InChI=1S/C12H18O3/c13-11(14)12(6-2-1-3-7-12)10-4-8-15-9-5-10/h1-2,10H,3-9H2,(H,13,14)","YQPBVJDSXMVFOX-UHFFFAOYSA-N"
"OC(=O)c(c1)nccn1","InChI=1S/C5H4N2O2/c8-5(9)4-3-6-1-2-7-4/h1-3H,(H,8,9)","NIPZZXUFJPQHNH-UHFFFAOYSA-N"
"OC(=O)C(C)c(c1)cccc1","InChI=1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)/t7-/m1/s1","YPGCWEMNNLXISK-SSDOTTSWSA-N"
"OC(=O)c(c1)ncc(O)n1","InChI=1S/C5H4N2O3/c8-4-2-6-3(1-7-4)5(9)10/h1-2H,(H,7,8)(H,9,10)","CGQFCIHUUCMACC-UHFFFAOYSA-N"
"CC(=O)CCc(c1)ccc(O)c1","InChI=1S/C10H12O2/c1-8(11)2-3-9-4-6-10(12)7-5-9/h4-7,12H,2-3H2,1H3","NJGBTKGETPDVIK-UHFFFAOYSA-N"
"Oc(c1)c(O)cc(n(C)2)c1c(O)c2","InChI=1S/C9H9NO3/c1-10-4-9(13)5-2-7(11)8(12)3-6(5)10/h2-4,11-13H,1H3","DINWCUSJIVPQIO-UHFFFAOYSA-N"
"OC(=O)C=Cc(c1)cc(O)c(O)c1","InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+","QAIPRVGONGVQAS-DUXPYHPUSA-N"
"Clc(c2)ccc(c2)C(=O)c(c1)c(Cl)ccc1","InChI=1S/C13H8Cl2O/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8H","YXMYPHLWXBXNFF-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(O)c(c1)c(Cl)ccc1","InChI=1S/C13H10Cl2O/c14-10-7-5-9(6-8-10)13(16)11-3-1-2-4-12(11)15/h1-8,13,16H","VFGVWLQSEJIIJV-UHFFFAOYSA-N"
"CC(C)Cc(c1)ccc(c1)C(C)C(O)=O","InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)","HEFNNWSXXWATRW-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N(C)2)c(c1)c(Cl)ccc1","InChI=1S/C16H12Cl2N2O2/c1-20-13-7-6-9(17)8-11(13)14(19-15(21)16(20)22)10-4-2-3-5-12(10)18/h2-8,15,21H,1H3","FJIKWRGCXUCUIG-UHFFFAOYSA-N"
"O=C(C4)CC([H])(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C([H])(O)C1","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14-,15-,16-,17-,18-,19-/m0/s1","NVKAWKQGWWIWPM-ABEVXSGRSA-N"
"CNCc(c1)cccc1","InChI=1S/C8H11N/c1-9-7-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3","RIWRFSMVIUAEBX-UHFFFAOYSA-N"
"CNC(=O)c(c1)cccc1","InChI=1S/C8H9NO/c1-9-8(10)7-5-3-2-4-6-7/h2-6H,1H3,(H,9,10)","NCCHARWOCKOHIH-UHFFFAOYSA-N"
"CN(C)Cc(c1)cccc1","InChI=1S/C9H13N/c1-10(2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3","XXBDWLFCJWSEKW-UHFFFAOYSA-N"
"CN(C)C(=O)c(c1)cccc1","InChI=1S/C9H11NO/c1-10(2)9(11)8-6-4-3-5-7-8/h3-7H,1-2H3","IMNDHOCGZLYMRO-UHFFFAOYSA-N"
"N#Cc(c(Cl)1)c(Cl)ccc1","InChI=1S/C7H3Cl2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H","YOYAIZYFCNQIRF-UHFFFAOYSA-N"
"","InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21-,22+,23-,24+,25+,26+,27-/m1/s1","XIIAYQZJNBULGD-XWLABEFZSA-N"
"Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)C1","InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17+,18+/m1/s1","VOXZDWNPVJITMN-ZBRFXRBCSA-N"
"O=Cc(c1)c(O)ccc1","InChI=1S/C7H6O2/c8-5-6-3-1-2-4-7(6)9/h1-5,9H","SMQUZDBALVYZAC-UHFFFAOYSA-N"
"c(c1)ccc(c1)CN(C)[Si](C)(C)C","InChI=1S/C11H19NSi/c1-12(13(2,3)4)10-11-8-6-5-7-9-11/h5-9H,10H2,1-4H3","RLBKKXDJGJYLBC-UHFFFAOYSA-N"
"c(c1)ccc(c1)CN[Si](C)(C)C","InChI=1S/C10H17NSi/c1-12(2,3)11-9-10-7-5-4-6-8-10/h4-8,11H,9H2,1-3H3","OVONARZNQIKMGQ-UHFFFAOYSA-N"
"COC(=O)C(C)c(c1)ccc(c1)CC(C)(C)O","InChI=1S/C14H20O3/c1-10(13(15)17-4)12-7-5-11(6-8-12)9-14(2,3)16/h5-8,10,16H,9H2,1-4H3","GVQBZZMJMBIALH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCN(C(C)1)C(=O)CC1","InChI=1S/C19H37NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-18(2)15-16-19(20)21/h18H,3-17H2,1-2H3","SJXQIZZEFURXKK-UHFFFAOYSA-N"
"CCCCCCCCCCN(C(C)1)C(=O)CC1","InChI=1S/C15H29NO/c1-3-4-5-6-7-8-9-10-13-16-14(2)11-12-15(16)17/h14H,3-13H2,1-2H3","XNNZELUYRQQXRD-UHFFFAOYSA-N"
"CCCCCCCCCN(C(C)1)C(=O)CC1","InChI=1S/C14H27NO/c1-3-4-5-6-7-8-9-12-15-13(2)10-11-14(15)16/h13H,3-12H2,1-2H3","XUFUPFVDXQDCNH-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C(C)1)C(=O)CC1","InChI=1S/C17H33NO/c1-3-4-5-6-7-8-9-10-11-12-15-18-16(2)13-14-17(18)19/h16H,3-15H2,1-2H3","WFUJIEKVPAOBIK-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C1)C(=O)C(C)C1","InChI=1S/C17H33NO/c1-3-4-5-6-7-8-9-10-11-12-14-18-15-13-16(2)17(18)19/h16H,3-15H2,1-2H3","FYOOQDICUASUJZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C1)C(=O)C(C(C)=O)C1","InChI=1S/C18H33NO2/c1-3-4-5-6-7-8-9-10-11-12-14-19-15-13-17(16(2)20)18(19)21/h17H,3-15H2,1-2H3","YRVCRDDXHVQXDT-UHFFFAOYSA-N"
"CCCCCCCCCCCN(C(C)1)C(=O)CC1","InChI=1S/C16H31NO/c1-3-4-5-6-7-8-9-10-11-14-17-15(2)12-13-16(17)18/h15H,3-14H2,1-2H3","CZANSEAJYFFNSZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C1)C(=O)CC(C(O)=O)1","InChI=1S/C17H31NO3/c1-2-3-4-5-6-7-8-9-10-11-12-18-14-15(17(20)21)13-16(18)19/h15H,2-14H2,1H3,(H,20,21)","ZNQTZHTYSHEJLH-UHFFFAOYSA-N"
"NCCCCCCCCCCCCN(C1)C(=O)CC1","InChI=1S/C16H32N2O/c17-13-9-7-5-3-1-2-4-6-8-10-14-18-15-11-12-16(18)19/h1-15,17H2","AWDGGAOYFMTHKT-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCN(C(C)1)C(=O)CC1","InChI=1S/C21H41NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-20(2)17-18-21(22)23/h20H,3-19H2,1-2H3","KQSWUMKCKNXRSK-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCN(C(C)1)C(=O)CC1","InChI=1S/C23H45NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24-22(2)19-20-23(24)25/h22H,3-21H2,1-2H3","TYAMTTBZEDCFHI-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C1)C(=S)CC1","InChI=1S/C16H31NS/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16(17)18/h2-15H2,1H3","XZIGJCHACSCDHN-UHFFFAOYSA-N"
"C(CCCCCCN(C2)C(=O)CC2)CCCCCN(C1)C(=O)CC1","InChI=1S/C20H36N2O2/c23-19-13-11-17-21(19)15-9-7-5-3-1-2-4-6-8-10-16-22-18-12-14-20(22)24/h1-18H2","LTHBKYXQRLHDSV-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C1)C(=O)CC1","InChI=1S/C16H31NO/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16(17)18/h2-15H2,1H3","NJPQAIBZIHNJDO-UHFFFAOYSA-N"
"CCCCCCCCc(c2)ccc(c2)N(C1)C(=O)CC1","InChI=1S/C18H27NO/c1-2-3-4-5-6-7-9-16-11-13-17(14-12-16)19-15-8-10-18(19)20/h11-14H,2-10,15H2,1H3","WMYDRTMKLYXZES-UHFFFAOYSA-N"
"CCOC(=O)Nc(c1)cc(Cl)c(Cl)c1","InChI=1S/C9H9Cl2NO2/c1-2-14-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)","AOVLXBXJFYNQAZ-UHFFFAOYSA-N"
"CCOC(=O)Nc(c1)ccc(Cl)c1","InChI=1S/C9H10ClNO2/c1-2-13-9(12)11-8-5-3-7(10)4-6-8/h3-6H,2H2,1H3,(H,11,12)","WSKXXIMERYQVGJ-UHFFFAOYSA-N"
"O=C(Nc(c2)ccc(Cl)c2)Nc(c1)ccc(Cl)c1","InChI=1S/C13H10Cl2N2O/c14-9-1-5-11(6-2-9)16-13(18)17-12-7-3-10(15)4-8-12/h1-8H,(H2,16,17,18)","ZNQCSLYENQIUMJ-UHFFFAOYSA-N"
"CCCCCCCCCCN(C1)C(=O)CCCC1","InChI=1S/C16H31NO/c1-2-3-4-5-6-7-8-11-14-17-15-12-9-10-13-16(17)18/h2-15H2,1H3","PCEPYENXHJPCEF-UHFFFAOYSA-N"
"CCCCCCN(C1)C(=O)CCCC1","InChI=1S/C12H23NO/c1-2-3-4-7-10-13-11-8-5-6-9-12(13)14/h2-11H2,1H3","JDQRYRLJZGMNIB-UHFFFAOYSA-N"
"CCCCCCCCN(C1)C(=O)CCCC1","InChI=1S/C14H27NO/c1-2-3-4-5-6-9-12-15-13-10-7-8-11-14(15)16/h2-13H2,1H3","VKAMZEDHHWTTNZ-UHFFFAOYSA-N"
"c(c3)ccc(c3)Oc(c2)ccc(c2)N(C1)C(=O)CC1","InChI=1S/C16H15NO2/c18-16-7-4-12-17(16)13-8-10-15(11-9-13)19-14-5-2-1-3-6-14/h1-3,5-6,8-11H,4,7,12H2","LVHLULNITPAAAG-UHFFFAOYSA-N"
"c(c3)ccc(c3)Oc(c2)c(ccc2)N(C1)C(=O)CC1","InChI=1S/C16H15NO2/c18-16-11-6-12-17(16)14-9-4-5-10-15(14)19-13-7-2-1-3-8-13/h1-5,7-10H,6,11-12H2","BZQZFICCIHXODN-UHFFFAOYSA-N"
"c(c3)ccc(c3)Oc(c2)cc(cc2)N(C1)C(=O)CC1","InChI=1S/C16H15NO2/c18-16-10-5-11-17(16)13-6-4-9-15(12-13)19-14-7-2-1-3-8-14/h1-4,6-9,12H,5,10-11H2","RFCQFBDBPGMUDP-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C)C(=O)CC","InChI=1S/C16H33NO/c1-4-6-7-8-9-10-11-12-13-14-15-17(3)16(18)5-2/h4-15H2,1-3H3","GQQHNTXKLBDYQN-UHFFFAOYSA-N"
"CCCCCCCCNC(=O)CCCCCO","InChI=1S/C14H29NO2/c1-2-3-4-5-6-9-12-15-14(17)11-8-7-10-13-16/h16H,2-13H2,1H3,(H,15,17)","CZALATPPVHTDBF-UHFFFAOYSA-N"
"OC(=O)CN(C1)C(=O)CC1","InChI=1S/C6H9NO3/c8-5-2-1-3-7(5)4-6(9)10/h1-4H2,(H,9,10)","JGPIWNNFLKDTSR-UHFFFAOYSA-N"
"CCCCCCNC(=O)CCCCO","InChI=1S/C11H23NO2/c1-2-3-4-6-9-12-11(14)8-5-7-10-13/h13H,2-10H2,1H3,(H,12,14)","RBXBYQAGFGAKKR-UHFFFAOYSA-N"
"CCCCCCNC(=O)CCCCCO","InChI=1S/C12H25NO2/c1-2-3-4-7-10-13-12(15)9-6-5-8-11-14/h14H,2-11H2,1H3,(H,13,15)","DNHFCFYTJSCXOI-UHFFFAOYSA-N"
"CCCCCCN(C1)C(=O)C(C)C1","InChI=1S/C11H21NO/c1-3-4-5-6-8-12-9-7-10(2)11(12)13/h10H,3-9H2,1-2H3","MGAPDRUAYAADPG-UHFFFAOYSA-N"
"CCCCCCCCN(C1)C(=O)C(C)C1","InChI=1S/C13H25NO/c1-3-4-5-6-7-8-10-14-11-9-12(2)13(14)15/h12H,3-11H2,1-2H3","RSLRMPBMJSZJKJ-UHFFFAOYSA-N"
"CCCCCCCCCCCCN(C=O)CCC","InChI=1S/C16H33NO/c1-3-5-6-7-8-9-10-11-12-13-15-17(16-18)14-4-2/h16H,3-15H2,1-2H3","KAUUMGSCMHSUOE-UHFFFAOYSA-N"
"O=C(C2)N(CC2)C(=O)Nc(c1)cc(Cl)c(Cl)c1","InChI=1S/C11H10Cl2N2O2/c12-8-4-3-7(6-9(8)13)14-11(17)15-5-1-2-10(15)16/h3-4,6H,1-2,5H2,(H,14,17)","MMMNMLFHTXRPJR-UHFFFAOYSA-N"
"O=C(C2)N(CC2)C(=O)NC(C1)CCCC1","InChI=1S/C11H18N2O2/c14-10-7-4-8-13(10)11(15)12-9-5-2-1-3-6-9/h9H,1-8H2,(H,12,15)","XTYPRCKTUGBVCB-UHFFFAOYSA-N"
"CCCCCCCCCCCNC(=O)N(C1)C(=O)CC1","InChI=1S/C16H30N2O2/c1-2-3-4-5-6-7-8-9-10-13-17-16(20)18-14-11-12-15(18)19/h2-14H2,1H3,(H,17,20)","SEWWFEQDXRPJLW-UHFFFAOYSA-N"
"ClCCN(C1)C(=O)CC1","InChI=1S/C6H10ClNO/c7-3-5-8-4-1-2-6(8)9/h1-5H2","CWLYHDWHNFLUEI-UHFFFAOYSA-N"
"CCCCCCCCCCCCNCC","InChI=1S/C14H31N/c1-3-5-6-7-8-9-10-11-12-13-14-15-4-2/h15H,3-14H2,1-2H3","LWIPGCTWFZCIKX-UHFFFAOYSA-N"
"OCN(C1)C(=O)CC1","InChI=1S/C5H9NO2/c7-4-6-3-1-2-5(6)8/h7H,1-4H2","PJEXUIKBGBSHBS-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)NC","InChI=1S/C13H27NO/c1-3-4-5-6-7-8-9-10-11-12-13(15)14-2/h3-12H2,1-2H3,(H,14,15)","APWSJINSLHHRPD-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)NCC","InChI=1S/C14H29NO/c1-3-5-6-7-8-9-10-11-12-13-14(16)15-4-2/h3-13H2,1-2H3,(H,15,16)","FEQGPEABBFYLNO-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)NCCC","InChI=1S/C15H31NO/c1-3-5-6-7-8-9-10-11-12-13-15(17)16-14-4-2/h3-14H2,1-2H3,(H,16,17)","AUYWNLPGKFYZFF-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(C1)CC(=O)O1","InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-16(17)18-14-15/h15H,2-14H2,1H3","KTTRQOLCFVDCNA-UHFFFAOYSA-N"
"CCOc(c2)ccc(c2)N(C1)C(=O)CC1","InChI=1S/C12H15NO2/c1-2-15-11-7-5-10(6-8-11)13-9-3-4-12(13)14/h5-8H,2-4,9H2,1H3","TWVVNUHXQJVIEC-UHFFFAOYSA-N"
"O=C(C1)N(CC1)CCl","InChI=1S/C5H8ClNO/c6-4-7-3-1-2-5(7)8/h1-4H2","KEBMRNXDMRFGNV-UHFFFAOYSA-N"
"CCCCCCCCc(c1)ccc(N)c1","InChI=1S/C14H23N/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h9-12H,2-8,15H2,1H3","ORKQJTBYQZITLA-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)NC(=O)N(C1)C(=O)CC1","InChI=1S/C11H11ClN2O2/c12-8-3-5-9(6-4-8)13-11(16)14-7-1-2-10(14)15/h3-6H,1-2,7H2,(H,13,16)","LIQARWOYAGGJFV-UHFFFAOYSA-N"
"CCCCCCC(C1)CC(=O)O1","InChI=1S/C10H18O2/c1-2-3-4-5-6-9-7-10(11)12-8-9/h9H,2-8H2,1H3","BAKYERABTYQIGZ-UHFFFAOYSA-N"
"CCCCCCCCCCN(C1)C(=O)C(C)C1","InChI=1S/C15H29NO/c1-3-4-5-6-7-8-9-10-12-16-13-11-14(2)15(16)17/h14H,3-13H2,1-2H3","HNGCEYRBEHSEMW-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCN(C1)C(=O)C(C)C1","InChI=1S/C23H45NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-24-21-19-22(2)23(24)25/h22H,3-21H2,1-2H3","MBWBDJQUYZJOBQ-UHFFFAOYSA-N"
"O=C(C3)N(CC3)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C14H13NO/c16-14-6-3-9-15(14)13-8-7-11-4-1-2-5-12(11)10-13/h1-2,4-5,7-8,10H,3,6,9H2","FJWHXLZPCPMMNL-UHFFFAOYSA-N"
"CCCCCCCCCCCCCN","InChI=1S/C13H29N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h2-14H2,1H3","ABVVEAHYODGCLZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCn(c(=O)1)c(=O)c(c2)c(ccc2)1","InChI=1S/C20H29NO2/c1-2-3-4-5-6-7-8-9-10-13-16-21-19(22)17-14-11-12-15-18(17)20(21)23/h11-12,14-15H,2-10,13,16H2,1H3","LFUHZZBSKQGQKA-UHFFFAOYSA-N"
"CCCCCCCCCCCCNC(=O)CCCO","InChI=1S/C16H33NO2/c1-2-3-4-5-6-7-8-9-10-11-14-17-16(19)13-12-15-18/h18H,2-15H2,1H3,(H,17,19)","XDLZKXFUWLXBCL-UHFFFAOYSA-N"
"N#CCCC(C#N)(C1)CC=CC1","InChI=1S/C10H12N2/c11-8-4-7-10(9-12)5-2-1-3-6-10/h1-2H,3-7H2","DFCDGWKPOLITPU-UHFFFAOYSA-N"
"CC[N+](CC)(CC)CC.[Br-]","InChI=1S/C8H20N.BrH/c1-5-9(6-2,7-3)8-4;/h5-8H2,1-4H3;1H/q+1;/p-1","HWCKGOZZJDHMNC-UHFFFAOYSA-M"
"CCCC[N+](CCCC)(CCCC)CCCC.[Cl-]","InChI=1S/C16H36N.ClH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1","NHGXDBSUJJNIRV-UHFFFAOYSA-M"
"CCCC[N+](CCCC)(CCCC)CCCC.[Br-]","InChI=1S/C16H36N.BrH/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1","JRMUNVKIHCOMHV-UHFFFAOYSA-M"
"CCCCC[N+](CCCCC)(CCCCC)CCCCC.[I-]","InChI=1S/C20H44N.HI/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;/h5-20H2,1-4H3;1H/q+1;/p-1","FBLZDUAOBOMSNZ-UHFFFAOYSA-M"
"CC(C)CC[N+](CCC(C)C)(CCC(C)C)CCC(C)C.[I-]","InChI=1S/C20H44N.HI/c1-17(2)9-13-21(14-10-18(3)4,15-11-19(5)6)16-12-20(7)8;/h17-20H,9-16H2,1-8H3;1H/q+1;/p-1","BMKCBSPIAGPRBW-UHFFFAOYSA-M"
"CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]","InChI=1S/C21H46N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(2,3)4;/h5-21H2,1-4H3;1H/q+1;/p-1","VBIIFPGSPJYLRR-UHFFFAOYSA-M"
"CCCCCCCCCCCCCCCC[N+](C)(C)C.[Br-]","InChI=1S/C19H42N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;/h5-19H2,1-4H3;1H/q+1;/p-1","LZZYPRNAOMGNLH-UHFFFAOYSA-M"
"CCCCCCCCCCCC[N+](C)(C)C.[Cl-]","InChI=1S/C15H34N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;/h5-15H2,1-4H3;1H/q+1;/p-1","DDXLVDQZPFLQMZ-UHFFFAOYSA-M"
"CCCCCCCCCCCCCCCC[N+](C)(C)CC.[Br-]","InChI=1S/C20H44N.BrH/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(3,4)6-2;/h5-20H2,1-4H3;1H/q+1;/p-1","VUFOSBDICLTFMS-UHFFFAOYSA-M"
"CCCC[N+](CCCC)(CCCC)CCCC.[I-]","InChI=1S/C16H36N.HI/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;/h5-16H2,1-4H3;1H/q+1;/p-1","DPKBAXPHAYBPRL-UHFFFAOYSA-M"
"CCC[N+](CCC)(CCC)CCC.[I-]","InChI=1S/C12H28N.HI/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H/q+1;/p-1","GKXDJYKZFZVASJ-UHFFFAOYSA-M"
"CCCCCCCCCCCCCC[N+](C)(C)C.[Br-]","InChI=1S/C17H38N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4;/h5-17H2,1-4H3;1H/q+1;/p-1","CXRFDZFCGOPDTD-UHFFFAOYSA-M"
"CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Br-]","InChI=1S/C21H38N.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22;/h15,17-18,20-21H,2-14,16,19H2,1H3;1H/q+1;/p-1","DVBJBNKEBPCGSY-UHFFFAOYSA-M"
"CC(=C)C(=O)OCC(C1)O1","InChI=1S/C7H10O3/c1-5(2)7(8)10-4-6-3-9-6/h6H,1,3-4H2,2H3","VOZRXNHHFUQHIL-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C8H7NO4/c1-13-8(10)6-3-2-4-7(5-6)9(11)12/h2-5H,1H3","AXLYJLKKPUICKV-UHFFFAOYSA-N"
"COC(=O)C(C)(Br)CBr","InChI=1S/C5H8Br2O2/c1-5(7,3-6)4(8)9-2/h3H2,1-2H3","GVLXNUSEDDXIGJ-UHFFFAOYSA-N"
"COC(=O)C(C)S","InChI=1S/C4H8O2S/c1-3(7)4(5)6-2/h3,7H,1-2H3","SNWKNPMDQONHKK-UHFFFAOYSA-N"
"COC(=O)C(C)SC","InChI=1S/C5H10O2S/c1-4(8-3)5(6)7-2/h4H,1-3H3","QMPSBIWJVUCDKV-UHFFFAOYSA-N"
"COC(=O)C(Br)(Br)Br","InChI=1S/C3H3Br3O2/c1-8-2(7)3(4,5)6/h1H3","QQHSHLKOWBDOFC-UHFFFAOYSA-N"
"COC(=O)C=CC(C)C","InChI=1S/C7H12O2/c1-6(2)4-5-7(8)9-3/h4-6H,1-3H3/b5-4+","YVOAQDZUARKSRL-SNAWJCMRSA-N"
"COC(=O)C(C)=C([H])C","InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4+","YYJWBYNQJLBIGS-SNAWJCMRSA-N"
"COC(=O)C(C)C(=O)OC","InChI=1S/C6H10O4/c1-4(5(7)9-2)6(8)10-3/h4H,1-3H3","LRBPFPZTIZSOGG-UHFFFAOYSA-N"
"CCCC(=O)C(=O)OC","InChI=1S/C6H10O3/c1-3-4-5(7)6(8)9-2/h3-4H2,1-2H3","MBNLVYPIKSWXCT-UHFFFAOYSA-N"
"CCCC(C)C(=O)OC","InChI=1S/C7H14O2/c1-4-5-6(2)7(8)9-3/h6H,4-5H2,1-3H3","ZTULNMNIVVMLIU-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(OC)c(OC)c(OC)1","InChI=1S/C11H14O5/c1-13-8-5-7(11(12)16-4)6-9(14-2)10(8)15-3/h5-6H,1-4H3","KACHFMOHOPLTNX-UHFFFAOYSA-N"
"COC(=O)c(c(O)1)c(O)cc(O)c1","InChI=1S/C8H8O5/c1-13-8(12)7-5(10)2-4(9)3-6(7)11/h2-3,9-11H,1H3","AQDIJIAUYXOCGX-UHFFFAOYSA-N"
"COC(=O)c(c(Cl)1)c(C(=O)OC)c(Cl)c(Cl)c(Cl)1","InChI=1S/C10H6Cl4O4/c1-17-9(15)3-4(10(16)18-2)6(12)8(14)7(13)5(3)11/h1-2H3","CXWWOTMXNBKMBO-UHFFFAOYSA-N"
"COC(=O)c(c(Br)1)c(C(=O)OC)c(Br)c(Br)c(Br)1","InChI=1S/C10H6Br4O4/c1-17-9(15)3-4(10(16)18-2)6(12)8(14)7(13)5(3)11/h1-2H3","GNBQLLNMXUOVRU-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(N=Nc(c2)cccc2)c1","InChI=1S/C14H12N2O2/c1-18-14(17)11-7-9-13(10-8-11)16-15-12-5-3-2-4-6-12/h2-10H,1H3/b16-15+","SUFXZYCPKGRJIZ-FOCLMDBBSA-N"
"COC(=O)c(c1)nccc1","InChI=1S/C7H7NO2/c1-10-7(9)6-4-2-3-5-8-6/h2-5H,1H3","NMMIHXMBOZYNET-UHFFFAOYSA-N"
"CCCOc(c1)ccc(c1)C(=O)OC","InChI=1S/C11H14O3/c1-3-8-14-10-6-4-9(5-7-10)11(12)13-2/h4-7H,3,8H2,1-2H3","OXOTVVQIIASDNF-UHFFFAOYSA-N"
"COC(=O)c(c1)nc(c2)c(ccc2)c1","InChI=1S/C11H9NO2/c1-14-11(13)10-7-6-8-4-2-3-5-9(8)12-10/h2-7H,1H3","CILJSZLWPHTUIP-UHFFFAOYSA-N"
"COC(=O)CCC(CCC(=O)OC)C(=O)OC","InChI=1S/C11H18O6/c1-15-9(12)6-4-8(11(14)17-3)5-7-10(13)16-2/h8H,4-7H2,1-3H3","BAWAMGSZOXWVIB-UHFFFAOYSA-N"
"COC(=O)CCCc(c1)cccc1","InChI=1S/C11H14O2/c1-13-11(12)9-5-8-10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3","YRYZGVBKMWFWGT-UHFFFAOYSA-N"
"COC(=O)CCC(C)=O","InChI=1S/C6H10O3/c1-5(7)3-4-6(8)9-2/h3-4H2,1-2H3","UAGJVSRUFNSIHR-UHFFFAOYSA-N"
"COC(=O)CCCC(C)=O","InChI=1S/C7H12O3/c1-6(8)4-3-5-7(9)10-2/h3-5H2,1-2H3","AVVPOKSKJSJVIX-UHFFFAOYSA-N"
"COC(=O)CNC(=O)Cc(c1)cccc1","InChI=1S/C11H13NO3/c1-15-11(14)8-12-10(13)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,12,13)","VISLHUSQBAQEBB-UHFFFAOYSA-N"
"COC(=O)CC(C)CC(=O)OC","InChI=1S/C8H14O4/c1-6(4-7(9)11-2)5-8(10)12-3/h6H,4-5H2,1-3H3","YIJLMTNDXYVGPQ-UHFFFAOYSA-N"
"COC(=O)C(C)(C1)CCCC1","InChI=1S/C9H16O2/c1-9(8(10)11-2)6-4-3-5-7-9/h3-7H2,1-2H3","NKZISBBWNQEPAH-UHFFFAOYSA-N"
"CCCCCCCCOc(c1)ccc(c1)C(=O)OC","InChI=1S/C16H24O3/c1-3-4-5-6-7-8-13-19-15-11-9-14(10-12-15)16(17)18-2/h9-12H,3-8,13H2,1-2H3","JCVLYBQFVTYGKT-UHFFFAOYSA-N"
"COC(=O)C(C)Oc(c1)cccc1","InChI=1S/C10H12O3/c1-8(10(11)12-2)13-9-6-4-3-5-7-9/h3-8H,1-2H3","KIBRBMKSBVQDMK-UHFFFAOYSA-N"
"COC(=O)Cc(c1)cc(C)cc1","InChI=1S/C10H12O2/c1-8-4-3-5-9(6-8)7-10(11)12-2/h3-6H,7H2,1-2H3","AWTKFTNNPQGGLX-UHFFFAOYSA-N"
"COC(=O)c(c1)c(SC)ccc1","InChI=1S/C9H10O2S/c1-11-9(10)7-5-3-4-6-8(7)12-2/h3-6H,1-2H3","CPQDZXPLQXZJGF-UHFFFAOYSA-N"
"COC(=O)C(C)Oc(c1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C10H9Cl3O3/c1-5(10(14)15-2)16-9-4-7(12)6(11)3-8(9)13/h3-5H,1-2H3","YTAXYXOJOYIQQO-UHFFFAOYSA-N"
"COC(=O)COc(c1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C9H7Cl3O3/c1-14-9(13)4-15-8-3-6(11)5(10)2-7(8)12/h2-3H,4H2,1H3","JUCNGUOYQGHBJC-UHFFFAOYSA-N"
"COC(=O)CSc(c1)cccc1","InChI=1S/C9H10O2S/c1-11-9(10)7-12-8-5-3-2-4-6-8/h2-6H,7H2,1H3","MUNSXQQODXYRKI-UHFFFAOYSA-N"
"COC(=O)CSCC(=O)OC","InChI=1S/C6H10O4S/c1-9-5(7)3-11-4-6(8)10-2/h3-4H2,1-2H3","ZQUQLLPRRJVUES-UHFFFAOYSA-N"
"COC(=O)c(c1)scc1","InChI=1S/C6H6O2S/c1-8-6(7)5-3-2-4-9-5/h2-4H,1H3","PGBFYLVIMDQYMS-UHFFFAOYSA-N"
"COC(=O)c(c1)c(C(=O)OC)c(cc1)[N+1]([O-1])=O","InChI=1S/C10H9NO6/c1-16-9(12)6-4-3-5-7(11(14)15)8(6)10(13)17-2/h3-5H,1-2H3","MLQMIKSBTAZNBK-UHFFFAOYSA-N"
"COC(=O)COc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C9H9NO5/c1-14-9(11)6-15-8-4-2-7(3-5-8)10(12)13/h2-5H,6H2,1H3","ZZVXTAUUUUCLAG-UHFFFAOYSA-N"
"COC(=O)Cc(c1)c(ccc1)[N+1]([O-1])=O","InChI=1S/C9H9NO4/c1-14-9(11)6-7-4-2-3-5-8(7)10(12)13/h2-5H,6H2,1H3","SWMFAAPTSMVULA-UHFFFAOYSA-N"
"COC(=O)Cc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C9H9NO4/c1-14-9(11)6-7-3-2-4-8(5-7)10(12)13/h2-5H,6H2,1H3","BFGYITRIATVARH-UHFFFAOYSA-N"
"COC(=O)Cc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C9H9NO4/c1-14-9(11)6-7-2-4-8(5-3-7)10(12)13/h2-5H,6H2,1H3","PQRGTRBYCFLHKY-UHFFFAOYSA-N"
"CCCCCC=CC(=O)OC","InChI=1S/C9H16O2/c1-3-4-5-6-7-8-9(10)11-2/h7-8H,3-6H2,1-2H3/b8-7+","CJBQSBZJDJHMLF-BQYQJAHWSA-N"
"COC(=O)CC(C)CC(C)(C)C","InChI=1S/C10H20O2/c1-8(6-9(11)12-5)7-10(2,3)4/h8H,6-7H2,1-5H3","DCPCIGBOUDWJEZ-UHFFFAOYSA-N"
"COC(=O)c(c1)cncc1","InChI=1S/C7H7NO2/c1-10-7(9)6-3-2-4-8-5-6/h2-5H,1H3","YNBADRVTZLEFNH-UHFFFAOYSA-N"
"COC(=O)c(c1)ccnc1","InChI=1S/C7H7NO2/c1-10-7(9)6-2-4-8-5-3-6/h2-5H,1H3","OLXYLDUSSBULGU-UHFFFAOYSA-N"
"CCCCCCCCc(c1)ccc(c1)C(=O)OC","InChI=1S/C16H24O2/c1-3-4-5-6-7-8-9-14-10-12-15(13-11-14)16(17)18-2/h10-13H,3-9H2,1-2H3","NKSKNAWLKUQLNY-UHFFFAOYSA-N"
"COC(=O)Cc(c1)cc(c2)c(ccc2)c1","InChI=1S/C13H12O2/c1-15-13(14)9-10-6-7-11-4-2-3-5-12(11)8-10/h2-8H,9H2,1H3","BGYOCQOJCMPTCY-UHFFFAOYSA-N"
"COC(=O)CN(CC(=O)OC)CC(=O)OC","InChI=1S/C9H15NO6/c1-14-7(11)4-10(5-8(12)15-2)6-9(13)16-3/h4-6H2,1-3H3","NHKRXCTYPGGSTL-UHFFFAOYSA-N"
"C=CC(O)=O","InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)","NIXOWILDQLNWCW-UHFFFAOYSA-N"
"OCC(C)=O","InChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3","XLSMFKSTNGKWQX-UHFFFAOYSA-N"
"C#CCCl","InChI=1S/C3H3Cl/c1-2-3-4/h1H,3H2","LJZPPWWHKPGCHS-UHFFFAOYSA-N"
"C#CCBr","InChI=1S/C3H3Br/c1-2-3-4/h1H,3H2","YORCIIVHUBAYBQ-UHFFFAOYSA-N"
"COC(=O)C=CC(O)=O","InChI=1S/C5H6O4/c1-9-5(8)3-2-4(6)7/h2-3H,1H3,(H,6,7)/b3-2-","NKHAVTQWNUWKEO-IHWYPQMZSA-N"
"O=C=Nc(c1)ccc(C)c1","InChI=1S/C8H7NO/c1-7-2-4-8(5-3-7)9-6-10/h2-5H,1H3","MGYGFNQQGAQEON-UHFFFAOYSA-N"
"[2H]C([2H])([2H])OC(=O)COC","InChI=1S/C4H8O3/c1-6-3-4(5)7-2/h3H2,1-2H3/i2D3","QRMHDGWGLNLHMN-BMSJAHLVSA-N"
"O=C=Nc(c1)cc(C)cc1","InChI=1S/C8H7NO/c1-7-3-2-4-8(5-7)9-6-10/h2-5H,1H3","CPPGZWWUPFWALU-UHFFFAOYSA-N"
"[2H]C([2H])([2H])OC(=O)C=CC(=O)OC([2H])([2H])[2H]","InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+/i1D3,2D3","LDCRTTXIJACKKU-XDMLVRQJSA-N"
"O=C=Nc(c1)c(C)ccc1","InChI=1S/C8H7NO/c1-7-4-2-3-5-8(7)9-6-10/h2-5H,1H3","VAYMIYBJLRRIFR-UHFFFAOYSA-N"
"OCC([H])=C([H])CO","InChI=1S/C4H8O2/c5-3-1-2-4-6/h1-2,5-6H,3-4H2/b2-1-","ORTVZLZNOYNASJ-UPHRSURJSA-N"
"CC(C)C(O)=O","InChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)","KQNPFQTWMSNSAP-UHFFFAOYSA-N"
"COCCO","InChI=1S/C3H8O2/c1-5-3-2-4/h4H,2-3H2,1H3","XNWFRZJHXBZDAG-UHFFFAOYSA-N"
"NCCOC","InChI=1S/C3H9NO/c1-5-3-2-4/h2-4H2,1H3","ASUDFOJKTJLAIK-UHFFFAOYSA-N"
"CCC(O)CC","InChI=1S/C5H12O/c1-3-5(6)4-2/h5-6H,3-4H2,1-2H3","AQIXEPGDORPWBJ-UHFFFAOYSA-N"
"C(C1)CO1","InChI=1S/C3H6O/c1-2-4-3-1/h1-3H2","AHHWIHXENZJRFG-UHFFFAOYSA-N"
"C[N+1]([O-1])=O","InChI=1S/CH3NO2/c1-2(3)4/h1H3","LYGJENNIWJXYER-UHFFFAOYSA-N"
"CCBr","InChI=1S/C2H5Br/c1-2-3/h2H2,1H3","RDHPKYGYEGBMSE-UHFFFAOYSA-N"
"Nc(c1)c(C)c(N)cc1","InChI=1S/C7H10N2/c1-5-6(8)3-2-4-7(5)9/h2-4H,8-9H2,1H3","RLYCRLGLCUXUPO-UHFFFAOYSA-N"
"CCCCC(=O)OC","InChI=1S/C6H12O2/c1-3-4-5-6(7)8-2/h3-5H2,1-2H3","HNBDRPTVWVGKBR-UHFFFAOYSA-N"
"CCOCCOCCOC(C)=O","InChI=1S/C8H16O4/c1-3-10-4-5-11-6-7-12-8(2)9/h3-7H2,1-2H3","FPZWZCWUIYYYBU-UHFFFAOYSA-N"
"CC(=O)CC(=O)N(C)C","InChI=1S/C6H11NO2/c1-5(8)4-6(9)7(2)3/h4H2,1-3H3","YPEWWOUWRRQBAX-UHFFFAOYSA-N"
"CC(=O)C(C1)C(=O)OC1","InChI=1S/C6H8O3/c1-4(7)5-2-3-9-6(5)8/h5H,2-3H2,1H3","OMQHDIHZSDEIFH-UHFFFAOYSA-N"
"N#CCCCCC#N","InChI=1S/C6H8N2/c7-5-3-1-2-4-6-8/h1-4H2","BTGRAWJCKBQKAO-UHFFFAOYSA-N"
"OCCOC(=O)C=C","InChI=1S/C5H8O3/c1-2-5(7)8-4-3-6/h2,6H,1,3-4H2","OMIGHNLMNHATMP-UHFFFAOYSA-N"
"CCOC(=O)CCC(=C1)C(=O)N(C=2)C(C=CC2)=N1","InChI=1S/C13H14N2O3/c1-2-18-12(16)7-6-10-9-14-11-5-3-4-8-15(11)13(10)17/h3-5,8-9H,2,6-7H2,1H3","YIXJMFGCUAPJCZ-UHFFFAOYSA-N"
"CCOC(=O)CC(=C2)C(=O)N(C=1)C(=N2)C(C)=CC1","InChI=1S/C13H14N2O3/c1-3-18-11(16)7-10-8-14-12-9(2)5-4-6-15(12)13(10)17/h4-6,8H,3,7H2,1-2H3","INWGIESOXMAPPF-UHFFFAOYSA-N"
"Cc(c(C)1)n(C)c(c2)c(ccc2)1","InChI=1S/C11H13N/c1-8-9(2)12(3)11-7-5-4-6-10(8)11/h4-7H,1-3H3","NRRVOLSTQHJDEG-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)NC(=C2C)C","InChI=1S/C11H13N/c1-7-4-5-11-10(6-7)8(2)9(3)12-11/h4-6,12H,1-3H3","HOFNMMIHFZBKPW-UHFFFAOYSA-N"
"CC1=CC=CC2=C1NC(=C2C)C","InChI=1S/C11H13N/c1-7-5-4-6-10-8(2)9(3)12-11(7)10/h4-6,12H,1-3H3","USKKDNORVCJALM-UHFFFAOYSA-N"
"CC1=C(C2=CC=CC=C2N1)CCN","InChI=1S/C11H14N2/c1-8-9(6-7-12)10-4-2-3-5-11(10)13-8/h2-5,13H,6-7,12H2,1H3","CPVSLHQIPGTMLH-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)NC=C2CCN","InChI=1S/C11H14N2/c1-8-2-3-11-10(6-8)9(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3","PYOUAIQXJALPKW-UHFFFAOYSA-N"
"CC1=CC=CC2=C1NC=C2CCN","InChI=1S/C11H14N2/c1-8-3-2-4-10-9(5-6-12)7-13-11(8)10/h2-4,7,13H,5-6,12H2,1H3","SGGBZKQTWMKXHD-UHFFFAOYSA-N"
"C=CCc(c(C)1)c(C)n(CC=C)n1","InChI=1S/C11H16N2/c1-5-7-11-9(3)12-13(8-6-2)10(11)4/h5-6H,1-2,7-8H2,3-4H3","BYQUXKFPPIMUKC-UHFFFAOYSA-N"
"CCCCCCn(n1)c(C)c([H])c(C)1","InChI=1S/C11H20N2/c1-4-5-6-7-8-13-11(3)9-10(2)12-13/h9H,4-8H2,1-3H3","XTOQAEWQESNBAS-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=O)c(c(C)1)c(C)on1","InChI=1S/C12H11NO2/c1-8-11(9(2)15-13-8)12(14)10-6-4-3-5-7-10/h3-7H,1-2H3","UMVZSCXHLBVSCM-UHFFFAOYSA-N"
"Cc(c(C)1)c(c3)c(c(cc3)2)n(CC2)1","InChI=1S/C12H13N/c1-8-9(2)13-7-6-10-4-3-5-11(8)12(10)13/h3-5H,6-7H2,1-2H3","HMDZEAHDWNDDRP-UHFFFAOYSA-N"
"Cc(n1)c(Cc(c2)cccc2)c(C)o1","InChI=1S/C12H13NO/c1-9-12(10(2)14-13-9)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3","JPBOUNOVBOOVFY-UHFFFAOYSA-N"
"Cc(n1)c(C)c(C)n1c(c2)cccc2","InChI=1S/C12H14N2/c1-9-10(2)13-14(11(9)3)12-7-5-4-6-8-12/h4-8H,1-3H3","UZHVNGNURWBNRG-UHFFFAOYSA-N"
"Cc(n1)c([H])c(C)n(Cc(c2)cccc2)1","InChI=1S/C12H14N2/c1-10-8-11(2)14(13-10)9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3","DDCXNXMLCDHLEU-UHFFFAOYSA-N"
"CC1=C(C(=NN1)C)CC2=CC=CC=C2","InChI=1S/C12H14N2/c1-9-12(10(2)14-13-9)8-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,13,14)","DYXNQVLCTOFNRG-UHFFFAOYSA-N"
"Cc(c2)c(n(C)1)c(cc2)c(C)c(C)1","InChI=1S/C12H15N/c1-8-6-5-7-11-9(2)10(3)13(4)12(8)11/h5-7H,1-4H3","XFMIBSDZPCAMEH-UHFFFAOYSA-N"
"CC(C)(C)C1=CC2=CC=CC=C2N1","InChI=1S/C12H15N/c1-12(2,3)11-8-9-6-4-5-7-10(9)13-11/h4-8,13H,1-3H3","WVPGIDWFLXGCLA-UHFFFAOYSA-N"
"NCCc(c(C)1)c(c2)c(ccc2)n(C)1","InChI=1S/C12H16N2/c1-9-10(7-8-13)11-5-3-4-6-12(11)14(9)2/h3-6H,7-8,13H2,1-2H3","KBEZJUQXXJDBDZ-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)NC(=C2CCN)C","InChI=1S/C12H16N2/c1-8-3-4-12-11(7-8)10(5-6-13)9(2)14-12/h3-4,7,14H,5-6,13H2,1-2H3","CMDMWYFWSISWBT-UHFFFAOYSA-N"
"CC1=CC=CC2=C1NC(=C2CCN)C","InChI=1S/C12H16N2/c1-8-4-3-5-11-10(6-7-13)9(2)14-12(8)11/h3-5,14H,6-7,13H2,1-2H3","MRCZUYPMFAPJQH-UHFFFAOYSA-N"
"CC1=C(C2=C(N1)C=CC(=C2)OC)CCN","InChI=1S/C12H16N2O/c1-8-10(5-6-13)11-7-9(15-2)3-4-12(11)14-8/h3-4,7,14H,5-6,13H2,1-2H3","TYAPSMFCSAKSOR-UHFFFAOYSA-N"
"CC(C2)C(C)N(C2)c(c1)cccc1","InChI=1S/C12H17N/c1-10-8-9-13(11(10)2)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3","RZZBXQJZKKGYHZ-UHFFFAOYSA-N"
"CCCCCC1=NNC2=C1CCCC2","InChI=1S/C12H20N2/c1-2-3-4-8-11-10-7-5-6-9-12(10)14-13-11/h2-9H2,1H3,(H,13,14)","BYZRXJISBWQTJQ-UHFFFAOYSA-N"
"C(C2)CCC(C2)N(C1)C(C)(C)CC1","InChI=1S/C12H23N/c1-12(2)9-6-10-13(12)11-7-4-3-5-8-11/h11H,3-10H2,1-2H3","OCWGOYKRMHQPEV-UHFFFAOYSA-N"
"CC1=C2C3=CC=CC=C3NC2=CC=C1","InChI=1S/C13H11N/c1-9-5-4-8-12-13(9)10-6-2-3-7-11(10)14-12/h2-8,14H,1H3","GNPUIRFDBYALRI-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)NC3=CC=CC=C32","InChI=1S/C13H11N/c1-9-6-7-13-11(8-9)10-4-2-3-5-12(10)14-13/h2-8,14H,1H3","PHKYYUQQYARDIU-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)C3=CC=CC=C3N2","InChI=1S/C13H11N/c1-9-6-7-11-10-4-2-3-5-12(10)14-13(11)8-9/h2-8,14H,1H3","PWJYOTPKLOICJK-UHFFFAOYSA-N"
"CC1=CC=CC2=C1NC3=CC=CC=C23","InChI=1S/C13H11N/c1-9-5-4-7-11-10-6-2-3-8-12(10)14-13(9)11/h2-8,14H,1H3","HIAGSPVAYSSKHL-UHFFFAOYSA-N"
"Cc(c(C)1)n(C3)c(c(CC3)2)c(ccc2)1","InChI=1S/C13H15N/c1-9-10(2)14-8-4-6-11-5-3-7-12(9)13(11)14/h3,5,7H,4,6,8H2,1-2H3","DAYGQMSLWLLBBZ-UHFFFAOYSA-N"
"NCCc(c(C)1)c(c3)c(c(cc3)2)n(CC2)1","InChI=1S/C13H16N2/c1-9-11(5-7-14)12-4-2-3-10-6-8-15(9)13(10)12/h2-4H,5-8,14H2,1H3","HJVGFIVXXPMEQG-UHFFFAOYSA-N"
"Cn(n1)c(C)c(Cc(c2)cccc2)c(C)1","InChI=1S/C13H16N2/c1-10-13(11(2)15(3)14-10)9-12-7-5-4-6-8-12/h4-8H,9H2,1-3H3","QYVBDODVVLOQNZ-UHFFFAOYSA-N"
"Cc(n1)c(C)c(C)n(Cc(c2)cccc2)1","InChI=1S/C13H16N2/c1-10-11(2)14-15(12(10)3)9-13-7-5-4-6-8-13/h4-8H,9H2,1-3H3","KDGAKYBYIHVBDF-UHFFFAOYSA-N"
"c(c2)ccc(c2)CC(C)(C(C)=1)C(C)=NN1","InChI=1S/C13H16N2/c1-10-13(3,11(2)15-14-10)9-12-7-5-4-6-8-12/h4-8H,9H2,1-3H3","DFYZWLUWIIRZOH-UHFFFAOYSA-N"
"Cc(c2)c(c(C)1)c(c(C)c2)n(C)c(C)1","InChI=1S/C13H17N/c1-8-6-7-9(2)13-12(8)10(3)11(4)14(13)5/h6-7H,1-5H3","BXFCMODFVWLTAT-UHFFFAOYSA-N"
"CC(C3)C(C)(c21)C(C)(N3)Nc(cccc2)1","InChI=1S/C13H18N2/c1-9-8-14-13(3)12(9,2)10-6-4-5-7-11(10)15-13/h4-7,9,14-15H,8H2,1-3H3","OIMZBCVZFFYREK-UHFFFAOYSA-N"
"Cc(c3)c(N1)c(cc3)C(C)(C2)C(C)(NC2)1","InChI=1S/C13H18N2/c1-9-5-4-6-10-11(9)15-13(3)12(10,2)7-8-14-13/h4-6,14-15H,7-8H2,1-3H3","ZKBWLNANRNSTME-UHFFFAOYSA-N"
"CC1=CC=CC2=C1NC(=C2CCCN)C","InChI=1S/C13H18N2/c1-9-5-3-6-12-11(7-4-8-14)10(2)15-13(9)12/h3,5-6,15H,4,7-8,14H2,1-2H3","ZZTQWIZGONHNFW-UHFFFAOYSA-N"
"NCCCc(c(C)1)c(c2)c(ccc2)n(C)1","InChI=1S/C13H18N2/c1-10-11(7-5-9-14)12-6-3-4-8-13(12)15(10)2/h3-4,6,8H,5,7,9,14H2,1-2H3","HVHXGAXYEYMESX-UHFFFAOYSA-N"
"COc(c3)c(N1)c(cc3)C(C)(C2)C(C)(NC2)1","InChI=1S/C13H18N2O/c1-12-7-8-14-13(12,2)15-11-9(12)5-4-6-10(11)16-3/h4-6,14-15H,7-8H2,1-3H3","JEXUCNIZYMSPIW-UHFFFAOYSA-N"
"CC1=C(C2=C(N1)C=CC(=C2)OC)CC(C)N","InChI=1S/C13H18N2O/c1-8(14)6-11-9(2)15-13-5-4-10(16-3)7-12(11)13/h4-5,7-8,15H,6,14H2,1-3H3","KQABRKIUSICDLA-UHFFFAOYSA-N"
"CC1=C(C2=C(N1)C=CC(=C2)OC)CCCN","InChI=1S/C13H18N2O/c1-9-11(4-3-7-14)12-8-10(16-2)5-6-13(12)15-9/h5-6,8,15H,3-4,7,14H2,1-2H3","XBGHNWZQUGBIMR-UHFFFAOYSA-N"
"CCCCCCCCn(n1)c(C)cc(C)1","InChI=1S/C13H24N2/c1-4-5-6-7-8-9-10-15-13(3)11-12(2)14-15/h11H,4-10H2,1-3H3","BCDZDZCKKMRPKF-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=CNC3=CC=CC=C32","InChI=1S/C14H11N/c1-2-6-11(7-3-1)13-10-15-14-9-5-4-8-12(13)14/h1-10,15H","XZNGTBLWFCRXKR-UHFFFAOYSA-N"
"Cc(c3)cc(c(C)1)c(c23)n(CCC2)c(C)1","InChI=1S/C14H17N/c1-9-7-12-5-4-6-15-11(3)10(2)13(8-9)14(12)15/h7-8H,4-6H2,1-3H3","CYGAMRLWUSNXFC-UHFFFAOYSA-N"
"NCCc(c(C)1)c(c3)c(c2cc3)n(CCC2)1","InChI=1S/C14H18N2/c1-10-12(7-8-15)13-6-2-4-11-5-3-9-16(10)14(11)13/h2,4,6H,3,5,7-9,15H2,1H3","VDHFYTROGAAQAG-UHFFFAOYSA-N"
"c(c2)cc(c31)C(C)(C4)C(C)(NC4)N(CCc23)1","InChI=1S/C14H18N2/c1-13-7-8-15-14(13,2)16-9-6-10-4-3-5-11(13)12(10)16/h3-5,15H,6-9H2,1-2H3","FVPWHJVDXZFCBO-UHFFFAOYSA-N"
"CC(C)(CCCC1=CNC2=CC=CC=C21)N","InChI=1S/C14H20N2/c1-14(2,15)9-5-6-11-10-16-13-8-4-3-7-12(11)13/h3-4,7-8,10,16H,5-6,9,15H2,1-2H3","OQURMEDKJWNFCU-UHFFFAOYSA-N"
"Cc(c3)cc(c(c3)1)C(C)(C2)C(C)(NCC2)N1","InChI=1S/C14H20N2/c1-10-5-6-12-11(9-10)13(2)7-4-8-15-14(13,3)16-12/h5-6,9,15-16H,4,7-8H2,1-3H3","XBXSGCCGTYQJNS-UHFFFAOYSA-N"
"c(c3)cc(N(C)1)c(c3)C(C)(C2)C(C)(NCC2)1","InChI=1S/C14H20N2/c1-13-9-6-10-15-14(13,2)16(3)12-8-5-4-7-11(12)13/h4-5,7-8,15H,6,9-10H2,1-3H3","MYKQPTVCLARZHD-UHFFFAOYSA-N"
"COc(c3)c(N1)c(cc3)C(C)(C2)C(C)(NCC2)1","InChI=1S/C14H20N2O/c1-13-8-5-9-15-14(13,2)16-12-10(13)6-4-7-11(12)17-3/h4,6-7,15-16H,5,8-9H2,1-3H3","LYDRNZPGJRDFDM-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(n2)c(Br)c(o2)c(c1)cccc1","InChI=1S/C15H10BrNO/c16-13-14(11-7-3-1-4-8-11)17-18-15(13)12-9-5-2-6-10-12/h1-10H","KBTBIQOIEHEJNM-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c2)nc(s2)c(c1)cccc1","InChI=1S/C15H11NS/c1-3-7-12(8-4-1)14-11-17-15(16-14)13-9-5-2-6-10-13/h1-11H","MIECVJDZXBUVSN-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c([H])2)c([H])n(n2)c(c1)cccc1","InChI=1S/C15H12N2/c1-3-7-13(8-4-1)14-11-16-17(12-14)15-9-5-2-6-10-15/h1-12H","CYKVEARUNZRABH-UHFFFAOYSA-N"
"[H]c(n1)c([H])c(c(c3)cccc3)n1c(c2)cccc2","InChI=1S/C15H12N2/c1-3-7-13(8-4-1)15-11-12-16-17(15)14-9-5-2-6-10-14/h1-12H","IDCXLYCLPHRSAZ-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(n1)c([H])c([H])n1c(c2)cccc2","InChI=1S/C15H12N2/c1-3-7-13(8-4-1)15-11-12-17(16-15)14-9-5-2-6-10-14/h1-12H","LQUBXCVRJZGBLM-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=CC(=NN2)C3=CC=CC=C3","InChI=1S/C15H12N2/c1-3-7-12(8-4-1)14-11-15(17-16-14)13-9-5-2-6-10-13/h1-11H,(H,16,17)","JXHKUYQCEJILEI-UHFFFAOYSA-N"
"CC1=C(NC2=CC=CC=C12)C3=CC=CC=C3","InChI=1S/C15H13N/c1-11-13-9-5-6-10-14(13)16-15(11)12-7-3-2-4-8-12/h2-10,16H,1H3","KYAXCYQVBBQQHB-UHFFFAOYSA-N"
"CC1=C(C2=CC=CC=C2N1)C3=CC=CC=C3","InChI=1S/C15H13N/c1-11-15(12-7-3-2-4-8-12)13-9-5-6-10-14(13)16-11/h2-10,16H,1H3","FLOZFGKBZCCIHS-UHFFFAOYSA-N"
"CC1=CC2=C(N1)C(=CC=C2)C3=CC=CC=C3","InChI=1S/C15H13N/c1-11-10-13-8-5-9-14(15(13)16-11)12-6-3-2-4-7-12/h2-10,16H,1H3","NZAAIMVQAOYHBU-UHFFFAOYSA-N"
"CCCCCCCCCC(C2)(C1)OC(C)(CC(=O)2)O1","InChI=1S/C16H28O3/c1-3-4-5-6-7-8-9-10-16-12-14(17)11-15(2,19-16)18-13-16/h3-13H2,1-2H3","PIMWQQQJSCEAQD-UHFFFAOYSA-N"
"O=C(C2)CC(C3)(OC(C)2O3)c(c1)cccc1","InChI=1S/C13H14O3/c1-12-7-11(14)8-13(16-12,9-15-12)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3","JHIJFTFLTBMQRN-UHFFFAOYSA-N"
"CC(=O)Cc(o2)cc(c2)c(c1)cccc1","InChI=1S/C13H12O2/c1-10(14)7-13-8-12(9-15-13)11-5-3-2-4-6-11/h2-6,8-9H,7H2,1H3","KDJQNMWIFZVWFL-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(O1)C(C2)(c(c3)cccc3)OC(C)(CC(=O)2)1","InChI=1S/C19H18O3/c1-18-12-16(20)13-19(22-18,15-10-6-3-7-11-15)17(21-18)14-8-4-2-5-9-14/h2-11,17H,12-13H2,1H3","YVQCQBZLHIQWKW-UHFFFAOYSA-N"
"CC(=O)CC(O2)(C1)OC(c(c4)cccc4)1C(c(c3)cccc3)2","InChI=1S/C19H18O3/c1-14(20)12-18-13-19(22-18,16-10-6-3-7-11-16)17(21-18)15-8-4-2-5-9-15/h2-11,17H,12-13H2,1H3","OQDWTZZQZLFWHR-UHFFFAOYSA-N"
"CCc(c1)oc(CC(C)=O)c1","InChI=1S/C9H12O2/c1-3-8-4-5-9(11-8)6-7(2)10/h4-5H,3,6H2,1-2H3","BAHJLUKBOMFQHQ-UHFFFAOYSA-N"
"C(C3)COC(C3)OC(c(c2)cccc2)C(=O)c(c1)cccc1","InChI=1S/C19H20O3/c20-18(15-9-3-1-4-10-15)19(16-11-5-2-6-12-16)22-17-13-7-8-14-21-17/h1-6,9-12,17,19H,7-8,13-14H2","DNNDHIKCLIZHBH-UHFFFAOYSA-N"
"CCC(C2)(C1)OC(C)(O2)CC(O)1","InChI=1S/C9H16O3/c1-3-9-5-7(10)4-8(2,12-9)11-6-9/h7,10H,3-6H2,1-2H3","VONWIFAYZFAVMY-UHFFFAOYSA-N"
"CCCCCCCCCC(CO)(C1)OC(=O)C(C)C(=O)1","InChI=1S/C16H28O4/c1-3-4-5-6-7-8-9-10-16(12-17)11-14(18)13(2)15(19)20-16/h13,17H,3-12H2,1-2H3","JUMPMZRCHSGMTA-UHFFFAOYSA-N"
"CCCCCCCCCC(COC(C2)OCCC2)(C1)OC(=O)C(C)=C1","InChI=1S/C21H36O4/c1-3-4-5-6-7-8-10-14-21(15-13-18(2)20(22)25-21)17-24-19-12-9-11-16-23-19/h13,19H,3-12,14-17H2,1-2H3","YIWAEGRIRLSFLS-UHFFFAOYSA-N"
"CCCCCCCCCC(COC(C2)OCCC2)(C1)OC(=O)C(C)C(=O)1","InChI=1S/C21H36O5/c1-3-4-5-6-7-8-10-13-21(15-18(22)17(2)20(23)26-21)16-25-19-12-9-11-14-24-19/h17,19H,3-16H2,1-2H3","TTYBVVTXBFJSTC-UHFFFAOYSA-N"
"Cc(c1)c(C2)c(CCC2)o1","InChI=1S/C9H12O/c1-7-6-10-9-5-3-2-4-8(7)9/h6H,2-5H2,1H3","ZQQRACBGKBCNQT-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c1)oc(C2)c(CCC2)1","InChI=1S/C14H14O/c1-2-6-11(7-3-1)14-10-12-8-4-5-9-13(12)15-14/h1-3,6-7,10H,4-5,8-9H2","ADAPEIYATTZSEK-UHFFFAOYSA-N"
"CC(=O)CCC(C3)(C1)C(SCC)(C(=O)2)C(C)(CC3)C(O2)1","InChI=1S/C16H24O3S/c1-4-20-16-13(18)19-12-10-15(16,9-6-11(2)17)8-5-7-14(12,16)3/h12H,4-10H2,1-3H3","QZBZPQKRMKDJFR-UHFFFAOYSA-N"
"CC(=O)CCC(C1)=CC(=O)CC1","InChI=1S/C10H14O2/c1-8(11)5-6-9-3-2-4-10(12)7-9/h7H,2-6H2,1H3","ZBCMIYJESBJOQT-UHFFFAOYSA-N"
"COCOCC(C1)(c32)C([H])(CCc(cc(C(C)C)c(O)c3)2)C(C)(C)CC1","InChI=1S/C22H34O3/c1-15(2)17-11-16-7-8-20-21(3,4)9-6-10-22(20,13-25-14-24-5)18(16)12-19(17)23/h11-12,15,20,23H,6-10,13-14H2,1-5H3/t20-,22-/m0/s1","MODQAVGXDPNSOD-UNMCSNQZSA-N"
"O=C(C3)C(C1)C(C2)C(C3)C(=O)C(C2)1","InChI=1S/C11H14O2/c12-10-4-3-8-7-2-1-6(11(8)13)5-9(7)10/h6-9H,1-5H2","KXAJCRZRVFLWNW-UHFFFAOYSA-N"
"Cc(c1)cc(C2)c(NCC2)c(C)1","InChI=1S/C11H15N/c1-8-6-9(2)11-10(7-8)4-3-5-12-11/h6-7,12H,3-5H2,1-2H3","IIYDCBDQCBTBFF-UHFFFAOYSA-N"
"CCc(c1)cc(C2)c(CCC2)n1","InChI=1S/C11H15N/c1-2-9-7-10-5-3-4-6-11(10)12-8-9/h7-8H,2-6H2,1H3","DTEHQVYSQJDEOP-UHFFFAOYSA-N"
"CC(C)CCc(c1)cnc(C)c1","InChI=1S/C11H17N/c1-9(2)4-6-11-7-5-10(3)12-8-11/h5,7-9H,4,6H2,1-3H3","HCWRYGVKWIWVQM-UHFFFAOYSA-N"
"Cc(c2)ncc(c2)c(c1)cccc1","InChI=1S/C12H11N/c1-10-7-8-12(9-13-10)11-5-3-2-4-6-11/h2-9H,1H3","JXNAIOCJWBJGFQ-UHFFFAOYSA-N"
"[2H]N(C3)Cn(c(C3)1)c(c2)c(ccc2)c(C)1","InChI=1S/C12H14N2/c1-9-10-4-2-3-5-12(10)14-8-13-7-6-11(9)14/h2-5,13H,6-8H2,1H3/i/hD","LLVSTJSKEUSCEP-DYCDLGHISA-N"
"CC1CC2=C(CN1)C3=C(N2)C(=CC=C3)[N+](=O)[O-]","InChI=1S/C12H13N3O2/c1-7-5-10-9(6-13-7)8-3-2-4-11(15(16)17)12(8)14-10/h2-4,7,13-14H,5-6H2,1H3","KKDSSFLSVBMYMO-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(N2)C=CC(=C3)[N+](=O)[O-]","InChI=1S/C12H13N3O2/c1-7-4-12-10(6-13-7)9-5-8(15(16)17)2-3-11(9)14-12/h2-3,5,7,13-14H,4,6H2,1H3","BTGLFBXJWGWNTP-UHFFFAOYSA-N"
"COC(=O)C(=N2)C(CN(C(C)=O)2)c(c1)nccc1","InChI=1S/C12H13N3O3/c1-8(16)15-7-9(10-5-3-4-6-13-10)11(14-15)12(17)18-2/h3-6,9H,7H2,1-2H3","HEXTXACJHZYMDZ-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=CC=CC=C3N2","InChI=1S/C12H14N2/c1-8-6-12-10(7-13-8)9-4-2-3-5-11(9)14-12/h2-5,8,13-14H,6-7H2,1H3","FJQBQOAQRCVZOL-UHFFFAOYSA-N"
"Cc(c21)c(c3)c(ccc3)n(CNCC2)1","InChI=1S/C12H14N2/c1-9-10-4-2-3-5-12(10)14-8-13-7-6-11(9)14/h2-5,13H,6-8H2,1H3","LLVSTJSKEUSCEP-UHFFFAOYSA-N"
"COc(c([N+1]([O-1])=O)2)c(n(C)1)c(cc2)c(C)c(C)1","InChI=1S/C12H14N2O3/c1-7-8(2)13(3)11-9(7)5-6-10(14(15)16)12(11)17-4/h5-6H,1-4H3","HRSSMGVUTYPSFO-UHFFFAOYSA-N"
"COc(c2)c(n(C)1)c(cc2)c(C)c(C)1","InChI=1S/C12H15NO/c1-8-9(2)13(3)12-10(8)6-5-7-11(12)14-4/h5-7H,1-4H3","BGYNKFZIOWEOSF-UHFFFAOYSA-N"
"CC(C)(CC1=CC2=CC=CC=C2N1)N","InChI=1S/C12H16N2/c1-12(2,13)8-10-7-9-5-3-4-6-11(9)14-10/h3-7,14H,8,13H2,1-2H3","ODPJAJNDECUREX-UHFFFAOYSA-N"
"CC1=C(NC2=C1C3=CC(=CN=C3C=C2)[N+](=O)[O-])C","InChI=1S/C13H11N3O2/c1-7-8(2)15-12-4-3-11-10(13(7)12)5-9(6-14-11)16(17)18/h3-6,15H,1-2H3","MLMAMEHPDWJUPS-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=C3C=C(C=NC3=C2)[N+](=O)[O-])C","InChI=1S/C13H11N3O2/c1-7-8(2)15-13-5-12-9(4-11(7)13)3-10(6-14-12)16(17)18/h3-6,15H,1-2H3","DGTVXHLUWZSTMQ-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC3=NC=C(C=C32)[N+](=O)[O-])C","InChI=1S/C13H11N3O2/c1-7-8(2)15-13-10(7)3-4-12-11(13)5-9(6-14-12)16(17)18/h3-6,15H,1-2H3","YIWGZJCOYMLLIP-UHFFFAOYSA-N"
"Cc(c3)cc(c(C)1)c(c3)n(C=2)c(C=CN2)1","InChI=1S/C13H12N2/c1-9-3-4-13-11(7-9)10(2)12-5-6-14-8-15(12)13/h3-8H,1-2H3","AWVNMLAXOCCOIM-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)cc(c(C)1)c(c23)n(CCC2)c(C)1","InChI=1S/C13H14N2O2/c1-8-9(2)14-5-3-4-10-6-11(15(16)17)7-12(8)13(10)14/h6-7H,3-5H2,1-2H3","NCJQZHIMDPIVGX-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC(=C2OC)/C=C/[N+](=O)[O-])C","InChI=1S/C13H14N2O3/c1-8-9(2)14-12-11(8)5-4-10(13(12)18-3)6-7-15(16)17/h4-7,14H,1-3H3/b7-6+","MGUCIGKTOVJJPS-VOTSOKGWSA-N"
"CCOC(=O)c(c(C)1)c(c2[N+1]([O-1])=O)c(ccc2)n(C)1","InChI=1S/C13H14N2O4/c1-4-19-13(16)11-8(2)14(3)9-6-5-7-10(12(9)11)15(17)18/h5-7H,4H2,1-3H3","JASOKHBUQKGMGB-UHFFFAOYSA-N"
"CN(C3)Cn(c(C3)1)c(c2)c(cc(Cl)c2)c(C)1","InChI=1S/C13H15ClN2/c1-9-11-7-10(14)3-4-13(11)16-8-15(2)6-5-12(9)16/h3-4,7H,5-6,8H2,1-2H3","IRZSWPJYGDXTIV-UHFFFAOYSA-N"
"CN(C3)Cn(c(C3)1)c(c2)c(ccc2)c(C)1","InChI=1S/C13H16N2/c1-10-11-5-3-4-6-13(11)15-9-14(2)8-7-12(10)15/h3-6H,7-9H2,1-2H3","YUNDRVUPOZFFJE-UHFFFAOYSA-N"
"Cc(c3)cc(c(C)1)c(c3)n(C2)c(CCN2)1","InChI=1S/C13H16N2/c1-9-3-4-13-11(7-9)10(2)12-5-6-14-8-15(12)13/h3-4,7,14H,5-6,8H2,1-2H3","RHOWSXIKPLWSFK-UHFFFAOYSA-N"
"CCC1CC2=C(CN1)C3=CC=CC=C3N2","InChI=1S/C13H16N2/c1-2-9-7-13-11(8-14-9)10-5-3-4-6-12(10)15-13/h3-6,9,14-15H,2,7-8H2,1H3","NYGCOJYVXSIDNN-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(N2)C(=CC=C3)C","InChI=1S/C13H16N2/c1-8-4-3-5-10-11-7-14-9(2)6-12(11)15-13(8)10/h3-5,9,14-15H,6-7H2,1-2H3","PCKAWONJGXWOLP-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(N2)C=CC(=C3)C","InChI=1S/C13H16N2/c1-8-3-4-12-10(5-8)11-7-14-9(2)6-13(11)15-12/h3-5,9,14-15H,6-7H2,1-2H3","UHEFNLOYNPQQGE-UHFFFAOYSA-N"
"CC1(CC2=C(CN1)C3=CC=CC=C3N2)C","InChI=1S/C13H16N2/c1-13(2)7-12-10(8-14-13)9-5-3-4-6-11(9)15-12/h3-6,14-15H,7-8H2,1-2H3","XODWBZQTJYTGBU-UHFFFAOYSA-N"
"COc(c3)cc(c(C)1)c(c3)n(C2)c(CCN2)1","InChI=1S/C13H16N2O/c1-9-11-7-10(16-2)3-4-13(11)15-8-14-6-5-12(9)15/h3-4,7,14H,5-6,8H2,1-2H3","UUHKIIGORPPPKV-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(N2)C(=CC=C3)OC","InChI=1S/C13H16N2O/c1-8-6-11-10(7-14-8)9-4-3-5-12(16-2)13(9)15-11/h3-5,8,14-15H,6-7H2,1-2H3","BIBQMGHARPUIPI-UHFFFAOYSA-N"
"[O-1][N+1](=O)C(C=3)=Cn(c1)c(C3)cc1c(c2)cccc2","InChI=1S/C14H10N2O2/c17-16(18)14-7-6-13-8-12(9-15(13)10-14)11-4-2-1-3-5-11/h1-10H","MAHPGNZUNZRRFK-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=CNC3=C2C=C(C=C3)[N+](=O)[O-]","InChI=1S/C14H10N2O2/c17-16(18)11-6-7-14-12(8-11)13(9-15-14)10-4-2-1-3-5-10/h1-9,15H","DCNCQDFYTMGSMZ-UHFFFAOYSA-N"
"O=CN(C3)Cn(c(C3)1)c(c2)c(cc(C)c2)c(C)1","InChI=1S/C14H16N2O/c1-10-3-4-14-12(7-10)11(2)13-5-6-15(9-17)8-16(13)14/h3-4,7,9H,5-6,8H2,1-2H3","XBHLAZQVTHHMTM-UHFFFAOYSA-N"
"CC1=C(NC2=C1C=CC(=C2OC)/C=C(/C)\[N+](=O)[O-])C","InChI=1S/C14H16N2O3/c1-8(16(17)18)7-11-5-6-12-9(2)10(3)15-13(12)14(11)19-4/h5-7,15H,1-4H3/b8-7-","QBFAGEORWGZEPB-FPLPWBNLSA-N"
"CCOC(=O)c(c(C)1)c(c2)c(c(C)c([N+1]([O-1])=O)c2)n(C)1","InChI=1S/C14H16N2O4/c1-5-20-14(17)12-9(3)15(4)13-8(2)11(16(18)19)7-6-10(12)13/h6-7H,5H2,1-4H3","SSYHHCUKTLJWLV-UHFFFAOYSA-N"
"CCOC(=O)c(c(C)1)c(c([N+1]([O-1])=O)2)c(c(C)cc2)n(C)1","InChI=1S/C14H16N2O4/c1-5-20-14(17)11-9(3)15(4)13-8(2)6-7-10(12(11)13)16(18)19/h6-7H,5H2,1-4H3","OTGJOVPKDZGPDA-UHFFFAOYSA-N"
"CCOC(=O)c(c(C)1)c(c2)c(cc([N+1]([O-1])=O)c(C)2)n(C)1","InChI=1S/C14H16N2O4/c1-5-20-14(17)13-9(3)15(4)12-7-11(16(18)19)8(2)6-10(12)13/h6-7H,5H2,1-4H3","IKVOYGADRHGINX-UHFFFAOYSA-N"
"CC(N(C)3)Cc(c(C)1)n(C3)c(c2)c(ccc2)1","InChI=1S/C14H18N2/c1-10-8-14-11(2)12-6-4-5-7-13(12)16(14)9-15(10)3/h4-7,10H,8-9H2,1-3H3","JQEUCWFQSSDQFQ-UHFFFAOYSA-N"
"CN(C3)Cn(c(C3)1)c(c2)c(cc(C)c2)c(C)1","InChI=1S/C14H18N2/c1-10-4-5-14-12(8-10)11(2)13-6-7-15(3)9-16(13)14/h4-5,8H,6-7,9H2,1-3H3","DJHRDZZCULOFNW-UHFFFAOYSA-N"
"CC1C2=C(CC(N1)(C)C)NC3=CC=CC=C32","InChI=1S/C14H18N2/c1-9-13-10-6-4-5-7-11(10)15-12(13)8-14(2,3)16-9/h4-7,9,15-16H,8H2,1-3H3","PYPDALXSANBYIO-UHFFFAOYSA-N"
"COc(c3)cc(c(C)1)c(c3)n(C2)c(CCN(C)2)1","InChI=1S/C14H18N2O/c1-10-12-8-11(17-3)4-5-14(12)16-9-15(2)7-6-13(10)16/h4-5,8H,6-7,9H2,1-3H3","IYRHEXXMQLCBLI-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C(=O)C2=CNC3=CC=CC=C32","InChI=1S/C15H11NO/c17-15(11-6-2-1-3-7-11)13-10-16-14-9-5-4-8-12(13)14/h1-10,16H","ADHQLIGSIQGNBW-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C(=O)C2=CC3=CC=CC=C3N2","InChI=1S/C15H11NO/c17-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)16-14/h1-10,16H","RLGAYEJPGHIHIB-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(c(c3)1)c(c2)c(ccc2)n(C)1","InChI=1S/C15H13NO/c1-10(17)11-7-8-15-13(9-11)12-5-3-4-6-14(12)16(15)2/h3-9H,1-2H3","RMOVJQZTZDJESW-UHFFFAOYSA-N"
"CCOC(=O)c(c(C)1)c(c3)c(c2c([N+1]([O-1])=O)c3)n(CCC2)1","InChI=1S/C15H16N2O4/c1-3-21-15(18)13-9(2)16-8-4-5-10-12(17(19)20)7-6-11(13)14(10)16/h6-7H,3-5,8H2,1-2H3","LVPQPHQRBMXNOL-UHFFFAOYSA-N"
"CCOC(=O)c(c(C)1)c(c([N+1]([O-1])=O)3)c(c2cc3)n(CCC2)1","InChI=1S/C15H16N2O4/c1-3-21-15(18)12-9(2)16-8-4-5-10-6-7-11(17(19)20)13(12)14(10)16/h6-7H,3-5,8H2,1-2H3","XLJJGPJLOJYXLV-UHFFFAOYSA-N"
"Cc(c3)cc(c(C)1)c(c3)n(C2)c(C(C)CN(C)2)1","InChI=1S/C15H20N2/c1-10-5-6-14-13(7-10)12(3)15-11(2)8-16(4)9-17(14)15/h5-7,11H,8-9H2,1-4H3","HTBMELNGEQHKCP-UHFFFAOYSA-N"
"CCCC1CC2=C(CN1)C3=C(N2)C(=CC=C3)C","InChI=1S/C15H20N2/c1-3-5-11-8-14-13(9-16-11)12-7-4-6-10(2)15(12)17-14/h4,6-7,11,16-17H,3,5,8-9H2,1-2H3","PMLQZTSHQIVGOM-UHFFFAOYSA-N"
"CC1(CC2=C(C3=CC=CC=C3N2)C(N1)(C)C)C","InChI=1S/C15H20N2/c1-14(2)9-12-13(15(3,4)17-14)10-7-5-6-8-11(10)16-12/h5-8,16-17H,9H2,1-4H3","KTRMOHGEUZMGAM-UHFFFAOYSA-N"
"CC1C2=C(CC(N1)(C)C)NC3=C2C=C(C=C3)OC","InChI=1S/C15H20N2O/c1-9-14-11-7-10(18-4)5-6-12(11)16-13(14)8-15(2,3)17-9/h5-7,9,16-17H,8H2,1-4H3","LYLHTAZPCNSJCK-UHFFFAOYSA-N"
"CC1(CC2=C(C3=C(N2)C=CC(=C3)O)C(N1)(C)C)C","InChI=1S/C15H20N2O/c1-14(2)8-12-13(15(3,4)17-14)10-7-9(18)5-6-11(10)16-12/h5-7,16-18H,8H2,1-4H3","VIROFEQDUJPDTE-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)c(c([2H])1)n(C)c(c2)c(ccc2)1","InChI=1S/C16H13NO/c1-17-14-10-6-5-9-13(14)11-15(17)16(18)12-7-3-2-4-8-12/h2-11H,1H3/i11D","NMPRIZDUHXAJTF-WORMITQPSA-N"
"c(c3)ccc(c3)C(=O)c(c([H])1)n(C)c(c2)c(ccc2)1","InChI=1S/C16H13NO/c1-17-14-10-6-5-9-13(14)11-15(17)16(18)12-7-3-2-4-8-12/h2-11H,1H3","NMPRIZDUHXAJTF-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)c(c([H])1)c(c2)c(ccc2)n(C)1","InChI=1S/C16H13NO/c1-17-11-14(13-9-5-6-10-15(13)17)16(18)12-7-3-2-4-8-12/h2-11H,1H3","STRIBORQTQQOGQ-UHFFFAOYSA-N"
"CCC(C)C(=C1)C(=O)NC(=O)N1","InChI=1S/C8H12N2O2/c1-3-5(2)6-4-9-8(12)10-7(6)11/h4-5H,3H2,1-2H3,(H2,9,10,11,12)","WJJQDMCCKSOEST-UHFFFAOYSA-N"
"N#Cc(c(Cl)1)c(Cl)ncn1","InChI=1S/C5HCl2N3/c6-4-3(1-8)5(7)10-2-9-4/h2H","IPEBKIMUIHKZJP-UHFFFAOYSA-N"
"Nc(c1)cnc(n1)S(C)(=O)=O","InChI=1S/C5H7N3O2S/c1-11(9,10)5-7-2-4(6)3-8-5/h2-3H,6H2,1H3","ZELVQVPQIRFOQU-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)c(n1)nccc1","InChI=1S/C10H7FN2/c11-9-4-2-8(3-5-9)10-12-6-1-7-13-10/h1-7H","OAJZNBBXWMPPNU-UHFFFAOYSA-N"
"Fc(c2)cc(cc2)c(n1)nccc1","InChI=1S/C10H7FN2/c11-9-4-1-3-8(7-9)10-12-5-2-6-13-10/h1-7H","AWFZHOCQRKLVCJ-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)c(c1)ncnc1","InChI=1S/C10H7FN2/c11-9-3-1-8(2-4-9)10-5-6-12-7-13-10/h1-7H","DPALDESLDSLUGD-UHFFFAOYSA-N"
"Fc(c2)cc(cc2)c(c1)ncnc1","InChI=1S/C10H7FN2/c11-9-3-1-2-8(6-9)10-4-5-12-7-13-10/h1-7H","WHCSLDOSGQOORQ-UHFFFAOYSA-N"
"CC(=C1)N=C(C=2)N(C(C)=CC2)C(=O)1","InChI=1S/C10H10N2O/c1-7-6-10(13)12-8(2)4-3-5-9(12)11-7/h3-6H,1-2H3","UPQKNTNJVQSGIH-UHFFFAOYSA-N"
"CC(=C1)C(=O)N(C(C)=2)C(C=CC2)=N1","InChI=1S/C10H10N2O/c1-7-6-11-9-5-3-4-8(2)12(9)10(7)13/h3-6H,1-2H3","VNZAABOALQMGKL-UHFFFAOYSA-N"
"CC(=C1)C(=O)N(C(C)2)C(CCC2)=N1","InChI=1S/C10H14N2O/c1-7-6-11-9-5-3-4-8(2)12(9)10(7)13/h6,8H,3-5H2,1-2H3","QLENPRKQIFCBST-UHFFFAOYSA-N"
"CN(C)C=Nc(c1)cnc(Cl)n1","InChI=1S/C7H9ClN4/c1-12(2)5-11-6-3-9-7(8)10-4-6/h3-5H,1-2H3/b11-5+","PIJYDARGDRWFFF-VZUCSPMQSA-N"
"O=C(N1)NC(=O)C(=C1)[Si](C)(C)C","InChI=1S/C7H12N2O2Si/c1-12(2,3)5-4-8-7(11)9-6(5)10/h4H,1-3H3,(H2,8,9,10,11)","ZBCOQAVPBYMQCH-UHFFFAOYSA-N"
"[O-1][n+1](c2)c(N)nc(c2)c(c1)cccc1","InChI=1S/C10H9N3O/c11-10-12-9(6-7-13(10)14)8-4-2-1-3-5-8/h1-7H,(H2,11,12)","YWRVUPYBXNCILR-UHFFFAOYSA-N"
"CCC(=C2)N(C(=O)1)C(C=C2)=NC(C)=C1","InChI=1S/C11H12N2O/c1-3-9-5-4-6-10-12-8(2)7-11(14)13(9)10/h4-7H,3H2,1-2H3","FMOMCNYIHPIKJZ-UHFFFAOYSA-N"
"CCC(=C1)C(=O)N(C(C)=2)C(C=CC2)=N1","InChI=1S/C11H12N2O/c1-3-9-7-12-10-6-4-5-8(2)13(10)11(9)14/h4-7H,3H2,1-2H3","JWAOHFWSXYKAAQ-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)C(=N1)NC(=O)C=C1","InChI=1S/C10H7FN2O/c11-8-3-1-7(2-4-8)10-12-6-5-9(14)13-10/h1-6H,(H,12,13,14)","SLVBPLUHJQMEAO-UHFFFAOYSA-N"
"O=C(C=2)NC(=NC2)c(c1)cc(F)cc1","InChI=1S/C10H7FN2O/c11-8-3-1-2-7(6-8)10-12-5-4-9(14)13-10/h1-6H,(H,12,13,14)","ARWFGZSZTLFUEI-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)C(N=1)=CC(=O)NC1","InChI=1S/C10H7FN2O/c11-8-3-1-7(2-4-8)9-5-10(14)13-6-12-9/h1-6H,(H,12,13,14)","UWDUMRWLLYZYBY-UHFFFAOYSA-N"
"O=C(N2)C=C(N=C2)c(c1)cc(F)cc1","InChI=1S/C10H7FN2O/c11-8-3-1-2-7(4-8)9-5-10(14)13-6-12-9/h1-6H,(H,12,13,14)","YWRPJIHIQQSAFE-UHFFFAOYSA-N"
"NC(=O)c(c(Cl)1)c(Cl)ncn1","InChI=1S/C5H3Cl2N3O/c6-3-2(5(8)11)4(7)10-1-9-3/h1H,(H2,8,11)","QYAHLZVZKDGUAW-UHFFFAOYSA-N"
"[H]C(N=3)=C([H])C(=O)N(C31)c(c2)c(ccc2)C([H])=C([H])1","InChI=1S/C12H8N2O/c15-12-7-8-13-11-6-5-9-3-1-2-4-10(9)14(11)12/h1-8H","AWTLDKNXRRLNGA-UHFFFAOYSA-N"
"N#Cc(c2)ccc(c2)c(n1)ncc(N)c1","InChI=1S/C11H8N4/c12-5-8-1-3-9(4-2-8)11-14-6-10(13)7-15-11/h1-4,6-7H,13H2","ZUHYODFJXMGYJE-UHFFFAOYSA-N"
"CN(C)C=Nc(c1)cnc(SC)n1","InChI=1S/C8H12N4S/c1-12(2)6-11-7-4-9-8(13-3)10-5-7/h4-6H,1-3H3/b11-6+","MDKISTZNRFJSFI-IZZDOVSWSA-N"
"N#Cc(n2)cc(nc2)c(c1)ccc(F)c1","InChI=1S/C11H6FN3/c12-9-3-1-8(2-4-9)11-5-10(6-13)14-7-15-11/h1-5,7H","XXGFPXWXJUQRRQ-UHFFFAOYSA-N"
"N#Cc(n2)nc(cc2)c(c1)ccc(F)c1","InChI=1S/C11H6FN3/c12-9-3-1-8(2-4-9)10-5-6-14-11(7-13)15-10/h1-6H","AVDFWALSDCMETF-UHFFFAOYSA-N"
"OC(=O)CC(=C1)C(=O)N(C=2)C(C=CC2)=N1","InChI=1S/C10H8N2O3/c13-9(14)5-7-6-11-8-3-1-2-4-12(8)10(7)15/h1-4,6H,5H2,(H,13,14)","RFQRASOBVQPNQC-UHFFFAOYSA-N"
"COc(n2)cc(nc2)c(c1)cc(F)cc1","InChI=1S/C11H9FN2O/c1-15-11-6-10(13-7-14-11)8-3-2-4-9(12)5-8/h2-7H,1H3","HRLQGXQHZGPTEA-UHFFFAOYSA-N"
"Clc(n2)cc([n+1]([O-1])c2)c(c1)cccc1","InChI=1S/C10H7ClN2O/c11-10-6-9(13(14)7-12-10)8-4-2-1-3-5-8/h1-7H","GOCVTCXBBBFQTJ-UHFFFAOYSA-N"
"Oc(c2)c(ccc2)c(c1)nc(Cl)nc1","InChI=1S/C10H7ClN2O/c11-10-12-6-5-8(13-10)7-3-1-2-4-9(7)14/h1-6,14H","SERWHLJYMARUJU-UHFFFAOYSA-N"
"O=NCC(=N1)C=C(NC(=O)1)C(F)(F)F","InChI=1S/C6H4F3N3O2/c7-6(8,9)4-1-3(2-10-14)11-5(13)12-4/h1H,2H2,(H,11,12,13)","VQFOOOKODWVMRH-UHFFFAOYSA-N"
"NC(=O)C(=C1)C(=O)N(C(C)2)C(CCC2)=N1","InChI=1S/C10H13N3O2/c1-6-3-2-4-8-12-5-7(9(11)14)10(15)13(6)8/h5-6H,2-4H2,1H3,(H2,11,14)","MJEOKLXWKIUJQD-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)c(c1)nc(Cl)nc1","InChI=1S/C10H6ClFN2/c11-10-13-6-5-9(14-10)7-1-3-8(12)4-2-7/h1-6H","DGTAWQNEBOGYLH-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)c(n1)cc(Cl)nc1","InChI=1S/C10H6ClFN2/c11-10-5-9(13-6-14-10)7-1-3-8(12)4-2-7/h1-6H","KYBYBOZNMFRRSF-UHFFFAOYSA-N"
"Fc(c2)cc(cc2)c(n1)cc(Cl)nc1","InChI=1S/C10H6ClFN2/c11-10-5-9(13-6-14-10)7-2-1-3-8(12)4-7/h1-6H","HFGCFWZSUWARQE-UHFFFAOYSA-N"
"OC(=O)C(=C1)C(=O)N(C(C)2)C(CCC2)=N1","InChI=1S/C10H12N2O3/c1-6-3-2-4-8-11-5-7(10(14)15)9(13)12(6)8/h5-6H,2-4H2,1H3,(H,14,15)","KOXNRJHZWXSKMF-UHFFFAOYSA-N"
"OC(=O)CC(=C1)C(=O)N(C2)C(CCC2)=N1","InChI=1S/C10H12N2O3/c13-9(14)5-7-6-11-8-3-1-2-4-12(8)10(7)15/h6H,1-5H2,(H,13,14)","MIMCZKZOXPTTSU-UHFFFAOYSA-N"
"NC(=O)C(=C1)C(=O)N(C(C)2)C(CCC2)N1","InChI=1S/C10H15N3O2/c1-6-3-2-4-8-12-5-7(9(11)14)10(15)13(6)8/h5-6,8,12H,2-4H2,1H3,(H2,11,14)","UWAODFKLWXEVDH-UHFFFAOYSA-N"
"O=C(O1)N=C(N=2)N(C=CC2c(c3)cccc3)1","InChI=1S/C11H7N3O2/c15-11-13-10-12-9(6-7-14(10)16-11)8-4-2-1-3-5-8/h1-7H","LOVGUMOTBPBRIX-UHFFFAOYSA-N"
"NC(=O)Cc(n2)nc(cc2)c(c1)cccc1","InChI=1S/C12H11N3O/c13-11(16)8-12-14-7-6-10(15-12)9-4-2-1-3-5-9/h1-7H,8H2,(H2,13,16)","UAJUIJVWCSVKEA-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc(c(O)c2)c(c1)ncnc1","InChI=1S/C10H7N3O3/c14-10-2-1-7(13(15)16)5-8(10)9-3-4-11-6-12-9/h1-6,14H","BCOZEBFOJIVOOU-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)c(c1)nc(nc1)N(C)C","InChI=1S/C12H12FN3/c1-16(2)12-14-8-7-11(15-12)9-3-5-10(13)6-4-9/h3-8H,1-2H3","HWSMMLHOCMQSRL-UHFFFAOYSA-N"
"CN(C)c(c2)nc(nc2)c(c1)ccc(F)c1","InChI=1S/C12H12FN3/c1-16(2)11-7-8-14-12(15-11)9-3-5-10(13)6-4-9/h3-8H,1-2H3","ZOWCHJPRKFSBHL-UHFFFAOYSA-N"
"CN(C)c(c2)nc(nc2)c(c1)cc(F)cc1","InChI=1S/C12H12FN3/c1-16(2)11-6-7-14-12(15-11)9-4-3-5-10(13)8-9/h3-8H,1-2H3","MCSYTOGAMSREKT-UHFFFAOYSA-N"
"OC(=O)CC(=C1)C(=O)N(C(C)=2)C(C=CC2)=N1","InChI=1S/C11H10N2O3/c1-7-3-2-4-9-12-6-8(5-10(14)15)11(16)13(7)9/h2-4,6H,5H2,1H3,(H,14,15)","XIXNFCBRYVASGT-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C=2)C(C=CC2)=N1","InChI=1S/C11H10N2O3/c1-2-16-11(15)8-7-12-9-5-3-4-6-13(9)10(8)14/h3-7H,2H2,1H3","LURYFDMBWJWDQH-UHFFFAOYSA-N"
"NC(=O)C(=C([H])1)C(=O)N(C(C)2)C(=C([H])CC2)N(C)1","InChI=1S/C11H15N3O2/c1-7-4-3-5-9-13(2)6-8(10(12)15)11(16)14(7)9/h5-7H,3-4H2,1-2H3,(H2,12,15)","OVTCEDCBXAYKQZ-UHFFFAOYSA-N"
"OC(=O)CC(=C1)C(=O)N(C(C)2)C(CCC2)=N1","InChI=1S/C11H14N2O3/c1-7-3-2-4-9-12-6-8(5-10(14)15)11(16)13(7)9/h6-7H,2-5H2,1H3,(H,14,15)","QNQLQKRDBLQOEZ-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C2)C(CCC2)=N1","InChI=1S/C11H14N2O3/c1-2-16-11(15)8-7-12-9-5-3-4-6-13(9)10(8)14/h7H,2-6H2,1H3","GRBTZPKCTXIBMP-UHFFFAOYSA-N"
"OC(=O)C(=C([H])1)C(=O)N(C(C)2)C(=C([H])CC2)N(C)1","InChI=1S/C11H14N2O3/c1-7-4-3-5-9-12(2)6-8(11(15)16)10(14)13(7)9/h5-7H,3-4H2,1-2H3,(H,15,16)","FVBPWWTWFCTXFK-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C2)C(CCC2)N1","InChI=1S/C11H16N2O3/c1-2-16-11(15)8-7-12-9-5-3-4-6-13(9)10(8)14/h7,9,12H,2-6H2,1H3","SVKDPZQTITZACV-UHFFFAOYSA-N"
"CN(C)C=Nc(c1)cnc(n1)S(C)(=O)=O","InChI=1S/C8H12N4O2S/c1-12(2)6-11-7-4-9-8(10-5-7)15(3,13)14/h4-6H,1-3H3/b11-6+","NAYHQVNVFIYDAF-IZZDOVSWSA-N"
"COc(c2)ccc(c2)c(n1)ncc([N+1]([O-1])=O)c1","InChI=1S/C11H9N3O3/c1-17-10-4-2-8(3-5-10)11-12-6-9(7-13-11)14(15)16/h2-7H,1H3","JLTGSEDKVYQMJR-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C(C)=2)C(C=CC2)=N1","InChI=1S/C12H12N2O3/c1-3-17-12(16)9-7-13-10-6-4-5-8(2)14(10)11(9)15/h4-7H,3H2,1-2H3","ZLYHSYOPYSDSHB-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C=2)C(C=CC(C)2)=N1","InChI=1S/C12H12N2O3/c1-3-17-12(16)9-6-13-10-5-4-8(2)7-14(10)11(9)15/h4-7H,3H2,1-2H3","LVRKSDQLEQQBHH-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C=2)C(C=C(C)C2)=N1","InChI=1S/C12H12N2O3/c1-3-17-12(16)9-7-13-10-6-8(2)4-5-14(10)11(9)15/h4-7H,3H2,1-2H3","BHAQEKYGTIQOGF-UHFFFAOYSA-N"
"CCOC(=O)C(=C2)C(=O)N(C=1)C(=N2)C(C)=CC1","InChI=1S/C12H12N2O3/c1-3-17-12(16)9-7-13-10-8(2)5-4-6-14(10)11(9)15/h4-7H,3H2,1-2H3","ZXNPJNYRDHFJBV-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C=2)C(C=CC2)=N1","InChI=1S/C12H12N2O3/c1-2-17-11(15)7-9-8-13-10-5-3-4-6-14(10)12(9)16/h3-6,8H,2,7H2,1H3","YGTOZAFCXGHMCT-UHFFFAOYSA-N"
"CCOC(=O)C(=C2)C(=O)N(C=1)C(=N2)C(O)=CC1","InChI=1S/C11H10N2O4/c1-2-17-11(16)7-6-12-9-8(14)4-3-5-13(9)10(7)15/h3-6,14H,2H2,1H3","YSOFEUXECYEGGL-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc(cc2)c(n1)nc(Cl)cc1","InChI=1S/C10H6ClN3O2/c11-9-4-5-12-10(13-9)7-2-1-3-8(6-7)14(15)16/h1-6H","CXDJXNOXJBOUQW-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C2)C(CCC2)=N1","InChI=1S/C12H16N2O3/c1-2-17-11(15)7-9-8-13-10-5-3-4-6-14(10)12(9)16/h8H,2-7H2,1H3","GPICITVVVLYZNF-UHFFFAOYSA-N"
"CCOC(=O)C(=C([H])1)C(=O)N(C2)C(=C([H])CC2)N(C)1","InChI=1S/C12H16N2O3/c1-3-17-12(16)9-8-13(2)10-6-4-5-7-14(10)11(9)15/h6,8H,3-5,7H2,1-2H3","RHEPHABEOUOQOY-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=C1)C(=O)N(C(C)=2)C(C=CC2)=N1","InChI=1S/C15H12N2O/c1-11-6-5-9-14-16-10-13(15(18)17(11)14)12-7-3-2-4-8-12/h2-10H,1H3","IWZFFFOCUCZNBH-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C(C)2)C(CCC2)N1","InChI=1S/C12H18N2O3/c1-3-17-12(16)9-7-13-10-6-4-5-8(2)14(10)11(9)15/h7-8,10,13H,3-6H2,1-2H3","LRNCBUQKZLZXAV-UHFFFAOYSA-N"
"OC(=O)C(=C([H])3)C(=O)N(C(=N3)1)c(c2)c(ccc2)C([H])=C([H])1","InChI=1S/C13H8N2O3/c16-12-9(13(17)18)7-14-11-6-5-8-3-1-2-4-10(8)15(11)12/h1-7H,(H,17,18)","PBPJARVCNLMOJA-UHFFFAOYSA-N"
"OC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)CC1","InChI=1S/C13H10N2O3/c16-12-9(13(17)18)7-14-11-6-5-8-3-1-2-4-10(8)15(11)12/h1-4,7H,5-6H2,(H,17,18)","MLXRYOPMMKQPES-UHFFFAOYSA-N"
"CC(=O)OCC(OC(C)=O)C(OC)C(OC)C(OC)C([H])([2H])OC(C)=O","InChI=1S/C15H26O9/c1-9(16)22-7-12(19-4)14(20-5)15(21-6)13(24-11(3)18)8-23-10(2)17/h12-15H,7-8H2,1-6H3/i7D","RUAAXNGDIMCTCD-WHRKIXHSSA-N"
"COCC(OC)C(OC(C)=O)C(OC)C(COC)N(C)C(C)=O","InChI=1S/C15H29NO7/c1-10(17)16(3)12(8-19-4)14(22-7)15(23-11(2)18)13(21-6)9-20-5/h12-15H,8-9H2,1-7H3","TZHLYKLJDVRHJC-UHFFFAOYSA-N"
"COCC(OC(C)=O)C(OC(C)=O)C(OC)C(OC(C)=O)C([H])([2H])OC(C)=O","InChI=1S/C16H26O10/c1-9(17)23-8-14(25-11(3)19)15(22-6)16(26-12(4)20)13(7-21-5)24-10(2)18/h13-16H,7-8H2,1-6H3/i8D","BWFYMIDEWZXNAH-BNEYPBHNSA-N"
"CC(=O)OCC(OC(C)=O)C(OC)C(OC(C)=O)C(OC)C([2H])OC(C)=O","InChI=1S/C16H26O10/c1-9(17)23-7-13(21-5)16(26-12(4)20)15(22-6)14(25-11(3)19)8-24-10(2)18/h13-16H,7-8H2,1-6H3/i7D","LYLOENTWFQIZDS-WHRKIXHSSA-N"
"COCC(OC(C)=O)C(OC)C(OC)C(N(C)C(C)=O)C([H])([2H])OC(C)=O","InChI=1S/C16H29NO8/c1-10(18)17(4)13(8-24-11(2)19)15(22-6)16(23-7)14(9-21-5)25-12(3)20/h13-16H,8-9H2,1-7H3/i8D","VQVCINYAHOCEMY-BNEYPBHNSA-N"
"COCC(OC(C)=O)C(OC(C)=O)C(OC)C(C([2H])OC(C)=O)N(C)C(C)=O","InChI=1S/C17H29NO9/c1-10(19)18(5)14(8-25-11(2)20)16(24-7)17(27-13(4)22)15(9-23-6)26-12(3)21/h14-17H,8-9H2,1-7H3/i8D","AWYJVKOIRCMUHE-BNEYPBHNSA-N"
"COCC(OC(C)=O)C(OC)C(OC)C(OC)C([H])([2H])OC(C)=O","InChI=1S/C14H26O8/c1-9(15)21-8-11(18-4)13(19-5)14(20-6)12(7-17-3)22-10(2)16/h11-14H,7-8H2,1-6H3/i8D","OVCJDQPBVXUBBF-BNEYPBHNSA-N"
"COCC(OC(C)=O)C(OC)C(OC)C(OC(C)=O)C([H])([2H])OC(C)=O","InChI=1S/C15H26O9/c1-9(16)22-8-13(24-11(3)18)15(21-6)14(20-5)12(7-19-4)23-10(2)17/h12-15H,7-8H2,1-6H3/i8D","JTIPYRUUQYKTIG-BNEYPBHNSA-N"
"CC(=O)OCC(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(OC)C([2H])OC(C)=O","InChI=1S/C17H26O11/c1-9(18)24-7-14(23-6)16(27-12(4)21)17(28-13(5)22)15(26-11(3)20)8-25-10(2)19/h14-17H,7-8H2,1-6H3/i7D","ICWCFTONPLAURK-WHRKIXHSSA-N"
"CC(C)CCCCCCCCCC(CC)CCC(=O)OCc(c1)cncc1","InChI=1S/C24H41NO2/c1-4-22(14-11-9-7-5-6-8-10-13-21(2)3)16-17-24(26)27-20-23-15-12-18-25-19-23/h12,15,18-19,21-22H,4-11,13-14,16-17,20H2,1-3H3","CKNSXXBZIRRIDD-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C20H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-15-20(22)23-18-19-14-13-16-21-17-19/h13-14,16-17H,2-12,15,18H2,1H3","UWHPETZHONZXLA-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C21H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-21(23)24-19-20-15-14-17-22-18-20/h14-15,17-18H,2-13,16,19H2,1H3","UTNGTSRXVAVXCM-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-22(24)25-20-21-16-15-18-23-19-21/h15-16,18-19H,2-14,17,20H2,1H3","BCEVKZRDQYYDNQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C24H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h17-18,20-21H,2-16,19,22H2,1H3","MSCVPMAJZWQQRO-UHFFFAOYSA-N"
"CCCCCCCCC([H])=C([H])CCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C24H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h9-10,17-18,20-21H,2-8,11-16,19,22H2,1H3/b10-9-","FBPJZADLPOSZEO-KTKRTIGZSA-N"
"CCCCCC([H])=C([H])CC([H])=C([H])CCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C24H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h6-7,9-10,17-18,20-21H,2-5,8,11-16,19,22H2,1H3/b7-6-,10-9-","CBIJRFCIJWDVAB-HZJYTTRNSA-N"
"CCCCCCCC([H])=C([H])CCCCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C26H43NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-26(28)29-24-25-20-19-22-27-23-25/h8-9,19-20,22-23H,2-7,10-18,21,24H2,1H3/b9-8-","RNIJINVRVTTYCR-HJWRWDBZSA-N"
"C(C([H])14)C(OC(=O)c(c5)cccc5)CCC1(C)C(C(CC4)3)CCC(C)(C23)C(C(CCCC(C)C)C)CC2","InChI=1S/C34H52O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-13,23-24,26-31H,9-11,14-22H2,1-5H3/t24-,26+,27+,28?,29?,30?,31?,33+,34-/m1/s1","YVXZAWFNDQLXBU-BUTIHPCESA-N"
"C(C([H])14)C(OC(=O)c(c5)cccc5)CCC1(C)C(C(CC4)3)CCC(C)(C23)C(C(CCCC(C)C)C)CC2","InChI=1S/C34H52O2/c1-23(2)10-9-11-24(3)29-16-17-30-28-15-14-26-22-27(36-32(35)25-12-7-6-8-13-25)18-20-33(26,4)31(28)19-21-34(29,30)5/h6-8,12-13,23-24,26-31H,9-11,14-22H2,1-5H3/t24-,26+,27-,28?,29?,30?,31?,33+,34-/m1/s1","YVXZAWFNDQLXBU-YVYPUYPBSA-N"
"CCOC(N)=O","InChI=1S/C3H7NO2/c1-2-6-3(4)5/h2H2,1H3,(H2,4,5)","JOYRKODLDBILNP-UHFFFAOYSA-N"
"COc(c(O)1)c([2H])c(c([2H])c([2H])1)C([2H])([2H])C(O)=O","InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12)/i2D,3D,4D,5D2","QRMZSPFSDQBLIX-DVHRWRHBSA-N"
"S=C=NC([2H])([2H])C([2H])([2H])c(c1)cccc1","InChI=1S/C9H9NS/c11-8-10-7-6-9-4-2-1-3-5-9/h1-5H,6-7H2/i6D2,7D2","IZJDOKYDEWTZSO-KXGHAPEVSA-N"
"C(C1([H])O[Si](C)(C)C)(C(C(C(C1([H])O[Si](C)(C)C)([H])O[Si](C)(C)C)([H])O[Si](C)(C)C)([H])O[Si](C)(C)C)([H])O[Si](C)(C)C","InChI=1S/C24H60O6Si6/c1-31(2,3)25-19-20(26-32(4,5)6)22(28-34(10,11)12)24(30-36(16,17)18)23(29-35(13,14)15)21(19)27-33(7,8)9/h19-24H,1-18H3/t19-,20-,21-,22+,23-,24-","FRTKXRNTVMCAKI-HPEVMFQJSA-N"
"C[N+](C)(C)C1=CC=CC=C1.[Br-]","InChI=1S/C9H14N.BrH/c1-10(2,3)9-7-5-4-6-8-9;/h4-8H,1-3H3;1H/q+1;/p-1","GNMJFQWRASXXMS-UHFFFAOYSA-M"
"CC[N+](CC)(CC)CC.[I-]","InChI=1S/C8H20N.HI/c1-5-9(6-2,7-3)8-4;/h5-8H2,1-4H3;1H/q+1;/p-1","UQFSVBXCNGCBBW-UHFFFAOYSA-M"
"C[N+](C)(C)C.[I-]","InChI=1S/C4H12N.HI/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1","RXMRGBVLCSYIBO-UHFFFAOYSA-M"
"C[N+](C)(C)C.[Cl-]","InChI=1S/C4H12N.ClH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1","OKIZCWYLBDKLSU-UHFFFAOYSA-M"
"C[N+](C)(C)C=C.[Br-]","InChI=1S/C5H12N.BrH/c1-5-6(2,3)4;/h5H,1H2,2-4H3;1H/q+1;/p-1","IDVSELVVGYIOEX-UHFFFAOYSA-M"
"C[N+](C)(C)C.[Br-]","InChI=1S/C4H12N.BrH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1","DDFYFBUWEBINLX-UHFFFAOYSA-M"
"CC(=O)C(C)(C1)CC(=O)O1","InChI=1S/C7H10O3/c1-5(8)7(2)3-6(9)10-4-7/h3-4H2,1-2H3","ZKYRRHDKDZNOQB-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC([H])(O[Si](C)(C)C)C([H])(N)CO[Si](C)(C)C","InChI=1S/C24H55NO2Si2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(27-29(5,6)7)23(25)22-26-28(2,3)4/h23-24H,8-22,25H2,1-7H3/t23-,24+/m0/s1","NWWZXRAARCRWNA-BJKOFHAPSA-N"
"COC(O1)C(OC)C(OC)C(O)C1","InChI=1S/C8H16O5/c1-10-6-5(9)4-13-8(12-3)7(6)11-2/h5-9H,4H2,1-3H3/t5-,6+,7-,8+/m1/s1","XOUFXMJHIWGWKK-CWKFCGSDSA-N"
"COC(C1)C(OC)C(OC)C(OC)O1","InChI=1S/C9H18O5/c1-10-6-5-14-9(13-4)8(12-3)7(6)11-2/h6-9H,5H2,1-4H3/t6-,7+,8-,9-/m1/s1","OQFUMNZJTHPYPI-BZNPZCIMSA-N"
"COCC(O1)C(O)C(OC)C(OC)C(OC)1","InChI=1S/C10H20O6/c1-12-5-6-7(11)8(13-2)9(14-3)10(15-4)16-6/h6-11H,5H2,1-4H3/t6-,7-,8+,9-,10+/m1/s1","WMAJFVGSEYZPMZ-SPFKKGSWSA-N"
"CCCCOP(=O)(OCCCC)CNC(=O)C(F)(F)F","InChI=1S/C11H21F3NO4P/c1-3-5-7-18-20(17,19-8-6-4-2)9-15-10(16)11(12,13)14/h3-9H2,1-2H3,(H,15,16)","DGEWAUAVZKJTCG-UHFFFAOYSA-N"
"CCCCOP(=O)(OCCCC)CCNC(=O)C(F)(F)F","InChI=1S/C12H23F3NO4P/c1-3-5-8-19-21(18,20-9-6-4-2)10-7-16-11(17)12(13,14)15/h3-10H2,1-2H3,(H,16,17)","ICWBNDWAEAJFRR-UHFFFAOYSA-N"
"CCCCOP(=O)(OCCCC)C(CC)NC(=O)C(F)(F)F","InChI=1S/C13H25F3NO4P/c1-4-7-9-20-22(19,21-10-8-5-2)11(6-3)17-12(18)13(14,15)16/h11H,4-10H2,1-3H3,(H,17,18)","DOBUKKUNTRWKHT-UHFFFAOYSA-N"
"CCCCOP(=O)(OCCCC)C(CC(C)C)NC(=O)C(F)(F)F","InChI=1S/C15H29F3NO4P/c1-5-7-9-22-24(21,23-10-8-6-2)13(11-12(3)4)19-14(20)15(16,17)18/h12-13H,5-11H2,1-4H3,(H,19,20)","XOWFAIAZFLPNQE-UHFFFAOYSA-N"
"CCCCOP(=O)(OCCCC)C(CCCC)NC(=O)C(F)(F)F","InChI=1S/C15H29F3NO4P/c1-4-7-10-13(19-14(20)15(16,17)18)24(21,22-11-8-5-2)23-12-9-6-3/h13H,4-12H2,1-3H3,(H,19,20)","VTGKYJIQDAIQCK-UHFFFAOYSA-N"
"C[Si](C)(C)OCC([H])(N[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C12H31NO3Si3/c1-17(2,3)13-11(10-15-18(4,5)6)12(14)16-19(7,8)9/h11,13H,10H2,1-9H3","MBEDINMZZORSJN-UHFFFAOYSA-N"
"C[Si](C)(C)OC(C(O[Si](C)(C)C)1)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)1","InChI=1S/C24H60O6Si6/c1-31(2,3)25-19-20(26-32(4,5)6)22(28-34(10,11)12)24(30-36(16,17)18)23(29-35(13,14)15)21(19)27-33(7,8)9/h19-24H,1-18H3","FRTKXRNTVMCAKI-UHFFFAOYSA-N"
"C[Si](C)(C)OCC([H])(O[Si](C)(C)C)C([H])(O[Si](C)(C)C)C([H])(O[Si](C)(C)C)C([H])(C=O)N[Si](C)(C)C","InChI=1S/C21H53NO5Si5/c1-28(2,3)22-18(16-23)20(26-31(10,11)12)21(27-32(13,14)15)19(25-30(7,8)9)17-24-29(4,5)6/h16,18-22H,17H2,1-15H3/t18-,19+,20+,21+/m0/s1","QGZLJFWINYQKTC-DOIPELPJSA-N"
"[Si](OC(C=CCCC=CC=CCCCCCCC)(C(NC(C)=O)(CO[Si](C)(C)C)[H])[H])(C)(C)C","InChI=1S/C26H51NO3Si2/c1-9-10-11-12-13-14-15-16-17-18-19-20-21-22-26(30-32(6,7)8)25(27-24(2)28)23-29-31(3,4)5/h15-18,21-22,25-26H,9-14,19-20,23H2,1-8H3,(H,27,28)/b16-15+,18-17+,22-21+/t25-,26+/m0/s1","FRLINEYRHLTCHB-OUDRZLFHSA-N"
"C[Si](C)(C)OP(=O)(CCN([Si](C)(C)C)[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C14H40NO3PSi4/c1-20(2,3)15(21(4,5)6)13-14-19(16,17-22(7,8)9)18-23(10,11)12/h13-14H2,1-12H3","MWAPEOTUZLVKOZ-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(C)c(c1)cccc1","InChI=1S/C14H13Cl/c1-11(12-5-3-2-4-6-12)13-7-9-14(15)10-8-13/h2-11H,1H3","OMWUABDOXSZJHX-UHFFFAOYSA-N"
"ClC=C(c(c2)ccc(Cl)c2)c(c1)ccc(Cl)c1","InChI=1S/C14H9Cl3/c15-9-14(10-1-5-12(16)6-2-10)11-3-7-13(17)8-4-11/h1-9H","LNKQQZFLNUVWQQ-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(Cl)(c(c1)ccc(Cl)c1)C(Cl)(Cl)Cl","InChI=1S/C14H8Cl6/c15-11-5-1-9(2-6-11)13(17,14(18,19)20)10-3-7-12(16)8-4-10/h1-8H","JOQCINXYMZALAZ-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(OC)c(O)c1","InChI=1S/C9H10O4/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5,10H,1-2H3","BVWTXUYLKBHMOX-UHFFFAOYSA-N"
"COc(c1)cc(cc1)CC(C)O","InChI=1S/C10H14O2/c1-8(11)6-9-4-3-5-10(7-9)12-2/h3-5,7-8,11H,6H2,1-2H3","JNKFBLWILRREOG-UHFFFAOYSA-N"
"COC(=O)C=Cc(c1)ccc(O)c1","InChI=1S/C10H10O3/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7,11H,1H3/b7-4+","NITWSHWHQAQBAW-QPJJXVBHSA-N"
"COC(=O)c(c1)cc(O)c(O)c1","InChI=1S/C8H8O4/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,9-10H,1H3","CUFLZUDASVUNOE-UHFFFAOYSA-N"
"COCC(C)COC(=O)C=C","InChI=1S/C8H14O3/c1-4-8(9)11-6-7(2)5-10-3/h4,7H,1,5-6H2,2-3H3","RCQZQQQKVUVYAW-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=O)NS2(=O)=O","InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)","CVHZOJJKTDOEJC-UHFFFAOYSA-N"
"CC(C)(C=3)OC(=C(C3)1)c(c2)c(ccc2)N(C)C(=O)1","InChI=1S/C15H15NO2/c1-15(2)9-8-11-13(18-15)10-6-4-5-7-12(10)16(3)14(11)17/h4-9H,1-3H3","RJZFGBNKPOVCHQ-UHFFFAOYSA-N"
"COC(=O)c(c(C(=O)OC)1)c(C([H])=4)n(C(=C([H])C([H])4)2)c(C(=O)C([H])=C(c(c3)cccc3)2)1","InChI=1S/C21H15NO5/c1-26-20(24)17-15-10-6-9-14-13(12-7-4-3-5-8-12)11-16(23)19(22(14)15)18(17)21(25)27-2/h3-11H,1-2H3","UISUVSVDSFOHCY-UHFFFAOYSA-N"
"CC(C=1)=C(O)C(C)=C(C=2)C(=C(O)C2)C(C)1","InChI=1S/C13H14O2/c1-7-6-8(2)13(15)9(3)10-4-5-11(14)12(7)10/h4-6,14-15H,1-3H3","UYNMLOQGFXASNF-UHFFFAOYSA-N"
"OC(C2)C(O1)C(CC2)C(=C)C(=O)1","InChI=1S/C9H12O3/c1-5-6-3-2-4-7(10)8(6)12-9(5)11/h6-8,10H,1-4H2","LBZLIYFBRVMLEG-UHFFFAOYSA-N"
"O=C(C1)OCCC1","InChI=1S/C5H8O2/c6-5-3-1-2-4-7-5/h1-4H2","OZJPLYNZGCXSJM-UHFFFAOYSA-N"
"O=C(CC(=O)c(c3)cccc3)CC(C)(C)Cc(n1)sc(c2)c(ccc2)1","InChI=1S/C21H21NO2S/c1-21(2,14-20-22-17-10-6-7-11-19(17)25-20)13-16(23)12-18(24)15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3","WRLWXBVNBFQXMJ-UHFFFAOYSA-N"
"O=C(OCc(c1)cccc1)N(C)CCP(O)(O)=O","InChI=1S/C11H16NO5P/c1-12(7-8-18(14,15)16)11(13)17-9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,14,15,16)","KNNQEYPDIAAUJQ-UHFFFAOYSA-N"
"CCCCC([H])=C([H])CCCCCCCCCO","InChI=1S/C15H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h5-6,16H,2-4,7-15H2,1H3/b6-5-","YWAXGXIQALUWKR-WAYWQWQTSA-N"
"CCCCC=CCCCCCCCCC(=O)OC","InChI=1S/C16H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18-2/h6-7H,3-5,8-15H2,1-2H3/b7-6-","JEDIPLFNJDRCFD-SREVYHEPSA-N"
"CCCCC=CCCCCCCCCC=O","InChI=1S/C15H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h5-6,15H,2-4,7-14H2,1H3/b6-5+","CQHGVQUJJPIQQW-AATRIKPKSA-N"
"CCCC=CC=CC(O)=O","InChI=1S/C8H12O2/c1-2-3-4-5-6-7-8(9)10/h4-7H,2-3H2,1H3,(H,9,10)/b5-4+,7-6+","QZGIOJSVUOCUMC-YTXTXJHMSA-N"
"CCOC(=O)C=CC=CCCCCCOc(c1)cccc1","InChI=1S/C18H24O3/c1-2-20-18(19)15-11-6-4-3-5-7-12-16-21-17-13-9-8-10-14-17/h4,6,8-11,13-15H,2-3,5,7,12,16H2,1H3/b6-4+,15-11+","UBCABTOWERAKNF-OKOYHYLBSA-N"
"CCCCCCCCCCCCCCCc(c1)c(C(=O)OCC)c(OC)cc1","InChI=1S/C25H42O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20-18-21-23(27-3)24(22)25(26)28-5-2/h18,20-21H,4-17,19H2,1-3H3","SQFAYXIKUHVPRT-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC=Cc(c1)c(C(=O)OCC)c(OC)cc1","InChI=1S/C25H40O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-19-22-20-18-21-23(27-3)24(22)25(26)28-5-2/h17-21H,4-16H2,1-3H3/b19-17+","JUWPXQAVBPMMNP-HTXNQAPBSA-N"
"CCCCC=CCCCCCCCCCc(c(O)1)c(=O)c(OC)cc(=O)1","InChI=1S/C22H34O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21(24)19(23)17-20(26-2)22(18)25/h6-7,17,24H,3-5,8-16H2,1-2H3/b7-6+","WVHQJXPRVZBEFP-VOTSOKGWSA-N"
"CCCCC=CCCCCCCCCCc(c(OC)1)c(O)c(OC)cc1","InChI=1S/C23H38O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-21(25-2)18-19-22(26-3)23(20)24/h7-8,18-19,24H,4-6,9-17H2,1-3H3/b8-7+","XVPHAYWQBAYETP-BQYQJAHWSA-N"
"O=CCCCCc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C17H18O2/c18-14-6-2-3-7-15-10-12-17(13-11-15)19-16-8-4-1-5-9-16/h1,4-5,8-14H,2-3,6-7H2","PTCVKJYCZZJKTC-UHFFFAOYSA-N"
"OC(=O)C=CC=CCCCCc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C21H22O3/c22-21(23)13-9-4-2-1-3-6-10-18-14-16-20(17-15-18)24-19-11-7-5-8-12-19/h2,4-5,7-9,11-17H,1,3,6,10H2,(H,22,23)/b4-2+,13-9+","XRGBVKNNGJJCAV-SUMSYXJWSA-N"
"CCOC(=O)C=CC=CCCCCc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C23H26O3/c1-2-25-23(24)15-11-6-4-3-5-8-12-20-16-18-22(19-17-20)26-21-13-9-7-10-14-21/h4,6-7,9-11,13-19H,2-3,5,8,12H2,1H3/b6-4+,15-11+","CICFIKLRBCYDKV-OKOYHYLBSA-N"
"CC(C)CNC(=O)C=CC=CCCCCc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C25H31NO2/c1-21(2)20-26-25(27)15-11-6-4-3-5-8-12-22-16-18-24(19-17-22)28-23-13-9-7-10-14-23/h4,6-7,9-11,13-19,21H,3,5,8,12,20H2,1-2H3,(H,26,27)/b6-4+,15-11+","OTARDPWABOQJQA-OKOYHYLBSA-N"
"CCCCCCCCCCCCCCC(O1)c(c2)c(c(OC)cc2)C(=O)1","InChI=1S/C23H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-19-16-15-18-21(25-2)22(19)23(24)26-20/h15-16,18,20H,3-14,17H2,1-2H3","PTWYVJKLACDNEO-UHFFFAOYSA-N"
"CCOC(C2)=CC(=O)C(C2)C(CCC=C(C)C)OC(C1)OCCC1","InChI=1S/C20H32O4/c1-4-22-16-11-12-17(18(21)14-16)19(9-7-8-15(2)3)24-20-10-5-6-13-23-20/h8,14,17,19-20H,4-7,9-13H2,1-3H3","PZUSLRHZOBPXDY-UHFFFAOYSA-N"
"CC(C)=CCCC(=O)c(c1)c(OC)ccc1","InChI=1S/C14H18O2/c1-11(2)7-6-9-13(15)12-8-4-5-10-14(12)16-3/h4-5,7-8,10H,6,9H2,1-3H3","YIHSMNILCSBGEM-UHFFFAOYSA-N"
"CC(C)=CCCC(O)c(c1)c(OC)ccc1","InChI=1S/C14H20O2/c1-11(2)7-6-9-13(15)12-8-4-5-10-14(12)16-3/h4-5,7-8,10,13,15H,6,9H2,1-3H3","DUJMRYWAZPGTNZ-UHFFFAOYSA-N"
"CC(C)=CCCCOC(C)=O","InChI=1S/C9H16O2/c1-8(2)6-4-5-7-11-9(3)10/h6H,4-5,7H2,1-3H3","PJDWPNFLWJGDIO-UHFFFAOYSA-N"
"C(C(CCCCCCCC(=O)OCC(=O)c(c2)ccc(Br)c2)1)(CC=CCCCCC)O1","InChI=1S/C26H37BrO4/c1-2-3-4-5-7-10-13-24-25(31-24)14-11-8-6-9-12-15-26(29)30-20-23(28)21-16-18-22(27)19-17-21/h7,10,16-19,24-25H,2-6,8-9,11-15,20H2,1H3/b10-7-","SQSKIUQVTZZYPC-YFHOEESVSA-N"
"CCOC(C2)=CC(=O)C(C2)C(O)CCC(Sc(c1)cccc1)C(C)(C)O","InChI=1S/C21H30O4S/c1-4-25-15-10-11-17(19(23)14-15)18(22)12-13-20(21(2,3)24)26-16-8-6-5-7-9-16/h5-9,14,17-18,20,22,24H,4,10-13H2,1-3H3","FFLJRCUCYXHDFQ-UHFFFAOYSA-N"
"CCCCCCCCC(O)C(O)CCCCCCCC(=O)OC","InChI=1S/C19H38O4/c1-3-4-5-6-8-11-14-17(20)18(21)15-12-9-7-10-13-16-19(22)23-2/h17-18,20-21H,3-16H2,1-2H3","RITHLQKJQSKUAO-UHFFFAOYSA-N"
"C(C(CC=CCC=CCCCCCCCC(=O)OCC(=O)c(c2)ccc(Br)c2)1)(CC)O1","InChI=1S/C26H35BrO4/c1-2-24-25(31-24)14-12-10-8-6-4-3-5-7-9-11-13-15-26(29)30-20-23(28)21-16-18-22(27)19-17-21/h4,6,10,12,16-19,24-25H,2-3,5,7-9,11,13-15,20H2,1H3/b6-4-,12-10-","PZWZKKDBNOEWCU-OHPMOLHNSA-N"
"CCC=CCC=CCC=CCC=CCC=CCCCC(=O)OC","InChI=1S/C21H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11,13-14,16-17H,3,6,9,12,15,18-20H2,1-2H3/b5-4-,8-7-,11-10-,14-13-,17-16-","QWDCYFDDFPWISL-JEBPEJKESA-N"
"C(C(CC=CCCCCCCCC(=O)OCC(=O)c(c2)ccc(Br)c2)1)(CC=CCC)O1","InChI=1S/C26H35BrO4/c1-2-3-10-13-24-25(31-24)14-11-8-6-4-5-7-9-12-15-26(29)30-20-23(28)21-16-18-22(27)19-17-21/h3,8,10-11,16-19,24-25H,2,4-7,9,12-15,20H2,1H3/b10-3-,11-8-","WUCZJVFIDHJZSJ-OOHFSOINSA-N"
"CCCCCC=CCC=CCC=CCC=CCCCC(=O)OC","InChI=1S/C21H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h7-8,10-11,13-14,16-17H,3-6,9,12,15,18-20H2,1-2H3/b8-7-,11-10-,14-13-,17-16-","OFIDNKMQBYGNIW-ZKWNWVNESA-N"
"C(C(CCCCCCCC(=O)OCC(=O)c(c2)ccc(Br)c2)1)(CC=CCC=CCC)O1","InChI=1S/C26H35BrO4/c1-2-3-4-5-7-10-13-24-25(31-24)14-11-8-6-9-12-15-26(29)30-20-23(28)21-16-18-22(27)19-17-21/h3-4,7,10,16-19,24-25H,2,5-6,8-9,11-15,20H2,1H3/b4-3-,10-7-","RUESRGNEFNCRBK-ZJSQCTGTSA-N"
"C(C2([H])C)C(C(CC2)(C(C)C)[H])OCC(=O)OC(C=1[H])([H])C(C(C)=C)([H])CCC(C)=C([H])CCC(C)=C([H])CCC1C","InChI=1S/C32H52O3/c1-22(2)28-18-16-27(8)19-30(28)34-21-32(33)35-31-20-26(7)14-10-12-24(5)11-9-13-25(6)15-17-29(31)23(3)4/h12-13,20,22,27-31H,3,9-11,14-19,21H2,1-2,4-8H3/b24-12+,25-13+,26-20+/t27-,28+,29+,30?,31-/m1/s1","BUSOZEVHMMWLRH-XURRZXJESA-N"
"C(C2)(O1)(C(OC(C(C(C)=C)3)C([H])=C(C)CCC(=C(CCC(=C(CC3)C)[H])C)[H])=O)C(C(C)(C2)C1=O)(C)C","InChI=1S/C30H44O4/c1-20(2)24-16-15-22(4)13-9-11-21(3)12-10-14-23(5)19-25(24)33-27(32)30-18-17-29(8,26(31)34-30)28(30,6)7/h12-13,19,24-25H,1,9-11,14-18H2,2-8H3/b21-12+,22-13+,23-19+","XPONBLPQQPCUGY-YISVINQMSA-N"
"COC(=O)CCCCCCCC=CCC=CCC(O)C(O)CC","InChI=1S/C19H34O4/c1-3-17(20)18(21)15-13-11-9-7-5-4-6-8-10-12-14-16-19(22)23-2/h5,7,11,13,17-18,20-21H,3-4,6,8-10,12,14-16H2,1-2H3/b7-5-,13-11-","KVWRAGFRXOWQHJ-DPTWWRMPSA-N"
"CCC=CCC=CCC(O)C(O)CCCCCCCC(=O)OC","InChI=1S/C19H34O4/c1-3-4-5-6-8-11-14-17(20)18(21)15-12-9-7-10-13-16-19(22)23-2/h4-5,8,11,17-18,20-21H,3,6-7,9-10,12-16H2,1-2H3/b5-4-,11-8-","XFTKSSHPEKMBJD-YMVJEYMASA-N"
"CCC=CCC(O)C(O)CC=CCCCCCCCC(=O)OC","InChI=1S/C19H34O4/c1-3-4-11-14-17(20)18(21)15-12-9-7-5-6-8-10-13-16-19(22)23-2/h4,9,11-12,17-18,20-21H,3,5-8,10,13-16H2,1-2H3/b11-4-,12-9-","KXVOHHSKVDULRX-UZXKCJFBSA-N"
"CCCCCC(C=CC=CCCCCCCCC(=O)OC)OC(=O)c(c1)cccc1","InChI=1S/C26H38O4/c1-3-4-13-20-24(30-26(28)23-18-14-12-15-19-23)21-16-10-8-6-5-7-9-11-17-22-25(27)29-2/h8,10,12,14-16,18-19,21,24H,3-7,9,11,13,17,20,22H2,1-2H3/b10-8-,21-16+","FXZQUTBDAOOHKA-KIMURVHYSA-N"
"O=CC(C)=C([H])CCCOC(C)=O","InChI=1S/C9H14O3/c1-8(7-10)5-3-4-6-12-9(2)11/h5,7H,3-4,6H2,1-2H3/b8-5+","KAYNMVNYLZADKJ-VMPITWQZSA-N"
"CC(C1)=C([H])CCC(C)=C([H])CC(O)(CCC(C)=C([H])C1)C(C)C","InChI=1S/C20H34O/c1-16(2)20(21)14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,16,21H,6-7,9-10,13-15H2,1-5H3/b17-8+,18-12+,19-11+","ZVWXZFYWLABNOW-GDVLXBNMSA-N"
"[H]C(C2)=C(C)CCC(C(C)(C3)O3)C(OC(C)=O)C(O1)C(C)(CCC([H])=C(C)C2)1","InChI=1S/C22H34O4/c1-15-8-6-9-16(2)11-12-18(22(5)14-24-22)19(25-17(3)23)20-21(4,26-20)13-7-10-15/h9-10,18-20H,6-8,11-14H2,1-5H3/b15-10+,16-9+","QXVBAUUPYLTTBN-BXIATTARSA-N"
"[H]C(C2)=C(C)CCC(C(C)=O)=C([H])C(O1)C(C)(CCC([H])=C(C)C2)1","InChI=1S/C19H28O2/c1-14-7-5-8-15(2)10-11-17(16(3)20)13-18-19(4,21-18)12-6-9-14/h8-9,13,18H,5-7,10-12H2,1-4H3/b14-9+,15-8+,17-13+","OOUAMFIGDJHZPY-FFHLZWFVSA-N"
"[H]C(C2)=C(C)CCC(C(C)(C)O)C(OC(C)=O)C(O1)C(C)(CCC([H])=C(C)C2)1","InChI=1S/C22H36O4/c1-15-9-7-10-16(2)12-13-18(21(4,5)24)19(25-17(3)23)20-22(6,26-20)14-8-11-15/h10-11,18-20,24H,7-9,12-14H2,1-6H3/b15-11+,16-10+","XXYGLMGTBAYLFD-YUCRUYSYSA-N"
"COC(=O)CC(C)(C1)C([H])=C([H])CCCC(C)=C([H])CCC(C)=C([H])C1","InChI=1S/C20H32O2/c1-17-10-6-5-7-14-20(3,16-19(21)22-4)15-9-13-18(2)12-8-11-17/h7,11,13-14H,5-6,8-10,12,15-16H2,1-4H3/b14-7+,17-11+,18-13+","LGAOQQAFLOZERD-GVXFGYANSA-N"
"OCCC(C)(C1)C([H])=C([H])CCCC(C)=C([H])CCC(C)=C([H])C1","InChI=1S/C19H32O/c1-17-9-5-4-6-13-19(3,15-16-20)14-8-12-18(2)11-7-10-17/h6,10,12-13,20H,4-5,7-9,11,14-16H2,1-3H3/b13-6+,17-10+,18-12+","QJPDJZAAVMEHCI-DDNAAWFUSA-N"
"OCCC(C)(C2)C(O1)C(CCCC(C)=C([H])CCC(C)=C([H])C2)1","InChI=1S/C19H32O2/c1-15-7-4-8-16(2)10-6-12-19(3,13-14-20)18-17(21-18)11-5-9-15/h7,10,17-18,20H,4-6,8-9,11-14H2,1-3H3/b15-7+,16-10+","AGXRTUPIZLCCNG-FJFWOBFQSA-N"
"CC(C1)=C([H])CCC(C)=C([H])CCC(C)=C([H])C(O)CC1","InChI=1S/C17H28O/c1-14-7-4-8-15(2)10-6-12-17(18)13-16(3)11-5-9-14/h8-9,13,17-18H,4-7,10-12H2,1-3H3/b14-9+,15-8+,16-13+","JDIPRPADZDTOOH-RDNNDEIWSA-N"
"CCOC(C1)=CC(=O)C(C1)C(O)CCC=C(C)C","InChI=1S/C15H24O3/c1-4-18-12-8-9-13(15(17)10-12)14(16)7-5-6-11(2)3/h6,10,13-14,16H,4-5,7-9H2,1-3H3","CWPPDQUJBNUZSF-UHFFFAOYSA-N"
"CCOC(C1)=CC(=O)C(C1)C(CCC=C(C)C)O[Si](C)(C)C","InChI=1S/C18H32O3Si/c1-7-20-15-11-12-16(17(19)13-15)18(21-22(4,5)6)10-8-9-14(2)3/h9,13,16,18H,7-8,10-12H2,1-6H3","GMLZOTBPHOVJRF-UHFFFAOYSA-N"
"CCOC(C1)=CC(=O)C(C1)C(OCSC)CCC=C(C)C","InChI=1S/C17H28O3S/c1-5-19-14-9-10-15(16(18)11-14)17(20-12-21-4)8-6-7-13(2)3/h7,11,15,17H,5-6,8-10,12H2,1-4H3","XTBWWOCUZHRPHV-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C2)(C1)C(=O)CCC(C)(C2)C1","InChI=1S/C16H20O/c1-15-8-7-14(17)16(11-9-15,12-10-15)13-5-3-2-4-6-13/h2-6H,7-12H2,1H3","XDANWUDVRYHBAB-UHFFFAOYSA-N"
"O=C(C2)C(C)(C1)C([H])=C([H])C(C)(C2)C1","InChI=1S/C11H16O/c1-10-4-3-9(12)11(2,7-5-10)8-6-10/h5,7H,3-4,6,8H2,1-2H3","YKRRCQKDFJAWKA-UHFFFAOYSA-N"
"CC(=C)C(=C1)C(C2)C=CC(C2)C(=O)1","InChI=1S/C12H14O/c1-8(2)11-7-12(13)10-5-3-9(11)4-6-10/h3,5,7,9-10H,1,4,6H2,2H3","DWRKJEWDQFGLCV-UHFFFAOYSA-N"
"N#CCCC(C)(C([H])21)C([H])(C=CCC2)1","InChI=1S/C11H15N/c1-11(7-4-8-12)9-5-2-3-6-10(9)11/h2,5,9-10H,3-4,6-7H2,1H3/t9-,10+,11-/m1/s1","IONBRIXRMLDYDE-OUAUKWLOSA-N"
"CC(=C1)C(C2)C=CC(C2)C(=O)1","InChI=1S/C10H12O/c1-7-6-10(11)9-4-2-8(7)3-5-9/h2,4,6,8-9H,3,5H2,1H3","PQVKSVQURJRKPY-UHFFFAOYSA-N"
"CC(C)C(=C1)C(C2)C=CC(C2)C(=O)1","InChI=1S/C12H16O/c1-8(2)11-7-12(13)10-5-3-9(11)4-6-10/h3,5,7-10H,4,6H2,1-2H3","WNDHRWVXEFLALM-UHFFFAOYSA-N"
"O=C(C=1)C(C3)C=CC(C3)C1c(c2)cccc2","InChI=1S/C15H14O/c16-15-10-14(11-4-2-1-3-5-11)12-6-8-13(15)9-7-12/h1-6,8,10,12-13H,7,9H2","KSVFWTHWHOQNBU-UHFFFAOYSA-N"
"COC(=O)CC(C)(C([H])21)C([H])(C=CCC2)1","InChI=1S/C11H16O2/c1-11(7-10(12)13-2)8-5-3-4-6-9(8)11/h3,5,8-9H,4,6-7H2,1-2H3/t8-,9+,11-/m1/s1","TWBDWZIXRGOTMW-WCABBAIRSA-N"
"O=CCCC(C)(C([H])21)C([H])(C=CCC2)1","InChI=1S/C11H16O/c1-11(7-4-8-12)9-5-2-3-6-10(9)11/h2,5,8-10H,3-4,6-7H2,1H3/t9-,10+,11-/m1/s1","COWXSOPBSILZLU-OUAUKWLOSA-N"
"CC(C)(C)[Si](C)(C)OCCCC(C)(C([H])21)C([H])(C=CCC2)1","InChI=1S/C17H32OSi/c1-16(2,3)19(5,6)18-13-9-12-17(4)14-10-7-8-11-15(14)17/h7,10,14-15H,8-9,11-13H2,1-6H3/t14-,15+,17-/m1/s1","SCIFODIHDCXKMV-HLLBOEOZSA-N"
"c(c3)ccc(c3)C(C2)(C=1)C(=O)CCC(C)(C2)C1","InChI=1S/C16H18O/c1-15-8-7-14(17)16(11-9-15,12-10-15)13-5-3-2-4-6-13/h2-6,9,11H,7-8,10,12H2,1H3","PNLJJKHZUGLECP-UHFFFAOYSA-N"
"O=C(C2)C(C)(C1)CCC(C)(C2)C1","InChI=1S/C11H18O/c1-10-4-3-9(12)11(2,7-5-10)8-6-10/h3-8H2,1-2H3","LSNOEYNQBMPMRH-UHFFFAOYSA-N"
"[H]C(=C([H])1)C(=O)C(C)(C2)CCC(C)(C2)1","InChI=1S/C11H16O/c1-10-4-3-9(12)11(2,7-5-10)8-6-10/h3-4H,5-8H2,1-2H3","MQEWKZNMDTWNJE-UHFFFAOYSA-N"
"BrCCC([H])=C([H])c(c1)cccc1","InChI=1S/C10H11Br/c11-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-8H,5,9H2/b8-4+","YENIUOKSTSIUOR-XBXARRHUSA-N"
"OCCCCC([H])=C([H])c(c1)cccc1","InChI=1S/C12H16O/c13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3-6,8-10,13H,1-2,7,11H2/b8-4+","QYYDTFNIOPDGML-XBXARRHUSA-N"
"BrCCCCC([H])=C([H])c(c1)cccc1","InChI=1S/C12H15Br/c13-11-7-2-1-4-8-12-9-5-3-6-10-12/h3-6,8-10H,1-2,7,11H2/b8-4+","HXQXSNNOGXXMLU-XBXARRHUSA-N"
"CC(C)CCCCCc(c1)cccc1","InChI=1S/C14H22/c1-13(2)9-5-3-6-10-14-11-7-4-8-12-14/h4,7-8,11-13H,3,5-6,9-10H2,1-2H3","TUFDHHZZUWXWRD-UHFFFAOYSA-N"
"CCCCCCc(c1)cccc1","InChI=1S/C12H18/c1-2-3-4-6-9-12-10-7-5-8-11-12/h5,7-8,10-11H,2-4,6,9H2,1H3","LTEQMZWBSYACLV-UHFFFAOYSA-N"
"CC(C2)C(=O)C(C(C2)1)C(C)(C)1","InChI=1S/C10H16O/c1-6-4-5-7-8(9(6)11)10(7,2)3/h6-8H,4-5H2,1-3H3","CNJLMVZFWLNOEP-UHFFFAOYSA-N"
"C(C4)CC([H])(C3)C(C)(C4)C([H])(C1)C([H])(C3)C([H])(C2)C(C)(CC2)C1","InChI=1S/C19H32/c1-18-11-5-7-16(18)15-9-8-14-6-3-4-12-19(14,2)17(15)10-13-18/h14-17H,3-13H2,1-2H3/t14-,15+,16+,17+,18+,19+/m1/s1","QZLYKIGBANMMBK-UGCZWRCOSA-N"
"C(C4)CC([H])(C3)C(C)(C4)C([H])(C1)C([H])(C3)C([H])(C2)C(C)(CC2)C1","InChI=1S/C19H32/c1-18-11-5-7-16(18)15-9-8-14-6-3-4-12-19(14,2)17(15)10-13-18/h14-17H,3-13H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1","QZLYKIGBANMMBK-DYKIIFRCSA-N"
"CCCCC(CC)COC(=O)c(c1)c(ccc1)C(=O)OC(C)C","InChI=1S/C19H28O4/c1-5-7-10-15(6-2)13-22-18(20)16-11-8-9-12-17(16)19(21)23-14(3)4/h8-9,11-12,14-15H,5-7,10,13H2,1-4H3","NDQBOQJEHVQCJE-UHFFFAOYSA-N"
"c(c1)ccc(c1)CI","InChI=1S/C7H7I/c8-6-7-4-2-1-3-5-7/h1-5H,6H2","XJTQJERLRPWUGL-UHFFFAOYSA-N"
"c(c2)cc(c1)c(c2)c(Br)cc1","InChI=1S/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H","DLKQHBOKULLWDQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)[Si](Cl)(C1)CCC1","InChI=1S/C10H13ClSi/c11-12(8-4-5-9-12)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2","YSIVTLKOXHCOIE-UHFFFAOYSA-N"
"CC[Si](CC)(CC)[Si](CC)(CC)CC","InChI=1S/C12H30Si2/c1-7-13(8-2,9-3)14(10-4,11-5)12-6/h7-12H2,1-6H3","XEJUFRSVJVTIFW-UHFFFAOYSA-N"
"c(c2)ccc(c2)[SiH](C)c(c1)cccc1","InChI=1S/C13H14Si/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,14H,1H3","FULSRCPEOUATID-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=C(c(c2)cccc2)1)[Si](C)(C)[Si](C)(CC)[Si](C)(C)1","InChI=1S/C21H30Si3/c1-7-24(6)22(2,3)20(18-14-10-8-11-15-18)21(23(24,4)5)19-16-12-9-13-17-19/h8-17H,7H2,1-6H3","WNWHEIYCWOFGOD-UHFFFAOYSA-N"
"CCOC(=O)CBr","InChI=1S/C4H7BrO2/c1-2-7-4(6)3-5/h2-3H2,1H3","PQJJJMRNHATNKG-UHFFFAOYSA-N"
"ClC[Si](C)(Cl)Cl","InChI=1S/C2H5Cl3Si/c1-6(4,5)2-3/h2H2,1H3","JAYBZWYBCUJLNQ-UHFFFAOYSA-N"
"C[Si](C)(C)C(Cl)I","InChI=1S/C4H10ClISi/c1-7(2,3)4(5)6/h4H,1-3H3","CSULUJJLSAGOBX-UHFFFAOYSA-N"
"C[Si](C)(C)C(I)I","InChI=1S/C4H10I2Si/c1-7(2,3)4(5)6/h4H,1-3H3","RXBPBTHLRBDCFU-UHFFFAOYSA-N"
"CCCC=C(Cl)Cl","InChI=1S/C5H8Cl2/c1-2-3-4-5(6)7/h4H,2-3H2,1H3","ZNPAFRLFBXOLET-UHFFFAOYSA-N"
"C[Si](C)(Cl)C[Si](C)(C)Cl","InChI=1S/C5H14Cl2Si2/c1-8(2,6)5-9(3,4)7/h5H2,1-4H3","VTDZAHJRMRMQNP-UHFFFAOYSA-N"
"BrCCC[Si](C)(C)C","InChI=1S/C6H15BrSi/c1-8(2,3)6-4-5-7/h4-6H2,1-3H3","NVEYOAXSXPSFHL-UHFFFAOYSA-N"
"C[Si](C)(C)N[Si](C)(C)C","InChI=1S/C6H19NSi2/c1-8(2,3)7-9(4,5)6/h7H,1-6H3","FFUAGWLWBBFQJT-UHFFFAOYSA-N"
"C[Si](C)(C)CCC[Si](C)(C)C","InChI=1S/C9H24Si2/c1-10(2,3)8-7-9-11(4,5)6/h7-9H2,1-6H3","YMPSYNWHUIOPJH-UHFFFAOYSA-N"
"C(C2)CC(C1)C(C2)1","InChI=1S/C7H12/c1-2-4-7-5-6(7)3-1/h6-7H,1-5H2","WPHGSKGZRAQSGP-UHFFFAOYSA-N"
"CCCCCC=C(Cl)Cl","InChI=1S/C7H12Cl2/c1-2-3-4-5-6-7(8)9/h6H,2-5H2,1H3","SHIGTIVKNFPBPY-UHFFFAOYSA-N"
"CCCC(C)C=C(Cl)Cl","InChI=1S/C7H12Cl2/c1-3-4-6(2)5-7(8)9/h5-6H,3-4H2,1-2H3","ZKIPLTGOCRHGCH-UHFFFAOYSA-N"
"CC(=C)C[Si](C)(C)C","InChI=1S/C7H16Si/c1-7(2)6-8(3,4)5/h1,6H2,2-5H3","OWVJMAKUWHECNI-UHFFFAOYSA-N"
"C[Si](C)(Cl)CCC[Si](C)(C)Cl","InChI=1S/C7H18Cl2Si2/c1-10(2,8)6-5-7-11(3,4)9/h5-7H2,1-4H3","XJYPEWPGZBASNR-UHFFFAOYSA-N"
"C[Si](C)(C)CCC[SiH2]C(Cl)Cl","InChI=1S/C7H18Cl2Si2/c1-11(2,3)6-4-5-10-7(8)9/h7H,4-6,10H2,1-3H3","DFVDZCPIGDUXFT-UHFFFAOYSA-N"
"ClC(Cl)=CCCc(c1)cccc1","InChI=1S/C10H10Cl2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2","UNJBNXSLPCBXPD-UHFFFAOYSA-N"
"ClC(Cl)=Cc(c1)cccc1","InChI=1S/C8H6Cl2/c9-8(10)6-7-4-2-1-3-5-7/h1-6H","CISIJYCKDJSTMX-UHFFFAOYSA-N"
"ClC(Cl)C(O)c(c1)cccc1","InChI=1S/C8H8Cl2O/c9-8(10)7(11)6-4-2-1-3-5-6/h1-5,7-8,11H","XNSCLDYOTQWNGW-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C1)O1","InChI=1S/C8H8O/c1-2-4-7(5-3-1)8-6-9-8/h1-5,8H,6H2","AWMVMTVKBNGEAK-UHFFFAOYSA-N"
"OCCC(C1)CC=CC1","InChI=1S/C8H14O/c9-7-6-8-4-2-1-3-5-8/h1-2,8-9H,3-7H2","FELLSOCIMJMONP-UHFFFAOYSA-N"
"CCCCCCCCBr","InChI=1S/C8H17Br/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3","VMKOFRJSULQZRM-UHFFFAOYSA-N"
"CCCCCCCCI","InChI=1S/C8H17I/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3","UWLHSHAHTBJTBA-UHFFFAOYSA-N"
"CCCC(O)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C8H18Cl2OSi/c1-5-6-7(11)8(9,10)12(2,3)4/h7,11H,5-6H2,1-4H3","LPDRWGIWGCOOKJ-UHFFFAOYSA-N"
"CCCC(C(Cl)Cl)O[Si](C)(C)C","InChI=1S/C8H18Cl2OSi/c1-5-6-7(8(9)10)11-12(2,3)4/h7-8H,5-6H2,1-4H3","HKBOWMWBSOSAMJ-UHFFFAOYSA-N"
"C[Si](C)(C)C=C[Si](C)(C)C","InChI=1S/C8H20Si2/c1-9(2,3)7-8-10(4,5)6/h7-8H,1-6H3","AMGXUPKDZBCKPF-UHFFFAOYSA-N"
"C[Si](C)(F)C#C[Si](C)(C)F","InChI=1S/C6H12F2Si2/c1-9(2,7)5-6-10(3,4)8/h1-4H3","WLXDJYZDTGKMSI-UHFFFAOYSA-N"
"CCCCCCCC","InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3","TVMXDCGIABBOFY-UHFFFAOYSA-N"
"C[Si](C)(C)C([Si](C)(C)F)=C([Si](C)(C)C)[Si](C)(C)F","InChI=1S/C12H30F2Si4/c1-15(2,3)11(17(7,8)13)12(16(4,5)6)18(9,10)14/h1-10H3/b12-11-","FPBYTAWRHHCVKE-QXMHVHEDSA-N"
"C[Si](C)(C#1)O[Si](C)(C)C#C[Si](C)(C)O[Si](C)(C)C#C[Si](C)(C)O[Si](C)(C)C1","InChI=1S/C18H36O3Si6/c1-22(2)13-14-24(5,6)20-26(9,10)17-18-27(11,12)21-25(7,8)16-15-23(3,4)19-22/h1-12H3","FVXVINSCAYJVGZ-UHFFFAOYSA-N"
"C[Si](C)(C#1)[Si](C)(C)C#C[Si](C)(C)[Si](C)(C)C#C[Si](C)(C)[Si](C)(C)C1","InChI=1S/C18H36Si6/c1-19(2)13-14-21(5,6)23(9,10)17-18-24(11,12)22(7,8)16-15-20(19,3)4/h1-12H3","QDTVPSUSAHRZKV-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(C(C)(C)C)c(c1C(C)(C)C)[Si](F)(F)C(C)C","InChI=1S/C21H36F2Si/c1-14(2)24(22,23)18-16(20(6,7)8)12-15(19(3,4)5)13-17(18)21(9,10)11/h12-14H,1-11H3","DIOHUZHBUVEMJL-UHFFFAOYSA-N"
"CC[Si](F)(F)c(c1C(C)(C)C)c(cc(C(C)(C)C)c1)C(C)(C)C","InChI=1S/C20H34F2Si/c1-11-23(21,22)17-15(19(5,6)7)12-14(18(2,3)4)13-16(17)20(8,9)10/h12-13H,11H2,1-10H3","QCSVJWLHWUAGLU-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(Br)c(C)1","InChI=1S/C9H11Br/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,1-3H3","RRTLQRYOJOSPEA-UHFFFAOYSA-N"
"Cc(c1)cc(C)cc(C)1","InChI=1S/C9H12/c1-7-4-8(2)6-9(3)5-7/h4-6H,1-3H3","AUHZEENZYGFFBQ-UHFFFAOYSA-N"
"CC(C)c(c1)cc(C(C)C)c(Br)c(C(C)C)1","InChI=1S/C15H23Br/c1-9(2)12-7-13(10(3)4)15(16)14(8-12)11(5)6/h7-11H,1-6H3","FUMMYHVKFAHQST-UHFFFAOYSA-N"
"CC(C)c(c1)cc(C(C)C)cc(C(C)C)1","InChI=1S/C15H24/c1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6/h7-12H,1-6H3","VUMCUSHVMYIRMB-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(C(C)(C)C)c(Br)c1C(C)(C)C","InChI=1S/C18H29Br/c1-16(2,3)12-10-13(17(4,5)6)15(19)14(11-12)18(7,8)9/h10-11H,1-9H3","JOKZWHPYNRDCOA-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(C(C)(C)C)c([Si](C)(F)F)c1C(C)(C)C","InChI=1S/C19H32F2Si/c1-17(2,3)13-11-14(18(4,5)6)16(22(10,20)21)15(12-13)19(7,8)9/h11-12H,1-10H3","PNHOHXUAISPGBF-UHFFFAOYSA-N"
"CC(C)c(c1)cc(C(C)C)c(c(C(C)C)1)[Si](O)(F)C(C)(C)C","InChI=1S/C19H33FOSi/c1-12(2)15-10-16(13(3)4)18(17(11-15)14(5)6)22(20,21)19(7,8)9/h10-14,21H,1-9H3","PLHNVQGPMAWVKH-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(C(C)(C)C)c([Si](C)(O)F)c1C(C)(C)C","InChI=1S/C19H33FOSi/c1-17(2,3)13-11-14(18(4,5)6)16(22(10,20)21)15(12-13)19(7,8)9/h11-12,21H,1-10H3","UGWOVUFMECJNIU-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)C(=C([Si](C)(C)C)[Si](C)(C)C)[Si](C)(C)C(C)(C)C","InChI=1S/C20H48Si4/c1-19(2,3)23(13,14)18(24(15,16)20(4,5)6)17(21(7,8)9)22(10,11)12/h1-16H3","OJAPZFCMKQRFJF-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cc(C(C)(C)C)c(c1C(C)(C)C)[Si](O)(F)C(C)C","InChI=1S/C21H37FOSi/c1-14(2)24(22,23)18-16(20(6,7)8)12-15(19(3,4)5)13-17(18)21(9,10)11/h12-14,23H,1-11H3","CHNRYWBDALCSCB-UHFFFAOYSA-N"
"CO[Si](C)(C)OC","InChI=1S/C4H12O2Si/c1-5-7(3,4)6-2/h1-4H3","JJQZDUKDJDQPMQ-UHFFFAOYSA-N"
"[H]c(c([H])1)c(=O)c([H])c([H])c(=O)1","InChI=1S/C6H4O2/c7-5-1-2-6(8)4-3-5/h1-4H","AZQWKYJCGOJGHM-UHFFFAOYSA-N"
"Cc(c1)c(C)cc(C)c(C)1","InChI=1S/C10H14/c1-7-5-9(3)10(4)6-8(7)2/h5-6H,1-4H3","SQNZJJAZBFDUTD-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)c(c(c2)c(ccc2)1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C19H24Si2/c1-20(2,3)21(4,5)19-17-12-8-6-10-15(17)14-16-11-7-9-13-18(16)19/h6-14H,1-5H3","FHUHBAOZQYFCRI-UHFFFAOYSA-N"
"COC(=O)C(C2)CC(O1)C(C2)(C[Si](C)(C)C)1","InChI=1S/C12H22O3Si/c1-14-11(13)9-5-6-12(8-16(2,3)4)10(7-9)15-12/h9-10H,5-8H2,1-4H3","ZRXHXHKQHYXCHY-UHFFFAOYSA-N"
"CC(C)(O)C(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C13H26OSi/c1-13(2,14)12-8-6-11(7-9-12)10-15(3,4)5/h6,12,14H,7-10H2,1-5H3","JKVMEKIYWAVPHZ-UHFFFAOYSA-N"
"CC(C)C(C1)C(C2)C(CCC(=C)2)C(=O)C1","InChI=1S/C14H22O/c1-9(2)11-6-7-14(15)12-5-4-10(3)8-13(11)12/h9,11-13H,3-8H2,1-2H3","JSJLUTZQCLOLOV-UHFFFAOYSA-N"
"CC(C)=CCCC(=O)C(C1)CCC(=C)C1","InChI=1S/C14H22O/c1-11(2)5-4-6-14(15)13-9-7-12(3)8-10-13/h5,13H,3-4,6-10H2,1-2H3","RUVQJUFOCKSEQX-UHFFFAOYSA-N"
"CC(C)=CCCC(O)C(C1)CCC(=C)C1","InChI=1S/C14H24O/c1-11(2)5-4-6-14(15)13-9-7-12(3)8-10-13/h5,13-15H,3-4,6-10H2,1-2H3","YNTXRJAXNARKST-UHFFFAOYSA-N"
"O=C(C2)C(C1)C(CC2)CC(=C1)C[Si](C)(C)C","InChI=1S/C14H24OSi/c1-16(2,3)10-11-7-8-13-12(9-11)5-4-6-14(13)15/h7,12-13H,4-6,8-10H2,1-3H3","RWOJYFLMIFUXLK-UHFFFAOYSA-N"
"COC(=O)C(=C(C)C)C(C)=O","InChI=1S/C8H12O3/c1-5(2)7(6(3)9)8(10)11-4/h1-4H3","CDHWLGSCWGPPCT-UHFFFAOYSA-N"
"CC(C)=CCCC(O)C(C1)CC([H])=C(C1)C[Si](C)(C)C","InChI=1S/C17H32OSi/c1-14(2)7-6-8-17(18)16-11-9-15(10-12-16)13-19(3,4)5/h7,9,16-18H,6,8,10-13H2,1-5H3","GYSUXFPJPGFPTA-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O)C(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C18H34OSi/c1-15(2)8-7-13-18(3,19)17-11-9-16(10-12-17)14-20(4,5)6/h8-9,17,19H,7,10-14H2,1-6H3","JYKDIEVVWXVFHF-UHFFFAOYSA-N"
"C=CCCCO","InChI=1S/C5H10O/c1-2-3-4-5-6/h2,6H,1,3-5H2","LQAVWYMTUMSFBE-UHFFFAOYSA-N"
"C[Si](C)(Cl)CC[Si](C)(Cl)Cl","InChI=1S/C5H13Cl3Si2/c1-9(2,6)4-5-10(3,7)8/h4-5H2,1-3H3","NIRGYLDVTGAPIO-UHFFFAOYSA-N"
"C=C(O[Si](C)(C)C)C(Cl)(Cl)Cl","InChI=1S/C6H11Cl3OSi/c1-5(6(7,8)9)10-11(2,3)4/h1H2,2-4H3","LWLRVUYGQXYZED-UHFFFAOYSA-N"
"ClCC(=CCl)O[Si](C)(C)C","InChI=1S/C6H12Cl2OSi/c1-10(2,3)9-6(4-7)5-8/h4H,5H2,1-3H3/b6-4-","ZHKMMCJJRXLVPW-XQRVVYSFSA-N"
"ClCC(=O)C[Si](C)(C)C","InChI=1S/C6H13ClOSi/c1-9(2,3)5-6(8)4-7/h4-5H2,1-3H3","GVDVPDPHJUOSTN-UHFFFAOYSA-N"
"ClCC(=C)O[Si](C)(C)C","InChI=1S/C6H13ClOSi/c1-6(5-7)8-9(2,3)4/h1,5H2,2-4H3","OHLRLWSRPAPEMZ-UHFFFAOYSA-N"
"C=C(CI)O[Si](C)(C)C","InChI=1S/C6H13IOSi/c1-6(5-7)8-9(2,3)4/h1,5H2,2-4H3","UNVYGHQAJAEUTD-UHFFFAOYSA-N"
"CC[Si](Cl)(CC)CC","InChI=1S/C6H15ClSi/c1-4-8(7,5-2)6-3/h4-6H2,1-3H3","DCFKHNIGBAHNSS-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)O","InChI=1S/C6H16OSi/c1-6(2,3)8(4,5)7/h7H,1-5H3","FGWRMMTYIZKYMA-UHFFFAOYSA-N"
"C[Si](C)(C)C(Cl)Cl","InChI=1S/C4H10Cl2Si/c1-7(2,3)4(5)6/h4H,1-3H3","XJTUNBKAWATELL-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)N","InChI=1S/C6H17NSi/c1-6(2,3)8(4,5)7/h7H2,1-5H3","FPTVUFLXTAXDDB-UHFFFAOYSA-N"
"C[Si](C)(C1)N[Si](C)(C)C1","InChI=1S/C6H17NSi2/c1-8(2)5-6-9(3,4)7-8/h7H,5-6H2,1-4H3","IPKOJSMGLIKFLO-UHFFFAOYSA-N"
"C[Si](C)(C1)N[Si](C)(C)CC1","InChI=1S/C7H19NSi2/c1-9(2)6-5-7-10(3,4)8-9/h8H,5-7H2,1-4H3","VVNWHIYYCOBFMW-UHFFFAOYSA-N"
"CCOC(=O)C(C#N)CC(C)=O","InChI=1S/C8H11NO3/c1-3-12-8(11)7(5-9)4-6(2)10/h7H,3-4H2,1-2H3","WCOOHFKTZREKRW-UHFFFAOYSA-N"
"CC(C1)=C(C)C(=O)C(C)1","InChI=1S/C8H12O/c1-5-4-6(2)8(9)7(5)3/h6H,4H2,1-3H3","HNZWNWPTJZTRTK-UHFFFAOYSA-N"
"COC(=O)CC(=O)C=C(C)C","InChI=1S/C8H12O3/c1-6(2)4-7(9)5-8(10)11-3/h4H,5H2,1-3H3","BRUOTCVCYPVYPM-UHFFFAOYSA-N"
"CC(=O)CC(=O)C(C)(C)C","InChI=1S/C8H14O2/c1-6(9)5-7(10)8(2,3)4/h5H2,1-4H3","LCLCVVVHIPPHCG-UHFFFAOYSA-N"
"CCOCC(=C)O[Si](C)(C)C","InChI=1S/C8H18O2Si/c1-6-9-7-8(2)10-11(3,4)5/h2,6-7H2,1,3-5H3","CRMAIVBWLODODC-UHFFFAOYSA-N"
"CCOCC(=O)C[Si](C)(C)C","InChI=1S/C8H18O2Si/c1-5-10-6-8(9)7-11(2,3)4/h5-7H2,1-4H3","DRFOZBMDVDTHMQ-UHFFFAOYSA-N"
"COC(=O)C(C1)CCC(=C)C1","InChI=1S/C9H14O2/c1-7-3-5-8(6-4-7)9(10)11-2/h8H,1,3-6H2,2H3","SYRKANZKKKAWNJ-UHFFFAOYSA-N"
"C=C(CC(C)(C)Cl)O[Si](C)(C)C","InChI=1S/C9H19ClOSi/c1-8(7-9(2,3)10)11-12(4,5)6/h1,7H2,2-6H3","HCZALZDONLJTTC-UHFFFAOYSA-N"
"C=C(C[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C9H22OSi2/c1-9(8-11(2,3)4)10-12(5,6)7/h1,8H2,2-7H3","CJEVAYSVMDKECV-UHFFFAOYSA-N"
"O=C(C1)C=C(C2)C(CCCC2)1","InChI=1S/C10H14O/c11-10-6-8-4-2-1-3-5-9(8)7-10/h6,9H,1-5,7H2","LPTBBUOSXDRPJK-UHFFFAOYSA-N"
"CC(=C)C(C1)CCC(=C)C1","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h10H,1,3-7H2,2H3","GOQRXDTWKVYHJH-UHFFFAOYSA-N"
"CC(=O)CC(C1)C(=O)CCCC1","InChI=1S/C10H16O2/c1-8(11)7-9-5-3-2-4-6-10(9)12/h9H,2-7H2,1H3","UJSZNPKZSFYPBL-UHFFFAOYSA-N"
"CC(=O)CC(C)(C1)C(=O)CCC1","InChI=1S/C10H16O2/c1-8(11)7-10(2)6-4-3-5-9(10)12/h3-7H2,1-2H3","GSNMEWFUVUYCCQ-UHFFFAOYSA-N"
"COC(=O)C(CC)(CC(C)=O)C(=O)OC","InChI=1S/C10H16O5/c1-5-10(6-7(2)11,8(12)14-3)9(13)15-4/h5-6H2,1-4H3","PBRWHUUBOYQIEO-UHFFFAOYSA-N"
"CCOC(=O)C(CC(C)=O)C(=O)OCC","InChI=1S/C10H16O5/c1-4-14-9(12)8(6-7(3)11)10(13)15-5-2/h8H,4-6H2,1-3H3","KGZCSZOGMMZHKB-UHFFFAOYSA-N"
"CC(=O)CCC(=O)c(c1)cccc1","InChI=1S/C11H12O2/c1-9(12)7-8-11(13)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3","RBLXWIPBPPVLPU-UHFFFAOYSA-N"
"CC(=O)COC(=O)Cc(c1)cccc1","InChI=1S/C11H12O3/c1-9(12)8-14-11(13)7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3","MXZBBLQECZKOBV-UHFFFAOYSA-N"
"COC(=O)C(C(=O)1)C(C)(C)CC(C)=C1","InChI=1S/C11H16O3/c1-7-5-8(12)9(10(13)14-4)11(2,3)6-7/h5,9H,6H2,1-4H3","DVRUDYWXVMIYKQ-UHFFFAOYSA-N"
"COC(=O)C(=C(C)1)C(=O)CC(C)(C)C1","InChI=1S/C11H16O3/c1-7-5-11(2,3)6-8(12)9(7)10(13)14-4/h5-6H2,1-4H3","NRQHBEIJFHZERL-UHFFFAOYSA-N"
"O=CC(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C11H20OSi/c1-13(2,3)9-11-6-4-10(8-12)5-7-11/h6,8,10H,4-5,7,9H2,1-3H3","PTJDAESHYAVRRS-UHFFFAOYSA-N"
"CCCCN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C11H27NSi2/c1-6-7-9-12-13(2,3)10-8-11-14(12,4)5/h6-11H2,1-5H3","ZWDFPXZHLQWYKN-UHFFFAOYSA-N"
"COC(=O)C(C1)CC(=CC1)C[Si](C)(C)C","InChI=1S/C12H22O2Si/c1-14-12(13)11-7-5-6-10(8-11)9-15(2,3)4/h6,11H,5,7-9H2,1-4H3","MHABJOQBNQANTI-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(C=C)[Si](C)(C)F","InChI=1S/C12H23FSi/c1-7-12(4,14(5,6)13)10-8-9-11(2)3/h7,9H,1,8,10H2,2-6H3","IUEPASPTDFFCEL-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)N[Si](C)(C)C(C)(C)C","InChI=1S/C12H31NSi2/c1-11(2,3)14(7,8)13-15(9,10)12(4,5)6/h13H,1-10H3","ZBLRLJUOIRWSCE-UHFFFAOYSA-N"
"CC[Si](CC)(CC)N[Si](CC)(CC)CC","InChI=1S/C12H31NSi2/c1-7-14(8-2,9-3)13-15(10-4,11-5)12-6/h13H,7-12H2,1-6H3","APDDLLVYBXGBRF-UHFFFAOYSA-N"
"CCOC(=O)C(CC(C)=O)c(c1)cccc1","InChI=1S/C13H16O3/c1-3-16-13(15)12(9-10(2)14)11-7-5-4-6-8-11/h4-8,12H,3,9H2,1-2H3","MPTUXQOIIUTVGD-UHFFFAOYSA-N"
"c(c2)ccc(c2)CN([Si](C)(C)1)[Si](C)(C)CC1","InChI=1S/C13H23NSi2/c1-15(2)10-11-16(3,4)14(15)12-13-8-6-5-7-9-13/h5-9H,10-12H2,1-4H3","ZWHJOKVPBMQCSF-UHFFFAOYSA-N"
"CC(=C)C(C1)CC=C(C1)C[Si](C)(C)C","InChI=1S/C13H24Si/c1-11(2)13-8-6-12(7-9-13)10-14(3,4)5/h6,13H,1,7-10H2,2-5H3","FDRSHCOPRLFDOK-UHFFFAOYSA-N"
"CCOC(=O)C(CC(=C)O[Si](C)(C)C)C(=O)OCC","InChI=1S/C13H24O5Si/c1-7-16-12(14)11(13(15)17-8-2)9-10(3)18-19(4,5)6/h11H,3,7-9H2,1-2,4-6H3","XRQYWQXVPALWDW-UHFFFAOYSA-N"
"c(c1)ccc(c1)CN([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C13H25NSi2/c1-15(2,3)14(16(4,5)6)12-13-10-8-7-9-11-13/h7-11H,12H2,1-6H3","MISAGEOFUVTSBB-UHFFFAOYSA-N"
"N#CC(C#N)(C1)C(C#N)(C#N)CC(=C1)C[Si](C)(C)C","InChI=1S/C14H16N4Si/c1-19(2,3)7-12-4-5-13(8-15,9-16)14(6-12,10-17)11-18/h4H,5-7H2,1-3H3","NELIXQYAOSBHOV-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C)(C1)CC(C)(C)C(=O)1","InChI=1S/C14H18O/c1-13(2)10-14(3,9-12(13)15)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3","SHZFCSMUTTUMRK-UHFFFAOYSA-N"
"CC(C1)=C(C)CC(C2)(CCCC2)C(=O)C1","InChI=1S/C14H22O/c1-11-6-7-13(15)14(10-12(11)2)8-4-3-5-9-14/h3-10H2,1-2H3","LJSYVDZQSXTISR-UHFFFAOYSA-N"
"C(C2)CCCC(CC2)=NC(C1)CCCC1","InChI=1S/C14H25N/c1-2-5-9-13(10-6-3-1)15-14-11-7-4-8-12-14/h14H,1-12H2","QEPBYAZZLLFREJ-UHFFFAOYSA-N"
"CCCCCCCCN[Si](C)(C)C(C)(C)C","InChI=1S/C14H33NSi/c1-7-8-9-10-11-12-13-15-16(5,6)14(2,3)4/h15H,7-13H2,1-6H3","UNIQFZXKPCLILS-UHFFFAOYSA-N"
"c(c2)ccc(c2)CN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C14H25NSi2/c1-16(2)11-8-12-17(3,4)15(16)13-14-9-6-5-7-10-14/h5-7,9-10H,8,11-13H2,1-4H3","XYGDRIWRTXHXLG-UHFFFAOYSA-N"
"CCCCCCCCN([Si](C)(C)1)[Si](C)(C)CC1","InChI=1S/C14H33NSi2/c1-6-7-8-9-10-11-12-15-16(2,3)13-14-17(15,4)5/h6-14H2,1-5H3","WEJCEXJZYNXOMD-UHFFFAOYSA-N"
"CCCCCCCCN([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C14H35NSi2/c1-8-9-10-11-12-13-14-15(16(2,3)4)17(5,6)7/h8-14H2,1-7H3","JQZMOUCEQQEWJG-UHFFFAOYSA-N"
"CCCCCCCCOS(=O)(=O)c(c1)ccc(C)c1","InChI=1S/C15H24O3S/c1-3-4-5-6-7-8-13-18-19(16,17)15-11-9-14(2)10-12-15/h9-12H,3-8,13H2,1-2H3","LYQJBZLAANNIER-UHFFFAOYSA-N"
"CCCCCCCCN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C15H35NSi2/c1-6-7-8-9-10-11-13-16-17(2,3)14-12-15-18(16,4)5/h6-15H2,1-5H3","AFMAQORKHHJCAG-UHFFFAOYSA-N"
"C(C3)CCC(C3)n(c(C)1)c(C2)c(CCCC2)c([H])1","InChI=1S/C16H25N/c1-13-12-14-8-4-2-7-11-16(14)17(13)15-9-5-3-6-10-15/h12,15H,2-11H2,1H3","ZBJSOGJLJZYIHY-UHFFFAOYSA-N"
"C(C3)CCc(c([H])1)c(CC3)n(C(C2)CCCC2)c(C)1","InChI=1S/C17H27N/c1-14-13-15-9-5-2-3-8-12-17(15)18(14)16-10-6-4-7-11-16/h13,16H,2-12H2,1H3","PVLINPQETXKYJN-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)C(C)(C1)C(C2)(CCCC2)C(=O)C1","InChI=1S/C18H24O/c1-14-6-8-15(9-7-14)17(2)13-10-16(19)18(17)11-4-3-5-12-18/h6-9H,3-5,10-13H2,1-2H3","QBXOFBXUZLPVDH-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)C(C)(C1)CC(C2)(CCCC2)C(=O)1","InChI=1S/C18H24O/c1-14-6-8-15(9-7-14)17(2)12-16(19)18(13-17)10-4-3-5-11-18/h6-9H,3-5,10-13H2,1-2H3","CRGRICRBYBKJMS-UHFFFAOYSA-N"
"C=CCC(C)(C1)OC(=O)C1","InChI=1S/C8H12O2/c1-3-5-8(2)6-4-7(9)10-8/h3H,1,4-6H2,2H3","HSHSOYVJJCKZDP-UHFFFAOYSA-N"
"C[Ge](C)(Cl)Cl","InChI=1S/C2H6Cl2Ge/c1-5(2,3)4/h1-2H3","YQECBLVSMFAWIZ-UHFFFAOYSA-N"
"C[Ge](C)(C)Cl","InChI=1S/C3H9ClGe/c1-5(2,3)4/h1-3H3","ZZBNZZCHSNOXOH-UHFFFAOYSA-N"
"Oc(c1)ccc(Br)c1","InChI=1S/C6H5BrO/c7-5-1-3-6(8)4-2-5/h1-4,8H","GZFGOTFRPZRKDS-UHFFFAOYSA-N"
"C[Si](C)(Cl)[Si](C)(C)[Si](C)(C)Cl","InChI=1S/C6H18Cl2Si3/c1-9(2,7)11(5,6)10(3,4)8/h1-6H3","VXZHPKCBWCBOAU-UHFFFAOYSA-N"
"COc(c1)ccc(Br)c1","InChI=1S/C7H7BrO/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3","QJPJQTDYNZXKQF-UHFFFAOYSA-N"
"CC(C1)CCCC1","InChI=1S/C7H14/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3","UAEPNZWRGJTJPN-UHFFFAOYSA-N"
"CC[Si](C)(CC)[Si](C)(C)Cl","InChI=1S/C7H19ClSi2/c1-6-10(5,7-2)9(3,4)8/h6-7H2,1-5H3","HMACUZHWIGKBMY-UHFFFAOYSA-N"
"CC[Si](C)(CC)[SiH](C)C","InChI=1S/C7H20Si2/c1-6-9(5,7-2)8(3)4/h8H,6-7H2,1-5H3","KPISIPFWLMPWOU-UHFFFAOYSA-N"
"CC[Si](C)(C)[Si](C)(C)C","InChI=1S/C7H20Si2/c1-7-9(5,6)8(2,3)4/h7H2,1-6H3","AIYNVZFMBDWFLW-UHFFFAOYSA-N"
"C[SiH](C)[Si](C)(C)[Si](C)(C)C","InChI=1S/C7H22Si3/c1-8(2)10(6,7)9(3,4)5/h8H,1-7H3","YNNGBLKAOSDCHG-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)[Si](C)(C)C","InChI=1S/C8H24Si3/c1-9(2,3)11(7,8)10(4,5)6/h1-8H3","DDIMPUQNMJIVKL-UHFFFAOYSA-N"
"C[Si](C)(C)Oc(c1)ccc(Br)c1","InChI=1S/C9H13BrOSi/c1-12(2,3)11-9-6-4-8(10)5-7-9/h4-7H,1-3H3","HWKPTBHJWBSOOP-UHFFFAOYSA-N"
"Oc(c1)ccc(c1)[Si](C)(C)C","InChI=1S/C9H14OSi/c1-11(2,3)9-6-4-8(10)5-7-9/h4-7,10H,1-3H3","ZOMMEPFDNFYOHO-UHFFFAOYSA-N"
"CO[Si](C)(OC)c(c1)cccc1","InChI=1S/C9H14O2Si/c1-10-12(3,11-2)9-7-5-4-6-8-9/h4-8H,1-3H3","CVQVSVBUMVSJES-UHFFFAOYSA-N"
"CC(C)[Si](C)(Cl)c(c1)cccc1","InChI=1S/C10H15ClSi/c1-9(2)12(3,11)10-7-5-4-6-8-10/h4-9H,1-3H3","KZSZEXYXZJZLHY-UHFFFAOYSA-N"
"C[Si](C)(C)C([H])=C([H])[Si](C)(C)[Si](C)(C)C","InChI=1S/C10H26Si3/c1-11(2,3)9-10-13(7,8)12(4,5)6/h9-10H,1-8H3/b10-9+","JNIYOGWIJMFISY-MDZDMXLPSA-N"
"CO[Si]([Si](C)(C)C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C10H30OSi4/c1-11-15(12(2,3)4,13(5,6)7)14(8,9)10/h1-10H3","VGECNGCCOSRMRH-UHFFFAOYSA-N"
"c(c1)ccc(c1)CCO[Si](C)(C)C","InChI=1S/C11H18OSi/c1-13(2,3)12-10-9-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3","ZDEFWWOHFSCODL-UHFFFAOYSA-N"
"C[Si](C)(C)C=C([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C11H28Si3/c1-12(2,3)10-11(13(4,5)6)14(7,8)9/h10H,1-9H3","CUFNUQSBSOKXJH-UHFFFAOYSA-N"
"C[Si](C)([Si](C)(C)1)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)1","InChI=1S/C12H36Si6/c1-13(2)14(3,4)16(7,8)18(11,12)17(9,10)15(13,5)6/h1-12H3","RTCLHEHPUHREBC-UHFFFAOYSA-N"
"ClC[SiH](c(c2)cccc2)c(c1)cccc1","InChI=1S/C13H13ClSi/c14-11-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2","FEHFUPASEBBYRC-UHFFFAOYSA-N"
"C[Si](C)(C)Oc(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C14H28OSi3/c1-16(2,3)15-13-9-11-14(12-10-13)18(7,8)17(4,5)6/h9-12H,1-8H3","NPRHWBLCHAPWGX-UHFFFAOYSA-N"
"O=C(CCC(=O)c(c2)cccc2)c(c1)cccc1","InChI=1S/C16H14O2/c17-15(13-7-3-1-4-8-13)11-12-16(18)14-9-5-2-6-10-14/h1-10H,11-12H2","OSWWFLDIIGGSJV-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)Oc(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C16H34OSi4/c1-18(2,3)20(7,8)16-13-11-15(12-14-16)17-21(9,10)19(4,5)6/h11-14H,1-10H3","YAOOGXJXOIJGSB-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(c(C)1)[Si](Cl)(Cl)Cl","InChI=1S/C9H11Cl3Si/c1-6-4-7(2)9(8(3)5-6)13(10,11)12/h4-5H,1-3H3","DNKIGCMPHGFTRD-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(c(C)1)[Si](Cl)(Cl)C(C)(C)C","InChI=1S/C13H20Cl2Si/c1-9-7-10(2)12(11(3)8-9)16(14,15)13(4,5)6/h7-8H,1-6H3","AGBTWRCKSJZBSE-UHFFFAOYSA-N"
"Cc(c2)cc(C)c(c(C)2)[Si](Cl)(Cl)c(c(C)1)c(C)cc(C)c1","InChI=1S/C18H22Cl2Si/c1-11-7-13(3)17(14(4)8-11)21(19,20)18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3","RUSBLLCPBKKDKQ-UHFFFAOYSA-N"
"Cc(c2)cc(C)c(c(C)2)[Si](F)(F)c(c(C)1)c(C)cc(C)c1","InChI=1S/C18H22F2Si/c1-11-7-13(3)17(14(4)8-11)21(19,20)18-15(5)9-12(2)10-16(18)6/h7-10H,1-6H3","WXVJHQLEUYJXTJ-UHFFFAOYSA-N"
"C(C)(C)c(c1)cc(C(C)C)c([Si](C(C)(C)C)(C42)C(c(c5)c(ccc5)4)c(c3)c(ccc3)2)c(C(C)C)1","InChI=1S/C33H42Si/c1-20(2)23-18-28(21(3)4)32(29(19-23)22(5)6)34(33(7,8)9)30-24-14-10-11-15-25(24)31(34)27-17-13-12-16-26(27)30/h10-22,30-31H,1-9H3","CGSXXQBFNHCFEK-UHFFFAOYSA-N"
"Clc(c1)ccc(Br)c1","InChI=1S/C6H4BrCl/c7-5-1-3-6(8)4-2-5/h1-4H","NHDODQWIKUYWMW-UHFFFAOYSA-N"
"Brc(c1)cc(Br)cc1","InChI=1S/C6H4Br2/c7-5-2-1-3-6(8)4-5/h1-4H","JSRLURSZEMLAFO-UHFFFAOYSA-N"
"Brc(c1)ccc(c1)N([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C12H22BrNSi2/c1-15(2,3)14(16(4,5)6)12-9-7-11(13)8-10-12/h7-10H,1-6H3","YJYMZGDBOMZWSR-UHFFFAOYSA-N"
"Clc(c1)ccc(c1)N([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C12H22ClNSi2/c1-15(2,3)14(16(4,5)6)12-9-7-11(13)8-10-12/h7-10H,1-6H3","FTAAFHOZHUFYBM-UHFFFAOYSA-N"
"COc(c1)ccc(c1)N([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C13H25NOSi2/c1-15-13-10-8-12(9-11-13)14(16(2,3)4)17(5,6)7/h8-11H,1-7H3","YQDOBHUSDRFHKO-UHFFFAOYSA-N"
"C[Si](C)(C)N([Si](C)(C)C)c(c1)ccc(c1)N([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C18H40N2Si4/c1-21(2,3)19(22(4,5)6)17-13-15-18(16-14-17)20(23(7,8)9)24(10,11)12/h13-16H,1-12H3","XQKWWUIRCYZBMX-UHFFFAOYSA-N"
"CC(C)CBr","InChI=1S/C4H9Br/c1-4(2)3-5/h4H,3H2,1-2H3","HLVFKOKELQSXIQ-UHFFFAOYSA-N"
"COc(c1)ccc(OC)c1","InChI=1S/C8H10O2/c1-9-7-3-5-8(10-2)6-4-7/h3-6H,1-2H3","OHBQPCCCRFSCAX-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(F)[Si](C)(Cl)C(C)(C)C","InChI=1S/C10H24ClFSi2/c1-9(2,3)13(7,11)14(8,12)10(4,5)6/h1-8H3","GFHWQOCAOXRKLP-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(Cl)[Si](C)(Cl)C(C)(C)C","InChI=1S/C10H24Cl2Si2/c1-9(2,3)13(7,11)14(8,12)10(4,5)6/h1-8H3","FRISHBNSKGDUHD-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(F)[Si](C)(F)C(C)(C)C","InChI=1S/C10H24F2Si2/c1-9(2,3)13(7,11)14(8,12)10(4,5)6/h1-8H3","DCFFYZURNZFNOS-UHFFFAOYSA-N"
"CC(C)(C)[SiH](C)[Si](C)(Cl)C(C)(C)C","InChI=1S/C10H25ClSi2/c1-9(2,3)12(7)13(8,11)10(4,5)6/h12H,1-8H3","NHPCBPMRAYGCSY-UHFFFAOYSA-N"
"c(c2)ccc(c2)Cc(c1)cccc1","InChI=1S/C13H12/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-10H,11H2","CZZYITDELCSZES-UHFFFAOYSA-N"
"N#Cc(c21)c(c3)c(ccc3)c(C#N)c(cccc2)1","InChI=1S/C16H8N2/c17-9-15-11-5-1-2-6-12(11)16(10-18)14-8-4-3-7-13(14)15/h1-8H","BIOPPFDHKHWJIA-UHFFFAOYSA-N"
"ClCC(C)=C([H])CCC(C)=C([H])CC(C1)C(C)(C)C(CC#N)=C(C)C1","InChI=1S/C21H32ClN/c1-16(7-6-8-17(2)15-22)9-11-19-12-10-18(3)20(13-14-23)21(19,4)5/h8-9,19H,6-7,10-13,15H2,1-5H3/b16-9+,17-8+","XCFXEBPOEFTTEK-AAZCYQLISA-N"
"[H]C(C1)=C(C)CCC(=C(C)2)C(C)(C)C(CC2)CC([H])=C(C)C1","InChI=1S/C20H32/c1-15-7-6-8-16(2)10-14-19-17(3)11-13-18(12-9-15)20(19,4)5/h8-9,18H,6-7,10-14H2,1-5H3/b15-9+,16-8+","PPHTWNLAMYYUHE-CBMFITSNSA-N"
"CC(C1)=CCCC(C)=CCCC(=C)C=CCC1","InChI=1S/C17H26/c1-15-9-5-4-6-10-16(2)12-8-14-17(3)13-7-11-15/h5,9,12-13H,1,4,6-8,10-11,14H2,2-3H3/b9-5-,16-12-,17-13-","IQUPQAZZFSHWOG-MESIBUNNSA-N"
"[H]C(C1)=C(C)CCC([H])=C([H])C(=O)C(C)(CCC([H])=C(C)C1)CCO[Si](C)(C)C(C)(C)C","InChI=1S/C25H44O2Si/c1-21-13-9-10-17-23(26)25(6,18-12-16-22(2)15-11-14-21)19-20-27-28(7,8)24(3,4)5/h10,14,16-17H,9,11-13,15,18-20H2,1-8H3/b17-10+,21-14+,22-16+","PKQHKSAHGDFLDE-SBCXIMPHSA-N"
"CC(=O)OC(C1)C([H])=C(C)CCC([H])=C(C)CCC([H])=C(C)CC1","InChI=1S/C19H30O2/c1-15-8-5-9-16(2)11-7-13-19(21-18(4)20)14-17(3)12-6-10-15/h9-10,14,19H,5-8,11-13H2,1-4H3/b15-10+,16-9+,17-14+","HJROHJIWKNEPNB-ZBUIQZEKSA-N"
"COC(C2)(C3)C=CC(C3)(C(=O)C2)c(c1)cccc1","InChI=1S/C16H18O2/c1-18-15-8-7-14(17)16(11-9-15,12-10-15)13-5-3-2-4-6-13/h2-6,9,11H,7-8,10,12H2,1H3","FZJQRWLZGFRJBS-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C=2)(C=1)C(=O)C=CC(C2)C1","InChI=1S/C15H12O/c16-14-7-6-12-8-10-15(14,11-9-12)13-4-2-1-3-5-13/h1-12H","KMQQYEHQPILLDQ-UHFFFAOYSA-N"
"CCCCC(C(=O)2)(C([H])=1)C([H])=C([H])C(C([H])=C([H])2)C([H])1","InChI=1S/C13H16O/c1-2-3-8-13-9-6-11(7-10-13)4-5-12(13)14/h4-7,9-11H,2-3,8H2,1H3","DDONLUKKNZXFPF-UHFFFAOYSA-N"
"COC(C1)(C2)C([H])=C([H])C(OC)(C2)C(=O)C1","InChI=1S/C11H16O3/c1-13-10-4-3-9(12)11(14-2,7-5-10)8-6-10/h5,7H,3-4,6,8H2,1-2H3","HNFIVFXSUQTJJF-UHFFFAOYSA-N"
"COC(C=2)(C3)C=CC(C3)(C(=O)C2)c(c1)cccc1","InChI=1S/C16H16O2/c1-18-15-8-7-14(17)16(11-9-15,12-10-15)13-5-3-2-4-6-13/h2-9,11H,10,12H2,1H3","MVGOFKVAGPVWCY-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C=2)(C=1)C(=O)CCC(C2)C1","InChI=1S/C15H14O/c16-14-7-6-12-8-10-15(14,11-9-12)13-4-2-1-3-5-13/h1-5,8-12H,6-7H2","UBXJWJIVXWHYSB-UHFFFAOYSA-N"
"CC(C)CC(C1)(C(=O)2)C([H])=C([H])C(CC2)C(C)1","InChI=1S/C14H22O/c1-10(2)8-14-7-6-12(11(3)9-14)4-5-13(14)15/h6-7,10-12H,4-5,8-9H2,1-3H3","YBJVMVDQCXDEGL-UHFFFAOYSA-N"
"CC(C)CC(C1)(C(=O)2)C([H])=C([H])C(C(C)C2)C(C)1","InChI=1S/C15H24O/c1-10(2)8-15-6-5-13(12(4)9-15)11(3)7-14(15)16/h5-6,10-13H,7-9H2,1-4H3","UNRSPCPGOKWMSY-UHFFFAOYSA-N"
"CC(C)CC(C1)(C(=O)2)C([H])=C([H])C(C([H])=C([H])2)C(C)1","InChI=1S/C14H20O/c1-10(2)8-14-7-6-12(11(3)9-14)4-5-13(14)15/h4-7,10-12H,8-9H2,1-3H3","RNYAORCVTYUGJU-UHFFFAOYSA-N"
"CC(C)CC(C1)=CC(C(O)2)C(CC2)C(C)1","InChI=1S/C14H24O/c1-9(2)6-11-7-10(3)12-4-5-14(15)13(12)8-11/h8-10,12-15H,4-7H2,1-3H3","ZKWOKEGHKOJMKX-UHFFFAOYSA-N"
"CC(C)CC(C1)=CC(C(OC(C)=O)2)C(CC2)C(C)1","InChI=1S/C16H26O2/c1-10(2)7-13-8-11(3)14-5-6-16(15(14)9-13)18-12(4)17/h9-11,14-16H,5-8H2,1-4H3","AOOZCPQVJAKLHX-UHFFFAOYSA-N"
"COC(C2)(C([H])=1)C(=O)C([H])=C(C)C(C2)C([H])1","InChI=1S/C11H14O2/c1-8-7-10(12)11(13-2)5-3-9(8)4-6-11/h3,5,7,9H,4,6H2,1-2H3","JHOVAQKYZFILSE-UHFFFAOYSA-N"
"CC(C)CC(O)(C1)C(OC)(C2)C=CC(C2)C(C)1","InChI=1S/C15H26O2/c1-11(2)9-14(16)10-12(3)13-5-7-15(14,17-4)8-6-13/h5,7,11-13,16H,6,8-10H2,1-4H3","WMOQJRHIXXRIQF-UHFFFAOYSA-N"
"O=CCC=CCCCCCCCC(=O)OCC(=O)c(c1)ccc(Br)c1","InChI=1S/C20H25BrO4/c21-18-13-11-17(12-14-18)19(23)16-25-20(24)10-8-6-4-2-1-3-5-7-9-15-22/h5,7,11-15H,1-4,6,8-10,16H2/b7-5-","UNNYUXYVCYITFX-ALCCZGGFSA-N"
"C([Si](C)(C)OC(CC=CCCCCCCCC(OCC(c(c1)ccc(c1)Br)=O)=O)CCCCCC)(C)(C)C","InChI=1S/C32H53BrO4Si/c1-7-8-9-16-19-29(37-38(5,6)32(2,3)4)20-17-14-12-10-11-13-15-18-21-31(35)36-26-30(34)27-22-24-28(33)25-23-27/h14,17,22-25,29H,7-13,15-16,18-21,26H2,1-6H3/b17-14-","SZHCEEWTBBCSDO-VKAVYKQESA-N"
"C(CC=CCC(O[Si](C)(C)C)C(O[Si](C)(C)C)CCCCC)CCCCCC(OCC(c(c1)ccc(c1)Br)=O)=O","InChI=1S/C32H55BrO5Si2/c1-8-9-16-19-30(37-39(2,3)4)31(38-40(5,6)7)20-17-14-12-10-11-13-15-18-21-32(35)36-26-29(34)27-22-24-28(33)25-23-27/h14,17,22-25,30-31H,8-13,15-16,18-21,26H2,1-7H3/b17-14-","ODKHJHMVUMKCEY-VKAVYKQESA-N"
"C(CCCCCCC(O[Si](C)(C)C)C(O[Si](C)(C)C)CC=CCCCCC)C(OCC(c(c1)ccc(c1)Br)=O)=O","InChI=1S/C32H55BrO5Si2/c1-8-9-10-11-13-16-19-30(37-39(2,3)4)31(38-40(5,6)7)20-17-14-12-15-18-21-32(35)36-26-29(34)27-22-24-28(33)25-23-27/h13,16,22-25,30-31H,8-12,14-15,17-21,26H2,1-7H3/b16-13-","ZDQPQPNUBMCVOD-SSZFMOIBSA-N"
"CC(C)(C)[Si](OC(CCCCC)C(CC=CCCCCCCCC(=O)OC)O[Si](C(C)(C)C)(C)C)(C)C","InChI=1S/C31H64O4Si2/c1-13-14-21-24-27(34-36(9,10)30(2,3)4)28(35-37(11,12)31(5,6)7)25-22-19-17-15-16-18-20-23-26-29(32)33-8/h19,22,27-28H,13-18,20-21,23-26H2,1-12H3/b22-19-","KKKRJPLCPSSPNS-QOCHGBHMSA-N"
"C(=CCC(C(CCCCCCCC(=O)OC)O[Si](C(C)(C)C)(C)C)O[Si](C(C)(C)C)(C)C)CCCCC","InChI=1S/C31H64O4Si2/c1-13-14-15-16-18-21-24-27(34-36(9,10)30(2,3)4)28(35-37(11,12)31(5,6)7)25-22-19-17-20-23-26-29(32)33-8/h18,21,27-28H,13-17,19-20,22-26H2,1-12H3/b21-18-","ZPGBMOYBPDWVGR-UZYVYHOESA-N"
"CCCCCC(O[Si](C)(C)C)C(CC=CCCCCCCCC(=O)OC)O[Si](C)(C)C","InChI=1S/C25H52O4Si2/c1-9-10-17-20-23(28-30(3,4)5)24(29-31(6,7)8)21-18-15-13-11-12-14-16-19-22-25(26)27-2/h15,18,23-24H,9-14,16-17,19-22H2,1-8H3/b18-15-","IYECOLONAGMZMJ-SDXDJHTJSA-N"
"CCCCCC=CCC(O[Si](C)(C)C)C(CCCCCCCC(=O)OC)O[Si](C)(C)C","InChI=1S/C25H52O4Si2/c1-9-10-11-12-14-17-20-23(28-30(3,4)5)24(29-31(6,7)8)21-18-15-13-16-19-22-25(26)27-2/h14,17,23-24H,9-13,15-16,18-22H2,1-8H3/b17-14-","AXALTMLNQNROGB-VKAVYKQESA-N"
"C=C(C3)C([H])(C([H])(C3)1)C([H])(C(C)(C)2)C(C)(CC2)C(=O)1","InChI=1S/C15H22O/c1-9-5-6-10-11(9)12-14(2,3)7-8-15(12,4)13(10)16/h10-12H,1,5-8H2,2-4H3/t10-,11+,12+,15-/m1/s1","AGQNZJFDBYCSEQ-OXJKWZBOSA-N"
"CCCCC(=C1)C(C)(C)C(C2)C(C(=O)C2)1","InChI=1S/C14H22O/c1-4-5-6-10-9-11-12(14(10,2)3)7-8-13(11)15/h9,11-12H,4-8H2,1-3H3","HUGDHXKPFPCNKN-UHFFFAOYSA-N"
"[H]C(=C([H])1)C(C)(C)C(C2)C(C)(C(=O)C2)1","InChI=1S/C11H16O/c1-10(2)6-7-11(3)8(10)4-5-9(11)12/h6-8H,4-5H2,1-3H3","HPSIMPAZMJPTEI-UHFFFAOYSA-N"
"O=C(C2)C(C=1)C(C)(C)C(C2)C(C)1","InChI=1S/C11H16O/c1-7-6-9-10(12)5-4-8(7)11(9,2)3/h6,8-9H,4-5H2,1-3H3","ZLPJOXYHLLMTKU-UHFFFAOYSA-N"
"CCCCC(=C1)C(C)(C)C(CCC=O)=C1","InChI=1S/C14H22O/c1-4-5-7-12-9-10-13(8-6-11-15)14(12,2)3/h9-11H,4-8H2,1-3H3","AJQQSCXBNGKHNR-UHFFFAOYSA-N"
"O=C(C2)C(C)(C1)C(C2)C(C)(C)C1","InChI=1S/C11H18O/c1-10(2)6-7-11(3)8(10)4-5-9(11)12/h8H,4-7H2,1-3H3","GKANQDYTWSKMIX-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)OCC)C(CC=C)C(C)c(c1)cccc1","InChI=1S/C19H26O4/c1-5-11-16(14(4)15-12-9-8-10-13-15)17(18(20)22-6-2)19(21)23-7-3/h5,8-10,12-14,16-17H,1,6-7,11H2,2-4H3","HZFSUVIIBNWDEV-UHFFFAOYSA-N"
"CCCCC(CC(=O)OCC)C(C)OCc(c1)cccc1","InChI=1S/C18H28O3/c1-4-6-12-17(13-18(19)20-5-2)15(3)21-14-16-10-8-7-9-11-16/h7-11,15,17H,4-6,12-14H2,1-3H3","GXWWTJCEMYRWCI-UHFFFAOYSA-N"
"CCOC(=O)CC(C)C(C)OCc(c1)cccc1","InChI=1S/C15H22O3/c1-4-17-15(16)10-12(2)13(3)18-11-14-8-6-5-7-9-14/h5-9,12-13H,4,10-11H2,1-3H3","ZWWXNEVKUXNIRZ-UHFFFAOYSA-N"
"COC(=O)CC(C)C(C)c(c1)cccc1","InChI=1S/C13H18O2/c1-10(9-13(14)15-3)11(2)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3","AICDYPXWSBSRPM-UHFFFAOYSA-N"
"CCCCC(C(C)OCc(c1)cccc1)C(C(=O)OCC)C(=O)OCC","InChI=1S/C21H32O5/c1-5-8-14-18(16(4)26-15-17-12-10-9-11-13-17)19(20(22)24-6-2)21(23)25-7-3/h9-13,16,18-19H,5-8,14-15H2,1-4H3","OTGVROSSWUCGBU-UHFFFAOYSA-N"
"CCCCC(C(C)c(c1)cccc1)C(C(=O)OCC)C(=O)OCC","InChI=1S/C20H30O4/c1-5-8-14-17(15(4)16-12-10-9-11-13-16)18(19(21)23-6-2)20(22)24-7-3/h9-13,15,17-18H,5-8,14H2,1-4H3","XCTWZWXHVJCPBJ-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)OCC)C(C)C(C)c(c1)cccc1","InChI=1S/C17H24O4/c1-5-20-16(18)15(17(19)21-6-2)13(4)12(3)14-10-8-7-9-11-14/h7-13,15H,5-6H2,1-4H3","VRPMYZZOZHSWRF-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)OCC)C(C)C(C)OCc(c1)cccc1","InChI=1S/C18H26O5/c1-5-21-17(19)16(18(20)22-6-2)13(3)14(4)23-12-15-10-8-7-9-11-15/h7-11,13-14,16H,5-6,12H2,1-4H3","BTIHIEFSRAFDKL-UHFFFAOYSA-N"
"CCCCC(CC(=O)OCC)C(C)c(c1)cccc1","InChI=1S/C17H26O2/c1-4-6-10-16(13-17(18)19-5-2)14(3)15-11-8-7-9-12-15/h7-9,11-12,14,16H,4-6,10,13H2,1-3H3","MVSHDPNATFNVJJ-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)OCC)C(CC=C)C(C)OCc(c1)cccc1","InChI=1S/C20H28O5/c1-5-11-17(15(4)25-14-16-12-9-8-10-13-16)18(19(21)23-6-2)20(22)24-7-3/h5,8-10,12-13,15,17-18H,1,6-7,11,14H2,2-4H3","QVNMMSANRIWVCH-UHFFFAOYSA-N"
"CN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C8H21NSi2/c1-9-10(2,3)7-6-8-11(9,4)5/h6-8H2,1-5H3","XSFQDEKDQXXGQN-UHFFFAOYSA-N"
"BrCCCSc(c1)cccc1","InChI=1S/C9H11BrS/c10-7-4-8-11-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2","QKGLUZCZUKTKCC-UHFFFAOYSA-N"
"COC(OC)c(c1)cccc1","InChI=1S/C9H12O2/c1-10-9(11-2)8-6-4-3-5-7-8/h3-7,9H,1-2H3","HEVMDQBCAHEHDY-UHFFFAOYSA-N"
"C=CC(C1)C(C)(C)C(=O)C1","InChI=1S/C9H14O/c1-4-7-5-6-8(10)9(7,2)3/h4,7H,1,5-6H2,2-3H3","FXJIIGNUCAFHEE-UHFFFAOYSA-N"
"CO[Si](OC)(OC)c(c1)cccc1","InChI=1S/C9H14O3Si/c1-10-13(11-2,12-3)9-7-5-4-6-8-9/h4-8H,1-3H3","ZNOCGWVLWPVKAO-UHFFFAOYSA-N"
"C(C2)CCC(C1)C(CC2)1","InChI=1S/C9H16/c1-2-4-6-9-7-8(9)5-3-1/h8-9H,1-7H2","FYECUAIUGWFPJF-UHFFFAOYSA-N"
"BrCCBr","InChI=1S/C2H4Br2/c3-1-2-4/h1-2H2","PAAZPARNPHGIKF-UHFFFAOYSA-N"
"CCI","InChI=1S/C2H5I/c1-2-3/h2H2,1H3","HVTICUPFWKNHNG-UHFFFAOYSA-N"
"ClCC=CCCl","InChI=1S/C4H6Cl2/c5-3-1-2-4-6/h1-2H,3-4H2/b2-1+","FQDIANVAWVHZIR-OWOJBTEDSA-N"
"CC(=C)CCl","InChI=1S/C4H7Cl/c1-4(2)3-5/h1,3H2,2H3","OHXAOPZTJOUYKM-UHFFFAOYSA-N"
"ClCCCCCl","InChI=1S/C4H8Cl2/c5-3-1-2-4-6/h1-4H2","KJDRSWPQXHESDQ-UHFFFAOYSA-N"
"COC(OC)OC","InChI=1S/C4H10O3/c1-5-4(6-2)7-3/h4H,1-3H3","PYOKUURKVVELLB-UHFFFAOYSA-N"
"O=Cc(c1)occ1","InChI=1S/C5H4O2/c6-4-5-2-1-3-7-5/h1-4H","HYBBIBNJHNGZAN-UHFFFAOYSA-N"
"C(C1)C=COC1","InChI=1S/C5H8O/c1-2-4-6-5-3-1/h2,4H,1,3,5H2","BUDQDWGNQVEFAC-UHFFFAOYSA-N"
"BrCCCCCBr","InChI=1S/C5H10Br2/c6-4-2-1-3-5-7/h1-5H2","IBODDUNKEPPBKW-UHFFFAOYSA-N"
"ClCCOCCOCCCl","InChI=1S/C6H12Cl2O2/c7-1-3-9-5-6-10-4-2-8/h1-6H2","AGYUOJIYYGGHKV-UHFFFAOYSA-N"
"FC(F)(F)c(c1)cccc1","InChI=1S/C7H5F3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H","GETTZEONDQJALK-UHFFFAOYSA-N"
"CC(C)C(=O)C(C)C","InChI=1S/C7H14O/c1-5(2)7(8)6(3)4/h5-6H,1-4H3","HXVNBWAKAOHACI-UHFFFAOYSA-N"
"CCOC(OCC)OCC","InChI=1S/C7H16O3/c1-4-8-7(9-5-2)10-6-3/h7H,4-6H2,1-3H3","GKASDNZWUGIAMG-UHFFFAOYSA-N"
"Clc(c1)c(c2)c(ccc2)cc1","InChI=1S/C10H7Cl/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H","JTPNRXUCIXHOKM-UHFFFAOYSA-N"
"CC(C1)CC(=O)C(C1)C(C)C","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9?/m0/s1","NFLGAXVYCFJBMK-IENPIDJESA-N"
"C=COC(C)=O","InChI=1S/C4H6O2/c1-3-6-4(2)5/h3H,1H2,2H3","XTXRWKRVRITETP-UHFFFAOYSA-N"
"CCOC(=O)CCl","InChI=1S/C4H7ClO2/c1-2-7-4(6)3-5/h2-3H2,1H3","VEUUMBGHMNQHGO-UHFFFAOYSA-N"
"CN(C1)C(=O)CC1","InChI=1S/C5H9NO/c1-6-4-2-3-5(6)7/h2-4H2,1H3","SECXISVLQFMRJM-UHFFFAOYSA-N"
"CC=CC(=O)OCC","InChI=1S/C6H10O2/c1-3-5-6(7)8-4-2/h3,5H,4H2,1-2H3/b5-3+","ZFDIRQKJPRINOQ-HWKANZROSA-N"
"CCOC(=O)CC(C)C","InChI=1S/C7H14O2/c1-4-9-7(8)5-6(2)3/h6H,4-5H2,1-3H3","PPXUHEORWJQRHJ-UHFFFAOYSA-N"
"CCOC(=O)C(C1)(C1)C(=O)OCC","InChI=1S/C9H14O4/c1-3-12-7(10)9(5-6-9)8(11)13-4-2/h3-6H2,1-2H3","KYYUCZOHNYSLFV-UHFFFAOYSA-N"
"CC(C1)=CCC(C)(C)C(=O)C1","InChI=1S/C10H16O/c1-8-4-5-9(11)10(2,3)7-6-8/h6H,4-5,7H2,1-3H3","SKKTZNHVYFHGDC-UHFFFAOYSA-N"
"ClC(Cl)C(O)CCc(c1)cccc1","InChI=1S/C10H12Cl2O/c11-10(12)9(13)7-6-8-4-2-1-3-5-8/h1-5,9-10,13H,6-7H2","AVSJCXYYYDSTTG-UHFFFAOYSA-N"
"Clc(c1)ccc(c1)C=C(Cl)Cl","InChI=1S/C8H5Cl3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-5H","XHNKLLVUWOTSGX-UHFFFAOYSA-N"
"CCN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C9H23NSi2/c1-6-10-11(2,3)8-7-9-12(10,4)5/h6-9H2,1-5H3","WIXJPVASNJQNDE-UHFFFAOYSA-N"
"CCC=CCC[Si](C)(C)C","InChI=1S/C9H20Si/c1-5-6-7-8-9-10(2,3)4/h6-7H,5,8-9H2,1-4H3/b7-6+","VLFAYCDTMFFDTR-VOTSOKGWSA-N"
"CC(C)CC(O)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C9H20Cl2OSi/c1-7(2)6-8(12)9(10,11)13(3,4)5/h7-8,12H,6H2,1-5H3","JIFGAVHEDYIENH-UHFFFAOYSA-N"
"c(c1)ccc(c1)SC(Cl)[Si](C)(C)C","InChI=1S/C10H15ClSSi/c1-13(2,3)10(11)12-9-7-5-4-6-8-9/h4-8,10H,1-3H3","QNJUWMRZLQBWEU-UHFFFAOYSA-N"
"CCO[Si](OC)(OC)c(c1)cccc1","InChI=1S/C10H16O3Si/c1-4-13-14(11-2,12-3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3","CBXRNQWZWLYUFD-UHFFFAOYSA-N"
"CCCCCC(O)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C10H22Cl2OSi/c1-5-6-7-8-9(13)10(11,12)14(2,3)4/h9,13H,5-8H2,1-4H3","OHGNPNQLXCOCCC-UHFFFAOYSA-N"
"CCCC(C)C(O)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C10H22Cl2OSi/c1-6-7-8(2)9(13)10(11,12)14(3,4)5/h8-9,13H,6-7H2,1-5H3","SSUALHCFYMRLAJ-UHFFFAOYSA-N"
"C=CCC(CC[Si](C)(C)C)Sc(c1)cccc1","InChI=1S/C15H24SSi/c1-5-9-14(12-13-17(2,3)4)16-15-10-7-6-8-11-15/h5-8,10-11,14H,1,9,12-13H2,2-4H3","LZQJZXYYZMVBJU-UHFFFAOYSA-N"
"CC(C)C=CCC[Si](C)(C)C","InChI=1S/C10H22Si/c1-10(2)8-6-7-9-11(3,4)5/h6,8,10H,7,9H2,1-5H3/b8-6+","JULRGPRGMOYRIX-SOFGYWHQSA-N"
"CCCC=CCC[Sn](C)(C)C","InChI=1S/C7H13.3CH3.Sn/c1-3-5-7-6-4-2;;;;/h5,7H,1,3-4,6H2,2H3;3*1H3;/b7-5+;;;;","TZNXFWLGOAUSQR-IGFSWITOSA-N"
"C=CCN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C10H23NSi2/c1-6-8-11-12(2,3)9-7-10-13(11,4)5/h6H,1,7-10H2,2-5H3","LXIRELDZPWPPQB-UHFFFAOYSA-N"
"CCCCN([Si](C)(C)1)[Si](C)(C)CC1","InChI=1S/C10H25NSi2/c1-6-7-8-11-12(2,3)9-10-13(11,4)5/h6-10H2,1-5H3","MFAHYUQAWVRZMH-UHFFFAOYSA-N"
"CCCN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C10H25NSi2/c1-6-8-11-12(2,3)9-7-10-13(11,4)5/h6-10H2,1-5H3","HKEZIKHMMUJDIJ-UHFFFAOYSA-N"
"CCCCN([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C10H27NSi2/c1-8-9-10-11(12(2,3)4)13(5,6)7/h8-10H2,1-7H3","VJVMYSNNXQHHFU-UHFFFAOYSA-N"
"CCCCC=CC[Si](C)(C)C","InChI=1S/C10H22Si/c1-5-6-7-8-9-10-11(2,3)4/h8-9H,5-7,10H2,1-4H3/b9-8+","UGNHZGDOTJSVAL-CMDGGOBGSA-N"
"C[Si](C)(C1)N[Si](C)(C)C[Si](C)(C)N[Si](C)(C)1","InChI=1S/C10H30N2Si4/c1-13(2)9-14(3,4)12-16(7,8)10-15(5,6)11-13/h11-12H,9-10H2,1-8H3","NVVQBMDSDDUFJD-UHFFFAOYSA-N"
"Clc(c1)ccc(c1)C(O)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C11H15Cl3OSi/c1-16(2,3)11(13,14)10(15)8-4-6-9(12)7-5-8/h4-7,10,15H,1-3H3","WJDFXRPGSMEIJW-UHFFFAOYSA-N"
"CCN(CC)C(=O)c(c1)cccc1","InChI=1S/C11H15NO/c1-3-12(4-2)11(13)10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3","JLNGEXDJAQASHD-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(C(Cl)Cl)O[Si](C)(C)C","InChI=1S/C11H16Cl2OSi/c1-15(2,3)14-10(11(12)13)9-7-5-4-6-8-9/h4-8,10-11H,1-3H3","WUTQBTWFSIXMBI-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(O)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C11H16Cl2OSi/c1-15(2,3)11(12,13)10(14)9-7-5-4-6-8-9/h4-8,10,14H,1-3H3","OWRRAILSOARBMK-UHFFFAOYSA-N"
"ClCCCCN([Si](C)(C)1)[Si](C)(C)CCC1","InChI=1S/C11H26ClNSi2/c1-14(2)10-7-11-15(3,4)13(14)9-6-5-8-12/h5-11H2,1-4H3","ZYFRNLUVMCUXNF-UHFFFAOYSA-N"
"Fc(c2)c(ccc2)[Hg]c(c1)c(F)ccc1","InChI=1S/2C6H4F.Hg/c2*7-6-4-2-1-3-5-6;/h2*1-4H;","VCIMYPFASJQYDJ-UHFFFAOYSA-N"
"O=C(C2)CC(CC2)Sc(c1)cccc1","InChI=1S/C12H14OS/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-9H2","ODZCHNYVOXNEKZ-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(C)(C(Cl)Cl)O[Si](C)(C)C","InChI=1S/C12H18Cl2OSi/c1-12(11(13)14,15-16(2,3)4)10-8-6-5-7-9-10/h5-9,11H,1-4H3","VMXRBRRRVHEDKG-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C1)C1[Si](C)(C)C","InChI=1S/C12H18Si/c1-13(2,3)12-9-11(12)10-7-5-4-6-8-10/h4-8,11-12H,9H2,1-3H3","YGQICJZACGXFSO-UHFFFAOYSA-N"
"CCO[Si](OCC)(OCC)c(c1)cccc1","InChI=1S/C12H20O3Si/c1-4-13-16(14-5-2,15-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3","JCVQKRGIASEUKR-UHFFFAOYSA-N"
"C[Si](C)(C)CCCSc(c1)cccc1","InChI=1S/C12H20SSi/c1-14(2,3)11-7-10-13-12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3","LOBCIEZDGYXMPV-UHFFFAOYSA-N"
"c(c1)ccc(c1)SCCC[Sn](C)(C)C","InChI=1S/C9H11S.3CH3.Sn/c1-2-8-10-9-6-4-3-5-7-9;;;;/h3-7H,1-2,8H2;3*1H3;","HMJQOLXJRJTWPL-UHFFFAOYSA-N"
"OCCCCCCCCCCC(=O)OC","InChI=1S/C12H24O3/c1-15-12(14)10-8-6-4-2-3-5-7-9-11-13/h13H,2-11H2,1H3","VASIFKMMXNGAGN-UHFFFAOYSA-N"
"c(c2)ccc(c2)SCSc(c1)cccc1","InChI=1S/C13H12S2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h1-10H,11H2","ZHUPZVIALZHGGP-UHFFFAOYSA-N"
"c(c1)ccc(c1)CCC(O)C(Cl)(Cl)[Si](C)(C)C","InChI=1S/C13H20Cl2OSi/c1-17(2,3)13(14,15)12(16)10-9-11-7-5-4-6-8-11/h4-8,12,16H,9-10H2,1-3H3","CNMYGWLCQSBOOX-UHFFFAOYSA-N"
"c(c1)ccc(c1)CC=CC[Si](C)(C)C","InChI=1S/C13H20Si/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-10H,11-12H2,1-3H3/b8-7+","SPZMUNLMWTULJC-BQYQJAHWSA-N"
"c(c1)ccc(c1)C=CCC[Si](C)(C)C","InChI=1S/C13H20Si/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-7,9-11H,8,12H2,1-3H3/b11-7+","ZVCCRJYTBSOWGI-YRNVUSSQSA-N"
"C=CC(Br)[Si](C)(C)C","InChI=1S/C6H13BrSi/c1-5-6(7)8(2,3)4/h5-6H,1H2,2-4H3","CNCUFOZUVQDEDC-UHFFFAOYSA-N"
"N#Cc(c1)ccc(c1)C(OC)OC","InChI=1S/C10H11NO2/c1-12-10(13-2)9-5-3-8(7-11)4-6-9/h3-6,10H,1-2H3","KAIKLOZUJNGBNP-UHFFFAOYSA-N"
"C=CCN(C)c(c1)cccc1","InChI=1S/C10H13N/c1-3-9-11(2)10-7-5-4-6-8-10/h3-8H,1,9H2,2H3","WJYIMFNLIJXFMX-UHFFFAOYSA-N"
"COC(OC)c(c1)ccc(C)c1","InChI=1S/C10H14O2/c1-8-4-6-9(7-5-8)10(11-2)12-3/h4-7,10H,1-3H3","MKZGLAOLSFUPRT-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(OC)OC","InChI=1S/C10H14O3/c1-11-9-6-4-8(5-7-9)10(12-2)13-3/h4-7,10H,1-3H3","NNHYAHOTXLASEA-UHFFFAOYSA-N"
"CCOC(OCC)c(c1)cccc1","InChI=1S/C11H16O2/c1-3-12-11(13-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3","MAQMEXSLUSZDQM-UHFFFAOYSA-N"
"CCCCCCCC[Si](C)(OCC)OCC","InChI=1S/C13H30O2Si/c1-5-8-9-10-11-12-13-16(4,14-6-2)15-7-3/h5-13H2,1-4H3","WQVJKRKRRMJKMC-UHFFFAOYSA-N"
"[H]C(=C([H])1)C([H])=C([H])[B](C)C([H])=C([H])1","InChI=1S/C7H9B/c1-8-6-4-2-3-5-7-8/h2-7H,1H3","METKHXNXRUJTPV-UHFFFAOYSA-N"
"CCCCCCC=CCC[Si](C)(C)C","InChI=1S/C13H28Si/c1-5-6-7-8-9-10-11-12-13-14(2,3)4/h10-11H,5-9,12-13H2,1-4H3/b11-10+","CXYBIESMEVGOIP-ZHACJKMWSA-N"
"CCCCCCCC[Si](OCC)(OCC)OCC","InChI=1S/C14H32O3Si/c1-5-9-10-11-12-13-14-18(15-6-2,16-7-3)17-8-4/h5-14H2,1-4H3","MSRJTTSHWYDFIU-UHFFFAOYSA-N"
"CCC(CC[Si](C)(C)C)Sc(c1)cccc1","InChI=1S/C14H24SSi/c1-5-13(11-12-16(2,3)4)15-14-9-7-6-8-10-14/h6-10,13H,5,11-12H2,1-4H3","SWCGWXTVPFCQKY-UHFFFAOYSA-N"
"[H]C(C3)=C([H])CC(C3)CC[Si](O2)(O1)OCCN(CC2)CC1","InChI=1S/C14H25NO3Si/c1-2-4-14(5-3-1)6-13-19-16-10-7-15(8-11-17-19)9-12-18-19/h1-2,14H,3-13H2","CTIDMPCTUFVTFC-UHFFFAOYSA-N"
"CCCCCCCC[Si](O2)(O1)OCCN(CC2)CC1","InChI=1S/C14H29NO3Si/c1-2-3-4-5-6-7-14-19-16-11-8-15(9-12-17-19)10-13-18-19/h2-14H2,1H3","RPEZIKXYNXVEST-UHFFFAOYSA-N"
"CCCCCCC=C[Si](OCC)(OCC)OCC","InChI=1S/C14H30O3Si/c1-5-9-10-11-12-13-14-18(15-6-2,16-7-3)17-8-4/h13-14H,5-12H2,1-4H3/b14-13+","SDIRFAFFHXXYEL-BUHFOSPRSA-N"
"CCCCCCCC=CCC[Si](C)(C)C","InChI=1S/C14H30Si/c1-5-6-7-8-9-10-11-12-13-14-15(2,3)4/h11-12H,5-10,13-14H2,1-4H3/b12-11+","NZAXKKKKVBISRC-VAWYXSNFSA-N"
"Cc(n3)cc(c1)c(c3)cc(c2)c(ccc2)1","InChI=1S/C14H11N/c1-10-6-13-7-11-4-2-3-5-12(11)8-14(13)9-15-10/h2-9H,1H3","VNYFIMAAUQDNKJ-UHFFFAOYSA-N"
"CCCCc(c1)c[n+1]([O-1])c(c1)C(O)=O","InChI=1S/C10H13NO3/c1-2-3-4-8-5-6-9(10(12)13)11(14)7-8/h5-7H,2-4H2,1H3,(H,12,13)","IXZMLXUNSSYGAJ-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)C([H])=C([H])c(c1)nccc1","InChI=1S/C14H13N/c1-12-5-7-13(8-6-12)9-10-14-4-2-3-11-15-14/h2-11H,1H3/b10-9+","HRBZKIXCQILVSA-MDZDMXLPSA-N"
"Nc(c2)ccc(c2)C=Cc(c1)nccc1","InChI=1S/C13H12N2/c14-12-7-4-11(5-8-12)6-9-13-3-1-2-10-15-13/h1-10H,14H2/b9-6+","NAUWKJSESHOJJL-RMKNXTFCSA-N"
"c(c2)ccc(c2)CCCc(c1)ccnc1","InChI=1S/C14H15N/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h1-3,5-6,9-12H,4,7-8H2","AQIIVEISJBBUCR-UHFFFAOYSA-N"
"CN(C)c(c2)ccc(c2)c(c1)ccnc1","InChI=1S/C13H14N2/c1-15(2)13-5-3-11(4-6-13)12-7-9-14-10-8-12/h3-10H,1-2H3","JJCFKNYYQZDTMT-UHFFFAOYSA-N"
"CCCCCCC#Cc(c1)cnc(C)c1","InChI=1S/C14H19N/c1-3-4-5-6-7-8-9-14-11-10-13(2)15-12-14/h10-12H,3-7H2,1-2H3","SEYAUDAFZYUQRC-UHFFFAOYSA-N"
"Cc(c2)ncc(c2)CCC(C1)CCCC1","InChI=1S/C14H21N/c1-12-7-8-14(11-15-12)10-9-13-5-3-2-4-6-13/h7-8,11,13H,2-6,9-10H2,1H3","RXNVXXITAMJILF-UHFFFAOYSA-N"
"OC(=O)c(c1)ncc(C#CC(C)(C)O)c1","InChI=1S/C11H11NO3/c1-11(2,15)6-5-8-3-4-9(10(13)14)12-7-8/h3-4,7,15H,1-2H3,(H,13,14)","ATARGFQQXZRVJR-UHFFFAOYSA-N"
"Cc(c1)ncc(c1)CCC(C)C(C)(C)C","InChI=1S/C14H23N/c1-11(14(3,4)5)6-8-13-9-7-12(2)15-10-13/h7,9-11H,6,8H2,1-5H3","KISZPRMLCZKKHG-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C([H])=C([H])c(c1)nccc1","InChI=1S/C14H13NO/c1-16-14-9-6-12(7-10-14)5-8-13-4-2-3-11-15-13/h2-11H,1H3/b8-5+","YVXLWJRTXKPYON-VMPITWQZSA-N"
"Cc(c2)ccc(c2)Cc(c1)c(C)cnc(C)1","InChI=1S/C15H17N/c1-11-4-6-14(7-5-11)9-15-8-13(3)16-10-12(15)2/h4-8,10H,9H2,1-3H3","HMOGIZJGJNSDQQ-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C([H])=C([H])c(c1)nccc1","InChI=1S/C13H10ClN/c14-12-7-4-11(5-8-12)6-9-13-3-1-2-10-15-13/h1-10H/b9-6+","KSRMKBJYFVLXQU-RMKNXTFCSA-N"
"CN(C)c(c2)ccc(c2)C([H])=C([H])c(c1)nccc1","InChI=1S/C15H16N2/c1-17(2)15-10-7-13(8-11-15)6-9-14-5-3-4-12-16-14/h3-12H,1-2H3/b9-6+","BKJUFUDGHOBEFF-RMKNXTFCSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)C([H])=C([H])c(c1)nccc1","InChI=1S/C13H10N2O2/c16-15(17)13-8-5-11(6-9-13)4-7-12-3-1-2-10-14-12/h1-10H/b7-4+","RBWIGCZMJZUUCB-QPJJXVBHSA-N"
"[O-1][N+1](=O)c(c2)cc(cc2)C([H])=C([H])c(c1)nccc1","InChI=1S/C13H10N2O2/c16-15(17)13-6-3-4-11(10-13)7-8-12-5-1-2-9-14-12/h1-10H/b8-7+","NFTQPJVUAHNPTC-BQYQJAHWSA-N"
"[O-1][N+1](=O)c(c2)c(ccc2)C([H])=C([H])c(c1)nccc1","InChI=1S/C13H10N2O2/c16-15(17)13-7-2-1-5-11(13)8-9-12-6-3-4-10-14-12/h1-10H/b9-8+","YADNATDOWRSAOC-CMDGGOBGSA-N"
"c(c3)ccc(c3)c(c2)nc(cc2)c(c1)cccc1","InChI=1S/C17H13N/c1-3-8-14(9-4-1)16-12-7-13-17(18-16)15-10-5-2-6-11-15/h1-13H","PJUOHDQXFNPPRF-UHFFFAOYSA-N"
"Cc(c1)ncc(C#CC#Cc(c2)cnc(C)c2)c1","InChI=1S/C16H12N2/c1-13-7-9-15(11-17-13)5-3-4-6-16-10-8-14(2)18-12-16/h7-12H,1-2H3","QDQYTJSEEWAVDH-UHFFFAOYSA-N"
"OC(=O)c(c1)ncc(CCC(C2)CCCC2)c1","InChI=1S/C14H19NO2/c16-14(17)13-9-8-12(10-15-13)7-6-11-4-2-1-3-5-11/h8-11H,1-7H2,(H,16,17)","BZDSBEBHOHGLIT-UHFFFAOYSA-N"
"CCCCCCCCc(c1)cnc(C(O)=O)c1","InChI=1S/C14H21NO2/c1-2-3-4-5-6-7-8-12-9-10-13(14(16)17)15-11-12/h9-11H,2-8H2,1H3,(H,16,17)","TVASHDLWKCMJDO-UHFFFAOYSA-N"
"OC(=O)c(c1)ncc(CCC(C)C(C)(C)C)c1","InChI=1S/C14H21NO2/c1-10(14(2,3)4)5-6-11-7-8-12(13(16)17)15-9-11/h7-10H,5-6H2,1-4H3,(H,16,17)","ZYGPKSVBOYEEGV-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)N(C1)c(c2)c(ccc2)CC1","InChI=1S/C16H15NO/c18-16(14-8-2-1-3-9-14)17-12-6-10-13-7-4-5-11-15(13)17/h1-5,7-9,11H,6,10,12H2","CEBQABUYWIZVHQ-UHFFFAOYSA-N"
"Cc(c1)ncc(CCCCc(c2)cnc(C)c2)c1","InChI=1S/C16H20N2/c1-13-7-9-15(11-17-13)5-3-4-6-16-10-8-14(2)18-12-16/h7-12H,3-6H2,1-2H3","HFVGYRZKBWBJRR-UHFFFAOYSA-N"
"OC(=O)c(c1)ncc(c1)C#CC(C)(O)C(C)(C)C","InChI=1S/C14H17NO3/c1-13(2,3)14(4,18)8-7-10-5-6-11(12(16)17)15-9-10/h5-6,9,18H,1-4H3,(H,16,17)","GCYBISMASZMPNE-UHFFFAOYSA-N"
"CCCCCCCCCCCc(c1)cnc(C)c1","InChI=1S/C17H29N/c1-3-4-5-6-7-8-9-10-11-12-17-14-13-16(2)18-15-17/h13-15H,3-12H2,1-2H3","RDLXNKSIBXLXSI-UHFFFAOYSA-N"
"CCCCCCCCc(c1)c[n+1]([O-1])c(C(O)=O)c1","InChI=1S/C14H21NO3/c1-2-3-4-5-6-7-8-12-9-10-13(14(16)17)15(18)11-12/h9-11H,2-8H2,1H3,(H,16,17)","CDSFRFKULYXZNV-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)nc(c3)c(c1)nc(c2)c(ccc2)c1","InChI=1S/C18H12N2/c1-3-7-15-13(5-1)9-11-17(19-15)18-12-10-14-6-2-4-8-16(14)20-18/h1-12H","WPTCSQBWLUUYDV-UHFFFAOYSA-N"
"c(c4)nc(c3)c(c4)cc(c3)c(c1)cc(c2)c(ncc2)c1","InChI=1S/C18H12N2/c1-3-15-11-13(5-7-17(15)19-9-1)14-6-8-18-16(12-14)4-2-10-20-18/h1-12H","CCKFFRXAFQLLDF-UHFFFAOYSA-N"
"c(c3)ccc(c3)Cc(c(C)1)c(Cc(c2)cccc2)c(C)nc1","InChI=1S/C21H21N/c1-16-15-22-17(2)21(14-19-11-7-4-8-12-19)20(16)13-18-9-5-3-6-10-18/h3-12,15H,13-14H2,1-2H3","QLKFDTSUPVWUME-UHFFFAOYSA-N"
"c(c3)ccc(c3)Cc(c1)c(C)c(Cc(c2)cccc2)nc(C)1","InChI=1S/C21H21N/c1-16-13-20(14-18-9-5-3-6-10-18)17(2)21(22-16)15-19-11-7-4-8-12-19/h3-13H,14-15H2,1-2H3","SYNAWBQDXYOWOR-UHFFFAOYSA-N"
"c(c3)ccc(c3)CCC(CCc(c2)cccc2)c(c1)nccc1","InChI=1S/C22H23N/c1-3-9-19(10-4-1)14-16-21(22-13-7-8-18-23-22)17-15-20-11-5-2-6-12-20/h1-13,18,21H,14-17H2","HZKSCRVWSXWSAZ-UHFFFAOYSA-N"
"CC1=CC=C(C=C1)C(=O)C2=CC3=CC=CC=C3N2","InChI=1S/C16H13NO/c1-11-6-8-12(9-7-11)16(18)15-10-13-4-2-3-5-14(13)17-15/h2-10,17H,1H3","ABJJWHBJUVWQEX-UHFFFAOYSA-N"
"CC1=CC=C(C=C1)C(=O)C2=CNC3=CC=CC=C32","InChI=1S/C16H13NO/c1-11-6-8-12(9-7-11)16(18)14-10-17-15-5-3-2-4-13(14)15/h2-10,17H,1H3","YHMFTSPEASEZMT-UHFFFAOYSA-N"
"CC1=CC=CC=C1C(=O)C2=CC3=CC=CC=C3N2","InChI=1S/C16H13NO/c1-11-6-2-4-8-13(11)16(18)15-10-12-7-3-5-9-14(12)17-15/h2-10,17H,1H3","WIUFCDBYZXHKSE-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)ccc(c3)C(=N2)C(CN(C(C)=O)2)c(c1)nccc1","InChI=1S/C16H14N4O3/c1-11(21)19-10-14(15-4-2-3-9-17-15)16(18-19)12-5-7-13(8-6-12)20(22)23/h2-9,14H,10H2,1H3","YQDAFIMRFPGXTQ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)ccc(c3)C(C2)C(=NN(C(C)=O)2)c(c1)nccc1","InChI=1S/C16H14N4O3/c1-11(21)19-10-14(12-5-7-13(8-6-12)20(22)23)16(18-19)15-4-2-3-9-17-15/h2-9,14H,10H2,1H3","CKZKCYBBQJYRIL-UHFFFAOYSA-N"
"CC(=O)N(C1)N=C(c(c3)nccc3)C1c(c2)cccc2","InChI=1S/C16H15N3O/c1-12(20)19-11-14(13-7-3-2-4-8-13)16(18-19)15-9-5-6-10-17-15/h2-10,14H,11H2,1H3","NIYILJAJXQAIMA-UHFFFAOYSA-N"
"ClCCC(=O)N(C3)Cn(c(C3)1)c(c2)c(cc(C)c2)c(C)1","InChI=1S/C16H19ClN2O/c1-11-3-4-15-13(9-11)12(2)14-6-8-18(10-19(14)15)16(20)5-7-17/h3-4,9H,5-8,10H2,1-2H3","KGCZWXYHBBNEQQ-UHFFFAOYSA-N"
"CC1(CC2=C(C3=CC=CC=C3N2)C(N1C)(C)C)C","InChI=1S/C16H22N2/c1-15(2)10-13-14(16(3,4)18(15)5)11-8-6-7-9-12(11)17-13/h6-9,17H,10H2,1-5H3","PUZMPPZASJFRPD-UHFFFAOYSA-N"
"CCC1(C2=C(CC(N1)(C)C)NC3=CC=CC=C32)C","InChI=1S/C16H22N2/c1-5-16(4)14-11-8-6-7-9-12(11)17-13(14)10-15(2,3)18-16/h6-9,17-18H,5,10H2,1-4H3","DZLUHXQREJTSIO-UHFFFAOYSA-N"
"CC1=CC=CC2=C1NC3=C2C(NC(C3)(C)C)(C)C","InChI=1S/C16H22N2/c1-10-7-6-8-11-13-12(17-14(10)11)9-15(2,3)18-16(13,4)5/h6-8,17-18H,9H2,1-5H3","AVMPTADIBRWHBS-UHFFFAOYSA-N"
"CCCCN1CCC2=C(C1)C3=C(N2)C=CC(=C3)C","InChI=1S/C16H22N2/c1-3-4-8-18-9-7-16-14(11-18)13-10-12(2)5-6-15(13)17-16/h5-6,10,17H,3-4,7-9,11H2,1-2H3","ZGEHJUDRCBHGTK-UHFFFAOYSA-N"
"CCC(C)N1CCC2=C(C1)C3=C(N2)C=CC(=C3)C","InChI=1S/C16H22N2/c1-4-12(3)18-8-7-16-14(10-18)13-9-11(2)5-6-15(13)17-16/h5-6,9,12,17H,4,7-8,10H2,1-3H3","OZALJKGFQHTUGN-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)NC3=C2CN(CC3)CC(C)C","InChI=1S/C16H22N2/c1-11(2)9-18-7-6-16-14(10-18)13-8-12(3)4-5-15(13)17-16/h4-5,8,11,17H,6-7,9-10H2,1-3H3","OJFPSTNSHCSEQW-UHFFFAOYSA-N"
"CC(C)(N1)CC(N(C)2)C(c(c3)c(ccc3)2)C(C)(C)1","InChI=1S/C16H24N2/c1-15(2)10-13-14(16(3,4)17-15)11-8-6-7-9-12(11)18(13)5/h6-9,13-14,17H,10H2,1-5H3","UQXRXCFJEVHHJV-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(c(c3)1)c(c2)c(ccc(C(C)=O)2)n(C)1","InChI=1S/C17H15NO2/c1-10(19)12-4-6-16-14(8-12)15-9-13(11(2)20)5-7-17(15)18(16)3/h4-9H,1-3H3","RINUGYQZSCXUFU-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(c21)c(c3)n(C(C)C)c(cccc2)1","InChI=1S/C17H17NO/c1-11(2)18-16-7-5-4-6-14(16)15-10-13(12(3)19)8-9-17(15)18/h4-11H,1-3H3","VNPUIJZPRGOMGS-UHFFFAOYSA-N"
"Cc(c3)ncc(c3)CCn(c1)c(c2)c(ccc2)c(C)1","InChI=1S/C17H18N2/c1-13-12-19(17-6-4-3-5-16(13)17)10-9-15-8-7-14(2)18-11-15/h3-8,11-12H,9-10H2,1-2H3","PDHUHGYABRWQPC-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(c(c3)1)c(c2)c(ccc(C(C)=O)2)n(CC)1","InChI=1S/C18H17NO2/c1-4-19-17-7-5-13(11(2)20)9-15(17)16-10-14(12(3)21)6-8-18(16)19/h5-10H,4H2,1-3H3","RIRBXBVFZCKFNX-UHFFFAOYSA-N"
"COc(c4)ccc(c4)c(n3)nc(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C19H14N2O/c1-22-15-9-6-14(7-10-15)19-20-12-17-16-5-3-2-4-13(16)8-11-18(17)21-19/h2-12H,1H3","CADPXUBGTFMZAG-UHFFFAOYSA-N"
"CCCCOC(=O)C(=C([H])3)C(=O)N(c21)C(=N3)C([H])=C([H])c(cccc2)1","InChI=1S/C17H16N2O3/c1-2-3-10-22-17(21)13-11-18-15-9-8-12-6-4-5-7-14(12)19(15)16(13)20/h4-9,11H,2-3,10H2,1H3","LDBMQSOXPOLETB-UHFFFAOYSA-N"
"CN(C)c(c4)ccc(c4)c(n3)nc(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C20H17N3/c1-23(2)16-10-7-15(8-11-16)20-21-13-18-17-6-4-3-5-14(17)9-12-19(18)22-20/h3-13H,1-2H3","GBGROYFHCSRCGK-UHFFFAOYSA-N"
"O=C(Nc(c3)cccc3)Nc([n+1]([O-1])2)nc(cc2)c(c1)cccc1","InChI=1S/C17H14N4O2/c22-17(18-14-9-5-2-6-10-14)20-16-19-15(11-12-21(16)23)13-7-3-1-4-8-13/h1-12H,(H2,18,19,20,22)","WXZOCNMWVLUOMZ-UHFFFAOYSA-N"
"C(C3)CCN(C3)c(c2)nc(nc2C(F)(F)F)c(c1)c(O)ccc1","InChI=1S/C16H16F3N3O/c17-16(18,19)13-10-14(22-8-4-1-5-9-22)21-15(20-13)11-6-2-3-7-12(11)23/h2-3,6-7,10,23H,1,4-5,8-9H2","VWGOMZPDBSWHRL-UHFFFAOYSA-N"
"c(c4)ccc(c4)Nc(n1)nc(c(c3)cccc3)cc1c(c2)cccc2","InChI=1S/C22H17N3/c1-4-10-17(11-5-1)20-16-21(18-12-6-2-7-13-18)25-22(24-20)23-19-14-8-3-9-15-19/h1-16H,(H,23,24,25)","VEIYBKXRSKDYON-UHFFFAOYSA-N"
"c(c4)ccc(c4)Oc(n1)nc(c(c3)cccc3)cc1c(c2)cccc2","InChI=1S/C22H16N2O/c1-4-10-17(11-5-1)20-16-21(18-12-6-2-7-13-18)24-22(23-20)25-19-14-8-3-9-15-19/h1-16H","JFBGDKDDIHPIEL-UHFFFAOYSA-N"
"COc(c3)ccc(c3)c(n2)cc(nc(Cl)2)c(c1)ccc(OC)c1","InChI=1S/C18H15ClN2O2/c1-22-14-7-3-12(4-8-14)16-11-17(21-18(19)20-16)13-5-9-15(23-2)10-6-13/h3-11H,1-2H3","DKOMXBVVTZTZDB-UHFFFAOYSA-N"
"c(c5)ccc(c5)C(=N1)NC(c(c4)cccc4)c(c32)c(ccc(cccc3)2)1","InChI=1S/C24H18N2/c1-3-10-18(11-4-1)23-22-20-14-8-7-9-17(20)15-16-21(22)25-24(26-23)19-12-5-2-6-13-19/h1-16,23H,(H,25,26)","RLLZDIXPNCTESL-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(n2)cc(nc(Cl)2)c(c(Cl)1)c(Cl)ncn1","InChI=1S/C14H7Cl3N4/c15-12-11(13(16)19-7-18-12)10-6-9(20-14(17)21-10)8-4-2-1-3-5-8/h1-7H","XCTTWVSSTMNUNV-UHFFFAOYSA-N"
"c(c5)ccc(c5)c(n3)c(C1)c(nc(c(c4)c(O)ccc4)3)c(c2)c(ccc2)C1","InChI=1S/C24H18N2O/c27-21-13-7-6-12-19(21)24-25-22(17-9-2-1-3-10-17)20-15-14-16-8-4-5-11-18(16)23(20)26-24/h1-13,27H,14-15H2","LRBKHMOUDPDKHY-UHFFFAOYSA-N"
"c(c4)ccc(c4)C=CC(N2)=C(c(c3)cccc3)C(=NC(=O)2)c(c1)cccc1","InChI=1S/C24H18N2O/c27-24-25-21(17-16-18-10-4-1-5-11-18)22(19-12-6-2-7-13-19)23(26-24)20-14-8-3-9-15-20/h1-17H,(H,25,26,27)/b17-16+","XVZMRIDMPDUGKB-WUKNDPDISA-N"
"COc(n1)nc(c(c4)cccc4)c(c(c3)cccc3)c(C=Cc(c2)cccc2)1","InChI=1S/C25H20N2O/c1-28-25-26-22(18-17-19-11-5-2-6-12-19)23(20-13-7-3-8-14-20)24(27-25)21-15-9-4-10-16-21/h2-18H,1H3/b18-17+","JNQXQVXORRLFKD-ISLYRVAYSA-N"
"COc(n1)nc(c(c4)cccc4)c(c(c3)cccc3)c(CCc(c2)cccc2)1","InChI=1S/C25H22N2O/c1-28-25-26-22(18-17-19-11-5-2-6-12-19)23(20-13-7-3-8-14-20)24(27-25)21-15-9-4-10-16-21/h2-16H,17-18H2,1H3","XVUHEFHMMXQDDJ-UHFFFAOYSA-N"
"c(c(c(c6)cccc6)4)(c(nc(c(c5)cccc5)n4)1)c(c32)c(ccc2=CC=CC3)=N1","InChI=1S/C26H17N3/c1-3-10-18(11-4-1)24-23-22-20-14-8-7-9-17(20)15-16-21(22)27-26(23)29-25(28-24)19-12-5-2-6-13-19/h1-13,15-16H,14H2","ILMXIHSUBMOWPZ-UHFFFAOYSA-N"
"COC(=O)c(c4)c(ccc4)Nc(n1)nc(c(c3)cccc3)cc(c(c2)cccc2)1","InChI=1S/C24H19N3O2/c1-29-23(28)19-14-8-9-15-20(19)25-24-26-21(17-10-4-2-5-11-17)16-22(27-24)18-12-6-3-7-13-18/h2-16H,1H3,(H,25,26,27)","XOQLGPYABGAZCJ-UHFFFAOYSA-N"
"c(c12)cccc(ccc(n4)c2c(nc(c(c(OC)5)cccc5)4)c(c(OC)3)cccc3)1","InChI=1S/C26H20N2O2/c1-29-22-13-7-5-11-19(22)25-24-18-10-4-3-9-17(18)15-16-21(24)27-26(28-25)20-12-6-8-14-23(20)30-2/h3-16H,1-2H3","ZGFNWRPKMZWLGN-UHFFFAOYSA-N"
"COc(c4)ccc(c4)c(n1)cc(c(c3)cccc3)nc(Nc(c2)c(ccc2)C(O)=O)1","InChI=1S/C24H19N3O3/c1-30-18-13-11-17(12-14-18)22-15-21(16-7-3-2-4-8-16)26-24(27-22)25-20-10-6-5-9-19(20)23(28)29/h2-15H,1H3,(H,28,29)(H,25,26,27)","HJJTWZSYYYGSQH-UHFFFAOYSA-N"
"COc(c4)ccc(c4)c(n1)cc(c(c3)cccc3)nc(Nc(c2)c(ccc2)C(=O)OC)1","InChI=1S/C25H21N3O3/c1-30-19-14-12-18(13-15-19)23-16-22(17-8-4-3-5-9-17)27-25(28-23)26-21-11-7-6-10-20(21)24(29)31-2/h3-16H,1-2H3,(H,26,27,28)","LSOQQYIGHRFRBM-UHFFFAOYSA-N"
"COC(=O)c(c4)c(ccc4)Nc(n2)nc(cc(c(c3)cccc3)2)c(c1)ccc([N+1]([O-1])=O)c1","InChI=1S/C24H18N4O4/c1-32-23(29)19-9-5-6-10-20(19)25-24-26-21(16-7-3-2-4-8-16)15-22(27-24)17-11-13-18(14-12-17)28(30)31/h2-15H,1H3,(H,25,26,27)","PXAMEXZBKFQCRD-UHFFFAOYSA-N"
"c(c15)cccc(c(c3cc5)c(nc(c(c4)cc(c(OC)c4)OC)n3)c(c2)cc(c(OC)c2)OC)1","InChI=1S/C28H24N2O4/c1-31-22-13-10-18(15-24(22)33-3)27-26-20-8-6-5-7-17(20)9-12-21(26)29-28(30-27)19-11-14-23(32-2)25(16-19)34-4/h5-16H,1-4H3","XCDSYIVMRAJUSN-UHFFFAOYSA-N"
"c(c(n4)cc(nc4Nc(c5)c(ccc5)C(=O)OC)c(c3)cccc3)(c1)ccc(Oc(c2)cccc2)c1","InChI=1S/C30H23N3O3/c1-35-29(34)25-14-8-9-15-26(25)31-30-32-27(21-10-4-2-5-11-21)20-28(33-30)22-16-18-24(19-17-22)36-23-12-6-3-7-13-23/h2-20H,1H3,(H,31,32,33)","JMGBAYVRYXIYQR-UHFFFAOYSA-N"
"Brc(c5)ccc(c5)c(n1)nc(c(c4)ccc(Br)c4)c(c32)c(ccc(cccc3)2)1","InChI=1S/C24H14Br2N2/c25-18-10-5-16(6-11-18)23-22-20-4-2-1-3-15(20)9-14-21(22)27-24(28-23)17-7-12-19(26)13-8-17/h1-14H","BVWXZSVFMDWDQR-UHFFFAOYSA-N"
"COc(n1)nc(C(Br)C(Br)c(c4)cccc4)c(c(c3)cccc3)c1c(c2)cccc2","InChI=1S/C25H20Br2N2O/c1-30-25-28-23(19-15-9-4-10-16-19)20(17-11-5-2-6-12-17)24(29-25)22(27)21(26)18-13-7-3-8-14-18/h2-16,21-22H,1H3","HFWYESJTBLLQKD-UHFFFAOYSA-N"
"c(c5c(c6)cccc6)c(nc(n5)OCCOc(n3)nc(cc3c(c4)cccc4)c(c2)cccc2)c(c1)cccc1","InChI=1S/C34H26N4O2/c1-5-13-25(14-6-1)29-23-30(26-15-7-2-8-16-26)36-33(35-29)39-21-22-40-34-37-31(27-17-9-3-10-18-27)24-32(38-34)28-19-11-4-12-20-28/h1-20,23-24H,21-22H2","YSJCUZMQWZRYBT-UHFFFAOYSA-N"
"C(CC)CCCOc(c1)ccc(c(n4)ncc(c4)N=Nc(c3)cnc(n3)c(c2)ccc(OCCCCCC)c2)c1","InChI=1S/C32H38N6O2/c1-3-5-7-9-19-39-29-15-11-25(12-16-29)31-33-21-27(22-34-31)37-38-28-23-35-32(36-24-28)26-13-17-30(18-14-26)40-20-10-8-6-4-2/h11-18,21-24H,3-10,19-20H2,1-2H3/b38-37+","NVKCRPKKJGPKEK-HEFFKOSUSA-N"
"Cc(c2)ccc(c2)c(c1)nccc1","InChI=1S/C12H11N/c1-10-5-7-11(8-6-10)12-4-2-3-9-13-12/h2-9H,1H3","KJNZQKYSNAQLEO-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)c(c1)ccnc1","InChI=1S/C12H11N/c1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h2-9H,1H3","MRAIVJPPOXSJNG-UHFFFAOYSA-N"
"c(c2)ccc(c2)Cc(c1)nccc1","InChI=1S/C12H11N/c1-2-6-11(7-3-1)10-12-8-4-5-9-13-12/h1-9H,10H2","PCFUWBOSXMKGIP-UHFFFAOYSA-N"
"c(c2)ccc(c2)Cc(c1)ccnc1","InChI=1S/C12H11N/c1-2-4-11(5-3-1)10-12-6-8-13-9-7-12/h1-9H,10H2","DBOLXXRVIFGDTI-UHFFFAOYSA-N"
"CCCCC#Cc(c1)cnc(C)c1","InChI=1S/C12H15N/c1-3-4-5-6-7-12-9-8-11(2)13-10-12/h8-10H,3-5H2,1-2H3","AEDCDTVCGSTPMW-UHFFFAOYSA-N"
"CC(C)CC#Cc(c1)cnc(C)c1","InChI=1S/C12H15N/c1-10(2)5-4-6-12-8-7-11(3)13-9-12/h7-10H,5H2,1-3H3","BQPMAIWIDJUIRL-UHFFFAOYSA-N"
"CC(=N1)CC(C)(C)c(c2)c(ccc2)1","InChI=1S/C12H15N/c1-9-8-12(2,3)10-6-4-5-7-11(10)13-9/h4-7H,8H2,1-3H3","MJETWKCGZXNUCV-UHFFFAOYSA-N"
"CC(=C1)c(c2)c(ccc2)NC(C)(C)1","InChI=1S/C12H15N/c1-9-8-12(2,3)13-11-7-5-4-6-10(9)11/h4-8,13H,1-3H3","ZNRLMGFXSPUZNR-UHFFFAOYSA-N"
"Oc(c2)cc(c(O)1)c(c2)nc(C)c1","InChI=1S/C10H9NO2/c1-6-4-10(13)8-5-7(12)2-3-9(8)11-6/h2-5,12H,1H3,(H,11,13)","NAGZLUGXHAFMPW-UHFFFAOYSA-N"
"Oc(c2)cc(c(C)1)c(c2)nc(O)c1","InChI=1S/C10H9NO2/c1-6-4-10(13)11-9-3-2-7(12)5-8(6)9/h2-5,12H,1H3,(H,11,13)","MLWJMEZPVTZSKE-UHFFFAOYSA-N"
"CCOC(=O)C=Cc(c1)nccc1","InChI=1S/C10H11NO2/c1-2-13-10(12)7-6-9-5-3-4-8-11-9/h3-8H,2H2,1H3/b7-6+","KLWMOCBNXFKZOS-VOTSOKGWSA-N"
"CCCCCCc(c1)cnc(C)c1","InChI=1S/C12H19N/c1-3-4-5-6-7-12-9-8-11(2)13-10-12/h8-10H,3-7H2,1-2H3","CVQOAKGVDNOWHA-UHFFFAOYSA-N"
"CC(C)CCCc(c1)cnc(C)c1","InChI=1S/C12H19N/c1-10(2)5-4-6-12-8-7-11(3)13-9-12/h7-10H,4-6H2,1-3H3","FIQYGILROUOWJB-UHFFFAOYSA-N"
"CCCCc(c1)cnc(c1)C(O)=O","InChI=1S/C10H13NO2/c1-2-3-4-8-5-6-9(10(12)13)11-7-8/h5-7H,2-4H2,1H3,(H,12,13)","DGMPVYSXXIOGJY-UHFFFAOYSA-N"
"[H]C(c(c2)cccc2)=C([H])c(c1)nccc1","InChI=1S/C13H11N/c1-2-6-12(7-3-1)9-10-13-8-4-5-11-14-13/h1-11H/b10-9-","BIAWAXVRXKIUQB-KTKRTIGZSA-N"
"[H]C(c(c2)cccc2)=C([H])c(c1)nccc1","InChI=1S/C13H11N/c1-2-6-12(7-3-1)9-10-13-8-4-5-11-14-13/h1-11H/b10-9+","BIAWAXVRXKIUQB-MDZDMXLPSA-N"
"n(c2)ccc(c2)C=Cc(c1)ccnc1","InChI=1S/C12H10N2/c1(11-3-7-13-8-4-11)2-12-5-9-14-10-6-12/h1-10H/b2-1+","MGFJDEHFNMWYBD-OWOJBTEDSA-N"
"[H]C(c(c2)nccc2)=C([H])c(c1)nccc1","InChI=1S/C12H10N2/c1-3-9-13-11(5-1)7-8-12-6-2-4-10-14-12/h1-10H/b8-7+","HKEOCEQLCZEBMK-BQYQJAHWSA-N"
"Cc(c2)ccc(c2)c(c1)cnc(C)c1","InChI=1S/C13H13N/c1-10-3-6-12(7-4-10)13-8-5-11(2)14-9-13/h3-9H,1-2H3","VMQIABRWAZWBEC-UHFFFAOYSA-N"
"Cc(c2)cc(nc2)Cc(c1)cccc1","InChI=1S/C13H13N/c1-11-7-8-14-13(9-11)10-12-5-3-2-4-6-12/h2-9H,10H2,1H3","BMVGPICTSDRAIS-UHFFFAOYSA-N"
"CCCCn(c21)c(c3)c(cc(C(C)=O)c3)c(cccc2)1","InChI=1S/C18H19NO/c1-3-4-11-19-17-8-6-5-7-15(17)16-12-14(13(2)20)9-10-18(16)19/h5-10,12H,3-4,11H2,1-2H3","ICOLUFIBXHLRIK-UHFFFAOYSA-N"
"Cc(c2)cnc(c2)c(c1)ncc(C)c1","InChI=1S/C12H12N2/c1-9-3-5-11(13-7-9)12-6-4-10(2)8-14-12/h3-8H,1-2H3","PTRATZCAGVBFIQ-UHFFFAOYSA-N"
"CC(C)CCc(c1)cnc(c1)C(O)=O","InChI=1S/C11H15NO2/c1-8(2)3-4-9-5-6-10(11(13)14)12-7-9/h5-8H,3-4H2,1-2H3,(H,13,14)","MXBGCRRAUSJALE-UHFFFAOYSA-N"
"CNC(C1)=CC(=O)O1","InChI=1S/C5H7NO2/c1-6-4-2-5(7)8-3-4/h2,6H,3H2,1H3","RMSSLCSOZKTRDB-UHFFFAOYSA-N"
"CN(C)C(C1)=CC(=O)O1","InChI=1S/C6H9NO2/c1-7(2)5-3-6(8)9-4-5/h3H,4H2,1-2H3","QKOJYKUPULYSSN-UHFFFAOYSA-N"
"O=C(O2)C=C(C2)N(C)c(c1)cccc1","InChI=1S/C11H11NO2/c1-12(9-5-3-2-4-6-9)10-7-11(13)14-8-10/h2-7H,8H2,1H3","QVVNFPQGPLIMFM-UHFFFAOYSA-N"
"O=C(O2)C=C(C2)Nc(c1)cccc1","InChI=1S/C10H9NO2/c12-10-6-9(7-13-10)11-8-4-2-1-3-5-8/h1-6,11H,7H2","CMEWGTYCQMDKHR-UHFFFAOYSA-N"
"O=C(O2)C=C(C2)NCc(c1)cccc1","InChI=1S/C11H11NO2/c13-11-6-10(8-14-11)12-7-9-4-2-1-3-5-9/h1-6,12H,7-8H2","JVDKXMKPYLYITQ-UHFFFAOYSA-N"
"CN(C)CC(C(=O)2)=C(CO2)N(C)c(c1)cccc1","InChI=1S/C14H18N2O2/c1-15(2)9-12-13(10-18-14(12)17)16(3)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3","FTYPFXXOUHSABS-UHFFFAOYSA-N"
"O=C(O2)C=C(C2)N(C1)CCC1","InChI=1S/C8H11NO2/c10-8-5-7(6-11-8)9-3-1-2-4-9/h5H,1-4,6H2","LJMCLJCNKMDYKL-UHFFFAOYSA-N"
"CN(C)CC(C(=O)2)=C(CO2)N(C1)CCC1","InChI=1S/C11H18N2O2/c1-12(2)7-9-10(8-15-11(9)14)13-5-3-4-6-13/h3-8H2,1-2H3","GKAUGBOWNRIMCG-UHFFFAOYSA-N"
"CN(C)CC(C(=O)1)=C(CO1)N(C)C","InChI=1S/C9H16N2O2/c1-10(2)5-7-8(11(3)4)6-13-9(7)12/h5-6H2,1-4H3","QTYZCHXMLPAIML-UHFFFAOYSA-N"
"OCc(c1)ccc(Br)c1","InChI=1S/C7H7BrO/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2","VEDDBHYQWFOITD-UHFFFAOYSA-N"
"C(C2)COC(C2)OCc(c1)ccc(Br)c1","InChI=1S/C12H15BrO2/c13-11-6-4-10(5-7-11)9-15-12-3-1-2-8-14-12/h4-7,12H,1-3,8-9H2","QQDHNPZEXZGTEL-UHFFFAOYSA-N"
"CCCCCCCCCCC([H])=C([H])CO","InChI=1S/C13H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h11-12,14H,2-10,13H2,1H3/b12-11-","VPYJHNADOJDSGU-QXMHVHEDSA-N"
"OCCCCCCCCCCc(c1)cccc1","InChI=1S/C16H26O/c17-15-11-6-4-2-1-3-5-8-12-16-13-9-7-10-14-16/h7,9-10,13-14,17H,1-6,8,11-12,15H2","WNFXODBOMMSELY-UHFFFAOYSA-N"
"OCCCCCCCCCCCCc(c1)cccc1","InChI=1S/C18H30O/c19-17-13-8-6-4-2-1-3-5-7-10-14-18-15-11-9-12-16-18/h9,11-12,15-16,19H,1-8,10,13-14,17H2","DXFKBQGRBJLAPG-UHFFFAOYSA-N"
"C(CCCCCc(c2)c(O)c(OC)cc2)CCCCc(c1)cccc1","InChI=1S/C23H32O2/c1-25-22-19-13-18-21(23(22)24)17-12-7-5-3-2-4-6-9-14-20-15-10-8-11-16-20/h8,10-11,13,15-16,18-19,24H,2-7,9,12,14,17H2,1H3","CXDMGALFOYTAAG-UHFFFAOYSA-N"
"C(CCCCCCc(c2)c(O)c(OC)cc2)CCCCCc(c1)cccc1","InChI=1S/C25H36O2/c1-27-24-21-15-20-23(25(24)26)19-14-9-7-5-3-2-4-6-8-11-16-22-17-12-10-13-18-22/h10,12-13,15,17-18,20-21,26H,2-9,11,14,16,19H2,1H3","FVKLYKTYJMVZBN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCc(c1)c(C(O)=O)c(O)cc1","InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-14-17-15-13-16-18(21)19(17)20(22)23/h13,15-16,21H,2-12,14H2,1H3,(H,22,23)","VEPUCZUJLKAVNM-UHFFFAOYSA-N"
"CCCCCCCCCCCCCc(c1)c(C(O)=O)c(OC)cc1","InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-15-18-16-14-17-19(24-2)20(18)21(22)23/h14,16-17H,3-13,15H2,1-2H3,(H,22,23)","DDGQLWOLBRRZGR-UHFFFAOYSA-N"
"CC(=O)c(c1)c(O)cc(O)c1","InChI=1S/C8H8O3/c1-5(9)7-3-2-6(10)4-8(7)11/h2-4,10-11H,1H3","SULYEHHGGXARJS-UHFFFAOYSA-N"
"CC(=O)c(c1)c(O)cc(OCc(c2)cccc2)c1","InChI=1S/C15H14O3/c1-11(16)14-8-7-13(9-15(14)17)18-10-12-5-3-2-4-6-12/h2-9,17H,10H2,1H3","AGQNLHOTLJFJCG-UHFFFAOYSA-N"
"OC(=O)Cc(c2)c(ccc2)Nc(c(Cl)1)c(Cl)ccc1","InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)","DCOPUUMXTXDBNB-UHFFFAOYSA-N"
"COC(=O)C(Cc(c2)cccc2)c(c1)cc(OC)c(OC)c1","InChI=1S/C18H20O4/c1-20-16-10-9-14(12-17(16)21-2)15(18(19)22-3)11-13-7-5-4-6-8-13/h4-10,12,15H,11H2,1-3H3","PTHKYMVDSUZYTR-UHFFFAOYSA-N"
"CC(=O)OCC(=O)C(Cc(c2)cccc2)c(c1)c(Cl)c(OC)c(OC)c1","InChI=1S/C20H21ClO5/c1-13(22)26-12-17(23)16(11-14-7-5-4-6-8-14)15-9-10-18(24-2)20(25-3)19(15)21/h4-10,16H,11-12H2,1-3H3","IHZNCXSMDVOALJ-UHFFFAOYSA-N"
"COc(c2)c(OC)c(cc2)C(C(N)=O)Cc(c1)cccc1","InChI=1S/C17H19NO3/c1-20-15-10-6-9-13(16(15)21-2)14(17(18)19)11-12-7-4-3-5-8-12/h3-10,14H,11H2,1-2H3,(H2,18,19)","XLADAWOYVRSIJI-UHFFFAOYSA-N"
"COC(=O)C(C(=O)OC)c(c1)cc(OC)c(OC)c1","InChI=1S/C13H16O6/c1-16-9-6-5-8(7-10(9)17-2)11(12(14)18-3)13(15)19-4/h5-7,11H,1-4H3","XAVJSXAJKRURQW-UHFFFAOYSA-N"
"COC(=O)C(C#N)c(c1)cc(OC)c(OC)c1","InChI=1S/C12H13NO4/c1-15-10-5-4-8(6-11(10)16-2)9(7-13)12(14)17-3/h4-6,9H,1-3H3","DUGGTIYZQSBNOY-UHFFFAOYSA-N"
"COc(c2)c(OC)cc(c2)C(Cc(c1)cccc1)(C(=O)OC)C(=O)OC","InChI=1S/C20H22O6/c1-23-16-11-10-15(12-17(16)24-2)20(18(21)25-3,19(22)26-4)13-14-8-6-5-7-9-14/h5-12H,13H2,1-4H3","UHEVCYGHLILPDY-UHFFFAOYSA-N"
"COc(c2)c(OC)cc(c2)C(C#N)(Cc(c1)cccc1)C(=O)OC","InChI=1S/C19H19NO4/c1-22-16-10-9-15(11-17(16)23-2)19(13-20,18(21)24-3)12-14-7-5-4-6-8-14/h4-11H,12H2,1-3H3","CLPZAUNVVJMFAY-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)Nc(c2)c(ccc2)SC(C1)CC(C)(C)CC(=O)1","InChI=1S/C21H23NO2S/c1-21(2)13-16(23)12-17(14-21)25-19-11-7-6-10-18(19)22-20(24)15-8-4-3-5-9-15/h3-11,17H,12-14H2,1-2H3,(H,22,24)","LDVNHMXTVMRLBL-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(N(C(C)C)1)C(C(=O)3)=C(CC(C)(C)C3)Nc(c2)c(ccc2)1","InChI=1S/C24H28N2O/c1-16(2)26-20-13-9-8-12-18(20)25-19-14-24(3,4)15-21(27)22(19)23(26)17-10-6-5-7-11-17/h5-13,16,23,25H,14-15H2,1-4H3","SEVRCRYZZRHOEP-UHFFFAOYSA-N"
"CC(=O)CC(C)(C)Cc(n1)sc(c2)c(ccc2)1","InChI=1S/C14H17NOS/c1-10(16)8-14(2,3)9-13-15-11-6-4-5-7-12(11)17-13/h4-7H,8-9H2,1-3H3","URIOICYHTUHHPI-UHFFFAOYSA-N"
"CC(C)Nc(c2)c(ccc2)NC(=C1)CC(C)(C)CC(=O)1","InChI=1S/C17H24N2O/c1-12(2)18-15-7-5-6-8-16(15)19-13-9-14(20)11-17(3,4)10-13/h5-9,12,18-19H,10-11H2,1-4H3","AKAQOFZTVJADDM-UHFFFAOYSA-N"
"Cc(c4)c(ccc4)C(=N1)C(C(=O)3)=C(CC(C)(C)C3)Nc(c2)c(ccc2)1","InChI=1S/C22H22N2O/c1-14-8-4-5-9-15(14)21-20-18(12-22(2,3)13-19(20)25)23-16-10-6-7-11-17(16)24-21/h4-11,23H,12-13H2,1-3H3","NDVVNGHRFCMKLV-UHFFFAOYSA-N"
"OC(=O)COC(C(=O)1)=C(c(c3)cccc3)c(c2)c(ccc2)N1","InChI=1S/C17H13NO4/c19-14(20)10-22-16-15(11-6-2-1-3-7-11)12-8-4-5-9-13(12)18-17(16)21/h1-9H,10H2,(H,18,21)(H,19,20)","CXHYJXBDMMINFW-UHFFFAOYSA-N"
"CC(=C)C(C1)CC(C(=C)2)C(C)(CCC2)C1","InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h13-14H,1,3,5-10H2,2,4H3","YOVSPTNQHMDJAG-UHFFFAOYSA-N"
"CC(=C)C(C1)CC(=C(C)2)C(C)(CCC(=O)2)C1","InChI=1S/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3","KUFXJZXMWHNCEH-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(NN=CC(C)C(C2)C(C=NNc(c3)c([N+1]([O-1])=O)cc([N+1]([O-1])=O)c3)C(C)C2)c1","InChI=1S/C22H24N8O8/c1-13-3-6-17(14(2)11-23-25-19-7-4-15(27(31)32)9-21(19)29(35)36)18(13)12-24-26-20-8-5-16(28(33)34)10-22(20)30(37)38/h4-5,7-14,17-18,25-26H,3,6H2,1-2H3/b23-11+,24-12+","SCNCMQWVAQHERI-ASIDMNOUSA-N"
"CC(C)(C)NCC(O[Si](C)(C)C)c(c1)cc(O[Si](C)(C)C)cc(O[Si](C)(C)C)1","InChI=1S/C21H43NO3Si3/c1-21(2,3)22-16-20(25-28(10,11)12)17-13-18(23-26(4,5)6)15-19(14-17)24-27(7,8)9/h13-15,20,22H,16H2,1-12H3","HCOIHNBLVDOGQK-UHFFFAOYSA-N"
"OCCC(C=2)=C(C=1)C(C=C(C(C)C)C2)=C(C)C1","InChI=1S/C16H20O/c1-11(2)14-6-5-13(8-9-17)15-7-4-12(3)16(15)10-14/h4-7,10-11,17H,8-9H2,1-3H3","IKCSTPCYLTYEQG-UHFFFAOYSA-N"
"CCCCCC(=O)OC(C)C","InChI=1S/C9H18O2/c1-4-5-6-7-9(10)11-8(2)3/h8H,4-7H2,1-3H3","JSHDAORXSNJOBA-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCCC(C)C","InChI=1S/C13H26O2/c1-4-5-6-7-8-9-13(14)15-11-10-12(2)3/h12H,4-11H2,1-3H3","XKWSWANXMRXDES-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCCCCC","InChI=1S/C13H26O2/c1-3-5-7-8-9-11-13(14)15-12-10-6-4-2/h3-12H2,1-2H3","GJWGZSBNFSBUPX-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCC(C)C","InChI=1S/C12H24O2/c1-4-5-6-7-8-9-12(13)14-10-11(2)3/h11H,4-10H2,1-3H3","CFQRBRGFNFRMBD-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCCCC","InChI=1S/C12H24O2/c1-3-5-7-8-9-10-12(13)14-11-6-4-2/h3-11H2,1-2H3","PSXNDMJWRZYVTM-UHFFFAOYSA-N"
"CCCCCCCC(=O)OC(C)C","InChI=1S/C11H22O2/c1-4-5-6-7-8-9-11(12)13-10(2)3/h10H,4-9H2,1-3H3","WCGIIHOFOFCKSM-UHFFFAOYSA-N"
"CCCCC(CC)COC(=O)C=C","InChI=1S/C11H20O2/c1-4-7-8-10(5-2)9-13-11(12)6-3/h6,10H,3-5,7-9H2,1-2H3","GOXQRTZXKQZDDN-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCC","InChI=1S/C10H20O2/c1-3-5-6-7-8-9-10(11)12-4-2/h3-9H2,1-2H3","YYZUSRORWSJGET-UHFFFAOYSA-N"
"CCCCCCCCCC","InChI=1S/C10H22/c1-3-5-7-9-10-8-6-4-2/h3-10H2,1-2H3","DIOQZVSQGTUSAI-UHFFFAOYSA-N"
"OCc(c1)occ1","InChI=1S/C5H6O2/c6-4-5-2-1-3-7-5/h1-3,6H,4H2","XPFVYQJUAUNWIW-UHFFFAOYSA-N"
"NCc(c1)occ1","InChI=1S/C5H7NO/c6-4-5-2-1-3-7-5/h1-3H,4,6H2","DDRPCXLAQZKBJP-UHFFFAOYSA-N"
"CCCCC(C)CO","InChI=1S/C7H16O/c1-3-4-5-7(2)6-8/h7-8H,3-6H2,1-2H3","LCFKURIJYIJNRU-UHFFFAOYSA-N"
"O=C(Cl)Cc(c1)cccc1","InChI=1S/C8H7ClO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2","VMZCDNSFRSVYKQ-UHFFFAOYSA-N"
"O=Cc(c1)oc(C)c1","InChI=1S/C6H6O2/c1-5-2-3-6(4-7)8-5/h2-4H,1H3","OUDFNZMQXZILJD-UHFFFAOYSA-N"
"CC(C)COC(=O)CC(C)C","InChI=1S/C9H18O2/c1-7(2)5-9(10)11-6-8(3)4/h7-8H,5-6H2,1-4H3","KEBDNKNVCHQIJU-UHFFFAOYSA-N"
"CC(C)CCOC(=O)Cc(c1)cccc1","InChI=1S/C13H18O2/c1-11(2)8-9-15-13(14)10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3","QWBQBUWZZBUFHN-UHFFFAOYSA-N"
"C=CCOC(=O)Cc(c1)cccc1","InChI=1S/C11H12O2/c1-2-8-13-11(12)9-10-6-4-3-5-7-10/h2-7H,1,8-9H2","ZCDYAMJXVAUTIM-UHFFFAOYSA-N"
"CC(C)COC(=O)Cc(c1)cccc1","InChI=1S/C12H16O2/c1-10(2)9-14-12(13)8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3","RJASFPFZACBKBE-UHFFFAOYSA-N"
"CC(C2)CC(C(C2)1)C(C)(C)1","InChI=1S/C10H18/c1-7-4-5-8-9(6-7)10(8,2)3/h7-9H,4-6H2,1-3H3","BWRHOYDPVJPXMF-UHFFFAOYSA-N"
"CC(=O)CCC=C(C)C=CC(=C(C)1)C(C)(CCC(=O)1)C(=O)OC","InChI=1S/C19H26O4/c1-13(7-6-8-14(2)20)9-10-16-15(3)17(21)11-12-19(16,4)18(22)23-5/h7,9-10H,6,8,11-12H2,1-5H3/b10-9+,13-7+/t19-/m0/s1","IBEKLXNZXQHTGY-OUOIIHKDSA-N"
"CC(C)=CCCC(C)(C3)C([H])(C1)C(CC3)(C(O2)OCC2)C(=O)C(C)C1","InChI=1S/C21H34O3/c1-15(2)7-5-10-20(4)11-6-12-21(19-23-13-14-24-19)17(20)9-8-16(3)18(21)22/h7,16-17,19H,5-6,8-14H2,1-4H3/t16?,17-,20+,21+/m0/s1","YXNQMYYPGYBXJH-JMCPUQKHSA-N"
"CC(C)=CCCC(C)(C3)C(C1)C(C)(CC3)C(CCC(C)(O2)OCC2)=C(C)C1","InChI=1S/C25H42O2/c1-19(2)9-7-13-23(4)14-8-15-24(5)21(20(3)10-11-22(23)24)12-16-25(6)26-17-18-27-25/h9,22H,7-8,10-18H2,1-6H3/t22?,23-,24-/m1/s1","BBPHUYZEVNFFEW-HEYJASKDSA-N"
"CCCCCCCCCC(CO)(C1)OC(=O)C([H])(C)C1","InChI=1S/C16H30O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h14,17H,3-13H2,1-2H3/t14-,16-/m1/s1","OEXPVULGTKWKEH-GDBMZVCRSA-N"
"CCCCCCCCCC(CO)(C1)OC(=O)C(C)=C1","InChI=1S/C16H28O3/c1-3-4-5-6-7-8-9-11-16(13-17)12-10-14(2)15(18)19-16/h10,17H,3-9,11-13H2,1-2H3","QSCPZTHCXWAHQG-UHFFFAOYSA-N"
"CCCCCCCCC([H])(O1)C([H])(C(=C)2)C([H])(OC(=O)2)C(=O)1","InChI=1S/C15H22O4/c1-3-4-5-6-7-8-9-11-12-10(2)14(16)19-13(12)15(17)18-11/h11-13H,2-9H2,1H3/t11-,12-,13-/m0/s1","GSTQYRQXFPSWSH-AVGNSLFASA-N"
"CC(C)(C)c(c2)cc(c(c2)1)C(C)(C)CC(=O)1","InChI=1S/C15H20O/c1-14(2,3)10-6-7-11-12(8-10)15(4,5)9-13(11)16/h6-8H,9H2,1-5H3","UAYMLJQAJQASDB-UHFFFAOYSA-N"
"CCCCCCC(=O)C=Cc(c1)cccc1","InChI=1S/C15H20O/c1-2-3-4-8-11-15(16)13-12-14-9-6-5-7-10-14/h5-7,9-10,12-13H,2-4,8,11H2,1H3/b13-12+","NUWFGSCHUJWGHJ-OUKQBFOZSA-N"
"O=C(C=Cc(c2)cccc2)N(C1)CCCC1","InChI=1S/C14H17NO/c16-14(15-11-5-2-6-12-15)10-9-13-7-3-1-4-8-13/h1,3-4,7-10H,2,5-6,11-12H2/b10-9+","KNOXUMZPTHELAO-MDZDMXLPSA-N"
"COC(=O)CCCCCCCCC(C)=O","InChI=1S/C12H22O3/c1-11(13)9-7-5-3-4-6-8-10-12(14)15-2/h3-10H2,1-2H3","TXRMRSKJQBFMRQ-UHFFFAOYSA-N"
"C(C3)CCN(C3)C(C1)Cc(c2)c(ccc2)C1","InChI=1S/C15H21N/c1-4-10-16(11-5-1)15-9-8-13-6-2-3-7-14(13)12-15/h2-3,6-7,15H,1,4-5,8-12H2","BUOJSWSFQHDDPH-UHFFFAOYSA-N"
"C=CCCCCCCCC(O)C(=O)OC","InChI=1S/C12H22O3/c1-3-4-5-6-7-8-9-10-11(13)12(14)15-2/h3,11,13H,1,4-10H2,2H3","FNDHOARZTUZRCW-UHFFFAOYSA-N"
"COC(=O)C(C=2)=C(C=1)C(C2)=C(C=O)C=CC1","InChI=1S/C13H10O3/c1-16-13(15)12-7-6-10-9(8-14)4-2-3-5-11(10)12/h2-8H,1H3","JGADTJRHGIFPNG-UHFFFAOYSA-N"
"CC(C3)C([H])(C1)C(C)(C)C([H])(C2)C(C3)1C([H])(C)C2","InChI=1S/C15H26/c1-10-7-8-15-9-12(10)14(3,4)13(15)6-5-11(15)2/h10-13H,5-9H2,1-4H3/t10-,11-,12+,13+,15?/m1/s1","JJTQQGNEXQKQRF-NFXCRTCFSA-N"
"[H]C(C)(C2)C([H])(C3)C([H])(C([H])(C)C3)C([H])(C(C)(C)1)C([H])(C2)1","InChI=1S/C15H26/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h9-14H,5-8H2,1-4H3/t9-,10-,11+,12+,13+,14+/m0/s1","UIDUJXXQMGYOIN-PRSXHHODSA-N"
"COC(=O)C(CC1=CNC2=CC=CC=C21)O","InChI=1S/C12H13NO3/c1-16-12(15)11(14)6-8-7-13-10-5-3-2-4-9(8)10/h2-5,7,11,13-14H,6H2,1H3","YHKXBTJWCNPFQV-UHFFFAOYSA-N"
"COC1=CC2=C(C=C1)NC=C2CC(=O)OC","InChI=1S/C12H13NO3/c1-15-9-3-4-11-10(6-9)8(7-13-11)5-12(14)16-2/h3-4,6-7,13H,5H2,1-2H3","UZOYTCVZJBYXIA-UHFFFAOYSA-N"
"CCOC(=O)C([H])(CCSC)NC(C)=O","InChI=1S/C9H17NO3S/c1-4-13-9(12)8(5-6-14-3)10-7(2)11/h8H,4-6H2,1-3H3,(H,10,11)/t8-/m1/s1","HWRSILOQIXCGQU-MRVPVSSYSA-N"
"COC(=O)CCCC1=CC2=CC=CC=C2N1","InChI=1S/C13H15NO2/c1-16-13(15)8-4-6-11-9-10-5-2-3-7-12(10)14-11/h2-3,5,7,9,14H,4,6,8H2,1H3","GHQNBSPRKLUEKB-UHFFFAOYSA-N"
"CC(C)CC(=O)OCC=Cc(c1)cccc1","InChI=1S/C14H18O2/c1-12(2)11-14(15)16-10-6-9-13-7-4-3-5-8-13/h3-9,12H,10-11H2,1-2H3/b9-6+","FOCMOGKCPPTERB-RMKNXTFCSA-N"
"CCCCCOC(=O)C=Cc(c1)cccc1","InChI=1S/C14H18O2/c1-2-3-7-12-16-14(15)11-10-13-8-5-4-6-9-13/h4-6,8-11H,2-3,7,12H2,1H3/b11-10+","QDRJCWZGTMRXCL-ZHACJKMWSA-N"
"CCOC(=O)c(c2)c(C1)c(cc2)C(C)(C)C1","InChI=1S/C14H18O2/c1-4-16-13(15)11-6-5-7-12-10(11)8-9-14(12,2)3/h5-7H,4,8-9H2,1-3H3","JAWKNTBIAIQVDD-UHFFFAOYSA-N"
"CCC(C)C(C(C)=O)C(=O)c(c1)cccc1","InChI=1S/C14H18O2/c1-4-10(2)13(11(3)15)14(16)12-8-6-5-7-9-12/h5-10,13H,4H2,1-3H3","KYIVSKWOJCLODL-UHFFFAOYSA-N"
"CCC(C)CCCC(C)CCCC(C)C","InChI=1S/C15H32/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h13-15H,6-12H2,1-5H3","YFHFHLSMISYUAQ-UHFFFAOYSA-N"
"CCOC(=O)C(C(C)=O)=Cc(c1)cccc1","InChI=1S/C13H14O3/c1-3-16-13(15)12(10(2)14)9-11-7-5-4-6-8-11/h4-9H,3H2,1-2H3/b12-9+","AYZGINZXVVKWKV-FMIVXFBMSA-N"
"O=C(C2)CCC(C2)OC(=O)c(c1)cccc1","InChI=1S/C13H14O3/c14-11-6-8-12(9-7-11)16-13(15)10-4-2-1-3-5-10/h1-5,12H,6-9H2","VFICJPDIBDJAGL-UHFFFAOYSA-N"
"CCC(OC)CCCCC(CC)SC","InChI=1S/C12H26OS/c1-5-11(13-3)9-7-8-10-12(6-2)14-4/h11-12H,5-10H2,1-4H3","CETCQZRWHPBUBX-UHFFFAOYSA-N"
"COC(=O)CCC1=C(NC2=CC=CC=C21)N","InChI=1S/C12H14N2O2/c1-16-11(15)7-6-9-8-4-2-3-5-10(8)14-12(9)13/h2-5,14H,6-7,13H2,1H3","VTYXPORYQXCQHS-UHFFFAOYSA-N"
"CC(=O)c(c(O)2)c(O1)c(cc2)C(C)=CC(=O)1","InChI=1S/C12H10O4/c1-6-5-10(15)16-12-8(6)3-4-9(14)11(12)7(2)13/h3-5,14H,1-2H3","WZOMQVFUPMLOGT-UHFFFAOYSA-N"
"Nc(c1)c(Cl)ccc1","InChI=1S/C6H6ClN/c7-5-3-1-2-4-6(5)8/h1-4H,8H2","AKCRQHGQIJBRMN-UHFFFAOYSA-N"
"Nc(c1)cc(Cl)cc1","InChI=1S/C6H6ClN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2","PNPCRKVUWYDDST-UHFFFAOYSA-N"
"O=Cc(c1)ccc(Cl)c1","InChI=1S/C7H5ClO/c8-7-3-1-6(5-9)2-4-7/h1-5H","AVPYQKSLYISFPO-UHFFFAOYSA-N"
"COC(=O)CCl","InChI=1S/C3H5ClO2/c1-6-3(5)2-4/h2H2,1H3","QABLOFMHHSOFRJ-UHFFFAOYSA-N"
"CC(C)OC(=O)CCl","InChI=1S/C5H9ClO2/c1-4(2)8-5(7)3-6/h4H,3H2,1-2H3","VODRWDBLLGYRJT-UHFFFAOYSA-N"
"CCCCOC(=O)CCl","InChI=1S/C6H11ClO2/c1-2-3-4-9-6(8)5-7/h2-5H2,1H3","YJRGMUWRPCPLNH-UHFFFAOYSA-N"
"C=CCOC(=O)CCl","InChI=1S/C5H7ClO2/c1-2-3-8-5(7)4-6/h2H,1,3-4H2","VMBJJCDVORDOCF-UHFFFAOYSA-N"
"CCCCl","InChI=1S/C3H7Cl/c1-2-3-4/h2-3H2,1H3","SNMVRZFUUCLYTO-UHFFFAOYSA-N"
"CC(C)Cl","InChI=1S/C3H7Cl/c1-3(2)4/h3H,1-2H3","ULYZAYCEDJDHCC-UHFFFAOYSA-N"
"C=CCCl","InChI=1S/C3H5Cl/c1-2-3-4/h2H,1,3H2","OSDWBNJEKMUWAV-UHFFFAOYSA-N"
"CC(C)(C)Cl","InChI=1S/C4H9Cl/c1-4(2,3)5/h1-3H3","NBRKLOOSMBRFMH-UHFFFAOYSA-N"
"ClC(C1)CCCC1","InChI=1S/C6H11Cl/c7-6-4-2-1-3-5-6/h6H,1-5H2","UNFUYWDGSFDHCW-UHFFFAOYSA-N"
"CCCCC(=O)OCC","InChI=1S/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3","ICMAFTSLXCXHRK-UHFFFAOYSA-N"
"CC(C)CCOC(=O)CC(C)C","InChI=1S/C10H20O2/c1-8(2)5-6-12-10(11)7-9(3)4/h8-9H,5-7H2,1-4H3","XINCECQTMHSORG-UHFFFAOYSA-N"
"CCCCCC(=O)OCC","InChI=1S/C8H16O2/c1-3-5-6-7-8(9)10-4-2/h3-7H2,1-2H3","SHZIWNPUGXLXDT-UHFFFAOYSA-N"
"CCCCCC(=O)OCCCC","InChI=1S/C10H20O2/c1-3-5-7-8-10(11)12-9-6-4-2/h3-9H2,1-2H3","RPRPDTXKGSIXMD-UHFFFAOYSA-N"
"CCCCCC(=O)OCC(C)C","InChI=1S/C10H20O2/c1-4-5-6-7-10(11)12-8-9(2)3/h9H,4-8H2,1-3H3","UXUPPWPIGVTVQI-UHFFFAOYSA-N"
"CCCCCC(=O)OCCC(C)C","InChI=1S/C11H22O2/c1-4-5-6-7-11(12)13-9-8-10(2)3/h10H,4-9H2,1-3H3","XVSZRAWFCDHCBP-UHFFFAOYSA-N"
"CCCCCCC","InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3","IMNFDUFMRHMDMM-UHFFFAOYSA-N"
"CCC(C)(C)C","InChI=1S/C6H14/c1-5-6(2,3)4/h5H2,1-4H3","HNRMPXKDFBEGFZ-UHFFFAOYSA-N"
"CC(C)CC(C)(C)C","InChI=1S/C8H18/c1-7(2)6-8(3,4)5/h7H,6H2,1-5H3","NHTMVDHEPJAVLT-UHFFFAOYSA-N"
"C#CC(C)(C)O","InChI=1S/C5H8O/c1-4-5(2,3)6/h1,6H,2-3H3","CEBKHWWANWSNTI-UHFFFAOYSA-N"
"CC(C1)=C([H])CC([H])(C1)C(C)(C)O","InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3/t9-/m1/s1","WUOACPNHFRMFPN-SECBINFHSA-N"
"CC(=C)C([H])(C1)C([H])(O)CC([H])(C)C1","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10-/m1/s1","ZYTMANIQRDEHIO-KXUCPTDWSA-N"
"CC[Si](C)(C)C","InChI=1S/C5H14Si/c1-5-6(2,3)4/h5H2,1-4H3","UKAJDOBPPOAZSS-UHFFFAOYSA-N"
"CC[SiH2]CC","InChI=1S/C4H12Si/c1-3-5-4-2/h3-5H2,1-2H3","UCXUKTLCVSGCNR-UHFFFAOYSA-N"
"CC[SiH2]C","InChI=1S/C3H10Si/c1-3-4-2/h3-4H2,1-2H3","BCSGKKPVRAKXLL-UHFFFAOYSA-N"
"CCC[SiH2]C","InChI=1S/C4H12Si/c1-3-4-5-2/h3-5H2,1-2H3","ROMCRKSGDFOTBY-UHFFFAOYSA-N"
"CC(C1)CC=CC1","InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h2-3,7H,4-6H2,1H3","FSWCCQWDVGZMRD-UHFFFAOYSA-N"
"CC(C1)C=CCC1","InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h3,5,7H,2,4,6H2,1H3","UZPWKTCMUADILM-UHFFFAOYSA-N"
"[H]C(C1)=C(C)CCC1","InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h5H,2-4,6H2,1H3","CTMHWPIWNRWQEG-UHFFFAOYSA-N"
"CCCCCC=CCCCCCCCCCCC(=O)OC","InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8H,3-6,9-18H2,1-2H3/b8-7-","LMWAESDDOGRMOK-FPLPWBNLSA-N"
"CCCCCC([H])=C([H])CC([H])=C([H])CCCCCCCC(=O)OC","InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11H,3-6,9,12-18H2,1-2H3/b8-7-,11-10-","WTTJVINHCBCLGX-NQLNTKRDSA-N"
"CCCCCC([H])=C([H])CC([H])=C([H])CC([H])=C([H])CCCCC(=O)OC","InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11,13-14H,3-6,9,12,15-18H2,1-2H3/b8-7-,11-10-,14-13-","JFRWATCOFCPIBM-JPFHKJGASA-N"
"CCC([H])=C([H])CCCCC([H])=C([H])CC([H])=C([H])CCCCC(=O)OC","InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,10-11,13-14H,3,6-9,12,15-18H2,1-2H3/b5-4-,11-10-,14-13-","SWFJVJVXGIDQRY-WMWLCQRCSA-N"
"CCC([H])=C([H])CC([H])=C([H])CCCCC([H])=C([H])CCCCC(=O)OC","InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,13-14H,3,6,9-12,15-18H2,1-2H3/b5-4-,8-7-,14-13-","NTHHALPEFAAFAP-RBIKCNJLSA-N"
"CCC([H])=C([H])CC([H])=C([H])CC([H])=C([H])CC([H])=C([H])CCCCC(=O)OC","InChI=1S/C19H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,10-11,13-14H,3,6,9,12,15-18H2,1-2H3/b5-4-,8-7-,11-10-,14-13-","BIRKCHKCDPCDEG-GJDCDIHCSA-N"
"CCCCCC([H])=C([H])CCCCCCCCCCC(=O)OC","InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8H,3-6,9-18H2,1-2H3/b8-7-","LMWAESDDOGRMOK-FPLPWBNLSA-N"
"CCC([H])=C([H])CCCCCCCCCCCCCC(=O)OC","InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5H,3,6-18H2,1-2H3/b5-4-","NQEFHAHNEYBAAD-PLNGDYQASA-N"
"CCC([H])=C([H])CCCCC([H])=C([H])CCCCCCCC(=O)OC","InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,10-11H,3,6-9,12-18H2,1-2H3/b5-4-,11-10-","OTROKOXHZSGHEN-NKIGAPEHSA-N"
"CCC([H])=C([H])CC([H])=C([H])CCCCCCCCCCC(=O)OC","InChI=1S/C19H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8H,3,6,9-18H2,1-2H3/b5-4-,8-7-","SQXLGHNKHZNVRT-UTOQUPLUSA-N"
"CCC([H])=C([H])CC([H])=C([H])CC([H])=C([H])CCCCCCCC(=O)OC","InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h4-5,7-8,10-11H,3,6,9,12-18H2,1-2H3/b5-4-,8-7-,11-10-","DVWSXZIHSUZZKJ-YSTUJMKBSA-N"
"CCCCCCCCC([H])=C([H])CCCCCCCC(=O)OC","InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h10-11H,3-9,12-18H2,1-2H3/b11-10-","QYDYPVFESGNLHU-KHPPLWFESA-N"
"CCCCCCCCCCCC([H])=C([H])CCCCC(=O)OC","InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h13-14H,3-12,15-18H2,1-2H3/b14-13-","QRTVDKVXAFJVRU-YPKPFQOOSA-N"
"CCCCCCCCCCCC(O1)C(CCCCC(=O)OC)1","InChI=1S/C19H36O3/c1-3-4-5-6-7-8-9-10-11-14-17-18(22-17)15-12-13-16-19(20)21-2/h17-18H,3-16H2,1-2H3","XZBRNQGAEDOQPT-UHFFFAOYSA-N"
"CCCCCCCCC(O1)C(CCCCCCCC(=O)OC)1","InChI=1S/C19H36O3/c1-3-4-5-6-8-11-14-17-18(22-17)15-12-9-7-10-13-16-19(20)21-2/h17-18H,3-16H2,1-2H3","CAMHHLOGFDZBBG-UHFFFAOYSA-N"
"OCCCCCCCC([H])=C([H])C([H])=C([H])C","InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-5,13H,6-12H2,1H3/b3-2+,5-4+","CSWBSLXBXRFNST-MQQKCMAXSA-N"
"CCCCCCC([H])=C([H])CCCCCCCCO","InChI=1S/C16H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h7-8,17H,2-6,9-16H2,1H3/b8-7-","LBIYNOAMNIKVKF-FPLPWBNLSA-N"
"CCCCCCCCC([H])=C([H])CCCCCCOC(C)=O","InChI=1S/C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h10-11H,3-9,12-17H2,1-2H3/b11-10-","QVXFGVVYTKZLJN-KHPPLWFESA-N"
"CCCCC([H])=C([H])CCC([H])=C([H])CCCCCCOC(C)=O","InChI=1S/C18H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h6-7,10-11H,3-5,8-9,12-17H2,1-2H3/b7-6-,11-10-","BXJHOKLLMOYSRQ-QOXWLJPHSA-N"
"CCCCCCC([H])=C([H])CCCCCCCC(=O)OC","InChI=1S/C17H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h8-9H,3-7,10-16H2,1-2H3/b9-8-","IZFGRAGOVZCUFB-HJWRWDBZSA-N"
"CCC(=O)OCCCCCCCC([H])=C([H])C([H])=C([H])C","InChI=1S/C15H26O2/c1-3-5-6-7-8-9-10-11-12-13-14-17-15(16)4-2/h3,5-7H,4,8-14H2,1-2H3/b5-3+,7-6+","VBAWYVHXKMJINV-TWTPFVCWSA-N"
"CCCCCCCCC([H])=C([H])CCO","InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h9-10,13H,2-8,11-12H2,1H3/b10-9-","BDGQTWOHKASHQU-KTKRTIGZSA-N"
"FCCCCCCCCC([H])=C([H])CCOC(C)=O","InChI=1S/C14H25FO2/c1-14(16)17-13-11-9-7-5-3-2-4-6-8-10-12-15/h7,9H,2-6,8,10-13H2,1H3/b9-7-","JYVIOFGAFDOEFQ-CLFYSBASSA-N"
"CCCCCC([H])=C([H])CC([H])=C([H])CCO","InChI=1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h6-7,9-10,13H,2-5,8,11-12H2,1H3/b7-6-,10-9-","WVTVMLXNKUWGBH-HZJYTTRNSA-N"
"FCCCCCCCCCCCCOC(C)=O","InChI=1S/C14H27FO2/c1-14(16)17-13-11-9-7-5-3-2-4-6-8-10-12-15/h2-13H2,1H3","GJRKOAXTXXIFAH-UHFFFAOYSA-N"
"OCC=Cc(c1)cccc1","InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2/b7-4+","OOCCDEMITAIZTP-QPJJXVBHSA-N"
"CCOCCO","InChI=1S/C4H10O2/c1-2-6-4-3-5/h5H,2-4H2,1H3","ZNQVEEAIQZEUHB-UHFFFAOYSA-N"
"COC(=O)CCC(=O)Cl","InChI=1S/C5H7ClO3/c1-9-5(8)3-2-4(6)7/h2-3H2,1H3","SRXOJMOGPYFZKC-UHFFFAOYSA-N"
"CC=CC(=O)OC","InChI=1S/C5H8O2/c1-3-4-5(6)7-2/h3-4H,1-2H3/b4-3+","MCVVUJPXSBQTRZ-ONEGZZNKSA-N"
"CCOC(=O)C(F)(F)F","InChI=1S/C4H5F3O2/c1-2-9-3(8)4(5,6)7/h2H2,1H3","STSCVKRWJPWALQ-UHFFFAOYSA-N"
"ClCCOc(c1)cccc1","InChI=1S/C8H9ClO/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,6-7H2","VQUYNUJARXBNPK-UHFFFAOYSA-N"
"CC(=O)CC(=O)C(F)(F)F","InChI=1S/C5H5F3O2/c1-3(9)2-4(10)5(6,7)8/h2H2,1H3","SHXHPUAKLCCLDV-UHFFFAOYSA-N"
"O=C(CC(=O)C(F)(F)F)C(F)(F)F","InChI=1S/C5H2F6O2/c6-4(7,8)2(12)1-3(13)5(9,10)11/h1H2","QAMFBRUWYYMMGJ-UHFFFAOYSA-N"
"C=CCO","InChI=1S/C3H6O/c1-2-3-4/h2,4H,1,3H2","XXROGKLTLUQVRX-UHFFFAOYSA-N"
"CC(C)=CC(C)=O","InChI=1S/C6H10O/c1-5(2)4-6(3)7/h4H,1-3H3","SHOJXDKTYKFBRD-UHFFFAOYSA-N"
"OCC(C)(C)N","InChI=1S/C4H11NO/c1-4(2,5)3-6/h6H,3,5H2,1-2H3","CBTVGIZVANVGBH-UHFFFAOYSA-N"
"CC(C1)OCOC1","InChI=1S/C5H10O2/c1-5-2-3-6-4-7-5/h5H,2-4H2,1H3","INCCMBMMWVKEGJ-UHFFFAOYSA-N"
"NCCNCCO","InChI=1S/C4H12N2O/c5-1-2-6-3-4-7/h6-7H,1-5H2","LHIJANUOQQMGNT-UHFFFAOYSA-N"
"CCC(C)(O)C#C","InChI=1S/C6H10O/c1-4-6(3,7)5-2/h1,7H,5H2,2-3H3","QXLPXWSKPNOQLE-UHFFFAOYSA-N"
"CCSCC","InChI=1S/C4H10S/c1-3-5-4-2/h3-4H2,1-2H3","LJSQFQKUNVCTIA-UHFFFAOYSA-N"
"c(c2)ccc(c2)OCCOc(c1)cccc1","InChI=1S/C14H14O2/c1-3-7-13(8-4-1)15-11-12-16-14-9-5-2-6-10-14/h1-10H,11-12H2","XCSGHNKDXGYELG-UHFFFAOYSA-N"
"CC(=O)CCC(O)=O","InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)","JOOXCMJARBKPKM-UHFFFAOYSA-N"
"CCCC(C)CO","InChI=1S/C6H14O/c1-3-4-6(2)5-7/h6-7H,3-5H2,1-2H3","PFNHSEQQEPMLNI-UHFFFAOYSA-N"
"NCCCOC","InChI=1S/C4H11NO/c1-6-4-2-3-5/h2-5H2,1H3","FAXDZWQIWUSWJH-UHFFFAOYSA-N"
"CCOC(=O)C(C1)(CC1)C(=O)OCC","InChI=1S/C10H16O4/c1-3-13-8(11)10(6-5-7-10)9(12)14-4-2/h3-7H2,1-2H3","JPNJEJSZSMXWSV-UHFFFAOYSA-N"
"NCCC[Si](C)(OCC)OCC","InChI=1S/C8H21NO2Si/c1-4-10-12(3,11-5-2)8-6-7-9/h4-9H2,1-3H3","HXLAEGYMDGUSBD-UHFFFAOYSA-N"
"C=CCOCCO","InChI=1S/C5H10O2/c1-2-4-7-5-3-6/h2,6H,1,3-5H2","GCYHRYNSUGLLMA-UHFFFAOYSA-N"
"CC(=O)OCCOC(C)=O","InChI=1S/C6H10O4/c1-5(7)9-3-4-10-6(2)8/h3-4H2,1-2H3","JTXMVXSTHSMVQF-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)OC1","InChI=1S/C8H8O/c1-2-4-8-7(3-1)5-6-9-8/h1-4H,5-6H2","HBEDSQVIWPRPAY-UHFFFAOYSA-N"
"C=CCC#N","InChI=1S/C4H5N/c1-2-3-4-5/h2H,1,3H2","SJNALLRHIVGIBI-UHFFFAOYSA-N"
"CCS","InChI=1S/C2H6S/c1-2-3/h3H,2H2,1H3","DNJIEGIFACGWOD-UHFFFAOYSA-N"
"CSC","InChI=1S/C2H6S/c1-3-2/h1-2H3","QMMFVYPAHWMCMS-UHFFFAOYSA-N"
"COCC(C)=O","InChI=1S/C4H8O2/c1-4(5)3-6-2/h3H2,1-2H3","CUZLJOLBIRPEFB-UHFFFAOYSA-N"
"COC(=O)CC(C=1)CC(C1)CC(=O)OC","InChI=1S/C11H16O4/c1-14-10(12)6-8-3-4-9(5-8)7-11(13)15-2/h3-4,8-9H,5-7H2,1-2H3","OPAILMNPWHPKFF-UHFFFAOYSA-N"
"OCCC(C=1)CC(CCO)C1","InChI=1S/C9H16O2/c10-5-3-8-1-2-9(7-8)4-6-11/h1-2,8-11H,3-7H2","UGHQHTMVEARZSS-UHFFFAOYSA-N"
"BrCCC(C=1)CC(C1)CCBr","InChI=1S/C9H14Br2/c10-5-3-8-1-2-9(7-8)4-6-11/h1-2,8-9H,3-7H2","JSMJHXUEAGYWJX-UHFFFAOYSA-N"
"SCc(c1)ccc(CS)c1","InChI=1S/C8H10S2/c9-5-7-1-2-8(6-10)4-3-7/h1-4,9-10H,5-6H2","IYPNRTQAOXLCQW-UHFFFAOYSA-N"
"COc(c1)c(CS)cc(OC)c(CS)1","InChI=1S/C10H14O2S2/c1-11-9-3-8(6-14)10(12-2)4-7(9)5-13/h3-4,13-14H,5-6H2,1-2H3","ZEDHECWYZXVVDM-UHFFFAOYSA-N"
"COc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1","BCWWDWHFBMPLFQ-VXNCWWDNSA-N"
"COC(=O)C([H])(CC(C)C)NC(=O)OC(C)(C)C","InChI=1S/C12H23NO4/c1-8(2)7-9(10(14)16-6)13-11(15)17-12(3,4)5/h8-9H,7H2,1-6H3,(H,13,15)/t9-/m0/s1","QSEVMIMUBKMNOU-VIFPVBQESA-N"
"CC(C)CC([H])(C(O)=O)NC(=O)OC(C)(C)C","InChI=1S/C11H21NO4/c1-7(2)6-8(9(13)14)12-10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14)/t8-/m0/s1","MDXGYYOJGPFFJL-QMMMGPOBSA-N"
"CCOC(C)OC(C=O)c(c1)cccc1","InChI=1S/C12H16O3/c1-3-14-10(2)15-12(9-13)11-7-5-4-6-8-11/h4-10,12H,3H2,1-2H3","MQMNEXVULRNNFS-UHFFFAOYSA-N"
"CCOC(=O)C=CC(C(C)O)O[Si](C)(C)C(C)(C)C","InChI=1S/C14H28O4Si/c1-8-17-13(16)10-9-12(11(2)15)18-19(6,7)14(3,4)5/h9-12,15H,8H2,1-7H3/b10-9+/t11-,12-/m1/s1","CLHAZTQYBPVDIY-CZHKVUGUSA-N"
"COC(=O)C=C(C)C([H])(O[Si](CC)(CC)CC)C([H])(C)OC(N)=O","InChI=1S/C15H29NO5Si/c1-7-22(8-2,9-3)21-14(12(5)20-15(16)18)11(4)10-13(17)19-6/h10,12,14H,7-9H2,1-6H3,(H2,16,18)/b11-10-/t12-,14-/m1/s1","CBVOENHYXRKIRF-XVGBTMSLSA-N"
"COC(=O)C=C(O)Cc(c1)cccc1","InChI=1S/C11H12O3/c1-14-11(13)8-10(12)7-9-5-3-2-4-6-9/h2-6,8,12H,7H2,1H3/b10-8-","MKQJLCBWPQPXAZ-NTMALXAHSA-N"
"CCOC(=O)CC(C)O","InChI=1S/C6H12O3/c1-3-9-6(8)4-5(2)7/h5,7H,3-4H2,1-2H3","OMSUIQOIVADKIM-UHFFFAOYSA-N"
"CCOC(=O)C=CC(C(C)OC(N)=O)O[Si](CC)(CC)CC","InChI=1S/C15H29NO5Si/c1-6-19-14(17)11-10-13(12(5)20-15(16)18)21-22(7-2,8-3)9-4/h10-13H,6-9H2,1-5H3,(H2,16,18)/b11-10+/t12-,13-/m1/s1","QDRUNCUKWPTKDV-HRFIDBLHSA-N"
"CCOC(=O)C=CC(OC(C1)OCCC1)C(C)O[Si](C)(C)C(C)(C)C","InChI=1S/C19H36O5Si/c1-8-21-17(20)13-12-16(23-18-11-9-10-14-22-18)15(2)24-25(6,7)19(3,4)5/h12-13,15-16,18H,8-11,14H2,1-7H3/b13-12+/t15-,16-,18?/m1/s1","KPCSBWXXYRWZKK-KVYRVHHJSA-N"
"CCOC(=O)C=CC(O)C(C)O[Si](C)(C)C(C)(C)C","InChI=1S/C14H28O4Si/c1-8-17-13(16)10-9-12(15)11(2)18-19(6,7)14(3,4)5/h9-12,15H,8H2,1-7H3/b10-9+/t11-,12-/m1/s1","RXPVQCWVKQYMHW-CZHKVUGUSA-N"
"CCOC(=O)C=CC(O)C(C)O","InChI=1S/C8H14O4/c1-3-12-8(11)5-4-7(10)6(2)9/h4-7,9-10H,3H2,1-2H3/b5-4+/t6-,7-/m1/s1","XDXGQILMSPBVGA-XIMOZBJHSA-N"
"CCOC(=O)C=CC(C(C)O)OC(C1)OCCC1","InChI=1S/C13H22O5/c1-3-16-12(15)8-7-11(10(2)14)18-13-6-4-5-9-17-13/h7-8,10-11,13-14H,3-6,9H2,1-2H3/b8-7+/t10-,11-,13?/m1/s1","ULWZRXAJUIGDNM-GVLHEDNSSA-N"
"[N-1]=[N+1]=NC(CCCOC(C2)OCCC2)C([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C18H32N4O4/c1-18(2,3)26-17(23)22-11-6-9-15(22)14(20-21-19)8-7-13-25-16-10-4-5-12-24-16/h14-16H,4-13H2,1-3H3/t14?,15-,16?/m0/s1","DCGHSOKXKSNQPQ-PCKAHOCUSA-N"
"C(C2)COC(C2)OCCCC(O)C([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C18H33NO5/c1-18(2,3)24-17(21)19-11-6-8-14(19)15(20)9-7-13-23-16-10-4-5-12-22-16/h14-16,20H,4-13H2,1-3H3/t14-,15?,16?/m0/s1","NKMQNPYMOPGXEE-FHERZECASA-N"
"OCCCC(O)C(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C13H25NO4/c1-13(2,3)18-12(17)14-8-4-6-10(14)11(16)7-5-9-15/h10-11,15-16H,4-9H2,1-3H3","QKLLJTULFSLJDL-UHFFFAOYSA-N"
"CC(C)(C)OC(=O)N(C2)C([H])(CC2)C(C1)=NCC1","InChI=1S/C13H22N2O2/c1-13(2,3)17-12(16)15-9-5-7-11(15)10-6-4-8-14-10/h11H,4-9H2,1-3H3/t11-/m0/s1","XAUFGSFCUYVTFU-NSHDSACASA-N"
"OCCCC(N=[N+1]=[N-1])C(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C13H24N4O3/c1-13(2,3)20-12(19)17-8-4-7-11(17)10(15-16-14)6-5-9-18/h10-11,18H,4-9H2,1-3H3","FRSVVFYJSIKWHH-UHFFFAOYSA-N"
"O=CC([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h7-8H,4-6H2,1-3H3/t8-/m0/s1","YDBPZCVWPFMBDH-QMMMGPOBSA-N"
"CC(C)(C)OC(=O)N(C1)C([H])(CC1)C(CCCOS(C)(=O)=O)OS(C)(=O)=O","InChI=1S/C15H29NO8S2/c1-15(2,3)23-14(17)16-10-6-8-12(16)13(24-26(5,20)21)9-7-11-22-25(4,18)19/h12-13H,6-11H2,1-5H3/t12-,13?/m0/s1","OCKVMNKHRCFGTJ-UEWDXFNNSA-N"
"CN(C2)C(CC2)C(C1)N(C)CC1","InChI=1S/C10H20N2/c1-11-7-3-5-9(11)10-6-4-8-12(10)2/h9-10H,3-8H2,1-2H3","CUUDITMQWYGVGB-UHFFFAOYSA-N"
"C(C2)CC(N2)C(C1)NCC1","InChI=1S/C8H16N2/c1-3-7(9-5-1)8-4-2-6-10-8/h7-10H,1-6H2","NQHVTVSAFRAXPA-UHFFFAOYSA-N"
"O=C(Cl)N(C2)C(CC2)C(C1)N(CC1)C(=O)Cl","InChI=1S/C10H14Cl2N2O2/c11-9(15)13-5-1-3-7(13)8-4-2-6-14(8)10(12)16/h7-8H,1-6H2","XXTJUUSGQUSWRF-UHFFFAOYSA-N"
"CC(C)(C)OC(=O)N(C2)C([H])(CC2)C([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C18H32N2O4/c1-17(2,3)23-15(21)19-11-7-9-13(19)14-10-8-12-20(14)16(22)24-18(4,5)6/h13-14H,7-12H2,1-6H3/t13-,14-/m0/s1","WAUCFRKIXOASFG-KBPBESRZSA-N"
"CC(C)(C)OC(=O)N(C2)C([H])(CC2)C([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C18H32N2O4/c1-17(2,3)23-15(21)19-11-7-9-13(19)14-10-8-12-20(14)16(22)24-18(4,5)6/h13-14H,7-12H2,1-6H3/t13-,14+","WAUCFRKIXOASFG-OKILXGFUSA-N"
"O=CCC([H])(NC(C)=O)C([H])(O)C([H])(C)O","InChI=1S/C8H15NO4/c1-5(11)8(13)7(3-4-10)9-6(2)12/h4-5,7-8,11,13H,3H2,1-2H3,(H,9,12)/t5-,7-,8-/m0/s1","KJUOTNQKCLKJFB-GEVIPFJHSA-N"
"COC(=O)C=CC(O)c(c1)cccc1","InChI=1S/C11H12O3/c1-14-11(13)8-7-10(12)9-5-3-2-4-6-9/h2-8,10,12H,1H3/b8-7+","UHAABQMOQDTLEC-BQYQJAHWSA-N"
"COC(=O)C=CC(C)OC(N)=O","InChI=1S/C7H11NO4/c1-5(12-7(8)10)3-4-6(9)11-2/h3-5H,1-2H3,(H2,8,10)/b4-3+","ATZBOVFCGNYIIN-ONEGZZNKSA-N"
"CC(C)C(Sc(c2)cccc2)N(C1)CCC1","InChI=1S/C14H21NS/c1-12(2)14(15-10-6-7-11-15)16-13-8-4-3-5-9-13/h3-5,8-9,12,14H,6-7,10-11H2,1-2H3","OQKUTWOEXVFICW-UHFFFAOYSA-N"
"c(c2)ccc(c2)SC(N(C1)CCC1)C(C)(C)C","InChI=1S/C15H23NS/c1-15(2,3)14(16-11-7-8-12-16)17-13-9-5-4-6-10-13/h4-6,9-10,14H,7-8,11-12H2,1-3H3","AZWMRNXAUKMORD-UHFFFAOYSA-N"
"CN(C)C(Sc(c1)cccc1)C(C)(C)C","InChI=1S/C13H21NS/c1-13(2,3)12(14(4)5)15-11-9-7-6-8-10-11/h6-10,12H,1-5H3","KXIPIPMMTWKHNV-UHFFFAOYSA-N"
"CCC(=O)C(C1)C(=O)C([H])(C([H])(C)2)C([H])1C(C)(C)C2","InChI=1S/C14H22O2/c1-5-11(15)9-6-10-12(13(9)16)8(2)7-14(10,3)4/h8-10,12H,5-7H2,1-4H3/t8-,9?,10-,12-/m1/s1","QUYUFRUVBMTHMP-FJJXIOPLSA-N"
"C(C3)COC(C3)OCCCC(O1)C(C2)N(CC2)C(=O)1","InChI=1S/C14H23NO4/c16-14-15-8-3-5-11(15)12(19-14)6-4-10-18-13-7-1-2-9-17-13/h11-13H,1-10H2","IBEQIQSCQAXIDD-UHFFFAOYSA-N"
"c(c4)ccc(c4)COC(=O)N(C3)C([H])(CC3)C([H])(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C24H28N2O4/c27-23(29-17-19-9-3-1-4-10-19)25-15-7-13-21(25)22-14-8-16-26(22)24(28)30-18-20-11-5-2-6-12-20/h1-6,9-12,21-22H,7-8,13-18H2/t21-,22-/m0/s1","PSKCDXYJPNXJRM-VXKWHMMOSA-N"
"c(c4)ccc(c4)COC(=O)N(C3)C([H])(CC3)C([H])(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C24H28N2O4/c27-23(29-17-19-9-3-1-4-10-19)25-15-7-13-21(25)22-14-8-16-26(22)24(28)30-18-20-11-5-2-6-12-20/h1-6,9-12,21-22H,7-8,13-18H2/t21-,22+","PSKCDXYJPNXJRM-SZPZYZBQSA-N"
"c(c3)ccc(c3)COC(=O)N(C2)C([H])(CC2)C(C1)NCC1","InChI=1S/C16H22N2O2/c19-16(20-12-13-6-2-1-3-7-13)18-11-5-9-15(18)14-8-4-10-17-14/h1-3,6-7,14-15,17H,4-5,8-12H2/t14?,15-/m0/s1","OAZZHYPVMWRACG-LOACHALJSA-N"
"[N-1]=[N+1]=NCCCC(=O)C(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C16H20N4O3/c17-19-18-10-4-9-15(21)14-8-5-11-20(14)16(22)23-12-13-6-2-1-3-7-13/h1-3,6-7,14H,4-5,8-12H2","COVIXFYTUPWGNP-UHFFFAOYSA-N"
"OCCCC(=O)C([H])(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C16H21NO4/c18-11-5-9-15(19)14-8-4-10-17(14)16(20)21-12-13-6-2-1-3-7-13/h1-3,6-7,14,18H,4-5,8-12H2/t14-/m0/s1","CFIYJVYPVKPPJX-AWEZNQCLSA-N"
"CCOC(C)OCCCC(=O)C([H])(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C20H29NO5/c1-3-24-16(2)25-14-8-12-19(22)18-11-7-13-21(18)20(23)26-15-17-9-5-4-6-10-17/h4-6,9-10,16,18H,3,7-8,11-15H2,1-2H3/t16?,18-/m0/s1","YWVPRAFNXRNGAE-DAFXYXGESA-N"
"C(C3)COC(C3)OCCCC(=O)C([H])(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C21H29NO5/c23-19(11-7-15-26-20-12-4-5-14-25-20)18-10-6-13-22(18)21(24)27-16-17-8-2-1-3-9-17/h1-3,8-9,18,20H,4-7,10-16H2/t18-,20?/m0/s1","JNNBLRCTGCPIRL-LROBGIAVSA-N"
"CC(C)(C)OC(=O)N(C2)C([H])(CC2)C(C1)OCC1","InChI=1S/C13H23NO3/c1-13(2,3)17-12(15)14-8-4-6-10(14)11-7-5-9-16-11/h10-11H,4-9H2,1-3H3/t10-,11?/m0/s1","SHSMIKWWIDAWEM-VUWPPUDQSA-N"
"OCCCC(=O)C([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C13H23NO4/c1-13(2,3)18-12(17)14-8-4-6-10(14)11(16)7-5-9-15/h10,15H,4-9H2,1-3H3/t10-/m0/s1","QAUHJCXUPAOFHU-JTQLQIEISA-N"
"CCOC(C)OCCCC(=O)C([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C17H31NO5/c1-6-21-13(2)22-12-8-10-15(19)14-9-7-11-18(14)16(20)23-17(3,4)5/h13-14H,6-12H2,1-5H3/t13?,14-/m0/s1","IGHNBAVKLAITMJ-KZUDCZAMSA-N"
"CCOC(C)OCCCC(O)C([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C17H33NO5/c1-6-21-13(2)22-12-8-10-15(19)14-9-7-11-18(14)16(20)23-17(3,4)5/h13-15,19H,6-12H2,1-5H3/t13?,14-,15?/m0/s1","NQCFHFIQLPCLSG-SLTAFYQDSA-N"
"OCC([H])(C1)N(CC1)C(=O)OC(C)(C)C","InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h8,12H,4-7H2,1-3H3/t8-/m0/s1","BFFLLBPMZCIGRM-QMMMGPOBSA-N"
"OCC([H])=C(C)CCC=C(C)C","InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7+","GLZPCOQZEFWAFX-JXMROGBWSA-N"
"OCC([H])=C(C)CCC=C(C)C","InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7-","GLZPCOQZEFWAFX-YFHOEESVSA-N"
"O=CC([H])=C(C)CCC=C(C)C","InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+","WTEVQBCEXWBHNA-JXMROGBWSA-N"
"O=CC([H])=C(C)CCC=C(C)C","InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7-","WTEVQBCEXWBHNA-YFHOEESVSA-N"
"N#CC([H])=C(C)CCC=C(C)C","InChI=1S/C10H15N/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6H2,1-3H3/b10-7+","HLCSDJLATUNSSI-JXMROGBWSA-N"
"N#CC([H])=C(C)CCC=C(C)C","InChI=1S/C10H15N/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6H2,1-3H3/b10-7-","HLCSDJLATUNSSI-YFHOEESVSA-N"
"OCC(NC(C)=O)C(=O)OC","InChI=1S/C6H11NO4/c1-4(9)7-5(3-8)6(10)11-2/h5,8H,3H2,1-2H3,(H,7,9)","ONUNDAQVOOLWTH-UHFFFAOYSA-N"
"O=C(C=1)C(C2)=C(CC2)OC1","InChI=1S/C8H8O2/c9-7-4-5-10-8-3-1-2-6(7)8/h4-5H,1-3H2","HZEXINHQHZFXBU-UHFFFAOYSA-N"
"O=C(C2=1)C(C3)=C(CC3)OC(CCC2)1","InChI=1S/C11H12O2/c12-11-7-3-1-5-9(7)13-10-6-2-4-8(10)11/h1-6H2","SYXQGSUZSKBHAC-UHFFFAOYSA-N"
"C(C4)CC(=C42)C(=O)C(C3)(C1)C(CC3)(O2)1","InChI=1S/C12H14O2/c13-10-8-3-1-4-9(8)14-12-6-2-5-11(10,12)7-12/h1-7H2","APMUNNMORCOGEY-UHFFFAOYSA-N"
"CC(=C([H])2)OC(C)(C1)C(C(=O)2)1","InChI=1S/C8H10O2/c1-5-3-7(9)6-4-8(6,2)10-5/h3,6H,4H2,1-2H3","GZOUQKLFUKOBFC-UHFFFAOYSA-N"
"CC(=C(C)2)OC(C)(C1)C(C)(C(=O)2)1","InChI=1S/C10H14O2/c1-6-7(2)12-10(4)5-9(10,3)8(6)11/h5H2,1-4H3","VCFJZOLLJFVYCM-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=C(C)1)C(=O)C(c(c2)cccc2)=C(C)O1","InChI=1S/C19H16O2/c1-13-17(15-9-5-3-6-10-15)19(20)18(14(2)21-13)16-11-7-4-8-12-16/h3-12H,1-2H3","YCMLUTKKOKKIMN-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=C(C)1)C(=S)C(c(c2)cccc2)=C(C)O1","InChI=1S/C19H16OS/c1-13-17(15-9-5-3-6-10-15)19(21)18(14(2)20-13)16-11-7-4-8-12-16/h3-12H,1-2H3","RJPSKYMOAGEJKT-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(=C(C)2)C(=O)C(c(c3)cccc3)(C1)C(C)(O2)1","InChI=1S/C20H18O2/c1-14-17(15-9-5-3-6-10-15)18(21)20(13-19(20,2)22-14)16-11-7-4-8-12-16/h3-12H,13H2,1-2H3","YVOMXSLUOQIDON-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C(C)=O)c(o2)c(cc(C)2)c(c1)cccc1","InChI=1S/C20H18O2/c1-14-13-18(16-9-5-3-6-10-16)20(22-14)19(15(2)21)17-11-7-4-8-12-17/h3-13,19H,1-2H3","PYTUHOXYDQJXEZ-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(=O)C(c(c3)cccc3)c(o2)c(cc(C)2)c(c1)cccc1","InChI=1S/C20H18O2/c1-14-13-18(16-9-5-3-6-10-16)20(22-14)19(15(2)21)17-11-7-4-8-12-17/h3-13,19H,1-2H3/i2D3","PYTUHOXYDQJXEZ-BMSJAHLVSA-N"
"CC(=O)CC(c(c2)cccc2)C(=O)C(C(C)=O)c(c1)cccc1","InChI=1S/C20H20O3/c1-14(21)13-18(16-9-5-3-6-10-16)20(23)19(15(2)22)17-11-7-4-8-12-17/h3-12,18-19H,13H2,1-2H3","XODLHHIXDHKQQO-UHFFFAOYSA-N"
"CC(=O)CC(c(c2)cccc2)C(=O)C(C(=O)C([2H])([2H])[2H])c(c1)cccc1","InChI=1S/C20H20O3/c1-14(21)13-18(16-9-5-3-6-10-16)20(23)19(15(2)22)17-11-7-4-8-12-17/h3-12,18-19H,13H2,1-2H3/i2D3","XODLHHIXDHKQQO-BMSJAHLVSA-N"
"CC(=O)CCC(=O)CC(C)=O","InChI=1S/C8H12O3/c1-6(9)3-4-8(11)5-7(2)10/h3-5H2,1-2H3","AIVJKJUUXMUBEG-UHFFFAOYSA-N"
"O=C(c32)C(C1)C(Oc(cccc3)2)1","InChI=1S/C10H8O2/c11-10-6-3-1-2-4-8(6)12-9-5-7(9)10/h1-4,7,9H,5H2","DQYKWUOLGDGKNU-UHFFFAOYSA-N"
"O=C(c32)C(C(Oc(cccc3)2)1)C([2H])([2H])1","InChI=1S/C10H8O2/c11-10-6-3-1-2-4-8(6)12-9-5-7(9)10/h1-4,7,9H,5H2/i5D2","DQYKWUOLGDGKNU-BFWBPSQCSA-N"
"OC(C3)CC(CC3)(C1)Sc(c2)c(ccc2)1","InChI=1S/C13H16OS/c14-11-5-3-7-13(9-11)8-10-4-1-2-6-12(10)15-13/h1-2,4,6,11,14H,3,5,7-9H2","RRJHOAVXFJNTTO-UHFFFAOYSA-N"
"CC(S1)=C(C)C(=O)c(c2)c(ccc2)1","InChI=1S/C11H10OS/c1-7-8(2)13-10-6-4-3-5-9(10)11(7)12/h3-6H,1-2H3","MBMJRWSFDYUTRL-UHFFFAOYSA-N"
"c(c3)cc(S1)c(c3)C(=O)C(C)(C2)C(C)12","InChI=1S/C12H12OS/c1-11-7-12(11,2)14-9-6-4-3-5-8(9)10(11)13/h3-6H,7H2,1-2H3","JNRKQNZIYOQNJR-UHFFFAOYSA-N"
"CC(=C1)Sc(c2)c(ccc2)C(=O)1","InChI=1S/C10H8OS/c1-7-6-9(11)8-4-2-3-5-10(8)12-7/h2-6H,1H3","MGMTVGPDPYFNAU-UHFFFAOYSA-N"
"CC(=C1)Sc(c2)c(ccc2)C(=S)1","InChI=1S/C10H8S2/c1-7-6-9(11)8-4-2-3-5-10(8)12-7/h2-6H,1H3","OPFHNXXKRKLZGV-UHFFFAOYSA-N"
"c(c4)cc(S1)c(c4)C(=O)C(C3)(C2)C(CC3)12","InChI=1S/C13H12OS/c14-11-9-4-1-2-5-10(9)15-13-7-3-6-12(11,13)8-13/h1-2,4-5H,3,6-8H2","RMHQTQMPLJWNQF-UHFFFAOYSA-N"
"CC(S1)=C(C)C(=S)c(c2)c(ccc2)1","InChI=1S/C11H10S2/c1-7-8(2)13-10-6-4-3-5-9(10)11(7)12/h3-6H,1-2H3","FRIYENJAXQGJMB-UHFFFAOYSA-N"
"c(c3)cc(c(c3)2)C(=C)C(C)(C1)C(C)(S2)1","InChI=1S/C13H14S/c1-9-10-6-4-5-7-11(10)14-13(3)8-12(9,13)2/h4-7H,1,8H2,2-3H3","XSUQCGXKUHOAEX-UHFFFAOYSA-N"
"O=C(c32)C(C)(C1)C(Oc(cccc3)2)1","InChI=1S/C11H10O2/c1-11-6-9(11)13-8-5-3-2-4-7(8)10(11)12/h2-5,9H,6H2,1H3","WYYFVKUBHSHHHS-UHFFFAOYSA-N"
"c(c3)cc(O1)c(c3)C(=O)C(C)(C2)C(C)12","InChI=1S/C12H12O2/c1-11-7-12(11,2)14-9-6-4-3-5-8(9)10(11)13/h3-6H,7H2,1-2H3","IKUPBRUXXGSVLP-UHFFFAOYSA-N"
"CC(O1)=C(C)C(=O)c(c2)c(ccc2)1","InChI=1S/C11H10O2/c1-7-8(2)13-10-6-4-3-5-9(10)11(7)12/h3-6H,1-2H3","KQLDYIIDXBUUCK-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(O1)=C(C)C(=O)c(c2)c(ccc2)1","InChI=1S/C11H10O2/c1-7-8(2)13-10-6-4-3-5-9(10)11(7)12/h3-6H,1-2H3/i2D3","KQLDYIIDXBUUCK-BMSJAHLVSA-N"
"c(c3)cc(O1)c(c3)C(=C)C(C)(C2)C12","InChI=1S/C12H12O/c1-8-9-5-3-4-6-10(9)13-11-7-12(8,11)2/h3-6,11H,1,7H2,2H3","UFRUXWQYRJYVNJ-UHFFFAOYSA-N"
"c(c3)cc(O1)c(c3)C(=C)C(C)(C2)C(C)12","InChI=1S/C13H14O/c1-9-10-6-4-5-7-11(10)14-13(3)8-12(9,13)2/h4-7H,1,8H2,2-3H3","SBDZNYORKBFULW-UHFFFAOYSA-N"
"O=C(N1)NC(=O)C(F)=C1","InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)","GHASVSINZRGABV-UHFFFAOYSA-N"
"O=C(N2)C(F)=C([H])N(C(=O)2)C(C1)OCC1","InChI=1S/C8H9FN2O3/c9-5-4-11(6-2-1-3-14-6)8(13)10-7(5)12/h4,6H,1-3H2,(H,10,12,13)","WFWLQNSHRPWKFK-UHFFFAOYSA-N"
"FC(=C2)C(=O)N(C(=O)N2)C(C1)OCC1","InChI=1S/C8H9FN2O3/c9-5-4-10-8(13)11(7(5)12)6-2-1-3-14-6/h4,6H,1-3H2,(H,10,13)","MGYWDJWGVICAEL-UHFFFAOYSA-N"
"FC(=C([H])1)C(=O)N(C(C3)OCC3)C(=O)N(C(C2)OCC2)1","InChI=1S/C12H15FN2O4/c13-8-7-14(9-3-1-5-18-9)12(17)15(11(8)16)10-4-2-6-19-10/h7,9-10H,1-6H2","FLMBDTNCANYTCP-UHFFFAOYSA-N"
"FC(=C1)C(=O)N(C)C(=O)N1C(C2)OCC2","InChI=1S/C9H11FN2O3/c1-11-8(13)6(10)5-12(9(11)14)7-3-2-4-15-7/h5,7H,2-4H2,1H3","CISSBGZOKGGEAQ-UHFFFAOYSA-N"
"[H]C(N(C)1)=C(F)C(=O)N(C(C2)OCC2)C(=O)1","InChI=1S/C9H11FN2O3/c1-11-5-6(10)8(13)12(9(11)14)7-3-2-4-15-7/h5,7H,2-4H2,1H3","OZIDQEJYZCIMCL-UHFFFAOYSA-N"
"[H]C(N(C)1)=C(F)C(=O)NC(=O)1","InChI=1S/C5H5FN2O2/c1-8-2-3(6)4(9)7-5(8)10/h2H,1H3,(H,7,9,10)","PPCVYQHUOMISIG-UHFFFAOYSA-N"
"O=C(N1)N(C)C(=O)C(F)=C1","InChI=1S/C5H5FN2O2/c1-8-4(9)3(6)2-7-5(8)10/h2H,1H3,(H,7,10)","BGXNFCXYRIAWDO-UHFFFAOYSA-N"
"O=C(N2)C(F)=C([H])N(C(=O)2)C(C1)OCCC1","InChI=1S/C9H11FN2O3/c10-6-5-12(9(14)11-8(6)13)7-3-1-2-4-15-7/h5,7H,1-4H2,(H,11,13,14)","BWGAYTZCYLWDSC-UHFFFAOYSA-N"
"FC(=C2)C(=O)N(C(=O)N2)C(C1)OCCC1","InChI=1S/C9H11FN2O3/c10-6-5-11-9(14)12(8(6)13)7-3-1-2-4-15-7/h5,7H,1-4H2,(H,11,14)","LIVRXWIFPFKXFO-UHFFFAOYSA-N"
"O=C(N2)C(F)=C([H])N(C(=O)2)C(=O)c(c1)cccc1","InChI=1S/C11H7FN2O3/c12-8-6-14(11(17)13-9(8)15)10(16)7-4-2-1-3-5-7/h1-6H,(H,13,15,17)","RQNLYAYTZCUHLO-UHFFFAOYSA-N"
"FC(=C2)C(=O)N(C(=O)N2)C(=O)c(c1)cccc1","InChI=1S/C11H7FN2O3/c12-8-6-13-11(17)14(10(8)16)9(15)7-4-2-1-3-5-7/h1-6H,(H,13,17)","OAPBZIITNDJWQW-UHFFFAOYSA-N"
"CCCCN(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C8H11FN2O2/c1-2-3-4-11-5-6(9)7(12)10-8(11)13/h5H,2-4H2,1H3,(H,10,12,13)","RCHKDVLSPJBSLU-UHFFFAOYSA-N"
"O=C(N1)C(F)=CN(CC(C2)OCC2)C(=O)1","InChI=1S/C9H11FN2O3/c10-7-5-12(9(14)11-8(7)13)4-6-2-1-3-15-6/h5-6H,1-4H2,(H,11,13,14)","NEPYLBSUVIVISN-UHFFFAOYSA-N"
"O=C(N1)C(F)=CN(COc(c2)cccc2)C(=O)1","InChI=1S/C11H9FN2O3/c12-9-6-14(11(16)13-10(9)15)7-17-8-4-2-1-3-5-8/h1-6H,7H2,(H,13,15,16)","QSWJBPPMMVWPBT-UHFFFAOYSA-N"
"O=C(N1)C(F)=C([H])N(Cc(c2)cccc2)C(=O)1","InChI=1S/C11H9FN2O2/c12-9-7-14(11(16)13-10(9)15)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,13,15,16)","DOLBESUBPIZBQY-UHFFFAOYSA-N"
"CCOC(C)N(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C8H11FN2O3/c1-3-14-5(2)11-4-6(9)7(12)10-8(11)13/h4-5H,3H2,1-2H3,(H,10,12,13)","HFFIZXGUEMOUQH-UHFFFAOYSA-N"
"CCCCNC(=O)N(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C9H12FN3O3/c1-2-3-4-11-8(15)13-5-6(10)7(14)12-9(13)16/h5H,2-4H2,1H3,(H,11,15)(H,12,14,16)","PVSNDBKXSKXPHM-UHFFFAOYSA-N"
"CCCCC(=O)N(C=1)C(=O)NC(=O)C(F)1","InChI=1S/C9H11FN2O3/c1-2-3-4-7(13)12-5-6(10)8(14)11-9(12)15/h5H,2-4H2,1H3,(H,11,14,15)","LKNGKKCXYHTGDO-UHFFFAOYSA-N"
"CC(C)COC(=O)N(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C9H11FN2O4/c1-5(2)4-16-9(15)12-3-6(10)7(13)11-8(12)14/h3,5H,4H2,1-2H3,(H,11,13,14)","DXDPKLIQOAVOAM-UHFFFAOYSA-N"
"COC(=O)CN(C(=O)1)C(=O)C(F)=CN1","InChI=1S/C7H7FN2O4/c1-14-5(11)3-10-6(12)4(8)2-9-7(10)13/h2H,3H2,1H3,(H,9,13)","FAFLWPCJUOMVBL-UHFFFAOYSA-N"
"CCCC(=O)NN(C(=O)1)C(=O)C(F)=CN1","InChI=1S/C8H10FN3O3/c1-2-3-6(13)11-12-7(14)5(9)4-10-8(12)15/h4H,2-3H2,1H3,(H,10,15)(H,11,13)","SAVBTPSHCMNKFU-UHFFFAOYSA-N"
"COC(=O)CN(C(=O)2)C(=O)N(C=C(F)2)C(C1)OCC1","InChI=1S/C11H13FN2O5/c1-18-9(15)6-14-10(16)7(12)5-13(11(14)17)8-3-2-4-19-8/h5,8H,2-4,6H2,1H3","NXVWCKFQVSEOHE-UHFFFAOYSA-N"
"[H]C(=C(F)1)N(C(=O)NC(=O)1)S(C)(=O)=O","InChI=1S/C5H5FN2O4S/c1-13(11,12)8-2-3(6)4(9)7-5(8)10/h2H,1H3,(H,7,9,10)","BLMFZILCTKKUMH-UHFFFAOYSA-N"
"CCCCS(=O)(=O)N(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C8H11FN2O4S/c1-2-3-4-16(14,15)11-5-6(9)7(12)10-8(11)13/h5H,2-4H2,1H3,(H,10,12,13)","IEMSBQFXHABBDB-UHFFFAOYSA-N"
"O=C(N2)C(F)=C([H])N(C(=O)2)S(=O)(=O)c(c1)cccc1","InChI=1S/C10H7FN2O4S/c11-8-6-13(10(15)12-9(8)14)18(16,17)7-4-2-1-3-5-7/h1-6H,(H,12,14,15)","ZZDRJVSCQGYTCG-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)S(=O)(=O)N(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C11H9FN2O4S/c1-7-2-4-8(5-3-7)19(17,18)14-6-9(12)10(15)13-11(14)16/h2-6H,1H3,(H,13,15,16)","PIZNOQYLTZXNRN-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)S(=O)(=O)NN(C(=O)1)C(=O)C(F)=CN1","InChI=1S/C11H10FN3O4S/c1-7-2-4-8(5-3-7)20(18,19)14-15-10(16)9(12)6-13-11(15)17/h2-6,14H,1H3,(H,13,17)","GKHMDORIVFCELX-UHFFFAOYSA-N"
"[H]C(=C([H])2)CC(O2)N(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C8H7FN2O3/c9-5-4-11(6-2-1-3-14-6)8(13)10-7(5)12/h1,3-4,6H,2H2,(H,10,12,13)","PDLPZZHYCMXDCF-UHFFFAOYSA-N"
"[H]C(C2)=C([H])C(O2)N(C(=O)1)C([H])=C(F)C(=O)N1","InChI=1S/C8H7FN2O3/c9-5-4-11(6-2-1-3-14-6)8(13)10-7(5)12/h1-2,4,6H,3H2,(H,10,12,13)","ULBMICPCMSSWMR-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C1N(C=2)C(=O)NC(=O)C(F)2","InChI=1S/C9H11FN2O6/c10-3-1-12(9(17)11-7(3)16)8-6(15)5(14)4(2-13)18-8/h1,4-6,8,13-15H,2H2,(H,11,16,17)","FHIDNBAQOFJWCA-UHFFFAOYSA-N"
"OCC([H])(O1)C([H])(O)CC([H])1N(C(=O)2)C([H])=C(F)C(=O)N2","InChI=1S/C9H11FN2O5/c10-4-2-12(9(16)11-8(4)15)7-1-5(14)6(3-13)17-7/h2,5-7,13-14H,1,3H2,(H,11,15,16)/t5-,6+,7+/m0/s1","ODKNJVUHOIMIIZ-RRKCRQDMSA-N"
"[H]C(=C([H])2)CC(O2)N(C([H])=1)C(=O)N(C)C(=O)C(F)1","InChI=1S/C9H9FN2O3/c1-11-8(13)6(10)5-12(9(11)14)7-3-2-4-15-7/h2,4-5,7H,3H2,1H3","OZEJWEWEYIPWIO-UHFFFAOYSA-N"
"CC(=O)c(c1)c(N)ccc1","InChI=1S/C8H9NO/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,9H2,1H3","GTDQGKWDWVUKTI-UHFFFAOYSA-N"
"CC(=O)c(c1)ccc(N)c1","InChI=1S/C8H9NO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,9H2,1H3","GPRYKVSEZCQIHD-UHFFFAOYSA-N"
"C(CCCCCC(=O)OCC(COC(=O)CCCCCCCCC)OC(CCCCCCCCC)=O)CCC","InChI=1S/C33H62O6/c1-4-7-10-13-16-19-22-25-31(34)37-28-30(39-33(36)27-24-21-18-15-12-9-6-3)29-38-32(35)26-23-20-17-14-11-8-5-2/h30H,4-29H2,1-3H3","LADGBHLMCUINGV-UHFFFAOYSA-N"
"C(CCCCCCC)CCCC(=O)OCC(OC(CCCCCCCCCCC)=O)COC(=O)CCCCCCCCCCC","InChI=1S/C39H74O6/c1-4-7-10-13-16-19-22-25-28-31-37(40)43-34-36(45-39(42)33-30-27-24-21-18-15-12-9-6-3)35-44-38(41)32-29-26-23-20-17-14-11-8-5-2/h36H,4-35H2,1-3H3","VMPHSYLJUKZBJJ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(OCC(COC(CCCCCCCCCCCCC)=O)OC(=O)CCCCCCCCCCCCC)=O","InChI=1S/C45H86O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-43(46)49-40-42(51-45(48)39-36-33-30-27-24-21-18-15-12-9-6-3)41-50-44(47)38-35-32-29-26-23-20-17-14-11-8-5-2/h42H,4-41H2,1-3H3","DUXYWXYOBMKGIN-UHFFFAOYSA-N"
"C=CCOC(=O)c(c1)c(O)ccc1","InChI=1S/C10H10O3/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h2-6,11H,1,7H2","YYKBLDCLPBWOOE-UHFFFAOYSA-N"
"C=CCOC(=O)c(c1)c(N)ccc1","InChI=1S/C10H11NO2/c1-2-7-13-10(12)8-5-3-4-6-9(8)11/h2-6H,1,7,11H2","UCANFCXAKYMFGA-UHFFFAOYSA-N"
"CC(=O)CCC(C)=O","InChI=1S/C6H10O2/c1-5(7)3-4-6(2)8/h3-4H2,1-2H3","OJVAMHKKJGICOG-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C1)OC(C)(C)O1","InChI=1S/C11H14O2/c1-11(2)12-8-10(13-11)9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3","SFDXYHMRHIVYET-UHFFFAOYSA-N"
"N#Cc(c1)cncc1","InChI=1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H","GZPHSAQLYPIAIN-UHFFFAOYSA-N"
"CCCCCC(C(=O)1)C(CC(C)=O)CC1","InChI=1S/C13H22O2/c1-3-4-5-6-12-11(9-10(2)14)7-8-13(12)15/h11-12H,3-9H2,1-2H3","PMVDYAQAPLAXSY-UHFFFAOYSA-N"
"CC(C)CCOC(=O)C=Cc(c1)cccc1","InChI=1S/C14H18O2/c1-12(2)10-11-16-14(15)9-8-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3/b9-8+","JFHCDEYLWGVZMX-CMDGGOBGSA-N"
"CCC(=O)C(=O)CC","InChI=1S/C6H10O2/c1-3-5(7)6(8)4-2/h3-4H2,1-2H3","KVFQMAZOBTXCAZ-UHFFFAOYSA-N"
"OCc(c1)ccc(C(C)C)c1","InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3-6,8,11H,7H2,1-2H3","OIGWAXDAPKFNCQ-UHFFFAOYSA-N"
"CCCCCOC(=O)c(c1)c(O)ccc1","InChI=1S/C12H16O3/c1-2-3-6-9-15-12(14)10-7-4-5-8-11(10)13/h4-5,7-8,13H,2-3,6,9H2,1H3","RANVDUNFZBMTBK-UHFFFAOYSA-N"
"C=CC(C)(C1)CC(=O)O1","InChI=1S/C7H10O2/c1-3-7(2)4-6(8)9-5-7/h3H,1,4-5H2,2H3","SNUQLXSRLZRCOJ-UHFFFAOYSA-N"
"CC(C)C(C(O)=O)NC(=O)OCc(c1)cccc1","InChI=1S/C13H17NO4/c1-9(2)11(12(15)16)14-13(17)18-8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3,(H,14,17)(H,15,16)/t11-/m0/s1","CANZBRDGRHNSGZ-NSHDSACASA-N"
"O=C(C2)C(CCC2)c(c1)cccc1","InChI=1S/C12H14O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2","DRLVMOAWNVOSPE-UHFFFAOYSA-N"
"OC(=O)c(c1)c(O)cc(c2)c(ccc2)1","InChI=1S/C11H8O3/c12-10-6-8-4-2-1-3-7(8)5-9(10)11(13)14/h1-6,12H,(H,13,14)","ALKYHXVLJMQRLQ-UHFFFAOYSA-N"
"Cc(c1)nc(c2)c(cc(C)c(N)2)c(C)1","InChI=1S/C12H14N2/c1-7-4-9(3)14-12-6-11(13)8(2)5-10(7)12/h4-6H,13H2,1-3H3","HAADFRCWPFJSDV-UHFFFAOYSA-N"
"OCCCc(c1)cccc1","InChI=1S/C9H12O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2","VAJVDSVGBWFCLW-UHFFFAOYSA-N"
"CNc(c1)c(ccc1)C(=O)OC(C)C","InChI=1S/C11H15NO2/c1-8(2)14-11(13)9-6-4-5-7-10(9)12-3/h4-8,12H,1-3H3","OBKVPPPSOAFJDS-UHFFFAOYSA-N"
"CC(=O)c(c2)c(C1)c(cc(C(C)(C)C)2)C(C)(C)C1","InChI=1S/C17H24O/c1-11(18)14-9-12(16(2,3)4)10-15-13(14)7-8-17(15,5)6/h9-10H,7-8H2,1-6H3","IKTHMQYJOWTSJO-UHFFFAOYSA-N"
"C=CCOC(=O)COc(c1)cccc1","InChI=1S/C11H12O3/c1-2-8-13-11(12)9-14-10-6-4-3-5-7-10/h2-7H,1,8-9H2","VUFZVGQUAVDKMC-UHFFFAOYSA-N"
"CCCCCC(=C1)OC(=O)C=C1","InChI=1S/C10H14O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h5,7-8H,2-4,6H2,1H3","MAUFTTLGOUBZNA-UHFFFAOYSA-N"
"COC(=O)C(O)c(c1)cccc1","InChI=1S/C9H10O3/c1-12-9(11)8(10)7-5-3-2-4-6-7/h2-6,8,10H,1H3","ITATYELQCJRCCK-UHFFFAOYSA-N"
"CCCCCC(=O)OCC(COC(=O)CCCCC)OC(=O)CCCCC","InChI=1S/C21H38O6/c1-4-7-10-13-19(22)25-16-18(27-21(24)15-12-9-6-3)17-26-20(23)14-11-8-5-2/h18H,4-17H2,1-3H3","MAYCICSNZYXLHB-UHFFFAOYSA-N"
"CCCC(O)CC","InChI=1S/C6H14O/c1-3-5-6(7)4-2/h6-7H,3-5H2,1-2H3","ZOCHHNOQQHDWHG-UHFFFAOYSA-N"
"CCC(O)C(C)C","InChI=1S/C6H14O/c1-4-6(7)5(2)3/h5-7H,4H2,1-3H3","ISTJMQSHILQAEC-UHFFFAOYSA-N"
"CCC(C)(O)CC","InChI=1S/C6H14O/c1-4-6(3,7)5-2/h7H,4-5H2,1-3H3","FRDAATYAJDYRNW-UHFFFAOYSA-N"
"CCC(CC)CO","InChI=1S/C6H14O/c1-3-6(4-2)5-7/h6-7H,3-5H2,1-2H3","TZYRSLHNPKPEFV-UHFFFAOYSA-N"
"CC(O)C(C)(C)C","InChI=1S/C6H14O/c1-5(7)6(2,3)4/h5,7H,1-4H3","DFOXKPDFWGNLJU-UHFFFAOYSA-N"
"CCCCCC(C)O","InChI=1S/C7H16O/c1-3-4-5-6-7(2)8/h7-8H,3-6H2,1-2H3","CETWDUZRCINIHU-UHFFFAOYSA-N"
"CCCC(C)(C)CO","InChI=1S/C7H16O/c1-4-5-7(2,3)6-8/h8H,4-6H2,1-3H3","QTOMCRXZFDHJOL-UHFFFAOYSA-N"
"ClCc(c(C)1)c(c2)c(ccc2)cc1","InChI=1S/C12H11Cl/c1-9-6-7-10-4-2-3-5-11(10)12(9)8-13/h2-7H,8H2,1H3","STBYRSZXHDPASK-UHFFFAOYSA-N"
"CCn(c(=O)1)c(=O)cc1","InChI=1S/C6H7NO2/c1-2-7-5(8)3-4-6(7)9/h3-4H,2H2,1H3","HDFGOPSGAURCEO-UHFFFAOYSA-N"
"Oc(c1)cc(cc1C(C)(C)C)C(C)(C)C","InChI=1S/C14H22O/c1-13(2,3)10-7-11(14(4,5)6)9-12(15)8-10/h7-9,15H,1-6H3","ZDWSNKPLZUXBPE-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C9H9NO4/c1-2-14-9(11)7-3-5-8(6-4-7)10(12)13/h3-6H,2H2,1H3","PHWSCBWNPZDYRI-UHFFFAOYSA-N"
"N#CC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C14H11N/c15-11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H","NEBPTMCRLHKPOB-UHFFFAOYSA-N"
"CCOC(=O)Cc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C10H11NO4/c1-2-15-10(12)7-8-3-5-9(6-4-8)11(13)14/h3-6H,2,7H2,1H3","DWDRNKYLWMKWTH-UHFFFAOYSA-N"
"CN(C)c(c1)ccnc1","InChI=1S/C7H10N2/c1-9(2)7-3-5-8-6-4-7/h3-6H,1-2H3","VHYFNPMBLIVWCW-UHFFFAOYSA-N"
"c(c2)ccc(c2)Nc(c1)cccc1","InChI=1S/C12H11N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10,13H","DMBHHRLKUKUOEG-UHFFFAOYSA-N"
"CN(C)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C8H10N2O2/c1-9(2)7-3-5-8(6-4-7)10(11)12/h3-6H,1-2H3","QJAIOCKFIORVFU-UHFFFAOYSA-N"
"[O-1][n+1](c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C5H4N2O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4H","RXKNNAKAVAHBNK-UHFFFAOYSA-N"
"ON=c(c1)ccc(=NO)c1","InChI=1S/C6H6N2O2/c9-7-5-1-2-6(8-10)4-3-5/h1-4,9-10H/b7-5-,8-6-","LNHURPJLTHSVMU-SFECMWDFSA-N"
"OC(=O)c(c1)cc(C(O)=O)cc(C(O)=O)1","InChI=1S/C9H6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H,(H,10,11)(H,12,13)(H,14,15)","QMKYBPDZANOJGF-UHFFFAOYSA-N"
"OCc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C7H7NO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,9H,5H2","CWNPOQFCIIFQDM-UHFFFAOYSA-N"
"Oc(c1)c(n2)c(ccc2)cc1","InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H","MCJGNVYPOGVAJF-UHFFFAOYSA-N"
"NC(=O)c(c1)cncc1","InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)","DFPAKSUCGFBDDF-UHFFFAOYSA-N"
"CN(C)C(=O)c(c1)cncc1","InChI=1S/C8H10N2O/c1-10(2)8(11)7-4-3-5-9-6-7/h3-6H,1-2H3","FJEVKYZLIRAAKE-UHFFFAOYSA-N"
"OC(=O)c(c1)cncc1","InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)","PVNIIMVLHYAWGP-UHFFFAOYSA-N"
"OCCN(CCO)CCO","InChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2","GSEJCLTVZPLZKY-UHFFFAOYSA-N"
"C1CCC(CC1)NO.Cl","InChI=1S/C6H13NO.ClH/c8-7-6-4-2-1-3-5-6;/h6-8H,1-5H2;1H","SSVAHXZUFFSFER-UHFFFAOYSA-N"
"OC(C1)CC(C)(C)NC(C)(C)1","InChI=1S/C9H19NO/c1-8(2)5-7(11)6-9(3,4)10-8/h7,10-11H,5-6H2,1-4H3","VDVUCLWJZJHFAV-UHFFFAOYSA-N"
"Cc(c(C)1)c(N)c(C)c(C)c(N)1","InChI=1S/C10H16N2/c1-5-6(2)10(12)8(4)7(3)9(5)11/h11-12H2,1-4H3","WCZNKVPCIFMXEQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)NN=Nc(c1)cccc1","InChI=1S/C12H11N3/c1-3-7-11(8-4-1)13-15-14-12-9-5-2-6-10-12/h1-10H,(H,13,14)","ALIFPGGMJDWMJH-UHFFFAOYSA-N"
"O=C(Cc(c2)cccc2)c(c1)cccc1","InChI=1S/C14H12O/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10H,11H2","OTKCEEWUXHVZQI-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(c2)c(ccc2)[n+1]([O-1])c1","InChI=1S/C9H6N2O3/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6H","YHQDZJICGQWFHK-UHFFFAOYSA-N"
"Oc(c2)c(ccc2)C(=O)OCc(c1)cccc1","InChI=1S/C14H12O3/c15-13-9-5-4-8-12(13)14(16)17-10-11-6-2-1-3-7-11/h1-9,15H,10H2","ZCTQGTTXIYCGGC-UHFFFAOYSA-N"
"O=C(C4)C=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-16H,3-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1","AEMFNILZOJDQLW-QAGGRKNESA-N"
"CC(=O)c(c1)c(O)ccc1","InChI=1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3","JECYUBVRTQDVAT-UHFFFAOYSA-N"
"CC(=O)c(c1)cc(O)cc1","InChI=1S/C8H8O2/c1-6(9)7-3-2-4-8(10)5-7/h2-5,10H,1H3","LUJMEECXHPYQOF-UHFFFAOYSA-N"
"CC(=O)c(c1)ccc(O)c1","InChI=1S/C8H8O2/c1-6(9)7-2-4-8(10)5-3-7/h2-5,10H,1H3","TXFPEBPIARQUIG-UHFFFAOYSA-N"
"CSSC","InChI=1S/C2H6S2/c1-3-4-2/h1-2H3","WQOXQRCZOLPYPM-UHFFFAOYSA-N"
"[O-1][n+1](c1)cccc1","InChI=1S/C5H5NO/c7-6-4-2-1-3-5-6/h1-5H","ILVXOBCQQYKLDS-UHFFFAOYSA-N"
"OCC(=O)C(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C2)C(=CC(=O)C2)C1","InChI=1S/C21H30O3/c1-20-9-7-14(23)11-13(20)3-4-15-16-5-6-18(19(24)12-22)21(16,2)10-8-17(15)20/h11,15-18,22H,3-10,12H2,1-2H3/t15-,16-,17-,18+,20-,21-/m0/s1","ZESRJSPZRDMNHY-YFWFAHHUSA-N"
"COc(c1)cc[n+1]([O-1])c1","InChI=1S/C6H7NO2/c1-9-6-2-4-7(8)5-3-6/h2-5H,1H3","BOFAIBPJCWFJFT-UHFFFAOYSA-N"
"CN(C)c(c1)cc[n+1]([O-1])c1","InChI=1S/C7H10N2O/c1-8(2)7-3-5-9(10)6-4-7/h3-6H,1-2H3","WZMNQOYCHMGCSS-UHFFFAOYSA-N"
"[H]C(C1)=C(C)C([H])(C2)C(C)(C)C([H])12","InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9-/m1/s1","GRWFGVWFFZKLTI-RKDXNWHRSA-N"
"C=C(C2)C([H])(C1)C(C)(C)C([H])(C2)1","InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3/t8-,9-/m0/s1","WTARULDDTDQWMU-IUCAKERBSA-N"
"O=C(C4)C([H])=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)(C(C)=O)C1","InChI=1S/C21H30O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h12,16-18,24H,4-11H2,1-3H3/t16-,17+,18+,19+,20+,21+/m1/s1","DBPWSSGDRRHUNT-CEGNMAFCSA-N"
"O=Cc(c1)ccc(c1)N(C)C","InChI=1S/C9H11NO/c1-10(2)9-5-3-8(7-11)4-6-9/h3-7H,1-2H3","BGNGWHSBYQYVRX-UHFFFAOYSA-N"
"O=Cc(c1)c(OC)c(OC)cc1","InChI=1S/C9H10O3/c1-11-8-5-3-4-7(6-10)9(8)12-2/h3-6H,1-2H3","JIVGSHFYXPRRSZ-UHFFFAOYSA-N"
"O=c(c(Cl)1)c(c2)c(ccc2)c(=O)c(Cl)1","InChI=1S/C10H4Cl2O2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H","SVPKNMBRVBMTLB-UHFFFAOYSA-N"
"Nc(c1)ccc(c1)S(O)(=O)=O","InChI=1S/C6H7NO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H,8,9,10)","HVBSAKJJOYLTQU-UHFFFAOYSA-N"
"O=C(CNC(=O)c(c2)cccc2)NC([H])(C(O)=O)Cc(c1)cccc1","InChI=1S/C18H18N2O4/c21-16(12-19-17(22)14-9-5-2-6-10-14)20-15(18(23)24)11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H,19,22)(H,20,21)(H,23,24)/t15-/m1/s1","CCLJGZGVIQBNDH-OAHLLOKOSA-N"
"Oc(n1)nc(O)nc(O)1","InChI=1S/C3H3N3O3/c7-1-4-2(8)6-3(9)5-1/h(H3,4,5,6,7,8,9)","ZFSLODLOARCGLH-UHFFFAOYSA-N"
"NCC(O1)=CC(=O)N1","InChI=1S/C4H6N2O2/c5-2-3-1-4(7)6-8-3/h1H,2,5H2,(H,6,7)","ZJQHPWUVQPJPQT-UHFFFAOYSA-N"
"CCOc(c1)cc(O2)c(C=CC(=O)2)c1","InChI=1S/C11H10O3/c1-2-13-9-5-3-8-4-6-11(12)14-10(8)7-9/h3-7H,2H2,1H3","LIFAQMGORKPVDH-UHFFFAOYSA-N"
"Oc(c3)c(O)c(O1)c(c3)C(=O)CC(c(c2)cccc2)1","InChI=1S/C15H12O4/c16-11-7-6-10-12(17)8-13(19-15(10)14(11)18)9-4-2-1-3-5-9/h1-7,13,16,18H,8H2","OXEDXEXEXGPMOG-UHFFFAOYSA-N"
"CC(C)CC([H])(N)C(O)=O","InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1","ROHFNLRQFUQHCH-YFKPBYRVSA-N"
"CCOC(OCC)(OCC)c(c1)cccc1","InChI=1S/C13H20O3/c1-4-14-13(15-5-2,16-6-3)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3","BQFPCTXLBRVFJL-UHFFFAOYSA-N"
"C1=CN=CN1","InChI=1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)","RAXXELZNTBOGNW-UHFFFAOYSA-N"
"C(C1)C([H])(O)CC(=C([H])4)C1(C([H])(C3([H])C4)CCC(C)(C23[H])C(CC2)([H])C(CCC([H])(C)C(C)C)([H])C)C","InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19-,20-,22+,23+,24-,25+,26+,27?,28?/m1/s1","SGNBVLSWZMBQTH-SSKRYHHQSA-N"
"","InChI=1S/C31H52O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h11,20-21,23,25-29H,8-10,12-19H2,1-7H3/t21-,23-,25+,26+,27-,28+,29+,30+,31-/m1/s1","PBWOIPCULUXTNY-LBKBYZTLSA-N"
"","InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1","KZJWDPNRJALLNS-VJSFXXLFSA-N"
"CCCCCCCCCCCCC","InChI=1S/C13H28/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3-13H2,1-2H3","IIYFAKIEWZDVMP-UHFFFAOYSA-N"
"CCCCCCCCCCCC","InChI=1S/C12H26/c1-3-5-7-9-11-12-10-8-6-4-2/h3-12H2,1-2H3","SNRUBQQJIBEYMU-UHFFFAOYSA-N"
"CCCC(C1)C(O)CCC1","InChI=1S/C9H18O/c1-2-5-8-6-3-4-7-9(8)10/h8-10H,2-7H2,1H3","VZBNUCDUQJCIDP-UHFFFAOYSA-N"
"CCCCCCCCCCC","InChI=1S/C11H24/c1-3-5-7-9-11-10-8-6-4-2/h3-11H2,1-2H3","RSJKGSCJYJTIGS-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C17H19ClN2S/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20/h3-4,6-9,12H,5,10-11H2,1-2H3","ZPEIMTDSQAKGNT-UHFFFAOYSA-N"
"CN(C)C(C)CN(c21)c(n3)c(ccc3)Sc(cccc2)1","InChI=1S/C16H19N3S/c1-12(18(2)3)11-19-13-7-4-5-8-14(13)20-15-9-6-10-17-16(15)19/h4-10,12H,11H2,1-3H3","OQJBSDFFQWMKBQ-UHFFFAOYSA-N"
"CN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc3)Sc(cccc2)1","InChI=1S/C20H25N3S/c1-21-13-15-22(16-14-21)11-6-12-23-17-7-2-4-9-19(17)24-20-10-5-3-8-18(20)23/h2-5,7-10H,6,11-16H2,1H3","WEYVCQFUGFRXOM-UHFFFAOYSA-N"
"CN(C)CCCN(c21)c(c3)c(ccc(C(F)(F)F)3)Sc(cccc2)1","InChI=1S/C18H19F3N2S/c1-22(2)10-5-11-23-14-6-3-4-7-16(14)24-17-9-8-13(12-15(17)23)18(19,20)21/h3-4,6-9,12H,5,10-11H2,1-2H3","XSCGXQMFQXDFCW-UHFFFAOYSA-N"
"CC(=O)C([H])=C([H])C(=C(C)1)C(C)(C)CCC1","InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+","PSQYTAPXSHCGMF-BQYQJAHWSA-N"
"CC(=O)OC([H])=C([H])C(=C(C)1)C(C)(C)CCC1","InChI=1S/C13H20O2/c1-10-6-5-8-13(3,4)12(10)7-9-15-11(2)14/h7,9H,5-6,8H2,1-4H3/b9-7+","QQLXIJJAHMEDSX-VQHVLOKHSA-N"
"CC(=O)C([H])=C([H])C(O1)(C(C)(C)2)C(C)(CCC2)1","InChI=1S/C13H20O2/c1-10(14)6-9-13-11(2,3)7-5-8-12(13,4)15-13/h6,9H,5,7-8H2,1-4H3/b9-6+","ZTJZJYUGOJYHCU-RMKNXTFCSA-N"
"CC(C)=CCCC(C)=C([H])COC(C)=O","InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8+","HIGQPQRQIQDZMP-DHZHZOJOSA-N"
"CCC(=O)OCC([H])=C(C)CCC=C(C)C","InChI=1S/C13H22O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,9H,5-6,8,10H2,1-4H3/b12-9+","BYCHQEILESTMQU-FMIVXFBMSA-N"
"CC(C)=CCCC(C)=C([H])COC(=O)C(C)C","InChI=1S/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9+","OGJYXQFXLSCKTP-UKTHLTGXSA-N"
"CCCC(=O)OCC([H])=C(C)CCC=C(C)C","InChI=1S/C14H24O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,10H,5-7,9,11H2,1-4H3/b13-10+","ZSBOMYJPSRFZAL-JLHYYAGUSA-N"
"CC(C1)=C([H])C([H])(O)C([H])(C1)C(C)C","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,9-11H,4-5H2,1-3H3/t9-,10-/m0/s1","HPOHAUWWDDPHRS-UWVGGRQHSA-N"
"CC(=C)C([H])(C1)CC([H])(O)C(C)=C([H])1","InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3/t9-,10+/m1/s1","BAVONGHXFVOKBV-ZJUUUORDSA-N"
"CC(=C)C([H])(C1)CC(=O)C(C)=C([H])1","InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3/t9-/m0/s1","ULDHMXUKGWMISQ-VIFPVBQESA-N"
"CC(=C)C([H])(C1)CC(=O)C(C)=C([H])1","InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3/t9-/m1/s1","ULDHMXUKGWMISQ-SECBINFHSA-N"
"C=CCc(c1)cc(O2)c(OC2)c1","InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2,4-6H,1,3,7H2","ZMQAAUBTXCXRIC-UHFFFAOYSA-N"
"O=C(C(C)21)C(C)(C)C([H])(CC2)C1","InChI=1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3/t7-,10+/m1/s1","LHXDLQBQYFFVNW-XCBNKYQSSA-N"
"CCC(C)c(c1)cc(c2)c(ncc2)c1","InChI=1S/C13H15N/c1-3-10(2)11-6-7-13-12(9-11)5-4-8-14-13/h4-10H,3H2,1-2H3","AUBLFWWZTFFBNU-UHFFFAOYSA-N"
"CCCCCCOC(=O)c(c1)c(O)ccc1","InChI=1S/C13H18O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h5-6,8-9,14H,2-4,7,10H2,1H3","DUKPKQFHJQGTGU-UHFFFAOYSA-N"
"C=CC(=O)c(c1)cc(O2)c(OC2)c1","InChI=1S/C10H8O3/c1-2-8(11)7-3-4-9-10(5-7)13-6-12-9/h2-5H,1,6H2","LNOUMTOCQWMBOJ-UHFFFAOYSA-N"
"C=CCOC(=O)c(c1)c(ccc1)C(=O)OCC=C","InChI=1S/C14H14O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h3-8H,1-2,9-10H2","QUDWYFHPNIMBFC-UHFFFAOYSA-N"
"c(c1C(=O)OCCCCCCCCC)(cccc1)C(=O)OCCCCCCCCC","InChI=1S/C26H42O4/c1-3-5-7-9-11-13-17-21-29-25(27)23-19-15-16-20-24(23)26(28)30-22-18-14-12-10-8-6-4-2/h15-16,19-20H,3-14,17-18,21-22H2,1-2H3","DROMNWUQASBTFM-UHFFFAOYSA-N"
"COC(=O)C([H])(C)O","InChI=1S/C4H8O3/c1-3(5)4(6)7-2/h3,5H,1-2H3/t3-/m0/s1","LPEKGGXMPWTOCB-VKHMYHEASA-N"
"CCCCOc(c1)ccc(C=O)c1","InChI=1S/C11H14O2/c1-2-3-8-13-11-6-4-10(9-12)5-7-11/h4-7,9H,2-3,8H2,1H3","XHWMNHADTZZHGI-UHFFFAOYSA-N"
"OC(CCl)CCl","InChI=1S/C3H6Cl2O/c4-1-3(6)2-5/h3,6H,1-2H2","DEWLEGDTCGBNGU-UHFFFAOYSA-N"
"ClCC(Cl)CCl","InChI=1S/C3H5Cl3/c4-1-3(6)2-5/h3H,1-2H2","CFXQEHVMCRXUSD-UHFFFAOYSA-N"
"OCC(Br)CBr","InChI=1S/C3H6Br2O/c4-1-3(5)2-6/h3,6H,1-2H2","QWVCIORZLNBIIC-UHFFFAOYSA-N"
"CC(=O)OCC(O)COC(C)=O","InChI=1S/C7H12O5/c1-5(8)11-3-7(10)4-12-6(2)9/h7,10H,3-4H2,1-2H3","MPPODKLDCLFLKT-UHFFFAOYSA-N"
"OCC(O)COC(C)=O","InChI=1S/C5H10O4/c1-4(7)9-3-5(8)2-6/h5-6,8H,2-3H2,1H3","KMZHZAAOEWVPSE-UHFFFAOYSA-N"
"CCC(=O)OCC(COC(=O)CC)OC(=O)CC","InChI=1S/C12H20O6/c1-4-10(13)16-7-9(18-12(15)6-3)8-17-11(14)5-2/h9H,4-8H2,1-3H3","YZWRNSARCRTXDS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(O)CO","InChI=1S/C21H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h20,22-23H,2-19H2,1H3","VBICKXHEKHSIBG-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCC(=O)OCC(O)CO","InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3/b10-9-","RZRNAYUHWVFMIP-KTKRTIGZSA-N"
"C(CCCCCCCCCCCCCCC)CC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCCCC","InChI=1S/C57H110O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h54H,4-53H2,1-3H3","DCXXMTOCNZCJGO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC","InChI=1S/C15H32/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-15H2,1-2H3","YCOZIPAWZNQLMR-UHFFFAOYSA-N"
"CCCCCCCC=CCC(=O)OC","InChI=1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h9-10H,3-8,11H2,1-2H3/b10-9+","UXEZTQUHDSYCQP-MDZDMXLPSA-N"
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"CCOC(CC)OCC","InChI=1S/C7H16O2/c1-4-7(8-5-2)9-6-3/h7H,4-6H2,1-3H3","MBNMGGKBGCIEGF-UHFFFAOYSA-N"
"CCC(C)C","InChI=1S/C5H12/c1-4-5(2)3/h5H,4H2,1-3H3","QWTDNUCVQCZILF-UHFFFAOYSA-N"
"C#CCO","InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2","TVDSBUOJIPERQY-UHFFFAOYSA-N"
"CC(C1)NCCC1","InChI=1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3","NNWUEBIEOFQMSS-UHFFFAOYSA-N"
"CC(C1)CNCC1","InChI=1S/C6H13N/c1-6-3-2-4-7-5-6/h6-7H,2-5H2,1H3","JEGMWWXJUXDNJN-UHFFFAOYSA-N"
"CC(C1)CCNC1","InChI=1S/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3","UZOFELREXGAFOI-UHFFFAOYSA-N"
"CC(N)c(c1)cccc1","InChI=1S/C8H11N/c1-7(9)8-5-3-2-4-6-8/h2-7H,9H2,1H3","RQEUFEKYXDPUSK-UHFFFAOYSA-N"
"CCOc(c1)c(N)ccc1","InChI=1S/C8H11NO/c1-2-10-8-6-4-3-5-7(8)9/h3-6H,2,9H2,1H3","ULHFFAFDSSHFDA-UHFFFAOYSA-N"
"CCOc(c1)ccc(N)c1","InChI=1S/C8H11NO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2,9H2,1H3","IMPPGHMHELILKG-UHFFFAOYSA-N"
"CC(C)(O)C(C)(C)O","InChI=1S/C6H14O2/c1-5(2,7)6(3,4)8/h7-8H,1-4H3","IVDFJHOHABJVEH-UHFFFAOYSA-N"
"CCC=O","InChI=1S/C3H6O/c1-2-3-4/h3H,2H2,1H3","NBBJYMSMWIIQGU-UHFFFAOYSA-N"
"CCOC(=O)C(C)=O","InChI=1S/C5H8O3/c1-3-8-5(7)4(2)6/h3H2,1-2H3","XXRCUYVCPSWGCC-UHFFFAOYSA-N"
"COC(=O)C(C)(C)C","InChI=1S/C6H12O2/c1-6(2,3)5(7)8-4/h1-4H3","CNMFHDIDIMZHKY-UHFFFAOYSA-N"
"OC(=O)C(C)(C)C","InChI=1S/C5H10O2/c1-5(2,3)4(6)7/h1-3H3,(H,6,7)","IUGYQRQAERSCNH-UHFFFAOYSA-N"
"CC(=O)OCC(C)OC(C)=O","InChI=1S/C7H12O4/c1-5(11-7(3)9)4-10-6(2)8/h5H,4H2,1-3H3","MLHOXUWWKVQEJB-UHFFFAOYSA-N"
"CCCBr","InChI=1S/C3H7Br/c1-2-3-4/h2-3H2,1H3","CYNYIHKIEHGYOZ-UHFFFAOYSA-N"
"CC(C)Br","InChI=1S/C3H7Br/c1-3(2)4/h3H,1-2H3","NAMYKGVDVNBCFQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)Sc(c1)cccc1","InChI=1S/C12H10S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-10H","LTYMSROWYAPPGB-UHFFFAOYSA-N"
"CCC(=O)Cl","InChI=1S/C3H5ClO/c1-2-3(4)5/h2H2,1H3","RZWZRACFZGVKFM-UHFFFAOYSA-N"
"CC(C)(C)C(=O)Cl","InChI=1S/C5H9ClO/c1-5(2,3)4(6)7/h1-3H3","JVSFQJZRHXAUGT-UHFFFAOYSA-N"
"ClCCc(c1)cccc1","InChI=1S/C8H9Cl/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2","MNNZINNZIQVULG-UHFFFAOYSA-N"
"CCC(C(O)=O)c(c1)cccc1","InChI=1S/C10H12O2/c1-2-9(10(11)12)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,11,12)","OFJWFSNDPCAWDK-UHFFFAOYSA-N"
"O=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C8H6O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-4H,5H2","SATCULPHIDQDRE-UHFFFAOYSA-N"
"CCOC(=O)Nc(c1)cccc1","InChI=1S/C9H11NO2/c1-2-12-9(11)10-8-6-4-3-5-7-8/h3-7H,2H2,1H3,(H,10,11)","LBKPGNUOUPTQKA-UHFFFAOYSA-N"
"O(C2)CCN(C2)c(c1)cccc1","InChI=1S/C10H13NO/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-5H,6-9H2","FHQRDEDZJIFJAL-UHFFFAOYSA-N"
"CC(Cl)c(c1)cccc1","InChI=1S/C8H9Cl/c1-7(9)8-5-3-2-4-6-8/h2-7H,1H3","GTLWADFFABIGAE-UHFFFAOYSA-N"
"O=C(C1)C=CC1","InChI=1S/C5H6O/c6-5-3-1-2-4-5/h1,3H,2,4H2","BZKFMUIJRXWWQK-UHFFFAOYSA-N"
"CC(C1)CC(=O)C1","InChI=1S/C6H10O/c1-5-2-3-6(7)4-5/h5H,2-4H2,1H3","AOKRXIIIYJGNNU-UHFFFAOYSA-N"
"CC(C1)C(=O)CC1","InChI=1S/C6H10O/c1-5-3-2-4-6(5)7/h5H,2-4H2,1H3","ZIXLDMFVRPABBX-UHFFFAOYSA-N"
"CCC(C1)CCC1","InChI=1S/C7H14/c1-2-7-5-3-4-6-7/h7H,2-6H2,1H3","IFTRQJLVEBNKJK-UHFFFAOYSA-N"
"CC(C1)CCC1","InChI=1S/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H3","GDOPTJXRTPNYNR-UHFFFAOYSA-N"
"C(C1)CC=C1","InChI=1S/C5H8/c1-2-4-5-3-1/h1-2H,3-5H2","LPIQUOYDBNQMRZ-UHFFFAOYSA-N"
"C(C1)CCC1","InChI=1S/C5H10/c1-2-4-5-3-1/h1-5H2","RGSFGYAAUTVSQA-UHFFFAOYSA-N"
"CCC=CCC(=C(C)1)C(=O)CC1","InChI=1S/C11H16O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5H,3,6-8H2,1-2H3/b5-4-","XMLSXPIVAXONDL-PLNGDYQASA-N"
"CCCCCC(C(=O)1)C(CC1)CC(=O)OC","InChI=1S/C13H22O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h10-11H,3-9H2,1-2H3","KVWWIYGFBYDJQC-UHFFFAOYSA-N"
"CC(=O)OC([H])(C1)C(C)CCC(C(C)=C)1","InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9?,11?,12-/m0/s1","TUSIZTVSUSBSQI-NHNAUAITSA-N"
"CC(=O)OC([H])(C1)C(C)CCC(C(C)=C)1","InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9?,11?,12-/m1/s1","TUSIZTVSUSBSQI-QEWOUOOISA-N"
"CC(=O)OC(C1)C(CCC(C)1)C(C)=C","InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9-,11+,12-/m1/s1","HLHIVJRLODSUCI-ADEWGFFLSA-N"
"[2H][Si](C)(C)[Si]([2H])(C)C","InChI=1S/C4H14Si2/c1-5(2)6(3)4/h5-6H,1-4H3/i5D,6D","RDWAGGBALVFUHB-KCZCTXNHSA-N"
"CC(C)C(C)C","InChI=1S/C6H14/c1-5(2)6(3)4/h5-6H,1-4H3","ZFFMLCVRJBZUDZ-UHFFFAOYSA-N"
"CC(C)(C)C(C)(C)C","InChI=1S/C8H18/c1-7(2,3)8(4,5)6/h1-6H3","OMMLUKLXGSRPHK-UHFFFAOYSA-N"
"CCCC[SiH2]C","InChI=1S/C5H14Si/c1-3-4-5-6-2/h3-6H2,1-2H3","MFGTZDMAYACKNE-UHFFFAOYSA-N"
"CCCC[Si]([2H])([2H])C","InChI=1S/C5H14Si/c1-3-4-5-6-2/h3-6H2,1-2H3/i6D2","MFGTZDMAYACKNE-NCYHJHSESA-N"
"CCCC[SiH2]C([2H])([2H])[2H]","InChI=1S/C5H14Si/c1-3-4-5-6-2/h3-6H2,1-2H3/i2D3","MFGTZDMAYACKNE-BMSJAHLVSA-N"
"OCCC(C)CC(C)(C)C","InChI=1S/C9H20O/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3","BODRLKRKPXBDBN-UHFFFAOYSA-N"
"OCCCOCCCOCCCOC","InChI=1S/C10H22O4/c1-12-6-3-8-14-10-4-9-13-7-2-5-11/h11H,2-10H2,1H3","GRTBNOKQBKPUGM-UHFFFAOYSA-N"
"CCCCOCCOCCOCCO","InChI=1S/C10H22O4/c1-2-3-5-12-7-9-14-10-8-13-6-4-11/h11H,2-10H2,1H3","COBPKKZHLDDMTB-UHFFFAOYSA-N"
"CC(=O)OCCOCCOCCOC(C)=O","InChI=1S/C10H18O6/c1-9(11)15-7-5-13-3-4-14-6-8-16-10(2)12/h3-8H2,1-2H3","OVOUKWFJRHALDD-UHFFFAOYSA-N"
"C=CC(=O)OCC(CC)(COC(=O)C=C)COC(=O)C=C","InChI=1S/C15H20O6/c1-5-12(16)19-9-15(8-4,10-20-13(17)6-2)11-21-14(18)7-3/h5-7H,1-3,8-11H2,4H3","DAKWPKUUDNSNPN-UHFFFAOYSA-N"
"CC(=C)C(=O)OCC(CC)(COC(=O)C(C)=C)COC(=O)C(C)=C","InChI=1S/C18H26O6/c1-8-18(9-22-15(19)12(2)3,10-23-16(20)13(4)5)11-24-17(21)14(6)7/h2,4,6,8-11H2,1,3,5,7H3","OKKRPWIIYQTPQF-UHFFFAOYSA-N"
"ClCCCBr","InChI=1S/C3H6BrCl/c4-2-1-3-5/h1-3H2","MFESCIUQSIBMSM-UHFFFAOYSA-N"
"CC(=O)OCCC(C)CC(C)(C)C","InChI=1S/C11H22O2/c1-9(8-11(3,4)5)6-7-13-10(2)12/h9H,6-8H2,1-5H3","DGKXDLCVQSQVBC-UHFFFAOYSA-N"
"Cc(c1)c(C)c(C)cc1","InChI=1S/C9H12/c1-7-5-4-6-8(2)9(7)3/h4-6H,1-3H3","FYGHSUNMUKGBRK-UHFFFAOYSA-N"
"COC(C)(OC)OC","InChI=1S/C5H12O3/c1-5(6-2,7-3)8-4/h1-4H3","HDPNBNXLBDFELL-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(Cl)(Cl)Cl","InChI=1S/C7H5Cl3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H","XEMRAKSQROQPBR-UHFFFAOYSA-N"
"c(c2)ccc(c2)OCC(C1)O1","InChI=1S/C9H10O2/c1-2-4-8(5-3-1)10-6-9-7-11-9/h1-5,9H,6-7H2","FQYUMYWMJTYZTK-UHFFFAOYSA-N"
"CCOCCOCCOCCO","InChI=1S/C8H18O4/c1-2-10-5-6-12-8-7-11-4-3-9/h9H,2-8H2,1H3","WFSMVVDJSNMRAR-UHFFFAOYSA-N"
"COC(=C(C)C)O[Si](C)(C)C","InChI=1S/C8H18O2Si/c1-7(2)8(9-3)10-11(4,5)6/h1-6H3","JNOGVQJEBGEKMG-UHFFFAOYSA-N"
"C[SiH](C)O[Si](O[SiH](C)C)(O[SiH](C)C)O[SiH](C)C","InChI=1S/C8H28O4Si5/c1-13(2)9-17(10-14(3)4,11-15(5)6)12-16(7)8/h13-16H,1-8H3","GTWPLTBXXGOHNT-UHFFFAOYSA-N"
"C[Si](C)(O1)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)1","InChI=1S/C8H24O4Si4/c1-13(2)9-14(3,4)11-16(7,8)12-15(5,6)10-13/h1-8H3","HMMGMWAXVFQUOA-UHFFFAOYSA-N"
"CCCCOC(=O)c(c1)cc(C(=O)OCCCC)c(c1)C(=O)OCCCC","InChI=1S/C21H30O6/c1-4-7-12-25-19(22)16-10-11-17(20(23)26-13-8-5-2)18(15-16)21(24)27-14-9-6-3/h10-11,15H,4-9,12-14H2,1-3H3","RJIFVNWOLLIBJV-UHFFFAOYSA-N"
"O=C(c(c1C(OCC(CCCC)CC)=O)ccc(c1)C(OCC(CCCC)CC)=O)OCC(CCCC)CC","InChI=1S/C33H54O6/c1-7-13-16-25(10-4)22-37-31(34)28-19-20-29(32(35)38-23-26(11-5)17-14-8-2)30(21-28)33(36)39-24-27(12-6)18-15-9-3/h19-21,25-27H,7-18,22-24H2,1-6H3","KRADHMIOFJQKEZ-UHFFFAOYSA-N"
"OCCC(C)(O)CCO","InChI=1S/C6H14O3/c1-6(9,2-4-7)3-5-8/h7-9H,2-5H2,1H3","AHHQDHCTHYTBSV-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OC","InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3","YRHYCMZPEVDGFQ-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCC","InChI=1S/C12H24O2/c1-3-5-6-7-8-9-10-11-12(13)14-4-2/h3-11H2,1-2H3","RGXWDWUGBIJHDO-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OC(C)C","InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-11-13(14)15-12(2)3/h12H,4-11H2,1-3H3","PKPPDYGHKDIKBH-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCCCC","InChI=1S/C14H28O2/c1-3-5-7-8-9-10-11-12-14(15)16-13-6-4-2/h3-13H2,1-2H3","ZRNCNTSXSYXHOW-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCC(C)C","InChI=1S/C14H28O2/c1-4-5-6-7-8-9-10-11-14(15)16-12-13(2)3/h13H,4-12H2,1-3H3","AXTPGRJJIGEOOY-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCCCCC","InChI=1S/C15H30O2/c1-3-5-7-8-9-10-11-13-15(16)17-14-12-6-4-2/h3-14H2,1-2H3","BGYFCELTJPRWBA-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCCC(C)C","InChI=1S/C15H30O2/c1-4-5-6-7-8-9-10-11-15(16)17-13-12-14(2)3/h14H,4-13H2,1-3H3","XDOGFYDZGUDBQY-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCCCCCCC","InChI=1S/C17H34O2/c1-3-5-7-9-10-11-13-15-17(18)19-16-14-12-8-6-4-2/h3-16H2,1-2H3","MPLLSYWBBPPERF-UHFFFAOYSA-N"
"O=C(OCc(c2)cccc2)Cc(c1)cccc1","InChI=1S/C15H14O2/c16-15(11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2","MIYFJEKZLFWKLZ-UHFFFAOYSA-N"
"CCOC(=O)C=Cc(c1)cccc1","InChI=1S/C11H12O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+","KBEBGUQPQBELIU-CMDGGOBGSA-N"
"OCCOC(C)C","InChI=1S/C5H12O2/c1-5(2)7-4-3-6/h5-6H,3-4H2,1-2H3","HCGFUIQPSOCUHI-UHFFFAOYSA-N"
"OCCO","InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2","LYCAIKOWRPUZTN-UHFFFAOYSA-N"
"CC(C)COCCOCC(C)C","InChI=1S/C10H22O2/c1-9(2)7-11-5-6-12-8-10(3)4/h9-10H,5-8H2,1-4H3","PWNZQSUHTOQNEK-UHFFFAOYSA-N"
"OCCOCC(C)C","InChI=1S/C6H14O2/c1-6(2)5-8-4-3-7/h6-7H,3-5H2,1-2H3","HHAPGMVKBLELOE-UHFFFAOYSA-N"
"CCCCOCCO","InChI=1S/C6H14O2/c1-2-3-5-8-6-4-7/h7H,2-6H2,1H3","POAOYUHQDCAZBD-UHFFFAOYSA-N"
"OCCOC(C)(C)C","InChI=1S/C6H14O2/c1-6(2,3)8-5-4-7/h7H,4-5H2,1-3H3","BDLXTDLGTWNUFM-UHFFFAOYSA-N"
"CCCCCCOCCO","InChI=1S/C8H18O2/c1-2-3-4-5-7-10-8-6-9/h9H,2-8H2,1H3","UPGSWASWQBLSKZ-UHFFFAOYSA-N"
"CCOC(=O)CCBr","InChI=1S/C5H9BrO2/c1-2-8-5(7)3-4-6/h2-4H2,1H3","FQTIYMRSUOADDK-UHFFFAOYSA-N"
"CCOC(=O)C(C)Br","InChI=1S/C5H9BrO2/c1-3-8-5(7)4(2)6/h4H,3H2,1-2H3","ARFLASKVLJTEJD-UHFFFAOYSA-N"
"COC(=O)OC","InChI=1S/C3H6O3/c1-5-3(4)6-2/h1-2H3","IEJIGPNLZYLLBP-UHFFFAOYSA-N"
"CCOC(=O)OCC","InChI=1S/C5H10O3/c1-3-7-5(6)8-4-2/h3-4H2,1-2H3","OIFBSDVPJOWBCH-UHFFFAOYSA-N"
"OCCOC(C)=O","InChI=1S/C4H8O3/c1-4(6)7-3-2-5/h5H,2-3H2,1H3","HXDLWJWIAHWIKI-UHFFFAOYSA-N"
"CCCC(=O)OCCOC(=O)CCC","InChI=1S/C10H18O4/c1-3-5-9(11)13-7-8-14-10(12)6-4-2/h3-8H2,1-2H3","SFTRWCBAYKQWCS-UHFFFAOYSA-N"
"CCCCCCCCCCCC(O)CC(=O)OC","InChI=1S/C15H30O3/c1-3-4-5-6-7-8-9-10-11-12-14(16)13-15(17)18-2/h14,16H,3-13H2,1-2H3","UOZZAMWODZQSOA-UHFFFAOYSA-N"
"OCCOC(=O)C(C)=C","InChI=1S/C6H10O3/c1-5(2)6(8)9-4-3-7/h7H,1,3-4H2,2H3","WOBHKFSMXKNTIM-UHFFFAOYSA-N"
"NCCOCCO","InChI=1S/C4H11NO2/c5-1-3-7-4-2-6/h6H,1-5H2","GIAFURWZWWWBQT-UHFFFAOYSA-N"
"CCCCOCCOCCCC","InChI=1S/C10H22O2/c1-3-5-7-11-9-10-12-8-6-4-2/h3-10H2,1-2H3","GDXHBFHOEYVPED-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OC","InChI=1S/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-12H2,1-2H3","UQDUPQYQJKYHQI-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(=O)OC","InChI=1S/C16H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18-2/h3-15H2,1-2H3","XIUXKAZJZFLLDQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C17H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-2/h3-16H2,1-2H3","FLIACVVOZYBSBS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-2/h3-17H2,1-2H3","HUEBIMLTDXKIPR-UHFFFAOYSA-N"
"CCCCCCCC(=O)OC","InChI=1S/C9H18O2/c1-3-4-5-6-7-8-9(10)11-2/h3-8H2,1-2H3","JGHZJRVDZXSNKQ-UHFFFAOYSA-N"
"CC(CCC([H])(C(C)C)CC)C(C1)C(C)(C4)C(C(C([H])3C4)CC=C(C(C)32)CC(O[Si](C)(C)C)CC2)(C1)[H]","InChI=1S/C32H58OSi/c1-10-24(22(2)3)12-11-23(4)28-15-16-29-27-14-13-25-21-26(33-34(7,8)9)17-19-31(25,5)30(27)18-20-32(28,29)6/h13,22-24,26-30H,10-12,14-21H2,1-9H3/t23-,24+,26+,27?,28-,29+,30+,31+,32-/m1/s1","XEWVATFZTBNDCF-IHCQZMFNSA-N"
"Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)(C#C)C1","InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3/t16-,17-,18+,19+,20+/m1/s1","BFPYWIDHMRZLRN-SLHNCBLASA-N"
"C(C)(CCC=C(C)CCC=C(C)C)=CCCC(C)=CCc(c(=O)1)c(C)c(=O)c(c2)c1ccc2","InChI=1S/C31H40O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,12,14,16,18-20H,9-11,13,15,17,21H2,1-6H3/b23-14+,24-16+,25-20+","DKHGMERMDICWDU-GHDNBGIDSA-N"
"c(c1CC=C(CCCC(CCCC(CCCC(C)C)([H])C)([H])C)C)(=O)c(c2)c(ccc2)c(=O)c(C)1","InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+/t23-,24-/m1/s1","MBWXNTAXLNYFJB-NKFFZRIASA-N"
"","InChI=1S/C24H40O2Si2/c1-24-15-14-20-19-11-9-18(25-27(2,3)4)16-17(19)8-10-21(20)22(24)12-13-23(24)26-28(5,6)7/h9,11,16,20-23H,8,10,12-15H2,1-7H3/t20-,21-,22+,23-,24+/m1/s1","WJUROLKZHWTVGC-SJSRKZJXSA-N"
"CCCCCCC(=O)OC","InChI=1S/C8H16O2/c1-3-4-5-6-7-8(9)10-2/h3-7H2,1-2H3","XNCNNDVCAUWAIT-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OC","InChI=1S/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3","IJXHLVMUNBOGRR-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(O)=O","InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)","IPCSVZSSVZVIGE-UHFFFAOYSA-N"
"OCc(c1)ccc(C)c1","InChI=1S/C8H10O/c1-7-2-4-8(6-9)5-3-7/h2-5,9H,6H2,1H3","KMTDMTZBNYGUNX-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)Cc(c1)ccnc1","InChI=1S/C12H10N2O2/c15-14(16)12-3-1-10(2-4-12)9-11-5-7-13-8-6-11/h1-8H,9H2","MNHKUCBXXMFQDM-UHFFFAOYSA-N"
"OCc(c1)c(ccc1)[N+1]([O-1])=O","InChI=1S/C7H7NO3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4,9H,5H2","BWRBVBFLFQKBPT-UHFFFAOYSA-N"
"OCCNCc(c1)cccc1","InChI=1S/C9H13NO/c11-7-6-10-8-9-4-2-1-3-5-9/h1-5,10-11H,6-8H2","XNIOWJUQPMKCIJ-UHFFFAOYSA-N"
"OCc(c1)c(CO)c(O)c(C)n1","InChI=1S/C8H11NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,10-12H,3-4H2,1H3","LXNHXLLTXMVWPM-UHFFFAOYSA-N"
"OCc(c1)ccc(OC)c1","InChI=1S/C8H10O2/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3","MSHFRERJPWKJFX-UHFFFAOYSA-N"
"Oc(c2)c(ccc2)c(c1)cccc1","InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H","LLEMOWNGBBNAJR-UHFFFAOYSA-N"
"C=Cc(c1)cc(c2)c(ccc2)c1","InChI=1S/C12H10/c1-2-10-7-8-11-5-3-4-6-12(11)9-10/h2-9H,1H2","KXYAVSFOJVUIHT-UHFFFAOYSA-N"
"OC(=O)c(c1)c(C(O)=O)c(cc1)[N+1]([O-1])=O","InChI=1S/C8H5NO6/c10-7(11)4-2-1-3-5(9(14)15)6(4)8(12)13/h1-3H,(H,10,11)(H,12,13)","KFIRODWJCYBBHY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c(O)1)c(O)ccc1","InChI=1S/C6H5NO4/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3,8-9H","ZLCPKMIJYMHZMJ-UHFFFAOYSA-N"
"C(C1)OCCOCCOCCO1","InChI=1S/C8H16O4/c1-2-10-5-6-12-8-7-11-4-3-9-1/h1-8H2","XQQZRZQVBFHBHL-UHFFFAOYSA-N"
"C(C1)OCCOCCOCCOCCO1","InChI=1S/C10H20O5/c1-2-12-5-6-14-9-10-15-8-7-13-4-3-11-1/h1-10H2","VFTFKUDGYRBSAL-UHFFFAOYSA-N"
"CC(C)NC(=O)N(C2)C(=O)N(C(=O)2)c(c1)cc(Cl)cc(Cl)1","InChI=1S/C13H13Cl2N3O3/c1-7(2)16-12(20)17-6-11(19)18(13(17)21)10-4-8(14)3-9(15)5-10/h3-5,7H,6H2,1-2H3,(H,16,20)","ONUFESLQCSAYKA-UHFFFAOYSA-N"
"OC(=O)c(c1)ccc(I)c1","InChI=1S/C7H5IO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)","GHICCUXQJBDNRN-UHFFFAOYSA-N"
"OC(=O)CCc(c1)cccc1","InChI=1S/C9H10O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)","XMIIGOLPHOKFCH-UHFFFAOYSA-N"
"C[Si](C)(C)Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C21H30O2Si/c1-21-12-11-17-16-8-6-15(23-24(2,3)4)13-14(16)5-7-18(17)19(21)9-10-20(21)22/h6,8,13,17-19H,5,7,9-12H2,1-4H3/t17-,18-,19+,21+/m1/s1","FRJOUBWXHQBBER-BNDYYXHWSA-N"
"C[Si](C)(C)Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)C1","InChI=1S/C21H32O2Si/c1-21-12-11-17-16-8-6-15(23-24(2,3)4)13-14(16)5-7-18(17)19(21)9-10-20(21)22/h6,8,13,17-20,22H,5,7,9-12H2,1-4H3/t17-,18-,19+,20+,21+/m1/s1","WAHGKGGDYYOOIH-MJCUULBUSA-N"
"CN(C)c(c1)nccc1","InChI=1S/C7H10N2/c1-9(2)7-5-3-4-6-8-7/h3-6H,1-2H3","PSHKMPUSSFXUIA-UHFFFAOYSA-N"
"O=CC(C)c(c1)cccc1","InChI=1S/C9H10O/c1-8(7-10)9-5-3-2-4-6-9/h2-8H,1H3","IQVAERDLDAZARL-UHFFFAOYSA-N"
"ClCc(c1)c(c2)c(ccc2)cc1","InChI=1S/C11H9Cl/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2","XMWGTKZEDLCVIG-UHFFFAOYSA-N"
"Cc(c(Cl)1)c(Cl)ccc1","InChI=1S/C7H6Cl2/c1-5-6(8)3-2-4-7(5)9/h2-4H,1H3","DMEDNTFWIHCBRK-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)S(=O)(=O)Nc(n1)cc(C)o1","InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)","JLKIGFTWXXRPMT-UHFFFAOYSA-N"
"COC(=O)NS(=O)(=O)c(c1)ccc(N)c1","InChI=1S/C8H10N2O4S/c1-14-8(11)10-15(12,13)7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11)","VGPYEHKOIGNJKV-UHFFFAOYSA-N"
"Nc(c1)ccc(c1)S(N)(=O)=O","InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)","FDDDEECHVMSUSB-UHFFFAOYSA-N"
"OCC(O)C(O1)C(O)=C(O)C(=O)1","InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1","CIWBSHSKHKDKBQ-JLAZNSOCSA-N"
"BrCC(=O)c(c1)ccc(Br)c1","InChI=1S/C8H6Br2O/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2","FKJSFKCZZIXQIP-UHFFFAOYSA-N"
"CNC=O","InChI=1S/C2H5NO/c1-3-2-4/h2H,1H3,(H,3,4)","ATHHXGZTWNVVOU-UHFFFAOYSA-N"
"BrCc(c1)c(C)ccc1","InChI=1S/C8H9Br/c1-7-4-2-3-5-8(7)6-9/h2-5H,6H2,1H3","WGVYCXYGPNNUQA-UHFFFAOYSA-N"
"c(c2)ccc(c2)CNCc(c1)cccc1","InChI=1S/C14H15N/c1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2","BWLUMTFWVZZZND-UHFFFAOYSA-N"
"Cc(c(C)1)c(C)c(C)c(C)c(C)1","InChI=1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3","YUWFEBAXEOLKSG-UHFFFAOYSA-N"
"O=C(Nc(c2)cccc2)c(c1)cccc1","InChI=1S/C13H11NO/c15-13(11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h1-10H,(H,14,15)","ZVSKZLHKADLHSD-UHFFFAOYSA-N"
"OC(=O)C(N)CSC","InChI=1S/C4H9NO2S/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1","IDIDJDIHTAOVLG-VKHMYHEASA-N"
"Cc(c1)cc(C)c(N)c(C)1","InChI=1S/C9H13N/c1-6-4-7(2)9(10)8(3)5-6/h4-5H,10H2,1-3H3","KWVPRPSXBZNOHS-UHFFFAOYSA-N"
"CC(C)(C4)C(C32)C(C(=O)1)C(C)(CC4)C1C(C)(O3)2","InChI=1S/C15H22O2/c1-13(2)6-5-7-14(3)8-9(13)12-15(4,17-12)11(14)10(8)16/h8-9,11-12H,5-7H2,1-4H3","OQTBYTAMNHCEOE-UHFFFAOYSA-N"
"O=C(C([H])23)C([H])(C(C)(C)3)C(C)(O1)C([H])(C2)1","InChI=1S/C10H14O2/c1-9(2)5-4-6-10(3,12-6)8(9)7(5)11/h5-6,8H,4H2,1-3H3/t5-,6-,8+,10-/m0/s1","MJKUEDLCFFNGOC-LVWRQZDYSA-N"
"O=C(C32)C(C3)C(C)(O1)C1C(C)(C)2","InChI=1S/C10H14O2/c1-9(2)5-4-6(7(5)11)10(3)8(9)12-10/h5-6,8H,4H2,1-3H3","LUANZWPGTAHQBV-UHFFFAOYSA-N"
"O=C(C(C)(C)3)C([H])(C([H])23)C(C)(O1)C([H])(C2)1","InChI=1S/C10H14O2/c1-9(2)5-4-6-10(3,12-6)7(5)8(9)11/h5-7H,4H2,1-3H3/t5-,6-,7+,10-/m0/s1","UMXWFBSAWGHMMF-DOACCVQLSA-N"
"CC(=C1)C([H])(O2)CC([H])(C(=O)2)C(C)(C)1","InChI=1S/C10H14O2/c1-6-5-10(2,3)7-4-8(6)12-9(7)11/h5,7-8H,4H2,1-3H3/t7-,8-/m0/s1","JHKNAYGQYUKKDQ-YUMQZZPRSA-N"
"CC(=C2)C(C(=O)1)C(C)(C)C(C2)1","InChI=1S/C10H14O/c1-6-4-5-7-9(11)8(6)10(7,2)3/h4,7-8H,5H2,1-3H3","IECBDTGWSQNQID-UHFFFAOYSA-N"
"CC(=C2)C(C(=O)1)C(C2)C(C)(C)1","InChI=1S/C10H14O/c1-6-4-5-7-8(6)9(11)10(7,2)3/h4,7-8H,5H2,1-3H3","JVEJBTZZORGEKF-UHFFFAOYSA-N"
"C=CC(C)(O)CCC([H])(C(C)=2)C(C)(C1)C([H])(CC([H])2)C(C)(C)CC1","InChI=1S/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,9,16-17,21H,1,8,10-14H2,2-6H3/t16-,17-,19-,20+/m0/s1","YHUUQRPBUXILLV-QGZVKYPTSA-N"
"CC(C)(C3)C([H])(C(C)1CC3)CC(=C(C([H])(CCC(OC([H])(C([H])(O)2)OC([H])(C)C([H])(O)C([H])(O)2)(C)C=C)1)C)[H]","InChI=1S/C26H44O5/c1-8-25(6,31-23-22(29)21(28)20(27)17(3)30-23)15-12-18-16(2)10-11-19-24(4,5)13-9-14-26(18,19)7/h8,10,17-23,27-29H,1,9,11-15H2,2-7H3/t17?,18-,19-,20-,21-,22?,23-,25-,26+/m0/s1","SHBMAOBNYQEHHP-AAVQNJBJSA-N"
"[H]C(C)(C([H])(O)3)OC([H])(C([H])(O)C3([H])O)OC(CCC([H])(C(C)12)C(=CCC([H])1C(CCC2)(C)C)C)(C)C=C","InChI=1S/C26H44O5/c1-8-25(6,31-23-22(29)21(28)20(27)17(3)30-23)15-12-18-16(2)10-11-19-24(4,5)13-9-14-26(18,19)7/h8,10,17-23,27-29H,1,9,11-15H2,2-7H3/t17?,18-,19-,20-,21+,22?,23-,25-,26+/m0/s1","SHBMAOBNYQEHHP-GOGYNWEZSA-N"
"CC(C)(C3)C([H])(C(C)1CC3)CC(=C(C([H])(CCC(OC([H])(C([H])(O)2)OC([H])(C)C([H])(O)C([H])(O)2)(C)C=C)1)C)[H]","InChI=1S/C26H44O5/c1-8-25(6,31-23-22(29)21(28)20(27)17(3)30-23)15-12-18-16(2)10-11-19-24(4,5)13-9-14-26(18,19)7/h8,10,17-23,27-29H,1,9,11-15H2,2-7H3/t17?,18-,19-,20+,21+,22?,23-,25-,26+/m0/s1","SHBMAOBNYQEHHP-NBNQVVCBSA-N"
"C(C=4C)(C(C3)(C)C([H])(CC([H])4)C(CC3)(C)C)([H])CCC(C=C)(OC([H])(O2)C(O1)(C(C([H])(O)C2([H])C)(OC(C)(C)1)[H])[H])C","InChI=1S/C29H48O5/c1-10-28(8,34-25-24-23(22(30)19(3)31-25)32-27(6,7)33-24)17-14-20-18(2)12-13-21-26(4,5)15-11-16-29(20,21)9/h10,12,19-25,30H,1,11,13-17H2,2-9H3/t19-,20-,21-,22-,23+,24+,25-,28-,29+/m0/s1","CYVZURJWSZNEAQ-QEUCPSMUSA-N"
"CC(C)(C2OC([H])(O4)C([H])(O)C(C(C([H])(C)4)3[H])(OC(C)(C)O3)[H])C([H])(C1(C)CC2)CC([H])=C(C)C(CCC([H])(C)C=C)1[H]","InChI=1S/C29H48O5/c1-10-17(2)11-13-20-18(3)12-14-21-27(5,6)22(15-16-29(20,21)9)32-26-23(30)25-24(19(4)31-26)33-28(7,8)34-25/h10,12,17,19-26,30H,1,11,13-16H2,2-9H3/t17-,19-,20+,21+,22?,23-,24+,25-,26+,29-/m1/s1","IEIKJOXKWGQASR-IGPZGSHMSA-N"
"C(C=4C)(C(C3)(C)C([H])(CC([H])4)C(CC3)(C)C)(CCC(C=C)(OC(C([H])(O)2)([H])OC([H])(C)C([H])(C12[H])OC(O1)(C([2H])([2H])[2H])C([2H])([2H])[2H])C)[H]","InChI=1S/C29H48O5/c1-10-28(8,34-25-22(30)24-23(19(3)31-25)32-27(6,7)33-24)17-14-20-18(2)12-13-21-26(4,5)15-11-16-29(20,21)9/h10,12,19-25,30H,1,11,13-17H2,2-9H3/t19-,20-,21-,22+,23-,24-,25-,28-,29+/m0/s1/i6D3,7D3","XXWIHOYJEBPTAM-JKJNFHSYSA-N"
"C(C=4C)(C(C3)(C)C([H])(CC([H])4)C(CC3)(C)C)(CCC(C=C)(OC(C([H])(O)2)([H])OC([H])(C)C([H])(C12[H])OC(O1)(C([2H])([2H])[2H])C([2H])([2H])[2H])C)[H]","InChI=1S/C29H48O5/c1-10-28(8,34-25-22(30)24-23(19(3)31-25)32-27(6,7)33-24)17-14-20-18(2)12-13-21-26(4,5)15-11-16-29(20,21)9/h10,12,19-25,30H,1,11,13-17H2,2-9H3/t19-,20+,21+,22-,23+,24-,25+,28+,29-/m1/s1/i6D3,7D3","XXWIHOYJEBPTAM-QEZZSVBVSA-N"
"COC(O1)C(O2)C(OC(C)(C)2)C(O)C(C)1","InChI=1S/C10H18O5/c1-5-6(11)7-8(9(12-4)13-5)15-10(2,3)14-7/h5-9,11H,1-4H3/t5-,6-,7+,8+,9+/m0/s1","TVKKWQAJQZHTDN-OFPUPOEVSA-N"
"COC(O1)C(O)C([H])(O2)C([H])(OC(C)(C)2)C(C)1","InChI=1S/C10H18O5/c1-5-7-8(15-10(2,3)14-7)6(11)9(12-4)13-5/h5-9,11H,1-4H3/t5-,6-,7+,8-,9-/m1/s1","UONDNTMXANWPHZ-SYHAXYEDSA-N"
"COC(O2)C([H])(O1)C([H])(C(O)C(C)2)OC(C([2H])([2H])[2H])(C([2H])([2H])[2H])1","InChI=1S/C10H18O5/c1-5-6(11)7-8(9(12-4)13-5)15-10(2,3)14-7/h5-9,11H,1-4H3/t5-,6-,7+,8+,9+/m0/s1/i2D3,3D3","TVKKWQAJQZHTDN-XQPZCLEZSA-N"
"COC(O2)C(O)C([H])(O1)C([H])(C(C)2)OC(C([2H])([2H])[2H])(C([2H])([2H])[2H])1","InChI=1S/C10H18O5/c1-5-7-8(15-10(2,3)14-7)6(11)9(12-4)13-5/h5-9,11H,1-4H3/t5-,6-,7+,8-,9-/m1/s1/i2D3,3D3","UONDNTMXANWPHZ-ZPOOEJENSA-N"
"CC(C)(C4)C([H])(C3)C(C)(CC4)C([H])(C2)C(C3)(C1)C(=O)C([H])(C)C([H])(C2)1","InChI=1S/C20H32O/c1-13-14-6-7-16-19(4)10-5-9-18(2,3)15(19)8-11-20(16,12-14)17(13)21/h13-16H,5-12H2,1-4H3/t13-,14+,15+,16-,19+,20+/m1/s1","WLPSBNSWPFRIPG-YSBNHYEQSA-N"
"COCC([H])(C(=O)1)C([H])(C4)CC(C3)1C([H])(C4)C(C)(C2)C([H])(C3)C(C)(C)CC2","InChI=1S/C21H34O2/c1-19(2)9-5-10-20(3)16(19)8-11-21-12-14(6-7-17(20)21)15(13-23-4)18(21)22/h14-17H,5-13H2,1-4H3/t14-,15-,16-,17+,20-,21-/m0/s1","PABWEJPEEQIDES-GQDVPIKJSA-N"
"OCC(C)(C4)C([H])(C3)C(C)(CC4)C([H])(C2)C(C3)(C1)C(=O)C([H])(C)C([H])(C2)1","InChI=1S/C20H32O2/c1-13-14-5-6-16-19(3)9-4-8-18(2,12-21)15(19)7-10-20(16,11-14)17(13)22/h13-16,21H,4-12H2,1-3H3/t13-,14+,15+,16-,18-,19?,20+/m1/s1","YIVOCKREJGXBSH-OSQPDDNXSA-N"
"OC(=O)C(C)(C4)C([H])(C3)C(C)(CC4)C([H])(C2)C(C3)(C1)C(=O)C([H])(C)C([H])(C2)1","InChI=1S/C20H30O3/c1-12-13-5-6-15-18(2)8-4-9-19(3,17(22)23)14(18)7-10-20(15,11-13)16(12)21/h12-15H,4-11H2,1-3H3,(H,22,23)/t12-,13+,14-,15-,18+,19+,20+/m1/s1","TUIVCCRIADUHNA-OPXKYWMESA-N"
"COC(=O)C(C)(C4)C([H])(C3)C(C)(CC4)C([H])(C2)C(C3)(C1)C(=O)C([H])(C)C([H])(C2)1","InChI=1S/C21H32O3/c1-13-14-6-7-16-19(2)9-5-10-20(3,18(23)24-4)15(19)8-11-21(16,12-14)17(13)22/h13-16H,5-12H2,1-4H3/t13-,14+,15-,16-,19+,20-,21+/m1/s1","PRNXIACAYGXMDC-OFJPHGDMSA-N"
"[2H]C([2H])([2H])Oc(c1)cc(O)c(c1)C(C)=O","InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3/i2D3","UILPJVPSNHJFIK-BMSJAHLVSA-N"
"[2H]C([2H])([2H])Oc(c1)cc(C(C)=O)c(O)c1","InChI=1S/C9H10O3/c1-6(10)8-5-7(12-2)3-4-9(8)11/h3-5,11H,1-2H3/i2D3","MLIBGOFSXXWRIY-BMSJAHLVSA-N"
"COc(c1)c(C(C)=O)c(O)cc1","InChI=1S/C9H10O3/c1-6(10)9-7(11)4-3-5-8(9)12-2/h3-5,11H,1-2H3","UENLHUMCIOWYQN-UHFFFAOYSA-N"
"[2H]C([2H])([2H])Oc(c1)c(C(C)=O)c(O)cc1","InChI=1S/C9H10O3/c1-6(10)9-7(11)4-3-5-8(9)12-2/h3-5,11H,1-2H3/i2D3","UENLHUMCIOWYQN-BMSJAHLVSA-N"
"COc(c1)ccc(c1)C(C)=O","InChI=1S/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H3","NTPLXRHDUXRPNE-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(C(C)=O)c(O)1","InChI=1S/C10H12O4/c1-6(11)10-8(12)4-7(13-2)5-9(10)14-3/h4-5,12H,1-3H3","FBUBVLUPUDBFME-UHFFFAOYSA-N"
"CC(=O)c(c1)c(O)c(O)c(O)c1","InChI=1S/C8H8O4/c1-4(9)5-2-3-6(10)8(12)7(5)11/h2-3,10-12H,1H3","XIROXSOOOAZHLL-UHFFFAOYSA-N"
"CC(C1)C(=O)C(C)=CC1","InChI=1S/C8H12O/c1-6-4-3-5-7(2)8(6)9/h4,7H,3,5H2,1-2H3","OBDPTOBECPVDMB-UHFFFAOYSA-N"
"O=C(C1)C(C)C(=O)CC1","InChI=1S/C7H10O2/c1-5-6(8)3-2-4-7(5)9/h5H,2-4H2,1H3","VSGJHHIAMHUZKF-UHFFFAOYSA-N"
"O=CCC([H])(C)CCC=C(C)C","InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3/t10-/m0/s1","NEHNMFOYXAPHSD-JTQLQIEISA-N"
"OCCC([H])(C)CCCC(C)=C","InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h10-11H,1,4-8H2,2-3H3/t10-/m0/s1","JGQFVRIQXUFPAH-JTQLQIEISA-N"
"CC(=O)C(C1)=C([H])CCC1","InChI=1S/C8H12O/c1-7(9)8-5-3-2-4-6-8/h5H,2-4,6H2,1H3","LTYLUDGDHUEBGX-UHFFFAOYSA-N"
"CC(=O)C(C1)=C([H])CC(O2)(OCC2)C1","InChI=1S/C10H14O3/c1-8(11)9-2-4-10(5-3-9)12-6-7-13-10/h2H,3-7H2,1H3","VKNUGMHPVXDEJF-UHFFFAOYSA-N"
"COC(=O)C(C1)C(C2)C(CCC2)C(=O)C1","InChI=1S/C12H18O3/c1-15-12(14)10-6-7-11(13)9-5-3-2-4-8(9)10/h8-10H,2-7H2,1H3","JPFUEZPXKCRLTQ-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C(C)(C)C([H])(C1)C(=O)CC([H])(C)C1","InChI=1S/C17H24O2/c1-12-5-10-15(16(18)11-12)17(2,3)13-6-8-14(19-4)9-7-13/h6-9,12,15H,5,10-11H2,1-4H3/t12-,15-/m1/s1","WQDWOPQKSKJKPZ-IUODEOHRSA-N"
"C=CC(=O)OC([H])(C2)C([H])(CCC([H])(C)2)C(C)(C)c(c1)ccc(OC)c1","InChI=1S/C20H28O3/c1-6-19(21)23-18-13-14(2)7-12-17(18)20(3,4)15-8-10-16(22-5)11-9-15/h6,8-11,14,17-18H,1,7,12-13H2,2-5H3/t14-,17-,18-/m1/s1","SSBMCNGYTXITRG-ZTFGCOKTSA-N"
"[H]C(C)(C3)CC([H])(O)C([H])(C3)C(C)(C)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C20H26O/c1-14-8-11-18(19(21)12-14)20(2,3)17-10-9-15-6-4-5-7-16(15)13-17/h4-7,9-10,13-14,18-19,21H,8,11-12H2,1-3H3/t14-,18-,19-/m1/s1","AKVNKXYVBBUSEZ-NIKGAXFTSA-N"
"C([H])(C([H])1C(C)(C)c(c4)cc(c3c4)cccc3)(OC(=O)c(c2)cccc2)CC(CC1)([H])C","InChI=1S/C27H30O2/c1-19-13-16-24(25(17-19)29-26(28)21-10-5-4-6-11-21)27(2,3)23-15-14-20-9-7-8-12-22(20)18-23/h4-12,14-15,18-19,24-25H,13,16-17H2,1-3H3/t19-,24-,25-/m1/s1","JRXOQOLTDOHKHN-UKDVSSAZSA-N"
"C=CC(=O)OC([H])(C3)C([H])(CCC([H])(C)3)C(C)(C)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C23H28O2/c1-5-22(24)25-21-14-16(2)10-13-20(21)23(3,4)19-12-11-17-8-6-7-9-18(17)15-19/h5-9,11-12,15-16,20-21H,1,10,13-14H2,2-4H3/t16-,20-,21-/m1/s1","NSKRHMFLTQEJFU-MAODMQOUSA-N"
"c(c12)cccc(ccc(c2c(c4C=CC(O)=O)c(c3)c(cc4)ccc3)C=CC(O)=O)1","InChI=1S/C26H18O4/c27-23(28)15-13-19-11-9-17-5-1-3-7-21(17)25(19)26-20(14-16-24(29)30)12-10-18-6-2-4-8-22(18)26/h1-16H,(H,27,28)(H,29,30)/b15-13+,16-14+","WDKPJHDWIXCUKA-WXUKJITCSA-N"
"COc(c2)ccc(c2)C(C)(C)C([H])(C1)C([H])(O)CC([H])(C)C1","InChI=1S/C17H26O2/c1-12-5-10-15(16(18)11-12)17(2,3)13-6-8-14(19-4)9-7-13/h6-9,12,15-16,18H,5,10-11H2,1-4H3/t12-,15-,16-/m1/s1","TYFKWJZQXPHTGK-DAXOMENPSA-N"
"C=CC(=O)OC([H])(C1)C([H])(C(C)C)CCC([H])(C)1","InChI=1S/C13H22O2/c1-5-13(14)15-12-8-10(4)6-7-11(12)9(2)3/h5,9-12H,1,6-8H2,2-4H3/t10-,11+,12-/m1/s1","XJBRSZAYOKVFRH-GRYCIOLGSA-N"
"Brc(c3)ccc(c3)C(=O)OC([H])(C2)C(C)(C1)C(CC2)=C(C)C(=O)C1","InChI=1S/C19H21BrO3/c1-12-15-4-3-5-17(19(15,2)11-10-16(12)21)23-18(22)13-6-8-14(20)9-7-13/h6-9,17H,3-5,10-11H2,1-2H3/t17-,19-/m0/s1","VLZZWVVPCSKXNE-HKUYNNGSSA-N"
"O=C(C2)C(C)=C(C1)C(C)(C2)C(=O)C1","InChI=1S/C11H14O2/c1-7-8-3-4-10(13)11(8,2)6-5-9(7)12/h3-6H2,1-2H3/t11-/m0/s1","NERGSGSEJNCZBN-NSHDSACASA-N"
"O=C(C1)C(C)=C(C2)C(C)(CCC2)C1","InChI=1S/C12H18O/c1-9-10-5-3-4-7-12(10,2)8-6-11(9)13/h3-8H2,1-2H3","WNVZKCBLUKHUBI-UHFFFAOYSA-N"
"C=CCCBr","InChI=1S/C4H7Br/c1-2-3-4-5/h2H,1,3-4H2","DMAYBPBPEUFIHJ-UHFFFAOYSA-N"
"CC(=O)C(C1)C1","InChI=1S/C5H8O/c1-4(6)5-2-3-5/h5H,2-3H2,1H3","HVCFCNAITDHQFX-UHFFFAOYSA-N"
"O=C(C1)C(C)C(=O)C1","InChI=1S/C6H8O2/c1-4-5(7)2-3-6(4)8/h4H,2-3H2,1H3","HXZILEQYFQYQCE-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(c2)c(ccc2)c1","InChI=1S/C12H10O2/c1-9(13)14-12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,1H3","RJNPPEUAJCEUPV-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(ccc(C)1)C(C)C","InChI=1S/C12H16O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h5-8H,1-4H3","WFMIUXMJJBBOGJ-UHFFFAOYSA-N"
"CC(=O)OCc(c1)cc(O2)c(OC2)c1","InChI=1S/C10H10O4/c1-7(11)12-5-8-2-3-9-10(4-8)14-6-13-9/h2-4H,5-6H2,1H3","PFWYHTORQZAGCA-UHFFFAOYSA-N"
"CC=Cc(c1)cc(OC)c(OC(C)=O)c1","InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+","IUSBVFZKQJGVEP-SNAWJCMRSA-N"
"C=CCOC(=O)CC","InChI=1S/C6H10O2/c1-3-5-8-6(7)4-2/h3H,1,4-5H2,2H3","XRFWKHVQMACVTA-UHFFFAOYSA-N"
"CCC(=O)OC(C)(C)C","InChI=1S/C7H14O2/c1-5-6(8)9-7(2,3)4/h5H2,1-4H3","JAELLLITIZHOGQ-UHFFFAOYSA-N"
"CCCCCOC(=O)CC","InChI=1S/C8H16O2/c1-3-5-6-7-10-8(9)4-2/h3-7H2,1-2H3","TWSRVQVEYJNFKQ-UHFFFAOYSA-N"
"CCC(=O)OCCC(C)C","InChI=1S/C8H16O2/c1-4-8(9)10-6-5-7(2)3/h7H,4-6H2,1-3H3","XAOGXQMKWQFZEM-UHFFFAOYSA-N"
"CCC=CCCOC(=O)CC","InChI=1S/C9H16O2/c1-3-5-6-7-8-11-9(10)4-2/h5-6H,3-4,7-8H2,1-2H3/b6-5-","LGTLDEUQCOJGFP-WAYWQWQTSA-N"
"CCCCCCOC(=O)CC","InChI=1S/C9H18O2/c1-3-5-6-7-8-11-9(10)4-2/h3-8H2,1-2H3","GOKKOFHHJFGZHW-UHFFFAOYSA-N"
"CCCC(CC)OC(=O)CC","InChI=1S/C9H18O2/c1-4-7-8(5-2)11-9(10)6-3/h8H,4-7H2,1-3H3","GYZCKXAOGZSSCT-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)CCC","InChI=1S/C12H24O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h3-11H2,1-2H3","PWLNAUNEAKQYLH-UHFFFAOYSA-N"
"CCCCCCCCCCOC(=O)CCC","InChI=1S/C14H28O2/c1-3-5-6-7-8-9-10-11-13-16-14(15)12-4-2/h3-13H2,1-2H3","PUCQHFICPFUPKW-UHFFFAOYSA-N"
"CCCCCCCCCCCOC(=O)CCC","InChI=1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-14-17-15(16)13-4-2/h3-14H2,1-2H3","DPMDQRRFSVRUMR-UHFFFAOYSA-N"
"CCCC(=O)OCC(C1)=CCC(C(C)=C)C1","InChI=1S/C14H22O2/c1-4-5-14(15)16-10-12-6-8-13(9-7-12)11(2)3/h6,13H,2,4-5,7-10H2,1,3H3","HAQGPJPCMFOGLO-UHFFFAOYSA-N"
"CCCC(=O)OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C14H24O2/c1-5-6-12(15)16-11-9-10-7-8-14(11,4)13(10,2)3/h10-11H,5-9H2,1-4H3","VIPNQHBVIDJXJE-UHFFFAOYSA-N"
"CCCC(=O)OCC=C(C)CCC=C(C)C","InChI=1S/C14H24O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,10H,5-7,9,11H2,1-4H3/b13-10+","ZSBOMYJPSRFZAL-JLHYYAGUSA-N"
"CCCC(=O)OC(C)(C=C)CCC=C(C)C","InChI=1S/C14H24O2/c1-6-9-13(15)16-14(5,7-2)11-8-10-12(3)4/h7,10H,2,6,8-9,11H2,1,3-5H3","FHLGUOHLUFIAAA-UHFFFAOYSA-N"
"CCCC(=O)OC(C1)C(C)=CCC(C(C)=C)1","InChI=1S/C14H22O2/c1-5-6-14(15)16-13-9-12(10(2)3)8-7-11(13)4/h7,12-13H,2,5-6,8-9H2,1,3-4H3/t12-,13+/m1/s1","NFYWZJFDZXGDJZ-OLZOCXBDSA-N"
"CCCC(=O)OC(C)(C)C([H])(C1)CC=C(C)C1","InChI=1S/C14H24O2/c1-5-6-13(15)16-14(3,4)12-9-7-11(2)8-10-12/h7,12H,5-6,8-10H2,1-4H3/t12-/m0/s1","LWKWNIYBQLKBMQ-LBPRGKRZSA-N"
"CCCC(=O)OCCC(C)CCC=C(C)C","InChI=1S/C14H26O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3","XQPZQXTWYZAXAK-UHFFFAOYSA-N"
"CCCC(=O)OC(C1)C(CCC(C)1)C(C)C","InChI=1S/C14H26O2/c1-5-6-14(15)16-13-9-11(4)7-8-12(13)10(2)3/h10-13H,5-9H2,1-4H3","PHCRRQSBYWJFBQ-UHFFFAOYSA-N"
"CCCC(=O)OCCC(C)CCCC(C)C","InChI=1S/C14H28O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h12-13H,5-11H2,1-4H3","MHOJKRQFONEPRN-UHFFFAOYSA-N"
"CCCC(=O)OCc(c1)occ1","InChI=1S/C9H12O3/c1-2-4-9(10)12-7-8-5-3-6-11-8/h3,5-6H,2,4,7H2,1H3","IXISGRHWGVGCAK-UHFFFAOYSA-N"
"CCCC(=O)Oc(c1)ccc(C)c1","InChI=1S/C11H14O2/c1-3-4-11(12)13-10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3","RRXBRABFDRJAPX-UHFFFAOYSA-N"
"CCCC(=O)OCCc(c1)cccc1","InChI=1S/C12H16O2/c1-2-6-12(13)14-10-9-11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3","WFNDDSQUKATKNX-UHFFFAOYSA-N"
"CCCC(=O)OC(C)c(c1)cccc1","InChI=1S/C12H16O2/c1-3-7-12(13)14-10(2)11-8-5-4-6-9-11/h4-6,8-10H,3,7H2,1-2H3","GGKADXREVJTZMF-UHFFFAOYSA-N"
"CCCC(=O)OCC=Cc(c1)cccc1","InChI=1S/C13H16O2/c1-2-7-13(14)15-11-6-10-12-8-4-3-5-9-12/h3-6,8-10H,2,7,11H2,1H3/b10-6+","YZYPQKZWNXANRB-UXBLZVDNSA-N"
"CCCCCCC(=O)OCCC","InChI=1S/C10H20O2/c1-3-5-6-7-8-10(11)12-9-4-2/h3-9H2,1-2H3","UWZVPQKWYFZLLW-UHFFFAOYSA-N"
"CCCCCCC(=O)OC(C)C","InChI=1S/C10H20O2/c1-4-5-6-7-8-10(11)12-9(2)3/h9H,4-8H2,1-3H3","RMQUEHVMCJEEOS-UHFFFAOYSA-N"
"CCCCCCC(=O)OCCCC","InChI=1S/C11H22O2/c1-3-5-7-8-9-11(12)13-10-6-4-2/h3-10H2,1-2H3","YPQSPODHFDGVAC-UHFFFAOYSA-N"
"CCCCCCC(=O)OCCCCC","InChI=1S/C12H24O2/c1-3-5-7-8-10-12(13)14-11-9-6-4-2/h3-11H2,1-2H3","PSQMUBJRXIGVIT-UHFFFAOYSA-N"
"CCCCCCC(=O)OCCC(C)C","InChI=1S/C12H24O2/c1-4-5-6-7-8-12(13)14-10-9-11(2)3/h11H,4-10H2,1-3H3","AFCXVDRTNQNGHS-UHFFFAOYSA-N"
"CCCCCCCOC(=O)CCCCCC","InChI=1S/C14H28O2/c1-3-5-7-9-11-13-16-14(15)12-10-8-6-4-2/h3-13H2,1-2H3","QOIIBPAJVWFEPE-UHFFFAOYSA-N"
"CCCCCCC(=O)Oc(c1)ccc(C)c1","InChI=1S/C14H20O2/c1-3-4-5-6-7-14(15)16-13-10-8-12(2)9-11-13/h8-11H,3-7H2,1-2H3","AGWLNVFDVVPLDL-UHFFFAOYSA-N"
"CCCCC=CC(=O)OC","InChI=1S/C8H14O2/c1-3-4-5-6-7-8(9)10-2/h6-7H,3-5H2,1-2H3/b7-6+","IQQDLHGWGKEQDS-VOTSOKGWSA-N"
"CCCCCCCC(=O)OCC=C","InChI=1S/C11H20O2/c1-3-5-6-7-8-9-11(12)13-10-4-2/h4H,2-3,5-10H2,1H3","PZGMUSDNQDCNAG-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCCC","InChI=1S/C11H22O2/c1-3-5-6-7-8-9-11(12)13-10-4-2/h3-10H2,1-2H3","IDHBLVYDNJDWNO-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCCCCCC","InChI=1S/C14H28O2/c1-3-5-7-9-10-12-14(15)16-13-11-8-6-4-2/h3-13H2,1-2H3","PBGWNXWNCSSXCO-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCc(c1)cccc1","InChI=1S/C15H22O2/c1-2-3-4-5-9-12-15(16)17-13-14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3","MWQWCHLIPMDVLS-UHFFFAOYSA-N"
"CC(C3)(O3)C(C2)CC(O1)C(C)(C2)1","InChI=1S/C10H16O2/c1-9-4-3-7(5-8(9)12-9)10(2)6-11-10/h7-8H,3-6H2,1-2H3","RBHIUNHSNSQJNG-UHFFFAOYSA-N"
"c(c2)cc(o2)COCc(c1)occ1","InChI=1S/C10H10O3/c1-3-9(12-5-1)7-11-8-10-4-2-6-13-10/h1-6H,7-8H2","YEQMNLGBLPBBNI-UHFFFAOYSA-N"
"CCC(=O)C=C","InChI=1S/C5H8O/c1-3-5(6)4-2/h3H,1,4H2,2H3","JLIDVCMBCGBIEY-UHFFFAOYSA-N"
"CCC(C)C(C)=O","InChI=1S/C6H12O/c1-4-5(2)6(3)7/h5H,4H2,1-3H3","UIHCLUNTQKBZGK-UHFFFAOYSA-N"
"CCC(=O)CC(C)C","InChI=1S/C7H14O/c1-4-7(8)5-6(2)3/h6H,4-5H2,1-3H3","DXVYLFHTJZWTRF-UHFFFAOYSA-N"
"COC=O","InChI=1S/C2H4O2/c1-4-2-3/h2H,1H3","TZIHFWKZFHZASV-UHFFFAOYSA-N"
"CCOC=O","InChI=1S/C3H6O2/c1-2-5-3-4/h3H,2H2,1H3","WBJINCZRORDGAQ-UHFFFAOYSA-N"
"C=CCOC=O","InChI=1S/C4H6O2/c1-2-3-6-4-5/h2,4H,1,3H2","ZHHZHHSFKCANOC-UHFFFAOYSA-N"
"CCCOC=O","InChI=1S/C4H8O2/c1-2-3-6-4-5/h4H,2-3H2,1H3","KFNNIILCVOLYIR-UHFFFAOYSA-N"
"O=COC(C)C","InChI=1S/C4H8O2/c1-4(2)6-3-5/h3-4H,1-2H3","RMOUBSOVHSONPZ-UHFFFAOYSA-N"
"CCCCCOC=O","InChI=1S/C6H12O2/c1-2-3-4-5-8-6-7/h6H,2-5H2,1H3","DIQMPQMYFZXDAX-UHFFFAOYSA-N"
"O=COCCC(C)C","InChI=1S/C6H12O2/c1-6(2)3-4-8-5-7/h5-6H,3-4H2,1-2H3","XKYICAQFSCFURC-UHFFFAOYSA-N"
"CCC=CCCOC=O","InChI=1S/C7H12O2/c1-2-3-4-5-6-9-7-8/h3-4,7H,2,5-6H2,1H3/b4-3-","XJHQVZQZUGLZLS-ARJAWSKDSA-N"
"CCCCCCOC=O","InChI=1S/C7H14O2/c1-2-3-4-5-6-9-7-8/h7H,2-6H2,1H3","OUGPMNMLWKSBRI-UHFFFAOYSA-N"
"CCCCCCCOC=O","InChI=1S/C8H16O2/c1-2-3-4-5-6-7-10-8-9/h8H,2-7H2,1H3","XEAMDSXSXYAICO-UHFFFAOYSA-N"
"CCCCCCCCOC=O","InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-11-9-10/h9H,2-8H2,1H3","AVBRYQRTMPHARE-UHFFFAOYSA-N"
"CCCCCCCCCCCCOC=O","InChI=1S/C13H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-15-13-14/h13H,2-12H2,1H3","WPSGFSPBRBRLIQ-UHFFFAOYSA-N"
"O=COC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C11H18O2/c1-10(2)8-4-5-11(10,3)9(6-8)13-7-12/h7-9H,4-6H2,1-3H3","RDWUNORUTVEHJF-UHFFFAOYSA-N"
"O=COCC([H])=C(C)CCC=C(C)C","InChI=1S/C11H18O2/c1-10(2)5-4-6-11(3)7-8-13-9-12/h5,7,9H,4,6,8H2,1-3H3/b11-7+","FQMZVFJYMPNUCT-YRNVUSSQSA-N"
"O=COC(C)(C=C)CCC=C(C)C","InChI=1S/C11H18O2/c1-5-11(4,13-9-12)8-6-7-10(2)3/h5,7,9H,1,6,8H2,2-4H3","JZOCDHMHLGUPFI-UHFFFAOYSA-N"
"O=COC(C1)C(CCC(C)1)C(C)C","InChI=1S/C11H20O2/c1-8(2)10-5-4-9(3)6-11(10)13-7-12/h7-11H,4-6H2,1-3H3","XEYZAKCJAFSLGZ-UHFFFAOYSA-N"
"O=COCC([H])=C(C)CCC=C(C)C","InChI=1S/C11H18O2/c1-10(2)5-4-6-11(3)7-8-13-9-12/h5,7,9H,4,6,8H2,1-3H3/b11-7-","FQMZVFJYMPNUCT-XFFZJAGNSA-N"
"O=COC(C)(C)C(C1)CC=C(C)C1","InChI=1S/C11H18O2/c1-9-4-6-10(7-5-9)11(2,3)13-8-12/h4,8,10H,5-7H2,1-3H3","IPYLQIQMGUZFCK-UHFFFAOYSA-N"
"O=COCCC(C)CCC=C(C)C","InChI=1S/C11H20O2/c1-10(2)5-4-6-11(3)7-8-13-9-12/h5,9,11H,4,6-8H2,1-3H3","DZNVIZQPWLDQHI-UHFFFAOYSA-N"
"CC(=O)OC(C)(C)C(C1)CC=C(C)C1","InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3","IGODOXYLBBXFDW-UHFFFAOYSA-N"
"CC(=O)OC(C)(C1)CCC(C(C)=C)C1","InChI=1S/C12H20O2/c1-9(2)11-5-7-12(4,8-6-11)14-10(3)13/h11H,1,5-8H2,2-4H3","URVNHQCLMBMWIW-UHFFFAOYSA-N"
"CC(=O)OC(C1)(CC=C(C)C1)C(C)C","InChI=1S/C12H20O2/c1-9(2)12(14-11(4)13)7-5-10(3)6-8-12/h5,9H,6-8H2,1-4H3","BFCBRSFYYLSTAA-UHFFFAOYSA-N"
"CC(C)=CCCC(C)CCOC(C)=O","InChI=1S/C12H22O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,11H,5,7-9H2,1-4H3","JOZKFWLRHCDGJA-UHFFFAOYSA-N"
"CC(=O)OC(C1)C(CCC(C)1)C(C)C","InChI=1S/C12H22O2/c1-8(2)11-6-5-9(3)7-12(11)14-10(4)13/h8-9,11-12H,5-7H2,1-4H3","XHXUANMFYXWVNG-UHFFFAOYSA-N"
"CC(=O)OC(C)(C3)C([H])(C1)C(C)(C)C([H])(C2)C(C3)(C([H])(C)C2)1","InChI=1S/C17H28O2/c1-11-6-7-13-15(3,4)14-10-17(11,13)9-8-16(14,5)19-12(2)18/h11,13-14H,6-10H2,1-5H3/t11-,13+,14-,16-,17?/m1/s1","HQKQRXZEXPXXIG-WRHXGLHUSA-N"
"CC(C)=CCCC(C)=C([H])CCC(C)(C=C)OC(C)=O","InChI=1S/C17H28O2/c1-7-17(6,19-16(5)18)13-9-12-15(4)11-8-10-14(2)3/h7,10,12H,1,8-9,11,13H2,2-6H3/b15-12-/t17-/m0/s1","PRNJXUQTUSFYLV-KSVUCXBSSA-N"
"CC(C)=CCCC(C)=C([H])CCC(C)(C=C)OC(C)=O","InChI=1S/C17H28O2/c1-7-17(6,19-16(5)18)13-9-12-15(4)11-8-10-14(2)3/h7,10,12H,1,8-9,11,13H2,2-6H3/b15-12+","PRNJXUQTUSFYLV-NTCAYCPXSA-N"
"CCC(=O)OCC=Cc(c1)cccc1","InChI=1S/C12H14O2/c1-2-12(13)14-10-6-9-11-7-4-3-5-8-11/h3-9H,2,10H2,1H3/b9-6+","KGDJMNKPBUNHGY-RMKNXTFCSA-N"
"C=CCOC(=O)CCC(C1)CCCC1","InChI=1S/C12H20O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h2,11H,1,3-10H2","TWXUTZNBHUWMKJ-UHFFFAOYSA-N"
"CC(C)COC(=O)CCc(c1)occ1","InChI=1S/C11H16O3/c1-9(2)8-14-11(12)6-5-10-4-3-7-13-10/h3-4,7,9H,5-6,8H2,1-2H3","SVDPTFHRRNUNRS-UHFFFAOYSA-N"
"C=CCOC(=O)CCC","InChI=1S/C7H12O2/c1-3-5-7(8)9-6-4-2/h4H,2-3,5-6H2,1H3","RMZIOVJHUJAAEY-UHFFFAOYSA-N"
"CCCC(=O)OCC(C)=C","InChI=1S/C8H14O2/c1-4-5-8(9)10-6-7(2)3/h2,4-6H2,1,3H3","AHRIFIYGSJEEKU-UHFFFAOYSA-N"
"CCCC=CCOC(=O)CCC","InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h6-7H,3-5,8-9H2,1-2H3/b7-6+","PCGACKLJNBBQGM-VOTSOKGWSA-N"
"CCC=CCCOC(=O)CCC","InChI=1S/C10H18O2/c1-3-5-6-7-9-12-10(11)8-4-2/h5-6H,3-4,7-9H2,1-2H3/b6-5-","ZCHOPXVYTWUHDS-WAYWQWQTSA-N"
"CCCCCCOC(=O)CCC","InChI=1S/C10H20O2/c1-3-5-6-7-9-12-10(11)8-4-2/h3-9H2,1-2H3","XAPCMTMQBXLDBB-UHFFFAOYSA-N"
"CCCCC(C)OC(=O)CCC","InChI=1S/C10H20O2/c1-4-6-8-9(3)12-10(11)7-5-2/h9H,4-8H2,1-3H3","LRUMZDICEGQZIB-UHFFFAOYSA-N"
"CCCC(=O)OC(CC)CCC","InChI=1S/C10H20O2/c1-4-7-9(6-3)12-10(11)8-5-2/h9H,4-8H2,1-3H3","RCEHZMJZHHUGOL-UHFFFAOYSA-N"
"CCCC(C)COC(=O)CCC","InChI=1S/C10H20O2/c1-4-6-9(3)8-12-10(11)7-5-2/h9H,4-8H2,1-3H3","DBEUZPOZVLFSAV-UHFFFAOYSA-N"
"CCCCCCCOC(=O)CCC","InChI=1S/C11H22O2/c1-3-5-6-7-8-10-13-11(12)9-4-2/h3-10H2,1-2H3","JPQHLIYIQARLQM-UHFFFAOYSA-N"
"CCCC=CCOC(=O)CCCC","InChI=1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7+","WDXAMNXWZLXISB-BQYQJAHWSA-N"
"CCCCCCOC(=O)CCCC","InChI=1S/C11H22O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h3-10H2,1-2H3","YERFHJZYNMRVLO-UHFFFAOYSA-N"
"CCCCC(=O)OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C15H26O2/c1-5-6-7-13(16)17-12-10-11-8-9-15(12,4)14(11,2)3/h11-12H,5-10H2,1-4H3","ILUAVCBOWYHFAI-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCOC(=O)CC(C)C","InChI=1S/C15H26O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,9,13H,6,8,10-11H2,1-5H3/b14-9+","SOUKTGNMIRUIQN-NTEUORMPSA-N"
"CCCCC(=O)OCCC(C)CCC=C(C)C","InChI=1S/C15H28O2/c1-5-6-10-15(16)17-12-11-14(4)9-7-8-13(2)3/h8,14H,5-7,9-12H2,1-4H3","PFOJEJPZUVQHEH-UHFFFAOYSA-N"
"CCCCC(=O)OC(C1)C(CCC(C)1)C(C)C","InChI=1S/C15H28O2/c1-5-6-7-15(16)17-14-10-12(4)8-9-13(14)11(2)3/h11-14H,5-10H2,1-4H3","LCJPVSLESAPYMK-UHFFFAOYSA-N"
"CCCCC(=O)OCc(c1)cccc1","InChI=1S/C12H16O2/c1-2-3-9-12(13)14-10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3","YZJCDVRXBOPXSQ-UHFFFAOYSA-N"
"CCCCC(=O)Oc(c1)ccc(C)c1","InChI=1S/C12H16O2/c1-3-4-5-12(13)14-11-8-6-10(2)7-9-11/h6-9H,3-5H2,1-2H3","XDIFYXKFWPNGRV-UHFFFAOYSA-N"
"CCCCC(=O)OCc(c1)occ1","InChI=1S/C10H14O3/c1-2-3-6-10(11)13-8-9-5-4-7-12-9/h4-5,7H,2-3,6,8H2,1H3","HRYAVTBTUKVHBU-UHFFFAOYSA-N"
"CCCCC(=O)OC(C1)CCCC1","InChI=1S/C11H20O2/c1-2-3-9-11(12)13-10-7-5-4-6-8-10/h10H,2-9H2,1H3","YLCHTSSXNSNXSW-UHFFFAOYSA-N"
"C=CCOC(=O)CC(C)C","InChI=1S/C8H14O2/c1-4-5-10-8(9)6-7(2)3/h4,7H,1,5-6H2,2-3H3","HOMAGVUCNZNWBC-UHFFFAOYSA-N"
"CCCOC(=O)CC(C)C","InChI=1S/C8H16O2/c1-4-5-10-8(9)6-7(2)3/h7H,4-6H2,1-3H3","LSJMDWFAADPNAX-UHFFFAOYSA-N"
"CC(C)CC(=O)OC(C)C","InChI=1S/C8H16O2/c1-6(2)5-8(9)10-7(3)4/h6-7H,5H2,1-4H3","ZOIRKXLFEHOVER-UHFFFAOYSA-N"
"CCCCOC(=O)CC(C)C","InChI=1S/C9H18O2/c1-4-5-6-11-9(10)7-8(2)3/h8H,4-7H2,1-3H3","AYWJSCLAAPJZEF-UHFFFAOYSA-N"
"CCC(C)COC(=O)CC(C)C","InChI=1S/C10H20O2/c1-5-9(4)7-12-10(11)6-8(2)3/h8-9H,5-7H2,1-4H3","CYGPPWVXOWCHJB-UHFFFAOYSA-N"
"CCCC=CCOC(=O)CC(C)C","InChI=1S/C11H20O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h6-7,10H,4-5,8-9H2,1-3H3/b7-6+","SAVRWHQEMHIAEB-VOTSOKGWSA-N"
"CCCCCCOC(=O)CC(C)C","InChI=1S/C11H22O2/c1-4-5-6-7-8-13-11(12)9-10(2)3/h10H,4-9H2,1-3H3","RSDDTPVXLMVLQE-UHFFFAOYSA-N"
"CCCCCCCOC(=O)CC(C)C","InChI=1S/C12H24O2/c1-4-5-6-7-8-9-14-12(13)10-11(2)3/h11H,4-10H2,1-3H3","NPBMPHKEFVCCEY-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)CC(C)C","InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-15-13(14)11-12(2)3/h12H,4-11H2,1-3H3","FUBGRVHGQADOJI-UHFFFAOYSA-N"
"CCCCCCCCCOC(=O)CC(C)C","InChI=1S/C14H28O2/c1-4-5-6-7-8-9-10-11-16-14(15)12-13(2)3/h13H,4-12H2,1-3H3","JHKZVDVMXZGMOX-UHFFFAOYSA-N"
"CCCCCOC(=O)CC(C)C","InChI=1S/C10H20O2/c1-4-5-6-7-12-10(11)8-9(2)3/h9H,4-8H2,1-3H3","QURFFFCYNQXLCU-UHFFFAOYSA-N"
"CCCCC(=O)OCC=C(C)CCC=C(C)C","InChI=1S/C15H26O2/c1-5-6-10-15(16)17-12-11-14(4)9-7-8-13(2)3/h8,11H,5-7,9-10,12H2,1-4H3/b14-11+","CVSWGLSBJFKWMW-SDNWHVSQSA-N"
"C=CCOC(=O)CCC(C)C","InChI=1S/C9H16O2/c1-4-7-11-9(10)6-5-8(2)3/h4,8H,1,5-7H2,2-3H3","HXQZJNMRGBBCDJ-UHFFFAOYSA-N"
"CC(C)CCOC(=O)CCC(C)C","InChI=1S/C11H22O2/c1-9(2)5-6-11(12)13-8-7-10(3)4/h9-10H,5-8H2,1-4H3","XGGPQUVMPUGUIC-UHFFFAOYSA-N"
"CCCC(C)C(=O)OCC","InChI=1S/C8H16O2/c1-4-6-7(3)8(9)10-5-2/h7H,4-6H2,1-3H3","HZPKNSYIDSNZKW-UHFFFAOYSA-N"
"CCOC(=O)CCC(C)C","InChI=1S/C8H16O2/c1-4-10-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3","OFQRUTMGVBMTFQ-UHFFFAOYSA-N"
"CCCC=CCOC(=O)CC","InChI=1S/C9H16O2/c1-3-5-6-7-8-11-9(10)4-2/h6-7H,3-5,8H2,1-2H3/b7-6+","LPWKTEHEFDVAQS-VOTSOKGWSA-N"
"CCCC(=O)OCC=C(C)CCC=C(C)C","InChI=1S/C14H24O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,10H,5-7,9,11H2,1-4H3/b13-10-","ZSBOMYJPSRFZAL-RAXLEYEMSA-N"
"CCCCCC(=O)OC(C)c(c1)cccc1","InChI=1S/C14H20O2/c1-3-4-6-11-14(15)16-12(2)13-9-7-5-8-10-13/h5,7-10,12H,3-4,6,11H2,1-2H3","XDNXTDFSRYCZFT-UHFFFAOYSA-N"
"CCCCCCC(=O)OCC","InChI=1S/C9H18O2/c1-3-5-6-7-8-9(10)11-4-2/h3-8H2,1-2H3","TVQGDYNRXLTQAP-UHFFFAOYSA-N"
"CCCCCCC(=O)OCC=C","InChI=1S/C10H18O2/c1-3-5-6-7-8-10(11)12-9-4-2/h4H,2-3,5-9H2,1H3","SJWKGDGUQTWDRV-UHFFFAOYSA-N"
"CCCCCCC(=O)OCC(C)C","InChI=1S/C11H22O2/c1-4-5-6-7-8-11(12)13-9-10(2)3/h10H,4-9H2,1-3H3","HXJOYVPESRRCDB-UHFFFAOYSA-N"
"CCCCC(CC)C(=O)OCC","InChI=1S/C10H20O2/c1-4-7-8-9(5-2)10(11)12-6-3/h9H,4-8H2,1-3H3","YXAGIRHBJJLWHW-UHFFFAOYSA-N"
"CCCCCCCCCCC(=O)OC","InChI=1S/C12H24O2/c1-3-4-5-6-7-8-9-10-11-12(13)14-2/h3-11H2,1-2H3","XPQPWPZFBULGKT-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OCC","InChI=1S/C14H28O2/c1-3-5-6-7-8-9-10-11-12-13-14(15)16-4-2/h3-13H2,1-2H3","MMXKVMNBHPAILY-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OCCC","InChI=1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-13-15(16)17-14-4-2/h3-14H2,1-2H3","FTBUKOLPOATXGV-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OC(C)C","InChI=1S/C15H30O2/c1-4-5-6-7-8-9-10-11-12-13-15(16)17-14(2)3/h14H,4-13H2,1-3H3","UJPPXNXOEVDSRW-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OCC(C)C","InChI=1S/C16H32O2/c1-4-5-6-7-8-9-10-11-12-13-16(17)18-14-15(2)3/h15H,4-14H2,1-3H3","SZFOMJOELAAHAF-UHFFFAOYSA-N"
"OCCC(C)CC","InChI=1S/C6H14O/c1-3-6(2)4-5-7/h6-7H,3-5H2,1-2H3","IWTBVKIGCDZRPL-UHFFFAOYSA-N"
"OCCCC(C)C","InChI=1S/C6H14O/c1-6(2)4-3-5-7/h6-7H,3-5H2,1-2H3","PCWGTDULNUVNBN-UHFFFAOYSA-N"
"CCCC(C)(C)O","InChI=1S/C6H14O/c1-4-5-6(2,3)7/h7H,4-5H2,1-3H3","WFRBDWRZVBPBDO-UHFFFAOYSA-N"
"CCCCC(O)CCCC","InChI=1S/C9H20O/c1-3-5-7-9(10)8-6-4-2/h9-10H,3-8H2,1-2H3","FCBBRODPXVPZAH-UHFFFAOYSA-N"
"OC(C1)C=CCC1","InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h2,4,6-7H,1,3,5H2","PQANGXXSEABURG-UHFFFAOYSA-N"
"OC(C1)CC([H])(C2)C([H])(CCC2)C1","InChI=1S/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2/t8-,9-,10?/m0/s1","UPMAOXLCTXPPAG-XMCUXHSSSA-N"
"OCC(C1)OCC1","InChI=1S/C5H10O2/c6-4-5-2-1-3-7-5/h5-6H,1-4H2","BSYVTEYKTMYBMK-UHFFFAOYSA-N"
"CC(C)(O)c(c1)cccc1","InChI=1S/C9H12O/c1-9(2,10)8-6-4-3-5-7-8/h3-7,10H,1-2H3","BDCFWIDZNLCTMF-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)C(C)O","InChI=1S/C9H12O/c1-7-3-5-9(6-4-7)8(2)10/h3-6,8,10H,1-2H3","JESIHYIJKKUWIS-UHFFFAOYSA-N"
"OCC(C)c(c1)cccc1","InChI=1S/C9H12O/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3","RNDNSYIPLPAXAZ-UHFFFAOYSA-N"
"CC(C)(O)Cc(c1)cccc1","InChI=1S/C10H14O/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7,11H,8H2,1-2H3","RIWRBSMFKVOJMN-UHFFFAOYSA-N"
"CCC(C)(O)Cc(c1)cccc1","InChI=1S/C11H16O/c1-3-11(2,12)9-10-7-5-4-6-8-10/h4-8,12H,3,9H2,1-2H3","FTZBYXCNXOPJEL-UHFFFAOYSA-N"
"CCC(C)(O)CCc(c1)cccc1","InChI=1S/C12H18O/c1-3-12(2,13)10-9-11-7-5-4-6-8-11/h4-8,13H,3,9-10H2,1-2H3","AEJRTNBCFUOSEM-UHFFFAOYSA-N"
"CC(C)CC(O)Cc(c1)cccc1","InChI=1S/C12H18O/c1-10(2)8-12(13)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3","IUADYGVMSDKSMB-UHFFFAOYSA-N"
"OCc(c1)c(OC)ccc1","InChI=1S/C8H10O2/c1-10-8-5-3-2-4-7(8)6-9/h2-5,9H,6H2,1H3","WYLYBQSHRJMURN-UHFFFAOYSA-N"
"COc(c1)cc(c2)c(ccc2)c1","InChI=1S/C11H10O/c1-12-11-7-6-9-4-2-3-5-10(9)8-11/h2-8H,1H3","LUZDYPLAQQGJEA-UHFFFAOYSA-N"
"CCOc(c1)c(OCC)ccc1","InChI=1S/C10H14O2/c1-3-11-9-7-5-6-8-10(9)12-4-2/h5-8H,3-4H2,1-2H3","QZYDOKBVZJLQCK-UHFFFAOYSA-N"
"CCOc(c1)cc(c2)c(ccc2)c1","InChI=1S/C12H12O/c1-2-13-12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,2H2,1H3","GUMOJENFFHZAFP-UHFFFAOYSA-N"
"CC(C)CCOCCc(c1)cccc1","InChI=1S/C13H20O/c1-12(2)8-10-14-11-9-13-6-4-3-5-7-13/h3-7,12H,8-11H2,1-2H3","BHQBQWOZHYUVTL-UHFFFAOYSA-N"
"CC(C)COc(c1)cc(c2)c(ccc2)c1","InChI=1S/C14H16O/c1-11(2)10-15-14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11H,10H2,1-2H3","XOHIHZHSDMWWMS-UHFFFAOYSA-N"
"C=CCOCC(C1)O1","InChI=1S/C6H10O2/c1-2-3-7-4-6-5-8-6/h2,6H,1,3-5H2","LSWYGACWGAICNM-UHFFFAOYSA-N"
"CC(=C)C(C2)CC([H])(O1)C(C)(C2)1","InChI=1S/C10H16O/c1-7(2)8-4-5-10(3)9(6-8)11-10/h8-9H,1,4-6H2,2-3H3/t8?,9-,10-/m0/s1","CCEFMUBVSUDRLG-AGROOBSYSA-N"
"CC(C)(C23)C(C3)C(C)(O1)C(C2)1","InChI=1S/C10H16O/c1-9(2)6-4-7(9)10(3)8(5-6)11-10/h6-8H,4-5H2,1-3H3","NQFUSWIGRKFAHK-UHFFFAOYSA-N"
"CC(C)C(C2)(C1)OC(C)(C2)C1","InChI=1S/C10H18O/c1-8(2)10-6-4-9(3,11-10)5-7-10/h8H,4-7H2,1-3H3","RFFOTVCVTJUTAD-UHFFFAOYSA-N"
"O=C(C2)C(CCC2)C(C1)CCCC1","InChI=1S/C12H20O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h10-11H,1-9H2","UOBQDYFTAJKQAL-UHFFFAOYSA-N"
"CCCCCCCC(C1)C(=O)CC1","InChI=1S/C12H22O/c1-2-3-4-5-6-8-11-9-7-10-12(11)13/h11H,2-10H2,1H3","PJXHBTZLHITWFX-UHFFFAOYSA-N"
"CCCCCCCCC(C1)CCC(=O)C1","InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-13-9-11-14(15)12-10-13/h13H,2-12H2,1H3","PKOWPSHVZJGPOJ-UHFFFAOYSA-N"
"O=C(C1)C(=O)CCC1","InChI=1S/C6H8O2/c7-5-3-1-2-4-6(5)8/h1-4H2","OILAIQUEIWYQPH-UHFFFAOYSA-N"
"CC(=C)C(C1)CC(=O)C(C)=C1","InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9H,1,5-6H2,2-3H3","ULDHMXUKGWMISQ-UHFFFAOYSA-N"
"CC(=C2)C(C1)C(C)(C)C(C(=O)2)1","InChI=1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3","DCSCXTJOXBUFGB-UHFFFAOYSA-N"
"CC(C)C(C1)C(=O)C=C(C)C1","InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,9H,4-5H2,1-3H3","YSTPAHQEHQSRJD-UHFFFAOYSA-N"
"CC(C1)CC(=O)C(C1)=C(C)C","InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h8H,4-6H2,1-3H3","NZGWDASTMWDZIW-UHFFFAOYSA-N"
"CC(C)C(C2)(C1)C([H])1C([H])(C)C(=O)2","InChI=1S/C10H16O/c1-6(2)10-4-8(10)7(3)9(11)5-10/h6-8H,4-5H2,1-3H3/t7-,8-,10+/m1/s1","USMNOWBWPHYOEA-MRTMQBJTSA-N"
"CC(C1)CC(=O)C(C1)C(C)C","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3","NFLGAXVYCFJBMK-UHFFFAOYSA-N"
"CC(=C)C([H])(C2)CC(O1)C(C)(C(=O)2)1","InChI=1S/C10H14O2/c1-6(2)7-4-8(11)10(3)9(5-7)12-10/h7,9H,1,4-5H2,2-3H3/t7-,9?,10?/m1/s1","YGMNGQDLUQECTO-CUUXFQNZSA-N"
"Cc(c3)ncc(c3)CCn(c1)c(c2)c(ccc2)c(CC)1","InChI=1S/C18H20N2/c1-3-16-13-20(18-7-5-4-6-17(16)18)11-10-15-9-8-14(2)19-12-15/h4-9,12-13H,3,10-11H2,1-2H3","MIMQNSSEFLNXDA-UHFFFAOYSA-N"
"CC1(CC2=C(C3=CC=CC=C3N2)C4(N1)CCCCC4)C","InChI=1S/C18H24N2/c1-17(2)12-15-16(13-8-4-5-9-14(13)19-15)18(20-17)10-6-3-7-11-18/h4-5,8-9,19-20H,3,6-7,10-12H2,1-2H3","WQHKGDKVBJGGSW-UHFFFAOYSA-N"
"OC(=O)CCn(c21)c(C3)c(C(C)(C)NC(C)(C)3)c(cccc2)1","InChI=1S/C18H24N2O2/c1-17(2)11-14-16(18(3,4)19-17)12-7-5-6-8-13(12)20(14)10-9-15(21)22/h5-8,19H,9-11H2,1-4H3,(H,21,22)","YEBNHDNLTDDSCG-UHFFFAOYSA-N"
"CC1=C(CCNC1)C2=C(NC3=CC=CC=C32)CC(C)(C)N","InChI=1S/C18H25N3/c1-12-11-20-9-8-13(12)17-14-6-4-5-7-15(14)21-16(17)10-18(2,3)19/h4-7,20-21H,8-11,19H2,1-3H3","WDBMKLFDTIFNLT-UHFFFAOYSA-N"
"CC(C)(CC1=C(C2=CC=CC=C2N1)C3=CCN(CC3)C)N","InChI=1S/C18H25N3/c1-18(2,19)12-16-17(13-8-10-21(3)11-9-13)14-6-4-5-7-15(14)20-16/h4-8,20H,9-12,19H2,1-3H3","AYENKGLDEPKBIU-UHFFFAOYSA-N"
"CC1(CC2=C(C3=CC=CC=C3N2)C4(N1)CCN(CC4)C)C","InChI=1S/C18H25N3/c1-17(2)12-15-16(13-6-4-5-7-14(13)19-15)18(20-17)8-10-21(3)11-9-18/h4-7,19-20H,8-12H2,1-3H3","CFJHAHNGZFRAIC-UHFFFAOYSA-N"
"CN(C)CCC(=O)N(C3)Cn(c(C3)1)c(c2)c(cc(C)c2)c(C)1","InChI=1S/C18H25N3O/c1-13-5-6-17-15(11-13)14(2)16-7-10-20(12-21(16)17)18(22)8-9-19(3)4/h5-6,11H,7-10,12H2,1-4H3","JUGHHPWVPUEEGC-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(C(=O)NCCCn(c([H])2)c(c3)c(ccc3)c(C)2)cc([N+1]([O-1])=O)1","InChI=1S/C19H18N4O5/c1-13-12-21(18-6-3-2-5-17(13)18)8-4-7-20-19(24)14-9-15(22(25)26)11-16(10-14)23(27)28/h2-3,5-6,9-12H,4,7-8H2,1H3,(H,20,24)","WCWRXJVFMSRLSV-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(c(c3)1)c(c2)c(ccc(C(C)=O)2)n(C(C)C)1","InChI=1S/C19H19NO2/c1-11(2)20-18-7-5-14(12(3)21)9-16(18)17-10-15(13(4)22)6-8-19(17)20/h5-11H,1-4H3","GDQJWNWGMRNRDG-UHFFFAOYSA-N"
"CCCn(c21)c(c3)c(cc(C(C)=O)c3)c(cc(C(C)=O)cc2)1","InChI=1S/C19H19NO2/c1-4-9-20-18-7-5-14(12(2)21)10-16(18)17-11-15(13(3)22)6-8-19(17)20/h5-8,10-11H,4,9H2,1-3H3","IAFSDNNCEQCMLQ-UHFFFAOYSA-N"
"CC1(C(C2=C(CN1)C3=CC=CC=C3N2)C4=CC=CC=C4)C","InChI=1S/C19H20N2/c1-19(2)17(13-8-4-3-5-9-13)18-15(12-20-19)14-10-6-7-11-16(14)21-18/h3-11,17,20-21H,12H2,1-2H3","QOAZZIUNJCUJTL-UHFFFAOYSA-N"
"CC1=CC=CC2=C1NC3=C2CNC(C3)CC4=CC=CC=C4","InChI=1S/C19H20N2/c1-13-6-5-9-16-17-12-20-15(11-18(17)21-19(13)16)10-14-7-3-2-4-8-14/h2-9,15,20-21H,10-12H2,1H3","QZYUBXGADHOMMA-UHFFFAOYSA-N"
"CC(C)CCn(c21)c(c3)c(cc(C(C)=O)c3)c(cccc2)1","InChI=1S/C19H21NO/c1-13(2)10-11-20-18-7-5-4-6-16(18)17-12-15(14(3)21)8-9-19(17)20/h4-9,12-13H,10-11H2,1-3H3","BXRQCBMCDRFRQC-UHFFFAOYSA-N"
"Cc(c3)ncc(c3)CCn(c(C)1)c(c2)c(cc(C)c2)c(C)1","InChI=1S/C19H22N2/c1-13-5-8-19-18(11-13)15(3)16(4)21(19)10-9-17-7-6-14(2)20-12-17/h5-8,11-12H,9-10H2,1-4H3","WXNFKYXQBWXAGZ-UHFFFAOYSA-N"
"COc(c3)cc(c(C)1)c(c3)n(CCc(c2)cnc(C)c2)c(C)1","InChI=1S/C19H22N2O/c1-13-5-6-16(12-20-13)9-10-21-15(3)14(2)18-11-17(22-4)7-8-19(18)21/h5-8,11-12H,9-10H2,1-4H3","MDKKFKKJFZJXBE-UHFFFAOYSA-N"
"CN(C4)CCC(C4)(N([2H])3)c(c21)c(CC(C)(C)3)n(C)c(cccc2)1","InChI=1S/C19H27N3/c1-18(2)13-16-17(14-7-5-6-8-15(14)22(16)4)19(20-18)9-11-21(3)12-10-19/h5-8,20H,9-13H2,1-4H3/i/hD","AZWJISVTQFEJDN-DYCDLGHISA-N"
"CN(C4)CCC(C4)(N3)c(c21)c(CC(C)(C)3)n(C)c(cccc2)1","InChI=1S/C19H27N3/c1-18(2)13-16-17(14-7-5-6-8-15(14)22(16)4)19(20-18)9-11-21(3)12-10-19/h5-8,20H,9-13H2,1-4H3","AZWJISVTQFEJDN-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(C=CC(=C3N2)Br)CCC4=CN=C(C=C4)C","InChI=1S/C20H22BrN3/c1-12-3-4-14(10-22-12)5-6-15-7-8-17(21)20-19(15)16-11-23-13(2)9-18(16)24-20/h3-4,7-8,10,13,23-24H,5-6,9,11H2,1-2H3","HAQZKCBPEQMRSH-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(C=CC=C3N2)CCC4=CN=C(C=C4)C","InChI=1S/C20H23N3/c1-13-6-7-15(11-21-13)8-9-16-4-3-5-18-20(16)17-12-22-14(2)10-19(17)23-18/h3-7,11,14,22-23H,8-10,12H2,1-2H3","CBHKORLHJIYAKT-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(C=CC(=C3N2)C)CCC4=CC=NC=C4","InChI=1S/C20H23N3/c1-13-3-5-16(6-4-15-7-9-21-10-8-15)19-17-12-22-14(2)11-18(17)23-20(13)19/h3,5,7-10,14,22-23H,4,6,11-12H2,1-2H3","NEGUYOMMCADVEE-UHFFFAOYSA-N"
"CCCc(c(C)1)c(c3)c(ccc3)n(CCc(c2)cnc(C)c2)1","InChI=1S/C20H24N2/c1-4-7-18-16(3)22(20-9-6-5-8-19(18)20)13-12-17-11-10-15(2)21-14-17/h5-6,8-11,14H,4,7,12-13H2,1-3H3","QXDOASKCLKYXAM-UHFFFAOYSA-N"
"CCOC(=O)CCn(c21)c(C3)c(C(C)(C)NC(C)(C)3)c(cccc2)1","InChI=1S/C20H28N2O2/c1-6-24-17(23)11-12-22-15-10-8-7-9-14(15)18-16(22)13-19(2,3)21-20(18,4)5/h7-10,21H,6,11-13H2,1-5H3","CVHWFRFKJLLGGG-UHFFFAOYSA-N"
"CC1CC(=C(CN1C)C)C2=C(NC3=CC=CC=C32)CC(C)(C)N","InChI=1S/C20H29N3/c1-13-12-23(5)14(2)10-16(13)19-15-8-6-7-9-17(15)22-18(19)11-20(3,4)21/h6-9,14,22H,10-12,21H2,1-5H3","VEDQOUBYXSKNPC-UHFFFAOYSA-N"
"CCN(CC)CCC(=O)N(C3)Cn(c(C3)1)c(c2)c(cc(C)c2)c(C)1","InChI=1S/C20H29N3O/c1-5-21(6-2)11-10-20(24)22-12-9-18-16(4)17-13-15(3)7-8-19(17)23(18)14-22/h7-8,13H,5-6,9-12,14H2,1-4H3","AEWCQUKMWATSDO-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(C(=O)NCC(C)Cn(c(C)2)c(c3)c(ccc3)c(C)2)cc([N+1]([O-1])=O)1","InChI=1S/C21H22N4O5/c1-13(12-23-15(3)14(2)19-6-4-5-7-20(19)23)11-22-21(26)16-8-17(24(27)28)10-18(9-16)25(29)30/h4-10,13H,11-12H2,1-3H3,(H,22,26)","LLYAIVBRRNJHHE-UHFFFAOYSA-N"
"CC(C)CCn(c21)c(c3)c(cc(C(C)=O)c3)c(cc(C(C)=O)cc2)1","InChI=1S/C21H23NO2/c1-13(2)9-10-22-20-7-5-16(14(3)23)11-18(20)19-12-17(15(4)24)6-8-21(19)22/h5-8,11-13H,9-10H2,1-4H3","ZRLGQXONUJTYQP-UHFFFAOYSA-N"
"CCCCCn(c21)c(c3)c(cc(C(C)=O)c3)c(cc(C(C)=O)cc2)1","InChI=1S/C21H23NO2/c1-4-5-6-11-22-20-9-7-16(14(2)23)12-18(20)19-13-17(15(3)24)8-10-21(19)22/h7-10,12-13H,4-6,11H2,1-3H3","ONKOWYDIQMQTBF-UHFFFAOYSA-N"
"Cc(c4)ncc(c4)CCn(c21)c(c3)c(cc(C)c3)c(CCCC2)1","InChI=1S/C21H24N2/c1-15-7-10-21-19(13-15)18-5-3-4-6-20(18)23(21)12-11-17-9-8-16(2)22-14-17/h7-10,13-14H,3-6,11-12H2,1-2H3","ZQAUQOVNFNDEEQ-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(C=CC(=C3N2)C)CCC4=CN=C(C=C4)C","InChI=1S/C21H25N3/c1-13-4-8-17(9-7-16-6-5-14(2)22-11-16)20-18-12-23-15(3)10-19(18)24-21(13)20/h4-6,8,11,15,23-24H,7,9-10,12H2,1-3H3","TUFPZHSAIVBOFW-UHFFFAOYSA-N"
"CC1CC2=C(CN1)C3=C(C=CC(=C3N2)OC)CCC4=CN=C(C=C4)C","InChI=1S/C21H25N3O/c1-13-4-5-15(11-22-13)6-7-16-8-9-19(25-3)21-20(16)17-12-23-14(2)10-18(17)24-21/h4-5,8-9,11,14,23-24H,6-7,10,12H2,1-3H3","AUBCQHPNQKVRHJ-UHFFFAOYSA-N"
"CC(N3)CC(=CC(C)(C)3)c(c21)c(CC(C)(C)N)n(C)c(cccc2)1","InChI=1S/C21H31N3/c1-14-11-15(12-21(4,5)23-14)19-16-9-7-8-10-17(16)24(6)18(19)13-20(2,3)22/h7-10,12,14,23H,11,13,22H2,1-6H3","KSWIBPTXLBGRNE-UHFFFAOYSA-N"
"COC(=O)c(c21)c(C(=O)OC)n(CCCNC(=O)c(c3)cc(N(=O)=O)cc(N(=O)=O)3)c(cccc2)1","InChI=1S/C22H20N4O9/c1-34-21(28)18-16-6-3-4-7-17(16)24(19(18)22(29)35-2)9-5-8-23-20(27)13-10-14(25(30)31)12-15(11-13)26(32)33/h3-4,6-7,10-12H,5,8-9H2,1-2H3,(H,23,27)","RPYNDUFRIRRTCT-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(C(=O)NCCCn(c32)c(c4)c(ccc4)c(CCCC3)2)cc([N+1]([O-1])=O)1","InChI=1S/C22H22N4O5/c27-22(15-12-16(25(28)29)14-17(13-15)26(30)31)23-10-5-11-24-20-8-3-1-6-18(20)19-7-2-4-9-21(19)24/h1,3,6,8,12-14H,2,4-5,7,9-11H2,(H,23,27)","XUCYUJTZKJXOSL-UHFFFAOYSA-N"
"CCCC1CC2=C(CN1)C3=C(C=CC=C3N2)CCC4=CN=C(C=C4)C","InChI=1S/C22H27N3/c1-3-5-18-12-21-19(14-24-18)22-17(6-4-7-20(22)25-21)11-10-16-9-8-15(2)23-13-16/h4,6-9,13,18,24-25H,3,5,10-12,14H2,1-2H3","FSBHSYJCHDQPIT-UHFFFAOYSA-N"
"CC1(CC(=CC(N1C)(C)C)C2=C(NC3=CC=CC=C32)CC(C)(C)N)C","InChI=1S/C22H33N3/c1-20(2,23)14-18-19(16-10-8-9-11-17(16)24-18)15-12-21(3,4)25(7)22(5,6)13-15/h8-12,24H,13-14,23H2,1-7H3","JDFFWTVSLWYLMQ-UHFFFAOYSA-N"
"CC(C)(N)Cc(n(C)1)c(C(C3)=CC(C)(C)NC(C)(C)3)c(c2)c(ccc2)1","InChI=1S/C22H33N3/c1-20(2,23)14-18-19(16-10-8-9-11-17(16)25(18)7)15-12-21(3,4)24-22(5,6)13-15/h8-12,24H,13-14,23H2,1-7H3","HTZWTKVGBYJNOF-UHFFFAOYSA-N"
"CCCN(CCC)CCC(=O)N(C3)Cn(c(C3)1)c(c2)c(cc(C)c2)c(C)1","InChI=1S/C22H33N3O/c1-5-11-23(12-6-2)13-10-22(26)24-14-9-20-18(4)19-15-17(3)7-8-21(19)25(20)16-24/h7-8,15H,5-6,9-14,16H2,1-4H3","FQJNJNDRZMPWHW-UHFFFAOYSA-N"
"Cc(c4)ncc(c4)CCn(c(C)1)c(c3)c(ccc3)c(c(c2)cccc2)1","InChI=1S/C23H22N2/c1-17-12-13-19(16-24-17)14-15-25-18(2)23(20-8-4-3-5-9-20)21-10-6-7-11-22(21)25/h3-13,16H,14-15H2,1-2H3","QWRPRRCNMLFWLB-UHFFFAOYSA-N"
"CC(NC(=O)c(c4)cc([N+1]([O-1])=O)cc([N+1]([O-1])=O)4)CCn(c21)c(c3)c(ccc3)c(CCCC2)1","InChI=1S/C23H24N4O5/c1-15(24-23(28)16-12-17(26(29)30)14-18(13-16)27(31)32)10-11-25-21-8-4-2-6-19(21)20-7-3-5-9-22(20)25/h2,4,6,8,12-15H,3,5,7,9-11H2,1H3,(H,24,28)","WVKLWVIKXMBKEJ-UHFFFAOYSA-N"
"CCOC(=O)c(c(C)1)c(c3)c(ccc3)n(CCC(C)NC(=O)c(c2)cc([N+1]([O-1])=O)cc([N+1]([O-1])=O)2)1","InChI=1S/C23H24N4O7/c1-4-34-23(29)21-15(3)25(20-8-6-5-7-19(20)21)10-9-14(2)24-22(28)16-11-17(26(30)31)13-18(12-16)27(32)33/h5-8,11-14H,4,9-10H2,1-3H3,(H,24,28)","FTPMDKWLUGCFND-UHFFFAOYSA-N"
"CCCC1CC2=C(CN1)C3=C(C=CC(=C3N2)OC)CCC4=CN=C(C=C4)C","InChI=1S/C23H29N3O/c1-4-5-18-12-20-19(14-25-18)22-17(10-11-21(27-3)23(22)26-20)9-8-16-7-6-15(2)24-13-16/h6-7,10-11,13,18,25-26H,4-5,8-9,12,14H2,1-3H3","MFCNPWMGDYTWNU-UHFFFAOYSA-N"
"CC(C)(N)Cc(n(C)1)c(C(C3)=CC(C)(C)N(C)C(C)(C)3)c(c2)c(ccc2)1","InChI=1S/C23H35N3/c1-21(2,24)15-19-20(17-11-9-10-12-18(17)25(19)7)16-13-22(3,4)26(8)23(5,6)14-16/h9-13H,14-15,24H2,1-8H3","IFWOETGMKMWMFG-UHFFFAOYSA-N"
"CC1=NC=C(C=C1)CCC2=C3C4=C(CC(NC4)C5CCCCC5)NC3=CC=C2","InChI=1S/C25H31N3/c1-17-10-11-18(15-26-17)12-13-20-8-5-9-22-25(20)21-16-27-23(14-24(21)28-22)19-6-3-2-4-7-19/h5,8-11,15,19,23,27-28H,2-4,6-7,12-14,16H2,1H3","YITAPQGFZHBSBY-UHFFFAOYSA-N"
"CCC([H])(C)C(=O)OC(C)(C(=O)1)C(OC)=C([H])C(OC)=C(C)1","InChI=1S/C15H22O5/c1-7-9(2)14(17)20-15(4)12(19-6)8-11(18-5)10(3)13(15)16/h8-9H,7H2,1-6H3/t9-,15-/m1/s1","MDMXRNQKNMWNRD-RFAUZJTJSA-N"
"CCC([H])(C)C(=O)OC(C)(C(=O)1)C(OC)=C(C)C(OC)=C([H])1","InChI=1S/C15H22O5/c1-7-9(2)14(17)20-15(4)12(16)8-11(18-5)10(3)13(15)19-6/h8-9H,7H2,1-6H3/t9-,15-/m1/s1","NIXQRWMKFDVWDZ-RFAUZJTJSA-N"
"CCOC(=C([H])1)C(C)(OC(=O)C(C)CC)C(=O)C(C)=C(OC)1","InChI=1S/C16H24O5/c1-7-10(3)15(18)21-16(5)13(20-8-2)9-12(19-6)11(4)14(16)17/h9-10H,7-8H2,1-6H3/t10-,16-/m1/s1","JUMCUINIMOUWNA-QLJPJBMISA-N"
"ClCCOC(=C1)C(C)(OC(=O)C([H])(C)CC)C(=O)C(C)=C(OC)1","InChI=1S/C16H23ClO5/c1-6-10(2)15(19)22-16(4)13(21-8-7-17)9-12(20-5)11(3)14(16)18/h9-10H,6-8H2,1-5H3/t10-,16-/m1/s1","FGUIKRIBAYASBF-QLJPJBMISA-N"
"CCC([H])(C)C(=O)OC(C)(C(O)=1)C(=O)C(C)=C(OC)C1","InChI=1S/C14H20O5/c1-6-8(2)13(17)19-14(4)11(15)7-10(18-5)9(3)12(14)16/h7-8,15H,6H2,1-5H3/t8-,14-/m1/s1","FLRPGUPKHDJDQL-XLKFXECMSA-N"
"COc(c1)c(C)c(OC)c(C)c(O)1","InChI=1S/C10H14O3/c1-6-8(11)5-9(12-3)7(2)10(6)13-4/h5,11H,1-4H3","KMLNRCNJULZPTB-UHFFFAOYSA-N"
"OCCNC(=C1)C(C)(OC(=O)C([H])(C)CC)C(=O)C(C)=C(OC)1","InChI=1S/C16H25NO5/c1-6-10(2)15(20)22-16(4)13(17-7-8-18)9-12(21-5)11(3)14(16)19/h9-10,17-18H,6-8H2,1-5H3/t10-,16-/m1/s1","UTRDVXSMNWAJLY-QLJPJBMISA-N"
"CC(=O)OCCNC(=C1)C(C)(OC(=O)C([H])(C)CC)C(=O)C(C)=C(OC)1","InChI=1S/C18H27NO6/c1-7-11(2)17(22)25-18(5)15(19-8-9-24-13(4)20)10-14(23-6)12(3)16(18)21/h10-11,19H,7-9H2,1-6H3/t11-,18-/m1/s1","RYGUAVIWYDWURX-ADLMAVQZSA-N"
"CCC([H])(C)C(=O)OC(C)(C(=O)1)C(OC(=O)c(c2)ccc([N+1]([O-1])=O)c2)=CC(OC)=C(C)1","InChI=1S/C21H23NO8/c1-6-12(2)19(24)30-21(4)17(11-16(28-5)13(3)18(21)23)29-20(25)14-7-9-15(10-8-14)22(26)27/h7-12H,6H2,1-5H3/t12-,21-/m1/s1","HLJRNTPUJKILLB-XUSGNXJCSA-N"
"CCC([H])(C)C(=O)OC(C)(C(=O)1)C(OC(C)=O)=CC(OC)=C(C)1","InChI=1S/C16H22O6/c1-7-9(2)15(19)22-16(5)13(21-11(4)17)8-12(20-6)10(3)14(16)18/h8-9H,7H2,1-6H3/t9-,16-/m1/s1","KHLPUDAOXGHKTN-JDNHERCYSA-N"
"CCC([H])(C)C(=O)OC(C)(C(=O)1)C(OC(C)=O)=C(C)C(OC)=C1","InChI=1S/C16H22O6/c1-7-9(2)15(19)22-16(5)13(18)8-12(20-6)10(3)14(16)21-11(4)17/h8-9H,7H2,1-6H3/t9-,16-/m1/s1","ZBFFFQJFHOMIMF-JDNHERCYSA-N"
"CC(=O)OCCN(C(C)=O)c(c1)c(C)c(OC(C)=O)c(C)c(OC)1","InChI=1S/C17H23NO6/c1-10-15(18(12(3)19)7-8-23-13(4)20)9-16(22-6)11(2)17(10)24-14(5)21/h9H,7-8H2,1-6H3","KZQSYDCXRAAFPA-UHFFFAOYSA-N"
"CC(=O)OCCN(C(C)=O)c(c1)cccc1","InChI=1S/C12H15NO3/c1-10(14)13(8-9-16-11(2)15)12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3","IGXHOQNEKVKXSV-UHFFFAOYSA-N"
"CC(=O)OCCN(C(C)=O)c(c1)c(C)ccc1","InChI=1S/C13H17NO3/c1-10-6-4-5-7-13(10)14(11(2)15)8-9-17-12(3)16/h4-7H,8-9H2,1-3H3","ICTRVJDZFDRVOX-UHFFFAOYSA-N"
"COC(=O)C(C2)(C1CC(O3)(OCC3)C2)C(C)(OC(C)=O)C(=O)O1","InChI=1S/C15H20O8/c1-9(16)23-13(2)11(17)22-10-8-14(20-6-7-21-14)4-5-15(10,13)12(18)19-3/h10H,4-8H2,1-3H3","OFYSQZHEUSDXPT-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)C(C=O)=CC(=O)1","InChI=1S/C11H8O4/c1-14-8-2-3-9-7(6-12)4-11(13)15-10(9)5-8/h2-6H,1H3","MHZUULROATWSBY-UHFFFAOYSA-N"
"COCc(c1)cc(O)c(O)c(O)1","InChI=1S/C8H10O4/c1-12-4-5-2-6(9)8(11)7(10)3-5/h2-3,9-11H,4H2,1H3","YAXUEWSAEFZPFJ-UHFFFAOYSA-N"
"COCc(c1)cc(OC(C)=O)c(OC(C)=O)c(OC(C)=O)1","InChI=1S/C14H16O7/c1-8(15)19-12-5-11(7-18-4)6-13(20-9(2)16)14(12)21-10(3)17/h5-6H,7H2,1-4H3","CAHWHTZJKRNHIT-UHFFFAOYSA-N"
"COCc(c1)cc(OC)c(OC)c(OC)1","InChI=1S/C11H16O4/c1-12-7-8-5-9(13-2)11(15-4)10(6-8)14-3/h5-6H,7H2,1-4H3","MRSLZYLPFVSLDY-UHFFFAOYSA-N"
"CSCc(c(CO)1)c(OC)c(OC)c(OC)c1","InChI=1S/C12H18O4S/c1-14-10-5-8(6-13)9(7-17-4)11(15-2)12(10)16-3/h5,13H,6-7H2,1-4H3","MXRWOBWNOFESSY-UHFFFAOYSA-N"
"COCc(c1)c(CSC)c(OC)c(OC)c(OC)1","InChI=1S/C13H20O4S/c1-14-7-9-6-11(15-2)13(17-4)12(16-3)10(9)8-18-5/h6H,7-8H2,1-5H3","GZJAMAMUGPOLDU-UHFFFAOYSA-N"
"COCc(c1)c(CS(C)(=O)=O)c(O)c(O)c(O)1","InChI=1S/C10H14O6S/c1-16-4-6-3-8(11)10(13)9(12)7(6)5-17(2,14)15/h3,11-13H,4-5H2,1-2H3","XUKVXIFSYPSVIJ-UHFFFAOYSA-N"
"COCc(c1)c(CS(C)(=O)=O)c(OC(C)=O)c(OC(C)=O)c(OC(C)=O)1","InChI=1S/C16H20O9S/c1-9(17)23-14-6-12(7-22-4)13(8-26(5,20)21)15(24-10(2)18)16(14)25-11(3)19/h6H,7-8H2,1-5H3","CHKJWAVWUXAAQN-UHFFFAOYSA-N"
"COCc(c1)c(CS(C)(=O)=O)c(OC)c(OC)c(OC)1","InChI=1S/C13H20O6S/c1-16-7-9-6-11(17-2)13(19-4)12(18-3)10(9)8-20(5,14)15/h6H,7-8H2,1-5H3","NRHCYHKESJWYNW-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(O)CC(=O)OC","InChI=1S/C17H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16(18)15-17(19)20-2/h16,18H,3-15H2,1-2H3","YBTWUESFQWFDMR-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(OC(C)=O)CC(=O)OC","InChI=1S/C19H36O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-18(23-17(2)20)16-19(21)22-3/h18H,4-16H2,1-3H3","LNSKNBASLYLDGC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)CC(=O)OC","InChI=1S/C17H32O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16(18)15-17(19)20-2/h3-15H2,1-2H3","OEEDRMFBAHHVQI-UHFFFAOYSA-N"
"COC(C1)=C([H])C(=O)C(O)1C(=O)OC","InChI=1S/C8H10O5/c1-12-5-3-6(9)8(11,4-5)7(10)13-2/h3,11H,4H2,1-2H3/t8-/m1/s1","YGCFLXLGPRNGTJ-MRVPVSSYSA-N"
"O=C(C1)NCCC1","InChI=1S/C5H9NO/c7-5-3-1-2-4-6-5/h1-4H2,(H,6,7)","XUWHAWMETYGRKB-UHFFFAOYSA-N"
"O=C(C2)N(CCC2)C(=O)Cc(c1)cccc1","InChI=1S/C13H15NO2/c15-12-8-4-5-9-14(12)13(16)10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2","JUSPZFQXNGGUEY-UHFFFAOYSA-N"
"O=C(C2)N(CCC2)C(=O)C([2H])([2H])c(c1)cccc1","InChI=1S/C13H15NO2/c15-12-8-4-5-9-14(12)13(16)10-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2/i10D2","JUSPZFQXNGGUEY-KBMKNGFXSA-N"
"COc(c2)ccc(c2)CC(=O)N(C1)C(=O)CCC1","InChI=1S/C14H17NO3/c1-18-12-7-5-11(6-8-12)10-14(17)15-9-3-2-4-13(15)16/h5-8H,2-4,9-10H2,1H3","NNLWVOZTPMGCEP-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)CC(=O)N(C1)C(=O)CCC1","InChI=1S/C13H15NO3/c15-11-6-4-10(5-7-11)9-13(17)14-8-2-1-3-12(14)16/h4-7,15H,1-3,8-9H2","HBHVGNOAVIEGFS-UHFFFAOYSA-N"
"O=C(C2)N(CCC2)C(=O)CCc(c1)cccc1","InChI=1S/C14H17NO2/c16-13-8-4-5-11-15(13)14(17)10-9-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2","ZVNUABIDENQZES-UHFFFAOYSA-N"
"O=C(C2)N(CCC2)C(=O)CC([2H])([2H])c(c1)cccc1","InChI=1S/C14H17NO2/c16-13-8-4-5-11-15(13)14(17)10-9-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2/i9D2","ZVNUABIDENQZES-KNXIQCGSSA-N"
"O=C(C2)N(CCC2)C(=O)C([2H])([2H])Cc(c1)cccc1","InChI=1S/C14H17NO2/c16-13-8-4-5-11-15(13)14(17)10-9-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2/i10D2","ZVNUABIDENQZES-KBMKNGFXSA-N"
"O=C(C2)N(CCC2)C(=O)C([2H])([2H])C([2H])([2H])c(c1)cccc1","InChI=1S/C14H17NO2/c16-13-8-4-5-11-15(13)14(17)10-9-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2/i9D2,10D2","ZVNUABIDENQZES-YQUBHJMPSA-N"
"COc(c2)ccc(c2)CCC(=O)N(C1)C(=O)CCC1","InChI=1S/C15H19NO3/c1-19-13-8-5-12(6-9-13)7-10-15(18)16-11-3-2-4-14(16)17/h5-6,8-9H,2-4,7,10-11H2,1H3","JSQRTBQRPZPFEF-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C([2H])([2H])CC(=O)N(C1)C(=O)CCC1","InChI=1S/C15H19NO3/c1-19-13-8-5-12(6-9-13)7-10-15(18)16-11-3-2-4-14(16)17/h5-6,8-9H,2-4,7,10-11H2,1H3/i7D2","JSQRTBQRPZPFEF-RJSZUWSASA-N"
"COc(c2)ccc(c2)CC([2H])([2H])C(=O)N(C1)C(=O)CCC1","InChI=1S/C15H19NO3/c1-19-13-8-5-12(6-9-13)7-10-15(18)16-11-3-2-4-14(16)17/h5-6,8-9H,2-4,7,10-11H2,1H3/i10D2","JSQRTBQRPZPFEF-KBMKNGFXSA-N"
"COc(c2)ccc(c2)C([2H])([2H])C([2H])([2H])C(=O)N(C1)C(=O)CCC1","InChI=1S/C15H19NO3/c1-19-13-8-5-12(6-9-13)7-10-15(18)16-11-3-2-4-14(16)17/h5-6,8-9H,2-4,7,10-11H2,1H3/i7D2,10D2","JSQRTBQRPZPFEF-AQVLYMJBSA-N"
"Oc(c2)ccc(c2)CCC(=O)N(C1)C(=O)CCC1","InChI=1S/C14H17NO3/c16-12-7-4-11(5-8-12)6-9-14(18)15-10-2-1-3-13(15)17/h4-5,7-8,16H,1-3,6,9-10H2","ZAKWRGNVJHPXOW-UHFFFAOYSA-N"
"c(c3)ccc(c3)COc(c2)ccc(c2)CCC(=O)N(C1)C(=O)CCC1","InChI=1S/C21H23NO3/c23-20-8-4-5-15-22(20)21(24)14-11-17-9-12-19(13-10-17)25-16-18-6-2-1-3-7-18/h1-3,6-7,9-10,12-13H,4-5,8,11,14-16H2","DCOVBLCOKIORBG-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)CCC(=O)N(C1)C(=O)CCC1","InChI=1S/C14H16ClNO2/c15-12-7-4-11(5-8-12)6-9-14(18)16-10-2-1-3-13(16)17/h4-5,7-8H,1-3,6,9-10H2","TUVNXTDOWWVEDK-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(CCC(=O)N(C2)C(=O)CCC2)c1","InChI=1S/C14H16N2O4/c17-13-3-1-2-10-15(13)14(18)9-6-11-4-7-12(8-5-11)16(19)20/h4-5,7-8H,1-3,6,9-10H2","JBGUTKDFHSQGSH-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)cc(CCC(=O)N(C2)C(=O)CCC2)1","InChI=1S/C17H23NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h10-11H,4-9H2,1-3H3","OTBKATNIYSZVJP-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)cc(C=CC(=O)N(C2)C(=O)CCC2)1","InChI=1S/C17H21NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h7-8,10-11H,4-6,9H2,1-3H3/b8-7+","HPXUNEGPCPQBQY-BQYQJAHWSA-N"
"O=C(C3)N(CCC3)C(=O)CC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H21NO2/c22-19-13-7-8-14-21(19)20(23)15-18(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18H,7-8,13-15H2","JHUZPHHKFDRSHW-UHFFFAOYSA-N"
"O=C(C2)N(CCC2)C(=O)C=Cc(c1)cccc1","InChI=1S/C14H15NO2/c16-13-8-4-5-11-15(13)14(17)10-9-12-6-2-1-3-7-12/h1-3,6-7,9-10H,4-5,8,11H2/b10-9+","ZRSPPDNPJCRTRU-MDZDMXLPSA-N"
"O=C(C2)N(CCC2)C(=O)CCCc(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2","VWMYFCUYOIXABI-UHFFFAOYSA-N"
"O=C(C2)N(CCC2)C(=O)CCC([2H])([2H])c(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2/i9D2","VWMYFCUYOIXABI-KNXIQCGSSA-N"
"O=C(C2)N(CCC2)C(=O)CC([2H])([2H])Cc(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2/i6D2","VWMYFCUYOIXABI-NCYHJHSESA-N"
"O=C(C2)N(CCC2)C(=O)C([2H])([2H])CCc(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2/i11D2","VWMYFCUYOIXABI-ZWGOZCLVSA-N"
"O=C(C2)N(CCC2)C(=O)CC([2H])([2H])C([2H])([2H])c(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2/i6D2,9D2","VWMYFCUYOIXABI-NJTUDRHMSA-N"
"O=C(C2)N(CCC2)C(=O)C([2H])([2H])C([2H])([2H])Cc(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2/i6D2,11D2","VWMYFCUYOIXABI-LNPHAEMRSA-N"
"O=C(C2)N(CCC2)C(=O)C([2H])([2H])C([2H])([2H])C([2H])([2H])c(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2/i6D2,9D2,11D2","VWMYFCUYOIXABI-BAZNXXDDSA-N"
"O=C(C2)N(CCC2)C(=O)C([2H])([2H])CC([2H])([2H])c(c1)cccc1","InChI=1S/C15H19NO2/c17-14-10-4-5-12-16(14)15(18)11-6-9-13-7-2-1-3-8-13/h1-3,7-8H,4-6,9-12H2/i9D2,11D2","VWMYFCUYOIXABI-ZXVMGSATSA-N"
"O=C(C2)N(CCC2)C(=O)CC(C)c(c1)cccc1","InChI=1S/C15H19NO2/c1-12(13-7-3-2-4-8-13)11-15(18)16-10-6-5-9-14(16)17/h2-4,7-8,12H,5-6,9-11H2,1H3","XLBJPDXJCDNABW-UHFFFAOYSA-N"
"CCC(c(c2)cccc2)C(=O)N(C1)C(=O)CCC1","InChI=1S/C15H19NO2/c1-2-13(12-8-4-3-5-9-12)15(18)16-11-7-6-10-14(16)17/h3-5,8-9,13H,2,6-7,10-11H2,1H3","FGMCWNHFZSYCNY-UHFFFAOYSA-N"
"O=C(C2)N(CC2)C(=O)Cc(c1)cccc1","InChI=1S/C12H13NO2/c14-11-7-4-8-13(11)12(15)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2","OPKFJWODEXMYNP-UHFFFAOYSA-N"
"O=C(C2)N(CC2)C(=O)CCc(c1)cccc1","InChI=1S/C13H15NO2/c15-12-7-4-10-14(12)13(16)9-8-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10H2","QSQPBTLPJIDITH-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)CCC(=O)N(C1)C(=O)CC1","InChI=1S/C13H15NO3/c15-11-6-3-10(4-7-11)5-8-13(17)14-9-1-2-12(14)16/h3-4,6-7,15H,1-2,5,8-9H2","NJDGMWIATFNDSL-UHFFFAOYSA-N"
"O=C(C3)N(CC3)C(=O)CC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C19H19NO2/c21-18-12-7-13-20(18)19(22)14-17(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-6,8-11,17H,7,12-14H2","UBDLSDMENHNPAW-UHFFFAOYSA-N"
"O=C(C2)N(CC2)C(=O)CC(C)c(c1)cccc1","InChI=1S/C14H17NO2/c1-11(12-6-3-2-4-7-12)10-14(17)15-9-5-8-13(15)16/h2-4,6-7,11H,5,8-10H2,1H3","GHTXJZLTXSIGLG-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(=O)C(C)(C2)C(C)12","InChI=1S/C13H14O3/c1-12-7-13(12,2)16-10-6-8(15-3)4-5-9(10)11(12)14/h4-6H,7H2,1-3H3","LUPDDXPOCMRECU-UHFFFAOYSA-N"
"Clc(c3)cc(O1)c(c3)C(=O)C(C)(C2)C(C)12","InChI=1S/C12H11ClO2/c1-11-6-12(11,2)15-9-5-7(13)3-4-8(9)10(11)14/h3-5H,6H2,1-2H3","JCJUWMGJSYDXDU-UHFFFAOYSA-N"
"Cc(c3)cc(O1)c(c3)C(=O)C(C)(C2)C(C)12","InChI=1S/C13H14O2/c1-8-4-5-9-10(6-8)15-13(3)7-12(13,2)11(9)14/h4-6H,7H2,1-3H3","NVDZXYOUPPJXIV-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c3)C(=O)C(C)(C2)C12","InChI=1S/C12H12O3/c1-12-6-10(12)15-9-5-7(14-2)3-4-8(9)11(12)13/h3-5,10H,6H2,1-2H3","YMAGECSHLQMIKM-UHFFFAOYSA-N"
"Clc(c3)cc(O1)c(c3)C(=O)C(C)(C2)C12","InChI=1S/C11H9ClO2/c1-11-5-9(11)14-8-4-6(12)2-3-7(8)10(11)13/h2-4,9H,5H2,1H3","QXHWEEJMQGJQLJ-UHFFFAOYSA-N"
"Cc(c3)cc(O1)c(c3)C(=O)C(C)(C2)C12","InChI=1S/C12H12O2/c1-7-3-4-8-9(5-7)14-10-6-12(10,2)11(8)13/h3-5,10H,6H2,1-2H3","AYOLJEXZSUEOSM-UHFFFAOYSA-N"
"c(c1)ccc(Br)c1","InChI=1S/C6H5Br/c7-6-4-2-1-3-5-6/h1-5H","QARVLSVVCXYDNA-UHFFFAOYSA-N"
"CC(=O)c(c1)ccc(Cl)c1","InChI=1S/C8H7ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3","BUZYGTVTZYSBCU-UHFFFAOYSA-N"
"Oc(c1)c(Br)ccc1","InChI=1S/C6H5BrO/c7-5-3-1-2-4-6(5)8/h1-4,8H","VADKRMSMGWJZCF-UHFFFAOYSA-N"
"O=Cc(c1)cc(Br)cc1","InChI=1S/C7H5BrO/c8-7-3-1-2-6(4-7)5-9/h1-5H","SUISZCALMBHJQX-UHFFFAOYSA-N"
"O=Cc(c(O)1)cc(Br)cc1","InChI=1S/C7H5BrO2/c8-6-1-2-7(10)5(3-6)4-9/h1-4,10H","MKKSTJKBKNCMRV-UHFFFAOYSA-N"
"O=Cc(c1)cc(Br)c(O)c1","InChI=1S/C7H5BrO2/c8-6-3-5(4-9)1-2-7(6)10/h1-4,10H","UOTMHAOCAJROQF-UHFFFAOYSA-N"
"O=Cc(c1)cc(Br)c(O)c(O)1","InChI=1S/C7H5BrO3/c8-5-1-4(3-9)2-6(10)7(5)11/h1-3,10-11H","GVSGSHGXUXLQNS-UHFFFAOYSA-N"
"CCc(c1)ccc(C=O)c1","InChI=1S/C9H10O/c1-2-8-3-5-9(7-10)6-4-8/h3-7H,2H2,1H3","QNGNSVIICDLXHT-UHFFFAOYSA-N"
"C=CC(C)=C","InChI=1S/C5H8/c1-4-5(2)3/h4H,1-2H2,3H3","RRHGJUQNOFWUDK-UHFFFAOYSA-N"
"CCC(CC)C=O","InChI=1S/C6H12O/c1-3-6(4-2)5-7/h5-6H,3-4H2,1-2H3","UNNGUFMVYQJGTD-UHFFFAOYSA-N"
"N#CCCOCCOCCC#N","InChI=1S/C8H12N2O2/c9-3-1-5-11-7-8-12-6-2-4-10/h1-2,5-8H2","VTHRQKSLPFJQHN-UHFFFAOYSA-N"
"CC(=O)CC(=O)c(c1)cccc1","InChI=1S/C10H10O2/c1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H3","CVBUKMMMRLOKQR-UHFFFAOYSA-N"
"BrCCOc(c1)cccc1","InChI=1S/C8H9BrO/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,6-7H2","JJFOBACUIRKUPN-UHFFFAOYSA-N"
"O=C(CC(=O)C(F)(F)F)c(c1)cccc1","InChI=1S/C10H7F3O2/c11-10(12,13)9(15)6-8(14)7-4-2-1-3-5-7/h1-5H,6H2","VVXLFFIFNVKFBD-UHFFFAOYSA-N"
"CCO","InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3","LFQSCWFLJHTTHZ-UHFFFAOYSA-N"
"Sc(c1)cccc1","InChI=1S/C6H6S/c7-6-4-2-1-3-5-6/h1-5,7H","RMVRSNDYEFQCLF-UHFFFAOYSA-N"
"OC(C1)CCCCC1","InChI=1S/C7H14O/c8-7-5-3-1-2-4-6-7/h7-8H,1-6H2","QCRFMSUKWRQZEM-UHFFFAOYSA-N"
"OC(C1)CCCCCC1","InChI=1S/C8H16O/c9-8-6-4-2-1-3-5-7-8/h8-9H,1-7H2","FHADSMKORVFYOS-UHFFFAOYSA-N"
"C(C1)OCCO1","InChI=1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2","RYHBNJHYFVUHQT-UHFFFAOYSA-N"
"CCOC(C)(C)OCC","InChI=1S/C7H16O2/c1-5-8-7(3,4)9-6-2/h5-6H2,1-4H3","FGQLGYBGTRHODR-UHFFFAOYSA-N"
"O=C(CC(=O)c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H12O2/c16-14(12-7-3-1-4-8-12)11-15(17)13-9-5-2-6-10-13/h1-10H,11H2","NZZIMKJIVMHWJC-UHFFFAOYSA-N"
"C=COc(c1)cccc1","InChI=1S/C8H8O/c1-2-9-8-6-4-3-5-7-8/h2-7H,1H2","NHOGGUYTANYCGQ-UHFFFAOYSA-N"
"c(c2)ccc(c2)C=Cc(c1)cccc1","InChI=1S/C14H12/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-12H/b12-11-","PJANXHGTPQOBST-QXMHVHEDSA-N"
"C(C1)CCCCC1","InChI=1S/C7H14/c1-2-4-6-7-5-3-1/h1-7H2","DMEGYFMYUHOHGS-UHFFFAOYSA-N"
"Fc(c1)cccc1","InChI=1S/C6H5F/c7-6-4-2-1-3-5-6/h1-5H","PYLWMHQQBFSUBP-UHFFFAOYSA-N"
"O=C(F)c(c1)cccc1","InChI=1S/C7H5FO/c8-7(9)6-4-2-1-3-5-6/h1-5H","HPMLGNIUXVXALD-UHFFFAOYSA-N"
"CC(C)CC(=O)CC(C)=O","InChI=1S/C8H14O2/c1-6(2)4-8(10)5-7(3)9/h6H,4-5H2,1-3H3","IGMOYJSFRIASIE-UHFFFAOYSA-N"
"CCC(C(C)=O)C(C)=O","InChI=1S/C7H12O2/c1-4-7(5(2)8)6(3)9/h7H,4H2,1-3H3","GUARKOVVHJSMRW-UHFFFAOYSA-N"
"CO[Si](C)(OC)OC","InChI=1S/C4H12O3Si/c1-5-8(4,6-2)7-3/h1-4H3","BFXIKLCIZHOAAZ-UHFFFAOYSA-N"
"CC(C)CI","InChI=1S/C4H9I/c1-4(2)3-5/h4H,3H2,1-2H3","BTUGGGLMQBJCBN-UHFFFAOYSA-N"
"CCC=CCCOC(C)=O","InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h4-5H,3,6-7H2,1-2H3/b5-4-","NPFVOOAXDOBMCE-PLNGDYQASA-N"
"CCC(CC)COC(C)=O","InChI=1S/C8H16O2/c1-4-8(5-2)6-10-7(3)9/h8H,4-6H2,1-3H3","HQLKZWRSOHTERR-UHFFFAOYSA-N"
"CCCC(C)COC(C)=O","InChI=1S/C8H16O2/c1-4-5-7(2)6-10-8(3)9/h7H,4-6H2,1-3H3","UZTVUHTZGGZFCI-UHFFFAOYSA-N"
"CCCC=CCCOC(C)=O","InChI=1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h5-6H,3-4,7-8H2,1-2H3/b6-5-","AAYIYWGTGAUKQY-WAYWQWQTSA-N"
"CCCCCC(CC)OC(C)=O","InChI=1S/C10H20O2/c1-4-6-7-8-10(5-2)12-9(3)11/h10H,4-8H2,1-3H3","STZUZYMKSMSTOU-UHFFFAOYSA-N"
"CCCCCC(C)(CC)OC(C)=O","InChI=1S/C11H22O2/c1-5-7-8-9-11(4,6-2)13-10(3)12/h5-9H2,1-4H3","PNBFEBGIWFNZLU-UHFFFAOYSA-N"
"CCCCCCCCCOC(C)=O","InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h3-10H2,1-2H3","GJQIMXVRFNLMTB-UHFFFAOYSA-N"
"CCCCCCC(CC)OC(C)=O","InChI=1S/C11H22O2/c1-4-6-7-8-9-11(5-2)13-10(3)12/h11H,4-9H2,1-3H3","GPBFEZPGSQXMPX-UHFFFAOYSA-N"
"CCCCCCCCCCOC(C)=O","InChI=1S/C12H24O2/c1-3-4-5-6-7-8-9-10-11-14-12(2)13/h3-11H2,1-2H3","NUPSHWCALHZGOV-UHFFFAOYSA-N"
"C=CCCCCCCCCCOC(C)=O","InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-15-13(2)14/h3H,1,4-12H2,2H3","VCVAXEYHJAFRGM-UHFFFAOYSA-N"
"CC(C)=CCOC(C)=O","InChI=1S/C7H12O2/c1-6(2)4-5-9-7(3)8/h4H,5H2,1-3H3","XXIKYCPRDXIMQM-UHFFFAOYSA-N"
"CCOCC(=O)OCC","InChI=1S/C6H12O3/c1-3-8-5-6(7)9-4-2/h3-5H2,1-2H3","CKSRFHWWBKRUKA-UHFFFAOYSA-N"
"C=CCOC(=O)C=CC","InChI=1S/C7H10O2/c1-3-5-7(8)9-6-4-2/h3-5H,2,6H2,1H3/b5-3+","WNJBUWVXSNLWEQ-HWKANZROSA-N"
"CCCCOC(=O)C=CC","InChI=1S/C8H14O2/c1-3-5-7-10-8(9)6-4-2/h4,6H,3,5,7H2,1-2H3/b6-4+","GWCTUKHUBWMAMI-GQCTYLIASA-N"
"CCCCCOC(=O)C=CC","InChI=1S/C9H16O2/c1-3-5-6-8-11-9(10)7-4-2/h4,7H,3,5-6,8H2,1-2H3/b7-4+","PWYYERNADDIMJR-QPJJXVBHSA-N"
"CC=CC(=O)OCCC(C)C","InChI=1S/C9H16O2/c1-4-5-9(10)11-7-6-8(2)3/h4-5,8H,6-7H2,1-3H3/b5-4+","JAVOYFHBJFLMRQ-SNAWJCMRSA-N"
"CCC=CCCOC(=O)C=CC","InChI=1S/C10H16O2/c1-3-5-6-7-9-12-10(11)8-4-2/h4-6,8H,3,7,9H2,1-2H3/b6-5-,8-4+","KITGYVIOYOCIIE-QNMAEOQASA-N"
"CCCCCCCCOC(=O)C=CC","InChI=1S/C12H22O2/c1-3-5-6-7-8-9-11-14-12(13)10-4-2/h4,10H,3,5-9,11H2,1-2H3/b10-4+","HULBECQFWZPEBI-ONNFQVAWSA-N"
"CC=CC(=O)OCc(c1)cccc1","InChI=1S/C11H12O2/c1-2-6-11(12)13-9-10-7-4-3-5-8-10/h2-8H,9H2,1H3/b6-2+","NCPTYZLUYHXITE-QHHAFSJGSA-N"
"CC=CC(=O)OCCc(c1)cccc1","InChI=1S/C12H14O2/c1-2-6-12(13)14-10-9-11-7-4-3-5-8-11/h2-8H,9-10H2,1H3/b6-2+","DVHGIHSWUYRIPZ-QHHAFSJGSA-N"
"CC=C(C)C(=O)OC","InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4+","YYJWBYNQJLBIGS-SNAWJCMRSA-N"
"CCOC(=O)C(C)=CC","InChI=1S/C7H12O2/c1-4-6(3)7(8)9-5-2/h4H,5H2,1-3H3/b6-4+","OAPHLAAOJMTMLY-GQCTYLIASA-N"
"C=CCOC(=O)C(C)=CC","InChI=1S/C8H12O2/c1-4-6-10-8(9)7(3)5-2/h4-5H,1,6H2,2-3H3/b7-5+","ODOZNBUSHKFCSH-FNORWQNLSA-N"
"CC=C(C)C(=O)OC(C)C","InChI=1S/C8H14O2/c1-5-7(4)8(9)10-6(2)3/h5-6H,1-4H3/b7-5+","VUPBIVVRPJDWNW-FNORWQNLSA-N"
"CC=C(C)C(=O)OCC(C)C","InChI=1S/C9H16O2/c1-5-8(4)9(10)11-6-7(2)3/h5,7H,6H2,1-4H3/b8-5+","XDEGQMQKHFPBEW-VMPITWQZSA-N"
"CC=C(C)C(=O)OCCC(C)C","InChI=1S/C10H18O2/c1-5-9(4)10(11)12-7-6-8(2)3/h5,8H,6-7H2,1-4H3/b9-5+","ZARFDQHJMNVNLE-WEVVVXLNSA-N"
"CCCCCCOC(=O)C(C)=CC","InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h5H,4,6-9H2,1-3H3/b10-5+","JTCIUOKKVACNCK-BJMVGYQFSA-N"
"CC=C(C)C(=O)OCc(c1)cccc1","InChI=1S/C12H14O2/c1-3-10(2)12(13)14-9-11-7-5-4-6-8-11/h3-8H,9H2,1-2H3/b10-3+","QRGSTISKDZCDHV-XCVCLJGOSA-N"
"CCCC=CCO","InChI=1S/C6H12O/c1-2-3-4-5-6-7/h4-5,7H,2-3,6H2,1H3/b5-4+","ZCHHRLHTBGRGOT-SNAWJCMRSA-N"
"CCC=CCCO","InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3-","UFLHIIWVXFIJGU-ARJAWSKDSA-N"
"CCC=CCCO","InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3+","UFLHIIWVXFIJGU-ONEGZZNKSA-N"
"CCCCC=CCO","InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h5-6,8H,2-4,7H2,1H3/b6-5+","ASFYPVGAALGVNR-AATRIKPKSA-N"
"CCCC=CCCO","InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h4-5,8H,2-3,6-7H2,1H3/b5-4-","SDZQUCJFTUULJX-PLNGDYQASA-N"
"CCCC(O)C(C)C","InChI=1S/C7H16O/c1-4-5-7(8)6(2)3/h6-8H,4-5H2,1-3H3","RGRUUTLDBCWYBL-UHFFFAOYSA-N"
"CCCCCC(O)CC","InChI=1S/C8H18O/c1-3-5-6-7-8(9)4-2/h8-9H,3-7H2,1-2H3","NMRPBPVERJPACX-UHFFFAOYSA-N"
"CCCCCCCC(C)O","InChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3","NGDNVOAEIVQRFH-UHFFFAOYSA-N"
"CCCCCCC(O)CC","InChI=1S/C9H20O/c1-3-5-6-7-8-9(10)4-2/h9-10H,3-8H2,1-2H3","GYSCXPVAKHVAAY-UHFFFAOYSA-N"
"CCCCCCCCCC(C)O","InChI=1S/C11H24O/c1-3-4-5-6-7-8-9-10-11(2)12/h11-12H,3-10H2,1-2H3","XMUJIPOFTAHSOK-UHFFFAOYSA-N"
"CCCCCCCCC(O)CC","InChI=1S/C11H24O/c1-3-5-6-7-8-9-10-11(12)4-2/h11-12H,3-10H2,1-2H3","HCARCYFXWDRVBZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCO","InChI=1S/C12H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h13H,2-12H2,1H3","LQZZUXJYWNFBMV-UHFFFAOYSA-N"
"CCCCCCCCCCCC(C)O","InChI=1S/C13H28O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h13-14H,3-12H2,1-2H3","HKOLRKVMHVYNGG-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCO","InChI=1S/C14H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h15H,2-14H2,1H3","HLZKNKRTKFSKGZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCO","InChI=1S/C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h17H,2-16H2,1H3","BXWNKGSJHAJOGX-UHFFFAOYSA-N"
"OCc(c1)cc(O2)c(OC2)c1","InChI=1S/C8H8O3/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3,9H,4-5H2","BHUIUXNAPJIDOG-UHFFFAOYSA-N"
"CCCCCC=CC","InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h3,5H,4,6-8H2,1-2H3/b5-3+","ILPBINAXDRFYPL-HWKANZROSA-N"
"CCCCCCCCC","InChI=1S/C9H20/c1-3-5-7-9-8-6-4-2/h3-9H2,1-2H3","BKIMMITUMNQMOS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC","InChI=1S/C14H30/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-14H2,1-2H3","BGHCVCJVXZWKCC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC=C","InChI=1S/C16H32/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3H,1,4-16H2,2H3","GQEZCXVZFLOKMC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC=C","InChI=1S/C17H34/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3H,1,4-17H2,2H3","ADOBXTDBFNCOBN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC","InChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3","NDJKXXJCMXVBJW-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCC","InChI=1S/C19H40/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3-19H2,1-2H3","LQERIDTXQFOHKA-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCC","InChI=1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3","CBFCDTFDPHXCNY-UHFFFAOYSA-N"
"C=C(C21)C(C)(C)C(CC2)C1","InChI=1S/C10H16/c1-7-8-4-5-9(6-8)10(7,2)3/h8-9H,1,4-6H2,2-3H3","CRPUJAZIXJMDBK-UHFFFAOYSA-N"
"CC(=O)OCCC(C1)CCCC1","InChI=1S/C10H18O2/c1-9(11)12-8-7-10-5-3-2-4-6-10/h10H,2-8H2,1H3","NOTFZGFABLVTIG-UHFFFAOYSA-N"
"CC(=O)OC(C(C)C)Cc(c1)cccc1","InChI=1S/C13H18O2/c1-10(2)13(15-11(3)14)9-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3","OOYSHHTYKLXILA-UHFFFAOYSA-N"
"CC(=O)OC(C)c(c1)cccc1","InChI=1S/C10H12O2/c1-8(12-9(2)11)10-6-4-3-5-7-10/h3-8H,1-2H3","QUMXDOLUJCHOAY-UHFFFAOYSA-N"
"CC(=O)OCc(c1)ccc(C)c1","InChI=1S/C10H12O2/c1-8-3-5-10(6-4-8)7-12-9(2)11/h3-6H,7H2,1-2H3","WDCUPFMSLUIQBH-UHFFFAOYSA-N"
"CC(=O)OCc(c1)cc(C)cc1","InChI=1S/C10H12O2/c1-8-4-3-5-10(6-8)7-12-9(2)11/h3-6H,7H2,1-2H3","QPTQLFCBVFKFLY-UHFFFAOYSA-N"
"CC(=O)OCc(c1)c(C)ccc1","InChI=1S/C10H12O2/c1-8-5-3-4-6-10(8)7-12-9(2)11/h3-6H,7H2,1-2H3","BKKDUUVBVHYZFA-UHFFFAOYSA-N"
"CCCCCCCOC(=O)CC","InChI=1S/C10H20O2/c1-3-5-6-7-8-9-12-10(11)4-2/h3-9H2,1-2H3","BGYICJVBGZQOCY-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)CC","InChI=1S/C11H22O2/c1-3-5-6-7-8-9-10-13-11(12)4-2/h3-10H2,1-2H3","CEQGYPPMTKWBIU-UHFFFAOYSA-N"
"CCOCCC(=O)OCC","InChI=1S/C7H14O3/c1-3-9-6-5-7(8)10-4-2/h3-6H2,1-2H3","BHXIWUJLHYHGSJ-UHFFFAOYSA-N"
"CCC(=O)OC(C1)C(C)=CCC(C(C)=C)1","InChI=1S/C13H20O2/c1-5-13(14)15-12-8-11(9(2)3)7-6-10(12)4/h6,11-12H,2,5,7-8H2,1,3-4H3","DFVXNZOMAOGTBL-UHFFFAOYSA-N"
"CCC(=O)OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C13H22O2/c1-5-11(14)15-10-8-9-6-7-13(10,4)12(9,2)3/h9-10H,5-8H2,1-4H3","FAFMZORPAAGQFV-UHFFFAOYSA-N"
"CCC(=O)OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C13H22O2/c1-5-11(14)15-10-8-9-6-7-13(10,4)12(9,2)3/h9-10H,5-8H2,1-4H3/t9-,10?,13+/m0/s1","FAFMZORPAAGQFV-BOURZNODSA-N"
"CCC(=O)OC(C)(C=C)CCC=C(C)C","InChI=1S/C13H22O2/c1-6-12(14)15-13(5,7-2)10-8-9-11(3)4/h7,9H,2,6,8,10H2,1,3-5H3","WAQIIHCCEMGYKP-UHFFFAOYSA-N"
"CCC(=O)OCC([H])=C(C)CCC=C(C)C","InChI=1S/C13H22O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,9H,5-6,8,10H2,1-4H3/b12-9-","BYCHQEILESTMQU-XFXZXTDPSA-N"
"CCC(=O)OC(C)(C)C(C1)CC=C(C)C1","InChI=1S/C13H22O2/c1-5-12(14)15-13(3,4)11-8-6-10(2)7-9-11/h6,11H,5,7-9H2,1-4H3","CMKQOKAXUWQAHG-UHFFFAOYSA-N"
"CCC(=O)OCCC(C)CCC=C(C)C","InChI=1S/C13H24O2/c1-5-13(14)15-10-9-12(4)8-6-7-11(2)3/h7,12H,5-6,8-10H2,1-4H3","POPNTVRHTZDEBW-UHFFFAOYSA-N"
"CCC(=O)OC(C1)C(CCC(C)1)C(C)C","InChI=1S/C13H24O2/c1-5-13(14)15-12-8-10(4)6-7-11(12)9(2)3/h9-12H,5-8H2,1-4H3","PELLUIPPBKHUAB-UHFFFAOYSA-N"
"CCC(=O)OCCC(C)CC(C)(C)C","InChI=1S/C12H24O2/c1-6-11(13)14-8-7-10(2)9-12(3,4)5/h10H,6-9H2,1-5H3","FJTRXKOPFZBNTF-UHFFFAOYSA-N"
"CCC(=O)OC(C1)CCCCCCCC1","InChI=1S/C13H24O2/c1-2-13(14)15-12-10-8-6-4-3-5-7-9-11-12/h12H,2-11H2,1H3","JBOWYBVZEHROJP-UHFFFAOYSA-N"
"CCC(=O)OCC(C1)OCC1","InChI=1S/C8H14O3/c1-2-8(9)11-6-7-4-3-5-10-7/h7H,2-6H2,1H3","FMKCDSXOYLTWBR-UHFFFAOYSA-N"
"CCC(=O)OC(C)c(c1)cccc1","InChI=1S/C11H14O2/c1-3-11(12)13-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3","WCIQNYOXLZQQMU-UHFFFAOYSA-N"
"OCCC(C)CCCC(C)C","InChI=1S/C10H22O/c1-9(2)5-4-6-10(3)7-8-11/h9-11H,4-8H2,1-3H3","PRNCMAKCNVRZFX-UHFFFAOYSA-N"
"OCC(CC=C(C)C)C(C)=C","InChI=1S/C10H18O/c1-8(2)5-6-10(7-11)9(3)4/h5,10-11H,3,6-7H2,1-2,4H3","CZVXBFUKBZRMKR-UHFFFAOYSA-N"
"C=CC(=C)CCCC(C)(C)O","InChI=1S/C10H18O/c1-5-9(2)7-6-8-10(3,4)11/h5,11H,1-2,6-8H2,3-4H3","DUNCVNHORHNONW-UHFFFAOYSA-N"
"CC(=C)C(C1)CCC(C)(O)C1","InChI=1S/C10H18O/c1-8(2)9-4-6-10(3,11)7-5-9/h9,11H,1,4-7H2,2-3H3","RUJPNZNXGCHGID-UHFFFAOYSA-N"
"CC(C1)=CCC(O)(C1)C(C)C","InChI=1S/C10H18O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,8,11H,5-7H2,1-3H3","WRYLYDPHFGVWKC-UHFFFAOYSA-N"
"CC(C)C([H])(C1)C([H])(O)CC([H])(C)C1","InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9-,10+/m0/s1","NOOLISFMXDJSKH-LPEHRKFASA-N"
"CC(C1)CCC(O)(C1)C(C)C","InChI=1S/C10H20O/c1-8(2)10(11)6-4-9(3)5-7-10/h8-9,11H,4-7H2,1-3H3","LWKGCZOYSGKTLB-UHFFFAOYSA-N"
"CC(O)C=CC(C(C)=1)C(C)(C)CCC1","InChI=1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,11-12,14H,5,9H2,1-4H3/b8-7+","PWDOJWCZWKWKSE-BQYQJAHWSA-N"
"C=CC(C)(C1)C([H])(C(C)=C)CC([H])(C1)C(C)(C)O","InChI=1S/C15H26O/c1-7-15(6)9-8-12(14(4,5)16)10-13(15)11(2)3/h7,12-13,16H,1-2,8-10H2,3-6H3/t12-,13+,15-/m1/s1","GFJIQNADMLPFOW-VNHYZAJKSA-N"
"CCCCCCCCCCCCCC(C)=O","InChI=1S/C15H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15(2)16/h3-14H2,1-2H3","CJPNOLIZCWDHJK-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)CC","InChI=1S/C16H32O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16(17)4-2/h3-15H2,1-2H3","LTMXHUUHBSCKEK-UHFFFAOYSA-N"
"CC(=O)C(C)=O","InChI=1S/C4H6O2/c1-3(5)4(2)6/h1-2H3","QSJXEFYPDANLFS-UHFFFAOYSA-N"
"CCC(=O)C(C)=O","InChI=1S/C5H8O2/c1-3-5(7)4(2)6/h3H2,1-2H3","TZMFJUDUGYTVRY-UHFFFAOYSA-N"
"CCCC(=O)C(C)=O","InChI=1S/C6H10O2/c1-3-4-6(8)5(2)7/h3-4H2,1-2H3","MWVFCEVNXHTDNF-UHFFFAOYSA-N"
"[H]c(o1)c([H])c([H])c1C(C)=O","InChI=1S/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H3","IEMMBWWQXVXBEU-UHFFFAOYSA-N"
"CCC(=O)c(c1)occ1","InChI=1S/C7H8O2/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3","HCPORNAVHSWTOJ-UHFFFAOYSA-N"
"CC(=O)C=Cc(o1)c([H])c([H])c([H])1","InChI=1S/C8H8O2/c1-7(9)4-5-8-3-2-6-10-8/h2-6H,1H3/b5-4+","GBKGJMYPQZODMI-SNAWJCMRSA-N"
"CCCCCC(=O)c(c1)occ1","InChI=1S/C10H14O2/c1-2-3-4-6-9(11)10-7-5-8-12-10/h5,7-8H,2-4,6H2,1H3","YUAYWSBSIJVIBS-UHFFFAOYSA-N"
"CCCC(C1)C(=O)CCC1","InChI=1S/C9H16O/c1-2-5-8-6-3-4-7-9(8)10/h8H,2-7H2,1H3","OCJLPZCBZSCVCO-UHFFFAOYSA-N"
"CC(C1)CC(C)(C)CC(=O)1","InChI=1S/C9H16O/c1-7-4-8(10)6-9(2,3)5-7/h7H,4-6H2,1-3H3","POSWICCRDBKBMH-UHFFFAOYSA-N"
"CCCCCC(=C1)C(=O)CC1","InChI=1S/C10H16O/c1-2-3-4-6-9-7-5-8-10(9)11/h7H,2-6,8H2,1H3","ILHZVKAXFCDFMT-UHFFFAOYSA-N"
"CCCCCC(C1)C(=O)CC1","InChI=1S/C10H18O/c1-2-3-4-6-9-7-5-8-10(9)11/h9H,2-8H2,1H3","VNWOJVJCRAHBJJ-UHFFFAOYSA-N"
"O=C(C1)CCC(C1)C(C)(C)C","InChI=1S/C10H18O/c1-10(2,3)8-4-6-9(11)7-5-8/h8H,4-7H2,1-3H3","YKFKEYKJGVSEIX-UHFFFAOYSA-N"
"CCCC(=O)OCCCc(c1)cccc1","InChI=1S/C13H18O2/c1-2-7-13(14)15-11-6-10-12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3","IWBHCESPSIQPME-UHFFFAOYSA-N"
"CCCC(=O)OC(C)(C)Cc(c1)cccc1","InChI=1S/C14H20O2/c1-4-8-13(15)16-14(2,3)11-12-9-6-5-7-10-12/h5-7,9-10H,4,8,11H2,1-3H3","SHSGYHAHMQLYRB-UHFFFAOYSA-N"
"CC(C)C(=O)OCCOc(c1)cccc1","InChI=1S/C12H16O3/c1-10(2)12(13)15-9-8-14-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3","MJTPMXWJHPOWGH-UHFFFAOYSA-N"
"COc(c1)ccc(COC(=O)C(C)C)c1","InChI=1S/C12H16O3/c1-9(2)12(13)15-8-10-4-6-11(14-3)7-5-10/h4-7,9H,8H2,1-3H3","ZOXXODFRADWDHG-UHFFFAOYSA-N"
"C=CCOC(=O)C(C)C","InChI=1S/C7H12O2/c1-4-5-9-7(8)6(2)3/h4,6H,1,5H2,2-3H3","QNBDJTKBKITRJI-UHFFFAOYSA-N"
"CCCCCOC(=O)C(C)C","InChI=1S/C9H18O2/c1-4-5-6-7-11-9(10)8(2)3/h8H,4-7H2,1-3H3","UYGGIIOLYXRSQY-UHFFFAOYSA-N"
"CC(C)CCOC(=O)C(C)C","InChI=1S/C9H18O2/c1-7(2)5-6-11-9(10)8(3)4/h7-8H,5-6H2,1-4H3","VFTGLSWXJMRZNB-UHFFFAOYSA-N"
"CCCC=CCOC(=O)C(C)C","InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h6-7,9H,4-5,8H2,1-3H3/b7-6+","DSFNTAVCWZDPEB-VOTSOKGWSA-N"
"CCC=CCCOC(=O)C(C)C","InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h5-6,9H,4,7-8H2,1-3H3/b6-5-","OSMAJVWUIUORGC-WAYWQWQTSA-N"
"CC(C)CC(C)OC(=O)C(C)C","InChI=1S/C10H20O2/c1-7(2)6-9(5)12-10(11)8(3)4/h7-9H,6H2,1-5H3","KOTIQBSLRXNDQH-UHFFFAOYSA-N"
"CCCCC(C)OC(=O)C(C)C","InChI=1S/C10H20O2/c1-5-6-7-9(4)12-10(11)8(2)3/h8-9H,5-7H2,1-4H3","QLUIRWJNPGJBRM-UHFFFAOYSA-N"
"CCCC(CC)OC(=O)C(C)C","InChI=1S/C10H20O2/c1-5-7-9(6-2)12-10(11)8(3)4/h8-9H,5-7H2,1-4H3","VZZDUJNRNFKSFD-UHFFFAOYSA-N"
"CCCCCCCOC(=O)C(C)C","InChI=1S/C11H22O2/c1-4-5-6-7-8-9-13-11(12)10(2)3/h10H,4-9H2,1-3H3","RFDUMBPGZUIKOG-UHFFFAOYSA-N"
"CC(C)C(=O)OCC(C1)=CCC(C(C)=C)C1","InChI=1S/C14H22O2/c1-10(2)13-7-5-12(6-8-13)9-16-14(15)11(3)4/h5,11,13H,1,6-9H2,2-4H3","KAQYLYYVKDTFRT-UHFFFAOYSA-N"
"CC(C)C(=O)OC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C14H24O2/c1-9(2)12(15)16-11-8-10-6-7-14(11,5)13(10,3)4/h9-11H,6-8H2,1-5H3","KRKIAJBQOUBNSE-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCOC(=O)C(C)C","InChI=1S/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9+","OGJYXQFXLSCKTP-UKTHLTGXSA-N"
"CC(C)=CCCC(C)(C=C)OC(=O)C(C)C","InChI=1S/C14H24O2/c1-7-14(6,10-8-9-11(2)3)16-13(15)12(4)5/h7,9,12H,1,8,10H2,2-6H3","JZIARAQCPRDGAC-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCOC(=O)C(C)C","InChI=1S/C14H24O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,9,12H,6,8,10H2,1-5H3/b13-9-","OGJYXQFXLSCKTP-LCYFTJDESA-N"
"CCCCCC(=O)OCCC","InChI=1S/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3","HTUIWRWYYVBCFT-UHFFFAOYSA-N"
"CCCCCC(=O)OCCCCC","InChI=1S/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3","WRFZKAGPPQGDDQ-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCCCC","InChI=1S/C12H24O2/c1-3-5-7-9-11-14-12(13)10-8-6-4-2/h3-11H2,1-2H3","NCDCLPBOMHPFCV-UHFFFAOYSA-N"
"CCCCCCCOC(=O)CCCCC","InChI=1S/C13H26O2/c1-3-5-7-8-10-12-15-13(14)11-9-6-4-2/h3-12H2,1-2H3","QEKCBKVWQYEUGY-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)CCCCC","InChI=1S/C14H28O2/c1-3-5-7-8-9-11-13-16-14(15)12-10-6-4-2/h3-13H2,1-2H3","CMNMHJVRZHGAAK-UHFFFAOYSA-N"
"CCCCCCCCCOC(=O)CCCCC","InChI=1S/C15H30O2/c1-3-5-7-8-9-10-12-14-17-15(16)13-11-6-4-2/h3-14H2,1-2H3","UQLYLJOCUOEHOM-UHFFFAOYSA-N"
"CCCCCC(=O)OCC=C(C)CCC=C(C)C","InChI=1S/C16H28O2/c1-5-6-7-11-16(17)18-13-12-15(4)10-8-9-14(2)3/h9,12H,5-8,10-11,13H2,1-4H3/b15-12+","ARVSCQUZFFSNKF-NTCAYCPXSA-N"
"CCCCCC(=O)OCCC(C)CCC=C(C)C","InChI=1S/C16H30O2/c1-5-6-7-11-16(17)18-13-12-15(4)10-8-9-14(2)3/h9,15H,5-8,10-13H2,1-4H3","KNYRCCKTQMBSFP-UHFFFAOYSA-N"
"CCCCCC(=O)OC(C1)CCCC1","InChI=1S/C12H22O2/c1-2-3-5-10-12(13)14-11-8-6-4-7-9-11/h11H,2-10H2,1H3","DTNOERNOMHQUCN-UHFFFAOYSA-N"
"CCCCCC(=O)OCCc(c1)cccc1","InChI=1S/C14H20O2/c1-2-3-5-10-14(15)16-12-11-13-8-6-4-7-9-13/h4,6-9H,2-3,5,10-12H2,1H3","BUYNWUMUDHPPDS-UHFFFAOYSA-N"
"CCCCCC(=O)OCCCc(c1)cccc1","InChI=1S/C15H22O2/c1-2-3-5-12-15(16)17-13-8-11-14-9-6-4-7-10-14/h4,6-7,9-10H,2-3,5,8,11-13H2,1H3","RSOGLEKUVSFLMO-UHFFFAOYSA-N"
"CCCCCCCC(=O)Oc(c1)ccc(C)c1","InChI=1S/C15H22O2/c1-3-4-5-6-7-8-15(16)17-14-11-9-13(2)10-12-14/h9-12H,3-8H2,1-2H3","ALRYNTSLFYRKGF-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCCCCCCC","InChI=1S/C15H30O2/c1-3-5-7-9-11-13-15(16)17-14-12-10-8-6-4-2/h3-14H2,1-2H3","TZXWLJYLYILFGM-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)CCCCCCC","InChI=1S/C16H32O2/c1-3-5-7-9-11-13-15-18-16(17)14-12-10-8-6-4-2/h3-15H2,1-2H3","DJNTZVRUYMHBTD-UHFFFAOYSA-N"
"CCCCCCCCCCOC(=O)CCCCCCC","InChI=1S/C18H36O2/c1-3-5-7-9-10-11-13-15-17-20-18(19)16-14-12-8-6-4-2/h3-17H2,1-2H3","WVWRBUIUZMBLNI-UHFFFAOYSA-N"
"CCCCCC(=O)OC(C)(C=C)CCC=C(C)C","InChI=1S/C16H28O2/c1-6-8-9-12-15(17)18-16(5,7-2)13-10-11-14(3)4/h7,11H,2,6,8-10,12-13H2,1,3-5H3","ALKCLFLTXBBMMP-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCC=C","InChI=1S/C12H22O2/c1-3-5-6-7-8-9-10-12(13)14-11-4-2/h4H,2-3,5-11H2,1H3","MFLWLDDOGSNSKO-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCCC","InChI=1S/C12H24O2/c1-3-5-6-7-8-9-10-12(13)14-11-4-2/h3-11H2,1-2H3","HCMSDHYNNJTLRW-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OC(C)C","InChI=1S/C12H24O2/c1-4-5-6-7-8-9-10-12(13)14-11(2)3/h11H,4-10H2,1-3H3","DVFZGWDMFKTMFQ-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCCCC","InChI=1S/C13H26O2/c1-3-5-7-8-9-10-11-13(14)15-12-6-4-2/h3-12H2,1-2H3","DOLFPCDDMUMIMR-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCC(C)C","InChI=1S/C13H26O2/c1-4-5-6-7-8-9-10-13(14)15-11-12(2)3/h12H,4-11H2,1-3H3","NVVLMTNIHQHZPR-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCCCCC","InChI=1S/C14H28O2/c1-3-5-7-8-9-10-12-14(15)16-13-11-6-4-2/h3-13H2,1-2H3","DZOQJRHASSOUOU-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCCC(C)C","InChI=1S/C14H28O2/c1-4-5-6-7-8-9-10-14(15)16-12-11-13(2)3/h13H,4-12H2,1-3H3","SHGMLOSSRPFLKG-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCCCCCC","InChI=1S/C15H30O2/c1-3-5-7-9-10-11-13-15(16)17-14-12-8-6-4-2/h3-14H2,1-2H3","GPHBCFMWKGZPRP-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCCCCCCC","InChI=1S/C16H32O2/c1-3-5-7-9-10-12-14-16(17)18-15-13-11-8-6-4-2/h3-15H2,1-2H3","ARSLOAKOWGOSEX-UHFFFAOYSA-N"
"CCCCCCCCC(C)O","InChI=1S/C10H22O/c1-3-4-5-6-7-8-9-10(2)11/h10-11H,3-9H2,1-2H3","ACUZDYFTRHEKOS-UHFFFAOYSA-N"
"CCCCCCCC(O)CC","InChI=1S/C10H22O/c1-3-5-6-7-8-9-10(11)4-2/h10-11H,3-9H2,1-2H3","ICEQLCZWZXUUIJ-UHFFFAOYSA-N"
"CCCCCCC(O)CCC","InChI=1S/C10H22O/c1-3-5-6-7-9-10(11)8-4-2/h10-11H,3-9H2,1-2H3","DTDMYWXTWWFLGJ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCO","InChI=1S/C13H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h14H,2-13H2,1H3","XFRVVPUIAFSTFO-UHFFFAOYSA-N"
"CC(C)(O)CCC(C)(C)O","InChI=1S/C8H18O2/c1-7(2,9)5-6-8(3,4)10/h9-10H,5-6H2,1-4H3","ZWNMRZQYWRLGMM-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCCC(C)CCCC(C)(O)C=C","InChI=1S/C20H40O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,17-19,21H,1,8-16H2,2-6H3","KEVYVLWNCKMXJX-UHFFFAOYSA-N"
"CC(O)CC(C)(C)O","InChI=1S/C6H14O2/c1-5(7)4-6(2,3)8/h5,7-8H,4H2,1-3H3","SVTBMSDMJJWYQN-UHFFFAOYSA-N"
"CC(C)CCCC(C)(O)CC","InChI=1S/C10H22O/c1-5-10(4,11)8-6-7-9(2)3/h9,11H,5-8H2,1-4H3","DLHQZZUEERVIGQ-UHFFFAOYSA-N"
"OCC(CCC(C)C)C(C)C","InChI=1S/C10H22O/c1-8(2)5-6-10(7-11)9(3)4/h8-11H,5-7H2,1-4H3","SFIQHFBITUEIBP-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)C(C)(C)O","InChI=1S/C10H14O/c1-8-4-6-9(7-5-8)10(2,3)11/h4-7,11H,1-3H3","XLPDVYGDNRIQFV-UHFFFAOYSA-N"
"CC(=C)C(C1)CC(O)C(C)=C1","InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3/t9-,10+/m1/s1","BAVONGHXFVOKBV-ZJUUUORDSA-N"
"OCC(=C2)C(C1)C(C)(C)C(C2)1","InChI=1S/C10H16O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,8-9,11H,4-6H2,1-2H3","RXBQNMWIQKOSCS-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=O","InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3","UHEPJGULSIKKTP-UHFFFAOYSA-N"
"CCC(C)CC(=O)CC","InChI=1S/C8H16O/c1-4-7(3)6-8(9)5-2/h7H,4-6H2,1-3H3","PSBKJPTZCVYXSD-UHFFFAOYSA-N"
"CCCCCCC(=O)CC","InChI=1S/C9H18O/c1-3-5-6-7-8-9(10)4-2/h3-8H2,1-2H3","IYTXKIXETAELAV-UHFFFAOYSA-N"
"CCCCCCCCC(C)=O","InChI=1S/C10H20O/c1-3-4-5-6-7-8-9-10(2)11/h3-9H2,1-2H3","ZAJNGDIORYACQU-UHFFFAOYSA-N"
"CCCCCCCC(=O)CC","InChI=1S/C10H20O/c1-3-5-6-7-8-9-10(11)4-2/h3-9H2,1-2H3","XJLDYKIEURAVBW-UHFFFAOYSA-N"
"CCC(=O)CCC(C)C","InChI=1S/C8H16O/c1-4-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3","CCCIYAQYQZQDIZ-UHFFFAOYSA-N"
"CCCCCCCCCC(C)=O","InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3","KYWIYKKSMDLRDC-UHFFFAOYSA-N"
"CCCCCCCCC(=O)CC","InChI=1S/C11H22O/c1-3-5-6-7-8-9-10-11(12)4-2/h3-10H2,1-2H3","YNMZZHPSYMOGCI-UHFFFAOYSA-N"
"CCCCCCCC(=O)CCC","InChI=1S/C11H22O/c1-3-5-6-7-8-10-11(12)9-4-2/h3-10H2,1-2H3","NBSLHMOSERBUOV-UHFFFAOYSA-N"
"CCCCCCC(=O)CCCC","InChI=1S/C11H22O/c1-3-5-7-8-10-11(12)9-6-4-2/h3-10H2,1-2H3","WENNKWXPAWNIOO-UHFFFAOYSA-N"
"CCCCCC(=O)CCCCC","InChI=1S/C11H22O/c1-3-5-7-9-11(12)10-8-6-4-2/h3-10H2,1-2H3","ZPQAKYPOZRXKFA-UHFFFAOYSA-N"
"CC(C)CCC(=O)CCC(C)C","InChI=1S/C11H22O/c1-9(2)5-7-11(12)8-6-10(3)4/h9-10H,5-8H2,1-4H3","JQCWLRHNAHIIGW-UHFFFAOYSA-N"
"CCCCCCCCCCC(C)=O","InChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h3-11H2,1-2H3","LSKONYYRONEBKA-UHFFFAOYSA-N"
"CCCCCCCCCCCC(C)=O","InChI=1S/C13H26O/c1-3-4-5-6-7-8-9-10-11-12-13(2)14/h3-12H2,1-2H3","CYIFVRUOHKNECG-UHFFFAOYSA-N"
"O=COCCC(C)CCCC(C)C","InChI=1S/C11H22O2/c1-10(2)5-4-6-11(3)7-8-13-9-12/h9-11H,4-8H2,1-3H3","AGARWNGUJKCDII-UHFFFAOYSA-N"
"O=COC(C)(C=C)CCC=C(C)CCC=C(C)C","InChI=1S/C16H26O2/c1-6-16(5,18-13-17)12-8-11-15(4)10-7-9-14(2)3/h6,9,11,13H,1,7-8,10,12H2,2-5H3/b15-11+","GJPVEZJRYIBIOD-RVDMUPIBSA-N"
"O=COC(C1)CCCC1","InChI=1S/C7H12O2/c8-6-9-7-4-2-1-3-5-7/h6-7H,1-5H2","VUXKVKAHWOVIDN-UHFFFAOYSA-N"
"O=COC(C1)CCC(C1)C(C)(C)C","InChI=1S/C11H20O2/c1-11(2,3)9-4-6-10(7-5-9)13-8-12/h8-10H,4-7H2,1-3H3","ZIIKTNCFALFPNK-UHFFFAOYSA-N"
"O=COCc(c1)cccc1","InChI=1S/C8H8O2/c9-7-10-6-8-4-2-1-3-5-8/h1-5,7H,6H2","UYWQUFXKFGHYNT-UHFFFAOYSA-N"
"O=COc(c1)ccc(C)c1","InChI=1S/C8H8O2/c1-7-2-4-8(5-3-7)10-6-9/h2-6H,1H3","NEIANUMOAXBNRT-UHFFFAOYSA-N"
"O=COCC=Cc(c1)cccc1","InChI=1S/C10H10O2/c11-9-12-8-4-7-10-5-2-1-3-6-10/h1-7,9H,8H2/b7-4+","LBHJXKYRYCUGPD-QPJJXVBHSA-N"
"O=COCCc(c1)cccc1","InChI=1S/C9H10O2/c10-8-11-7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2","IKDIJXDZEYHZSD-UHFFFAOYSA-N"
"O=COCc(c1)ccc(OC)c1","InChI=1S/C9H10O3/c1-11-9-4-2-8(3-5-9)6-12-7-10/h2-5,7H,6H2,1H3","XPDORSROGAZEGY-UHFFFAOYSA-N"
"CC=CC=CCOC(C)=O","InChI=1S/C8H12O2/c1-3-4-5-6-7-10-8(2)9/h3-6H,7H2,1-2H3/b4-3+,6-5+","PXVKYPFROMBALG-VNKDHWASSA-N"
"CCCC=CCOC(C)=O","InChI=1S/C8H14O2/c1-3-4-5-6-7-10-8(2)9/h5-6H,3-4,7H2,1-2H3/b6-5+","HRHOWZHRCRZVCU-AATRIKPKSA-N"
"CC(C)=CCCC(C)(C=C)OC(=O)CC(C)C","InChI=1S/C15H26O2/c1-7-15(6,10-8-9-12(2)3)17-14(16)11-13(4)5/h7,9,13H,1,8,10-11H2,2-6H3","WCDGWAIZRYMVOW-UHFFFAOYSA-N"
"CC(C)CC(=O)OC(C1)C(CCC(C)1)C(C)C","InChI=1S/C15H28O2/c1-10(2)8-15(16)17-14-9-12(5)6-7-13(14)11(3)4/h10-14H,6-9H2,1-5H3","VYQSSWZYPCCBRN-UHFFFAOYSA-N"
"CC(C)CC(=O)OCc(c1)cccc1","InChI=1S/C12H16O2/c1-10(2)8-12(13)14-9-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3","HVJKZICIMIWFCP-UHFFFAOYSA-N"
"CC(C)CC(=O)Oc(c1)ccc(C)c1","InChI=1S/C12H16O2/c1-9(2)8-12(13)14-11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3","MVDPTWHTUYDLTL-UHFFFAOYSA-N"
"CC(C)CC(=O)OCCc(c1)cccc1","InChI=1S/C13H18O2/c1-11(2)10-13(14)15-9-8-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3","JIMGVOCOYZFDKB-UHFFFAOYSA-N"
"CC(C)CC(=O)OCCCc(c1)cccc1","InChI=1S/C14H20O2/c1-12(2)11-14(15)16-10-6-9-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3","LBNFCOMOXOWXCD-UHFFFAOYSA-N"
"CC(C)CC(=O)OCc(c1)occ1","InChI=1S/C10H14O3/c1-8(2)6-10(11)13-7-9-4-3-5-12-9/h3-5,8H,6-7H2,1-2H3","FKGUIBCHHSHJNQ-UHFFFAOYSA-N"
"CC(C)CC(=O)OC(C1)CCCC1","InChI=1S/C11H20O2/c1-9(2)8-11(12)13-10-6-4-3-5-7-10/h9-10H,3-8H2,1-2H3","SQPOKBBCNZIWFI-UHFFFAOYSA-N"
"CCC(C)C(=O)OC","InChI=1S/C6H12O2/c1-4-5(2)6(7)8-3/h5H,4H2,1-3H3","OCWLYWIFNDCWRZ-UHFFFAOYSA-N"
"CCOC(=O)C(C)CC","InChI=1S/C7H14O2/c1-4-6(3)7(8)9-5-2/h6H,4-5H2,1-3H3","HCRBXQFHJMCTLF-UHFFFAOYSA-N"
"CCCOC(=O)C(C)CC","InChI=1S/C8H16O2/c1-4-6-10-8(9)7(3)5-2/h7H,4-6H2,1-3H3","TZFQMSDUSOTCJC-UHFFFAOYSA-N"
"CCC(C)C(=O)OC(C)C","InChI=1S/C8H16O2/c1-5-7(4)8(9)10-6(2)3/h6-7H,5H2,1-4H3","DIRDKDDFAMNBNY-UHFFFAOYSA-N"
"CCCCOC(=O)C(C)CC","InChI=1S/C9H18O2/c1-4-6-7-11-9(10)8(3)5-2/h8H,4-7H2,1-3H3","OTKQNSSMCDLVQV-UHFFFAOYSA-N"
"CCC(C)C(=O)OCC(C)C","InChI=1S/C9H18O2/c1-5-8(4)9(10)11-6-7(2)3/h7-8H,5-6H2,1-4H3","NWZQCEQAPBRMFX-UHFFFAOYSA-N"
"CCCCCOC(=O)C(C)CC","InChI=1S/C10H20O2/c1-4-6-7-8-12-10(11)9(3)5-2/h9H,4-8H2,1-3H3","RHNBXPIJLXBHMF-UHFFFAOYSA-N"
"CCC(C)C(=O)OCCC(C)C","InChI=1S/C10H20O2/c1-5-9(4)10(11)12-7-6-8(2)3/h8-9H,5-7H2,1-4H3","VGIRHYHLQKDEPP-UHFFFAOYSA-N"
"CCC(C)COC(=O)C(C)CC","InChI=1S/C10H20O2/c1-5-8(3)7-12-10(11)9(4)6-2/h8-9H,5-7H2,1-4H3","PVYFCGRBIREQLL-UHFFFAOYSA-N"
"CCC=CCCOC(=O)C(C)CC","InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h6-7,10H,4-5,8-9H2,1-3H3/b7-6-","JKKGTSUICJWEKB-SREVYHEPSA-N"
"CCCCCCOC(=O)C(C)CC","InChI=1S/C11H22O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h10H,4-9H2,1-3H3","YUECNVSODFDKOQ-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)C(C)CC","InChI=1S/C13H26O2/c1-4-6-7-8-9-10-11-15-13(14)12(3)5-2/h12H,4-11H2,1-3H3","BCOJVEMHTBSAOE-UHFFFAOYSA-N"
"CCC(C)C(=O)OC([H])(C1)C([H])(C(C)C)CCC([H])(C)1","InChI=1S/C15H28O2/c1-6-12(5)15(16)17-14-9-11(4)7-8-13(14)10(2)3/h10-14H,6-9H2,1-5H3/t11-,12?,13+,14-/m0/s1","FGHREPYEIHRUKM-FUEJHIMDSA-N"
"CCC(C)C(=O)OCCc(c1)cccc1","InChI=1S/C13H18O2/c1-3-11(2)13(14)15-10-9-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3","KVKKTLBBYFABAZ-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OCCC(C)C","InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-17(18)19-15-14-16(2)3/h16H,4-15H2,1-3H3","FVKRIDSRWFEQME-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OCc(c1)cccc1","InChI=1S/C19H30O2/c1-2-3-4-5-6-7-8-9-13-16-19(20)21-17-18-14-11-10-12-15-18/h10-12,14-15H,2-9,13,16-17H2,1H3","QNRYOQRUGRVBRL-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OCCC","InChI=1S/C19H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-19(20)21-18-4-2/h3-18H2,1-2H3","BEKZXQKGTDVSKX-UHFFFAOYSA-N"
"CCC(O)C=C","InChI=1S/C5H10O/c1-3-5(6)4-2/h3,5-6H,1,4H2,2H3","VHVMXWZXFBOANQ-UHFFFAOYSA-N"
"CC(C)C(C1)C=CC(C)=C1","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3","OGLDWXZKYODSOB-UHFFFAOYSA-N"
"CC(C)C(C1)=C([H])C([H])=C(C)C1","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8H,5,7H2,1-3H3","YHQGMYUVUMAZJR-UHFFFAOYSA-N"
"CC(C)C(C1)=C([H])CC(C)=C([H])1","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,7-8H,5-6H2,1-3H3","YKFLAYDHMOASIY-UHFFFAOYSA-N"
"CC(C1)=CCC(C1)=C(C)C","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4H,5-7H2,1-3H3","MOYAFQVGZZPNRA-UHFFFAOYSA-N"
"CC(=C)C(C2)CC(C)(C(C)1)C(C2)=CC(=O)C1","InChI=1S/C15H22O/c1-10(2)12-5-6-13-8-14(16)7-11(3)15(13,4)9-12/h8,11-12H,1,5-7,9H2,2-4H3/t11-,12-,15+/m1/s1","WTOYNNBCKUYIKC-JMSVASOKSA-N"
"CC(=O)C=Cc(c1)cccc1","InChI=1S/C10H10O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+","BWHOZHOGCMHOBV-BQYQJAHWSA-N"
"CC(=O)CCc(c1)cccc1","InChI=1S/C10H12O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3","AKGGYBADQZYZPD-UHFFFAOYSA-N"
"CCc(c1)ccc(c1)C(C)=O","InChI=1S/C10H12O/c1-3-9-4-6-10(7-5-9)8(2)11/h4-7H,3H2,1-2H3","NODGRWCMFMEGJH-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(c1)C(C)=O","InChI=1S/C10H12O/c1-7-4-5-10(9(3)11)8(2)6-7/h4-6H,1-3H3","HSDSKVWQTONQBJ-UHFFFAOYSA-N"
"CC(=O)OCc(c1)ccc(C(C)C)c1","InChI=1S/C12H16O2/c1-9(2)12-6-4-11(5-7-12)8-14-10(3)13/h4-7,9H,8H2,1-3H3","QBCRVYRADYXNOW-UHFFFAOYSA-N"
"CC(=O)OC([H])(C(C)=1)CC([H])(C(C)=C)CC1","InChI=1S/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12-/m1/s1","YTHRBOFHFYZBRJ-VXGBXAGGSA-N"
"CC(=O)OC(C1)C(C)=CCC(C(C)=C)1","InChI=1S/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12+/m1/s1","YTHRBOFHFYZBRJ-NEPJUHHUSA-N"
"CC(=O)OCC(=C2)C(C1)C(C)(C)C(C2)1","InChI=1S/C12H18O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h4,10-11H,5-7H2,1-3H3/t10-,11-/m0/s1","BKATZVAUANSCKN-QWRGUYRKSA-N"
"CC(=O)OC([H])(C1)C([H])(C)CCC([H])(C(C)=C)1","InChI=1S/C12H20O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h9,11-12H,1,5-7H2,2-4H3/t9-,11-,12-/m1/s1","TUSIZTVSUSBSQI-YUSALJHKSA-N"
"CC(=O)OC([H])(C(C)21)C(C)(C)C([H])(CC2)C1","InChI=1S/C12H20O2/c1-8(13)14-10-11(2,3)9-5-6-12(10,4)7-9/h9-10H,5-7H2,1-4H3/t9?,10-,12?/m1/s1","JUWUWIGZUVEFQB-SQLBVSGCSA-N"
"CC(C)=CCC([H])(COC(C)=O)C(C)=C","InChI=1S/C12H20O2/c1-9(2)6-7-12(10(3)4)8-14-11(5)13/h6,12H,3,7-8H2,1-2,4-5H3/t12-/m0/s1","HYNGAVZPWWXQIU-LBPRGKRZSA-N"
"CC(C)=CCCC(C)=CCOC(C)=O","InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8-","HIGQPQRQIQDZMP-FLIBITNWSA-N"
"CC(C)=CCCC(C)CCOC(=O)C(C)C","InChI=1S/C14H26O2/c1-11(2)7-6-8-13(5)9-10-16-14(15)12(3)4/h7,12-13H,6,8-10H2,1-5H3","ZGPPERKMXSGYRK-UHFFFAOYSA-N"
"CC(C)C(=O)OC(C1)C(C)=CCC(C(C)=C)1","InChI=1S/C14H22O2/c1-9(2)12-7-6-11(5)13(8-12)16-14(15)10(3)4/h6,10,12-13H,1,7-8H2,2-5H3/t12-,13+/m1/s1","FCZDTLWQNRALDC-OLZOCXBDSA-N"
"CCC=CCCOC(=O)C(C)C","InChI=1S/C10H18O2/c1-4-5-6-7-8-12-10(11)9(2)3/h5-6,9H,4,7-8H2,1-3H3/b6-5+","OSMAJVWUIUORGC-AATRIKPKSA-N"
"CCCCCCOC(=O)C(C)C","InChI=1S/C10H20O2/c1-4-5-6-7-8-12-10(11)9(2)3/h9H,4-8H2,1-3H3","CYHBDKTZDLSRMY-UHFFFAOYSA-N"
"CC(C)C(=O)OC(C1)CC(C)(C)CC(C)1","InChI=1S/C13H24O2/c1-9(2)12(14)15-11-6-10(3)7-13(4,5)8-11/h9-11H,6-8H2,1-5H3","RXJFMOVDBZCVES-UHFFFAOYSA-N"
"CC(C)C(=O)OCc(c1)cccc1","InChI=1S/C11H14O2/c1-9(2)11(12)13-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","UIKJRDSCEYGECG-UHFFFAOYSA-N"
"CC(C)C(=O)Oc(c1)ccc(C)c1","InChI=1S/C11H14O2/c1-8(2)11(12)13-10-6-4-9(3)5-7-10/h4-8H,1-3H3","UPPSFGGDKACIKP-UHFFFAOYSA-N"
"CC(C)C(=O)OC(C)c(c1)cccc1","InChI=1S/C12H16O2/c1-9(2)12(13)14-10(3)11-7-5-4-6-8-11/h4-10H,1-3H3","JZCCYSDOUYQZMW-UHFFFAOYSA-N"
"CC(C)C(=O)OCCc(c1)cccc1","InChI=1S/C12H16O2/c1-10(2)12(13)14-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3","JDQVBGQWADMTAM-UHFFFAOYSA-N"
"CC(C)C(=O)OCC=Cc(c1)cccc1","InChI=1S/C13H16O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-9,11H,10H2,1-2H3/b9-6+","KLKQSZIWHVEARN-RMKNXTFCSA-N"
"CC(C)C(=O)OC(C)(C)c(c1)cccc1","InChI=1S/C13H18O2/c1-10(2)12(14)15-13(3,4)11-8-6-5-7-9-11/h5-10H,1-4H3","LQOHUFIIIKBPQC-UHFFFAOYSA-N"
"CC(C)C(=O)OCCCc(c1)cccc1","InChI=1S/C13H18O2/c1-11(2)13(14)15-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3","VBTAKMZSMFMLGT-UHFFFAOYSA-N"
"CC(C)C(=O)OC(C)(C)Cc(c1)cccc1","InChI=1S/C14H20O2/c1-11(2)13(15)16-14(3,4)10-12-8-6-5-7-9-12/h5-9,11H,10H2,1-4H3","KOEHGIXXSWVEPT-UHFFFAOYSA-N"
"CC(C)C(=O)OC(C)(C)CCc(c1)cccc1","InChI=1S/C15H22O2/c1-12(2)14(16)17-15(3,4)11-10-13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3","WCEXWNUHYPYHDN-UHFFFAOYSA-N"
"CCCCC(=O)OCC=C","InChI=1S/C8H14O2/c1-3-5-6-8(9)10-7-4-2/h4H,2-3,5-7H2,1H3","PWYXVVREDGESBB-UHFFFAOYSA-N"
"CCCCC(=O)OCCC","InChI=1S/C8H16O2/c1-3-5-6-8(9)10-7-4-2/h3-7H2,1-2H3","ROJKPKOYARNFNB-UHFFFAOYSA-N"
"CCCCC(=O)OC(C)C","InChI=1S/C8H16O2/c1-4-5-6-8(9)10-7(2)3/h7H,4-6H2,1-3H3","OCAIYHCKLADPEG-UHFFFAOYSA-N"
"CCCCOC(=O)CCCC","InChI=1S/C9H18O2/c1-3-5-7-9(10)11-8-6-4-2/h3-8H2,1-2H3","OKJADYKTJJGKDX-UHFFFAOYSA-N"
"CCCCC(=O)OCC(C)C","InChI=1S/C9H18O2/c1-4-5-6-9(10)11-7-8(2)3/h8H,4-7H2,1-3H3","ADNADZOSMJDVIS-UHFFFAOYSA-N"
"CCCCCOC(=O)CCCC","InChI=1S/C10H20O2/c1-3-5-7-9-12-10(11)8-6-4-2/h3-9H2,1-2H3","FGPPDYNPZTUNIU-UHFFFAOYSA-N"
"CCCCC(=O)OCCC(C)C","InChI=1S/C10H20O2/c1-4-5-6-10(11)12-8-7-9(2)3/h9H,4-8H2,1-3H3","UBLAMKHIFZBBSS-UHFFFAOYSA-N"
"CCC=CCCOC(=O)CCCC","InChI=1S/C11H20O2/c1-3-5-7-8-10-13-11(12)9-6-4-2/h5,7H,3-4,6,8-10H2,1-2H3/b7-5-","XPFTVTFOOTVHIA-ALCCZGGFSA-N"
"CCCCCCCCC(=O)OCCCCCCCC","InChI=1S/C17H34O2/c1-3-5-7-9-11-13-15-17(18)19-16-14-12-10-8-6-4-2/h3-16H2,1-2H3","XMCQOINBECWLBL-UHFFFAOYSA-N"
"CCCCCCCCCCOC(=O)CCCCCCCC","InChI=1S/C19H38O2/c1-3-5-7-9-11-12-14-16-18-21-19(20)17-15-13-10-8-6-4-2/h3-18H2,1-2H3","KEGIMMCZWZCLGJ-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCc(c1)cccc1","InChI=1S/C16H24O2/c1-2-3-4-5-6-10-13-16(17)18-14-15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3","KVIQEJMWUXBBQJ-UHFFFAOYSA-N"
"CCCCCCCCC(=O)OCCc(c1)cccc1","InChI=1S/C17H26O2/c1-2-3-4-5-6-10-13-17(18)19-15-14-16-11-8-7-9-12-16/h7-9,11-12H,2-6,10,13-15H2,1H3","AFBMLGHBGGLHOF-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCC=C","InChI=1S/C13H24O2/c1-3-5-6-7-8-9-10-11-13(14)15-12-4-2/h4H,2-3,5-12H2,1H3","DQVOTEHORLHPRW-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCCC","InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-13(14)15-12-4-2/h3-12H2,1-2H3","OVFMRFMJVFDSAA-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCCCCCC","InChI=1S/C16H32O2/c1-3-5-7-9-10-11-12-14-16(17)18-15-13-8-6-4-2/h3-15H2,1-2H3","DGPNTCACXCHFDI-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCCC=CCC","InChI=1S/C16H30O2/c1-3-5-7-9-10-11-12-14-16(17)18-15-13-8-6-4-2/h6,8H,3-5,7,9-15H2,1-2H3/b8-6-","APSRJAGZYONPLL-VURMDHGXSA-N"
"CC=Cc(c1)ccc(C)c1","InChI=1S/C10H12/c1-3-4-10-7-5-9(2)6-8-10/h3-8H,1-2H3/b4-3+","LSMSSYSRCUNIFX-ONEGZZNKSA-N"
"C=CCOCC=C","InChI=1S/C6H10O/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H2","ATVJXMYDOSMEPO-UHFFFAOYSA-N"
"CCC=CCCOC","InChI=1S/C7H14O/c1-3-4-5-6-7-8-2/h4-5H,3,6-7H2,1-2H3/b5-4+","KUPODEXLSGEWFR-SNAWJCMRSA-N"
"CCCCCCOC","InChI=1S/C7H16O/c1-3-4-5-6-7-8-2/h3-7H2,1-2H3","ICBJCVRQDSQPGI-UHFFFAOYSA-N"
"CCCCCCCCCCOC","InChI=1S/C11H24O/c1-3-4-5-6-7-8-9-10-11-12-2/h3-11H2,1-2H3","JPEWDCTZJFUITH-UHFFFAOYSA-N"
"CCCCCCCCCCOC=C","InChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12-13-4-2/h4H,2-3,5-12H2,1H3","NSOAQRMLVFRWIT-UHFFFAOYSA-N"
"CCOC(C1)CC(C)(C)CC(C)1","InChI=1S/C11H22O/c1-5-12-10-6-9(2)7-11(3,4)8-10/h9-10H,5-8H2,1-4H3","JVBNHJDWWBSWLE-UHFFFAOYSA-N"
"COC(C)(C1)CCCCCCCCCC1","InChI=1S/C14H28O/c1-14(15-2)12-10-8-6-4-3-5-7-9-11-13-14/h3-13H2,1-2H3","QACBYNLZEUNZSC-UHFFFAOYSA-N"
"CCOCc(c1)cccc1","InChI=1S/C9H12O/c1-2-10-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3","AXPZDYVDTMMLNB-UHFFFAOYSA-N"
"COCCc(c1)cccc1","InChI=1S/C9H12O/c1-10-8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3","CQLYXIUHVFRXLT-UHFFFAOYSA-N"
"","InChI=1S/C8H8O2/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H,9,10)/i1+1","LPNBBFKOUUSUDB-OUBTZVSYSA-N"
"Oc(c1)cc(O)c(c1)C(O)=O","InChI=1S/C7H6O4/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,8-9H,(H,10,11)","UIAFKZKHHVMJGS-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(O)c(O)c1","InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)","YQUVCSBJEUQKSH-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(c1)C(O)=O","InChI=1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)","DAUAQNGYDSHRET-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(O)c(O)c(O)1","InChI=1S/C7H6O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,8-10H,(H,11,12)","LNTHITQWFMADLM-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(CC(O)=O)c1","InChI=1S/C10H12O4/c1-13-8-4-3-7(6-10(11)12)5-9(8)14-2/h3-5H,6H2,1-2H3,(H,11,12)","WUAXWQRULBZETB-UHFFFAOYSA-N"
"OC(=O)C=Cc(c1)ccc(O)c1","InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)/b6-3+","NGSWKAQJJWESNS-ZZXKWVIFSA-N"
"COC(=O)C=Cc(c1)cc(O)c(O)c1","InChI=1S/C10H10O4/c1-14-10(13)5-3-7-2-4-8(11)9(12)6-7/h2-6,11-12H,1H3/b5-3+","OCNYGKNIVPVPPX-HWKANZROSA-N"
"COc(c1)c(O)ccc(C=CC(O)=O)1","InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+","KSEBMYQBYZTDHS-HWKANZROSA-N"
"CCCCCC=CC(=O)CCc(c1)cc(OC)c(O)c1","InChI=1S/C17H24O3/c1-3-4-5-6-7-8-15(18)11-9-14-10-12-16(19)17(13-14)20-2/h7-8,10,12-13,19H,3-6,9,11H2,1-2H3/b8-7+","OQWKEEOHDMUXEO-BQYQJAHWSA-N"
"CCCCCC=CC(=O)CCc(c1)cc(OC)c(OC(C)=O)c1","InChI=1S/C19H26O4/c1-4-5-6-7-8-9-17(21)12-10-16-11-13-18(23-15(2)20)19(14-16)22-3/h8-9,11,13-14H,4-7,10,12H2,1-3H3/b9-8+","UMPBPDLXVPCHRQ-CMDGGOBGSA-N"
"CCCCC[C@@H](CC(=O)CCC1=CC(=C(C=C1)O)OC)O","InChI=1S/C17H26O4/c1-3-4-5-6-14(18)12-15(19)9-7-13-8-10-16(20)17(11-13)21-2/h8,10-11,14,18,20H,3-7,9,12H2,1-2H3/t14-/m0/s1","NLDDIKRKFXEWBK-AWEZNQCLSA-N"
"CCCCCC(OC(C)=O)CC(=O)CCc(c1)cc(OC)c(OC(C)=O)c1","InChI=1S/C21H30O6/c1-5-6-7-8-19(26-15(2)22)14-18(24)11-9-17-10-12-20(27-16(3)23)21(13-17)25-4/h10,12-13,19H,5-9,11,14H2,1-4H3","PBYHUELMIHUJFS-UHFFFAOYSA-N"
"CCCCCCCCCC([H])(O)CC(=O)CCc(c1)cc(OC)c(O)c1","InChI=1S/C21H34O4/c1-3-4-5-6-7-8-9-10-18(22)16-19(23)13-11-17-12-14-20(24)21(15-17)25-2/h12,14-15,18,22,24H,3-11,13,16H2,1-2H3/t18-/m0/s1","AIULWNKTYPZYAN-SFHVURJKSA-N"
"[H]C(O)(C4)CC(=C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3/t13-,14-,15-,16-,18-,19-/m0/s1","FMGSKLZLMKYGDP-USOAJAOKSA-N"
"OC(C4)CC(=C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(C(C)=O)C1","InChI=1S/C21H32O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h4,15-19,23H,5-12H2,1-3H3/t15-,16-,17+,18-,19-,20-,21+/m0/s1","ORNBQBCIOKFOEO-QGVNFLHTSA-N"
"[H]C(O)(C4)CC(=C([H])3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)(C(C)=O)C1","InChI=1S/C21H32O3/c1-13(22)21(24)11-8-18-16-5-4-14-12-15(23)6-9-19(14,2)17(16)7-10-20(18,21)3/h4,15-18,23-24H,5-12H2,1-3H3/t15-,16+,17-,18-,19-,20-,21-/m0/s1","JERGUCIJOXJXHF-TVWVXWENSA-N"
"","InChI=1S/C27H44O2/c1-17(2)7-6-8-18(3)21-9-10-22-20-16-25(29)24-15-19(28)11-13-27(24,5)23(20)12-14-26(21,22)4/h17-18,20-24H,6-16H2,1-5H3/t18-,20+,21-,22+,23+,24?,26-,27-/m1/s1","LNGLEOIUQBVRRY-JYQHCDCXSA-N"
"","InChI=1S/C27H42O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h6,11,17-19,21-23,25H,7-10,12-16H2,1-5H3/t19-,21-,22+,23+,25+,26+,27-/m1/s1","TTXJJFWWNDJDNR-CZRUWHASSA-N"
"OCCC([H])(CCOC(=O)C(C)(C)C)O[Si](C)(C)C(C)(C)C","InChI=1S/C16H34O4Si/c1-15(2,3)14(18)19-12-10-13(9-11-17)20-21(7,8)16(4,5)6/h13,17H,9-12H2,1-8H3/t13-/m1/s1","FQTAHDDRQJYHQC-CYBMUJFWSA-N"
"OCCC([H])(CCS(=O)(=O)c(c1)ccc(C)c1)O[Si](C)(C)C(C)(C)C","InChI=1S/C18H32O4SSi/c1-15-7-9-17(10-8-15)23(20,21)14-12-16(11-13-19)22-24(5,6)18(2,3)4/h7-10,16,19H,11-14H2,1-6H3/t16-/m0/s1","SPMRWEUDUQZCPY-INIZCTEOSA-N"
"CC(=O)OC=CCC([H])(C(C)OC(=O)C(C)(C)C)O[Si](C)(C)C(C)(C)C","InChI=1S/C19H36O5Si/c1-14(23-17(21)18(3,4)5)16(12-11-13-22-15(2)20)24-25(9,10)19(6,7)8/h11,13-14,16H,12H2,1-10H3/b13-11-/t14?,16-/m1/s1","XVTNRFPREODEJE-WXMOLBAOSA-N"
"BrCCC([H])(CCOC(=O)C(C)(C)C)O[Si](C)(C)C(C)(C)C","InChI=1S/C16H33BrO3Si/c1-15(2,3)14(18)19-12-10-13(9-11-17)20-21(7,8)16(4,5)6/h13H,9-12H2,1-8H3/t13-/m1/s1","HEFXUJHDVOFZKD-CYBMUJFWSA-N"
"CC(=O)C#CC([H])(C)C([H])(O[Si](C)(C)C(C)(C)C)C([H])(C)CC","InChI=1S/C17H32O2Si/c1-10-13(2)16(14(3)11-12-15(4)18)19-20(8,9)17(5,6)7/h13-14,16H,10H2,1-9H3/t13-,14-,16+/m0/s1","ANMQIGDCTZETJU-OFQRWUPVSA-N"
"CCC([H])(C)C([H])(C([H])(C)C#C)O[Si](C)(C)C(C)(C)C","InChI=1S/C15H30OSi/c1-10-12(3)14(13(4)11-2)16-17(8,9)15(5,6)7/h1,12-14H,11H2,2-9H3/t12-,13-,14-/m0/s1","KGBRESJDKNPUOY-IHRRRGAJSA-N"
"CCC([H])(C)C([H])(O[Si](C)(C)C(C)(C)C)C([H])(C)C=C(Br)Br","InChI=1S/C15H30Br2OSi/c1-9-11(2)14(12(3)10-13(16)17)18-19(7,8)15(4,5)6/h10-12,14H,9H2,1-8H3/t11-,12-,14+/m0/s1","RVMWJIWHPXCBGC-SGMGOOAPSA-N"
"CC(C)=CCCC([H])(CCOC(=O)C(C)(C)C)O[Si](C)(C)C(C)(C)C","InChI=1S/C20H40O3Si/c1-16(2)12-11-13-17(23-24(9,10)20(6,7)8)14-15-22-18(21)19(3,4)5/h12,17H,11,13-15H2,1-10H3/t17-/m1/s1","USNUDOVSPZLAND-QGZVFWFLSA-N"
"COCCOCOC([H])(CO[Si](C)(C)C(C)(C)C)C([H])(C)COCc(c1)cccc1","InChI=1S/C22H40O5Si/c1-19(15-25-16-20-11-9-8-10-12-20)21(26-18-24-14-13-23-5)17-27-28(6,7)22(2,3)4/h8-12,19,21H,13-18H2,1-7H3/t19-,21+/m0/s1","FKGJRLSCIIACGO-PZJWPPBQSA-N"
"COCCOCOC([H])(CO)C([H])(C)COCc(c1)cccc1","InChI=1S/C16H26O5/c1-14(11-20-12-15-6-4-3-5-7-15)16(10-17)21-13-19-9-8-18-2/h3-7,14,16-17H,8-13H2,1-2H3/t14-,16+/m0/s1","GQRCJVXBMORUOT-GOEBONIOSA-N"
"COCCOCOC([H])(C(C)O)C([H])(C)COCc(c1)cccc1","InChI=1S/C17H28O5/c1-14(11-21-12-16-7-5-4-6-8-16)17(15(2)18)22-13-20-10-9-19-3/h4-8,14-15,17-18H,9-13H2,1-3H3/t14-,15?,17-/m0/s1","ODZBZVMOADMGBO-AYWPPYMVSA-N"
"CCC([H])(C)C([H])(O[Si](C)(C)C(C)(C)C)C([H])(C)CO","InChI=1S/C14H32O2Si/c1-9-11(2)13(12(3)10-15)16-17(7,8)14(4,5)6/h11-13,15H,9-10H2,1-8H3/t11-,12-,13+/m0/s1","PRVBIUMEVADSBB-RWMBFGLXSA-N"
"COC(=O)C(C)C([H])(C([H])(C)CC)O[Si](C)(C)C(C)(C)C","InChI=1S/C15H32O3Si/c1-10-11(2)13(12(3)14(16)17-7)18-19(8,9)15(4,5)6/h11-13H,10H2,1-9H3/t11-,12-,13-/m0/s1","KOCLWUYPTOWPJL-AVGNSLFASA-N"
"CCCCCCOC(=O)CC([H])(O)CCOC","InChI=1S/C12H24O4/c1-3-4-5-6-8-16-12(14)10-11(13)7-9-15-2/h11,13H,3-10H2,1-2H3/t11-/m0/s1","UHORLCSNXGMRHG-NSHDSACASA-N"
"CCCCCOC(=O)CC([H])(O)CCOC","InChI=1S/C11H22O4/c1-3-4-5-7-15-11(13)9-10(12)6-8-14-2/h10,12H,3-9H2,1-2H3/t10-/m0/s1","HLHZXMVWWLTQHD-JTQLQIEISA-N"
"CCCCOC(=O)CC([H])(O)CCOC","InChI=1S/C10H20O4/c1-3-4-6-14-10(12)8-9(11)5-7-13-2/h9,11H,3-8H2,1-2H3/t9-/m0/s1","FWFMYGMZSYGPRE-VIFPVBQESA-N"
"CCCOC(=O)CC(O)CCOC","InChI=1S/C9H18O4/c1-3-5-13-9(11)7-8(10)4-6-12-2/h8,10H,3-7H2,1-2H3/t8-/m0/s1","MWNWLBWZVDQQGO-QMMMGPOBSA-N"
"CCCCCCCOC(=O)CC([H])(O)CCOC","InChI=1S/C13H26O4/c1-3-4-5-6-7-9-17-13(15)11-12(14)8-10-16-2/h12,14H,3-11H2,1-2H3/t12-/m0/s1","YFELLKLSWXVTKU-LBPRGKRZSA-N"
"COC(=O)CC(=O)CCOCc(c1)cccc1","InChI=1S/C13H16O4/c1-16-13(15)9-12(14)7-8-17-10-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3","ADHIZSXYKLZVOR-UHFFFAOYSA-N"
"COCCC(=O)CC(=O)OCC","InChI=1S/C8H14O4/c1-3-12-8(10)6-7(9)4-5-11-2/h3-6H2,1-2H3","HDTMYNBYBPPREL-UHFFFAOYSA-N"
"CCCOC(=O)CC(=O)CCOC","InChI=1S/C9H16O4/c1-3-5-13-9(11)7-8(10)4-6-12-2/h3-7H2,1-2H3","ANORNWNGPBBCKZ-UHFFFAOYSA-N"
"CCCCOC(=O)CC(=O)CCOC","InChI=1S/C10H18O4/c1-3-4-6-14-10(12)8-9(11)5-7-13-2/h3-8H2,1-2H3","HNNOSSFFDRALPJ-UHFFFAOYSA-N"
"COC(=O)CC(=O)CCSC","InChI=1S/C7H12O3S/c1-10-7(9)5-6(8)3-4-11-2/h3-5H2,1-2H3","BUQCLWBTCPWQHB-UHFFFAOYSA-N"
"COC(=O)CC(=O)CCOCC[Si](C)(C)C","InChI=1S/C11H22O4Si/c1-14-11(13)9-10(12)5-6-15-7-8-16(2,3)4/h5-9H2,1-4H3","CGODJIKNHUDKMC-UHFFFAOYSA-N"
"CCOC(=O)CC(=O)C([H])(C)CC","InChI=1S/C9H16O3/c1-4-7(3)8(10)6-9(11)12-5-2/h7H,4-6H2,1-3H3/t7-/m0/s1","KHIHEUAINZCGRS-ZETCQYMHSA-N"
"COC(=O)CC(=O)C([H])(C)CC","InChI=1S/C8H14O3/c1-4-6(2)7(9)5-8(10)11-3/h6H,4-5H2,1-3H3/t6-/m0/s1","XAXXMCKRKUYHNJ-LURJTMIESA-N"
"CCCSCCC(=O)CC(=O)OC","InChI=1S/C9H16O3S/c1-3-5-13-6-4-8(10)7-9(11)12-2/h3-7H2,1-2H3","JFBJRVFKIJIGDL-UHFFFAOYSA-N"
"OCC([H])(C)C([H])(C1)OC(C)(C)O1","InChI=1S/C8H16O3/c1-6(4-9)7-5-10-8(2,3)11-7/h6-7,9H,4-5H2,1-3H3/t6-,7+/m0/s1","ZEXONBYTDOABDB-NKWVEPMBSA-N"
"c(c2)ccc(c2)COCC([H])(C)C([H])(C1)OC(C)(C)O1","InChI=1S/C15H22O3/c1-12(14-11-17-15(2,3)18-14)9-16-10-13-7-5-4-6-8-13/h4-8,12,14H,9-11H2,1-3H3/t12-,14-/m1/s1","MHEZVHROAZUHDG-TZMCWYRMSA-N"
"OCC([H])(O)C([H])(C)COCc(c1)cccc1","InChI=1S/C12H18O3/c1-10(12(14)7-13)8-15-9-11-5-3-2-4-6-11/h2-6,10,12-14H,7-9H2,1H3/t10-,12+/m0/s1","BSAZSOBKWUSCEH-CMPLNLGQSA-N"
"COCCOCOC([H])(C(C)=O)C([H])(C)COCc(c1)cccc1","InChI=1S/C17H26O5/c1-14(11-21-12-16-7-5-4-6-8-16)17(15(2)18)22-13-20-10-9-19-3/h4-8,14,17H,9-13H2,1-3H3/t14-,17-/m0/s1","RUSMEUAZQDINKI-YOEHRIQHSA-N"
"c(c1)ccc(c1)COCC([H])(C)C([H])(O)CO[Si](C)(C)C(C)(C)C","InChI=1S/C18H32O3Si/c1-15(12-20-13-16-10-8-7-9-11-16)17(19)14-21-22(5,6)18(2,3)4/h7-11,15,17,19H,12-14H2,1-6H3/t15-,17+/m0/s1","AJYYRHUJGZKBBW-DOTOQJQBSA-N"
"CCOC(=O)CC([H])(O)C([H])(C)CC","InChI=1S/C9H18O3/c1-4-7(3)8(10)6-9(11)12-5-2/h7-8,10H,4-6H2,1-3H3/t7-,8-/m0/s1","CZXCSMLBDWISAK-YUMQZZPRSA-N"
"CCC([H])(C)C([H])(O)C([H])(C)C(=O)OC","InChI=1S/C9H18O3/c1-5-6(2)8(10)7(3)9(11)12-4/h6-8,10H,5H2,1-4H3/t6-,7-,8+/m1/s1","AZNLDHRMNLQTDM-PRJMDXOYSA-N"
"CCOC(=O)C([H])(C)C([H])(O)C([H])(C)CC","InChI=1S/C10H20O3/c1-5-7(3)9(11)8(4)10(12)13-6-2/h7-9,11H,5-6H2,1-4H3/t7-,8+,9-/m0/s1","JKQZDYNEMFREIK-YIZRAAEISA-N"
"COC(=O)CC([H])(O)C([H])(C)CC","InChI=1S/C8H16O3/c1-4-6(2)7(9)5-8(10)11-3/h6-7,9H,4-5H2,1-3H3/t6-,7-/m0/s1","IHQUHJQCUGFAPE-BQBZGAKWSA-N"
"COCOC([H])(C([H])(C)CC)C([H])(C)C=C(Br)Br","InChI=1S/C11H20Br2O2/c1-5-8(2)11(15-7-14-4)9(3)6-10(12)13/h6,8-9,11H,5,7H2,1-4H3/t8-,9-,11+/m0/s1","GBTIXNCCLOMTCN-ATZCPNFKSA-N"
"COC(=O)C([H])(C)C([H])(O)C(=O)OC","InChI=1S/C7H12O5/c1-4(6(9)11-2)5(8)7(10)12-3/h4-5,8H,1-3H3/t4-,5+/m1/s1","RUUHUDXJDHEPBZ-UHNVWZDZSA-N"
"[Si](OCC([H])(O)C(OCc(c3)cccc3)(CO[Si](C(C)(C)C)(c(c2)cccc2)c(c1)cccc1)[H])(C(C)(C)C)(C)C","InChI=1S/C33H48O4Si2/c1-32(2,3)38(7,8)36-25-30(34)31(35-24-27-18-12-9-13-19-27)26-37-39(33(4,5)6,28-20-14-10-15-21-28)29-22-16-11-17-23-29/h9-23,30-31,34H,24-26H2,1-8H3/t30-,31-/m0/s1","AFPKGUQWJNXKFR-CONSDPRKSA-N"
"c(c2)ccc(c2)COC([H])(C1)C([H])(O)CO1","InChI=1S/C11H14O3/c12-10-7-13-8-11(10)14-6-9-4-2-1-3-5-9/h1-5,10-12H,6-8H2/t10-,11-/m0/s1","FNVLHINATFTNQV-QWRGUYRKSA-N"
"OCC([H])(O)C([H])(OCc(c1)cccc1)COC(=O)C(C)(C)C","InChI=1S/C16H24O5/c1-16(2,3)15(19)21-11-14(13(18)9-17)20-10-12-7-5-4-6-8-12/h4-8,13-14,17-18H,9-11H2,1-3H3/t13-,14-/m0/s1","RHALHAIHZXQZTH-KBPBESRZSA-N"
"OCC([H])(O1)C([H])(O)COC(C)(C)1","InChI=1S/C7H14O4/c1-7(2)10-4-5(9)6(3-8)11-7/h5-6,8-9H,3-4H2,1-2H3/t5-,6+/m1/s1","ODWXYNAGEJVSQH-RITPCOANSA-N"
"OCCCOCc(c1)ccc(OC)c1","InChI=1S/C11H16O3/c1-13-11-5-3-10(4-6-11)9-14-8-2-7-12/h3-6,12H,2,7-9H2,1H3","BGEHPNIXVMWYJD-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C(O1)OCCC1","InChI=1S/C11H14O3/c1-12-10-5-3-9(4-6-10)11-13-7-2-8-14-11/h3-6,11H,2,7-8H2,1H3","DCZOQZICJJOKQT-UHFFFAOYSA-N"
"CC(C)(O1)OC([H])(CO[Si](C)(C)C(C)(C)C)C([H])(O)C1","InChI=1S/C13H28O4Si/c1-12(2,3)18(6,7)16-9-11-10(14)8-15-13(4,5)17-11/h10-11,14H,8-9H2,1-7H3/t10-,11+/m1/s1","FSMGSCCKIWXNAF-MNOVXSKESA-N"
"c(c2)ccc(c2)COC([H])(CO[Si](C)(C)C(C)(C)C)C([H])(C1)OC(C)(C)O1","InChI=1S/C20H34O4Si/c1-19(2,3)25(6,7)23-15-17(18-14-22-20(4,5)24-18)21-13-16-11-9-8-10-12-16/h8-12,17-18H,13-15H2,1-7H3/t17-,18-/m0/s1","AVXDOWVDZGSQDA-ROUUACIJSA-N"
"OCC([H])(OCc(c1)cccc1)C([H])(O)CO[Si](C)(C)C(C)(C)C","InChI=1S/C17H30O4Si/c1-17(2,3)22(4,5)21-13-15(19)16(11-18)20-12-14-9-7-6-8-10-14/h6-10,15-16,18-19H,11-13H2,1-5H3/t15-,16-/m0/s1","YKXAHXIQIKQEFO-HOTGVXAUSA-N"
"C=CCC(C=O)(C2)C(C(OC)3)(C(C)(CC3)1)C([H])(C2)C(C)(C)C1","InChI=1S/C19H30O2/c1-6-9-18(13-20)11-7-14-16(2,3)12-17(4)10-8-15(21-5)19(14,17)18/h6,13-15H,1,7-12H2,2-5H3/t14-,15+,17+,18+,19?/m0/s1","IYIFJDIXWYMMOQ-BTFQZXIOSA-N"
"COC([H])(C3)C(C(=O)2)(C(C)(C3)1)C([H])(CC2)C(C)(C)C1","InChI=1S/C15H24O2/c1-13(2)9-14(3)8-7-12(17-4)15(14)10(13)5-6-11(15)16/h10,12H,5-9H2,1-4H3/t10-,12+,14-,15?/m0/s1","SOKSYFAKJXAODO-MFWTVYFASA-N"
"O=CCCCCC(C)(C2)C(C(=O)3)(C(C)(CC3)1)C([H])(C2)C(C)(C)C1","InChI=1S/C20H32O2/c1-17(2)14-19(4)12-9-16(22)20(19)15(17)8-11-18(20,3)10-6-5-7-13-21/h13,15H,5-12,14H2,1-4H3/t15-,18+,19+,20?/m1/s1","SAAJYIFIQYHRGM-GQBHHSQQSA-N"
"CCC(=O)C(C4)C(O)(C3)C(C(C)24)(C(C)(C3)1)C([H])(CC2)C(C)(C)C1","InChI=1S/C20H32O2/c1-6-14(21)13-11-17(4)8-7-15-16(2,3)12-18(5)9-10-19(13,22)20(15,17)18/h13,15,22H,6-12H2,1-5H3/t13?,15-,17+,18+,19+,20?/m1/s1","DBATUTTYKIKNAC-SPAAZLJQSA-N"
"O=CC([H])(C2)C(C([H])(OC)3)(C(C)(CC3)1)C([H])(C2)C(C)(C)C1","InChI=1S/C16H26O2/c1-14(2)10-15(3)8-7-13(18-4)16(15)11(9-17)5-6-12(14)16/h9,11-13H,5-8,10H2,1-4H3/t11?,12-,13-,15-,16?/m0/s1","UAECGCRCKRSQPE-GKDSDUKGSA-N"
"OCC(C2)C(C([H])(OC)3)(C(C)(CC3)1)C([H])(C2)C(C)(C)C1","InChI=1S/C16H28O2/c1-14(2)10-15(3)8-7-13(18-4)16(15)11(9-17)5-6-12(14)16/h11-13,17H,5-10H2,1-4H3/t11-,12-,13+,15-,16?/m1/s1","GHENTVCCMFGXJL-AUNKHLMRSA-N"
"C=CCOC=C(C2)C(C([H])(OC)3)(C(C)(CC3)1)C([H])(C2)C(C)(C)C1","InChI=1S/C19H30O2/c1-6-11-21-12-14-7-8-15-17(2,3)13-18(4)10-9-16(20-5)19(14,15)18/h6,12,15-16H,1,7-11,13H2,2-5H3/b14-12+/t15-,16?,18+,19?/m1/s1","ZRWMNCQXEPTRRZ-UXWNNGGKSA-N"
"OCCCC(C)(C2)C(C(OC)3)(C(C)(CC3)1)C([H])(C2)C(C)(C)C1","InChI=1S/C19H34O2/c1-16(2)13-18(4)11-8-15(21-5)19(18)14(16)7-10-17(19,3)9-6-12-20/h14-15,20H,6-13H2,1-5H3/t14-,15?,17+,18-,19?/m1/s1","UVAHUFINWOHERU-IQQHIWDUSA-N"
"C=CCC(C)(C2)C(C([H])(OC)3)(C(C)(CC3)1)C([H])(C2)C(C)(C)C1","InChI=1S/C19H32O/c1-7-10-17(4)11-8-14-16(2,3)13-18(5)12-9-15(20-6)19(14,17)18/h7,14-15H,1,8-13H2,2-6H3/t14-,15-,17+,18+,19?/m1/s1","WBPMONJNDURAQM-SAWZMIPTSA-N"
"OCCCCCCCCCCO","InChI=1S/C10H22O2/c11-9-7-5-3-1-2-4-6-8-10-12/h11-12H,1-10H2","FOTKYAAJKYLFFN-UHFFFAOYSA-N"
"OCCN(C)C","InChI=1S/C4H11NO/c1-5(2)3-4-6/h6H,3-4H2,1-2H3","UEEJHVSXFDXPFK-UHFFFAOYSA-N"
"C=CCN","InChI=1S/C3H7N/c1-2-3-4/h2H,1,3-4H2","VVJKKWFAADXIJK-UHFFFAOYSA-N"
"CC(C)OC(=O)CCCCC(=O)OC(C)C","InChI=1S/C12H22O4/c1-9(2)15-11(13)7-5-6-8-12(14)16-10(3)4/h9-10H,5-8H2,1-4H3","ZDQWESQEGGJUCH-UHFFFAOYSA-N"
"C=CCOC(=O)CCCCC(=O)OCC=C","InChI=1S/C12H18O4/c1-3-9-15-11(13)7-5-6-8-12(14)16-10-4-2/h3-4H,1-2,5-10H2","FPODCVUTIPDRTE-UHFFFAOYSA-N"
"COc(c1)c(N)cc(C)c1","InChI=1S/C8H11NO/c1-6-3-4-8(10-2)7(9)5-6/h3-5H,9H2,1-2H3","WXWCDTXEKCVRRO-UHFFFAOYSA-N"
"C=CCOC(=O)C=Cc(c1)cccc1","InChI=1S/C12H12O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h2-9H,1,10H2/b9-8+","KCMITHMNVLRGJU-CMDGGOBGSA-N"
"O=C(C=Cc(c2)cccc2)OCc(c1)cccc1","InChI=1S/C16H14O2/c17-16(12-11-14-7-3-1-4-8-14)18-13-15-9-5-2-6-10-15/h1-12H,13H2/b12-11+","NGHOLYJTSCBCGC-VAWYXSNFSA-N"
"COCCOCCO","InChI=1S/C5H12O3/c1-7-4-5-8-3-2-6/h6H,2-5H2,1H3","SBASXUCJHJRPEV-UHFFFAOYSA-N"
"CCCCOCCOCCO","InChI=1S/C8H18O3/c1-2-3-5-10-7-8-11-6-4-9/h9H,2-8H2,1H3","OAYXUHPQHDHDDZ-UHFFFAOYSA-N"
"COc(c1)cc(OC)cc1","InChI=1S/C8H10O2/c1-9-7-4-3-5-8(6-7)10-2/h3-6H,1-2H3","DPZNOMCNRMUKPS-UHFFFAOYSA-N"
"COCC(C)O","InChI=1S/C4H10O2/c1-4(5)3-6-2/h4-5H,3H2,1-2H3","ARXJGSRGQADJSQ-UHFFFAOYSA-N"
"CCC(O)COC","InChI=1S/C5H12O2/c1-3-5(6)4-7-2/h5-6H,3-4H2,1-2H3","CSZZMFWKAQEMPB-UHFFFAOYSA-N"
"OCCC(C)OC","InChI=1S/C5H12O2/c1-5(7-2)3-4-6/h5-6H,3-4H2,1-2H3","JSGVZVOGOQILFM-UHFFFAOYSA-N"
"OCCC(C)(C)OC","InChI=1S/C6H14O2/c1-6(2,8-3)4-5-7/h7H,4-5H2,1-3H3","MFKRHJVUCZRDTF-UHFFFAOYSA-N"
"CCC(N)COC","InChI=1S/C5H13NO/c1-3-5(6)4-7-2/h5H,3-4,6H2,1-2H3","QAFODUGVXFNLBE-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H10O2/c1-9(13)14-12-8-4-6-10-5-2-3-7-11(10)12/h2-8H,1H3","VGKONPUVOVVNSU-UHFFFAOYSA-N"
"CC(C1)CC(=O)C(C1)C(C)C","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9+/m1/s1","NFLGAXVYCFJBMK-BDAKNGLRSA-N"
"CC(C)C([H])(C1)C([2H])([2H])CC([H])(C)C1","InChI=1S/C10H20/c1-8(2)10-6-4-9(3)5-7-10/h8-10H,4-7H2,1-3H3/t9-,10+/i6D2/m1/s1","CFJYNSNXFXLKNS-CUHIHYFZSA-N"
"CC(=C)C([H])(C1)CC([H])(O)C([H])(C)C1","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h8-11H,1,4-6H2,2-3H3/t8-,9-,10+/m0/s1","KRCZYMFUWVJCLI-LPEHRKFASA-N"
"CC(=C)C([H])(C1)CC([H])(O)C([H])(C)C1","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h8-11H,1,4-6H2,2-3H3/t8-,9-,10-/m0/s1","KRCZYMFUWVJCLI-GUBZILKMSA-N"
"CC(C)C(C1)CC(=O)C(C)C1","InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h7-9H,4-6H2,1-3H3","GCRTVIUGJCJVDD-UHFFFAOYSA-N"
"CC(C)C(C1)CC([2H])([2H])C(C)C1","InChI=1S/C10H20/c1-8(2)10-6-4-9(3)5-7-10/h8-10H,4-7H2,1-3H3/i4D2","CFJYNSNXFXLKNS-APZFVMQVSA-N"
"[2H]C(C)(C2)C(C1)C(C)(C)C(C2)1","InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/i7D","XOKSLPVRUOBDEW-WHRKIXHSSA-N"
"[2H]C(C1)C(C)C(C2)C(C)(C)C12","InChI=1S/C10H18/c1-7-4-5-8-6-9(7)10(8,2)3/h7-9H,4-6H2,1-3H3/i4D","XOKSLPVRUOBDEW-QYKNYGDISA-N"
"[H]C(C2)(C1)C([H])(CCC2)NCC1","InChI=1S/C9H17N/c1-2-6-9-8(4-1)5-3-7-10-9/h8-10H,1-7H2/t8-,9+/m1/s1","POTIYWUALSJREP-BDAKNGLRSA-N"
"C(C2)CC(C1)C(C2)OCC1","InChI=1S/C9H16O/c1-2-6-9-8(4-1)5-3-7-10-9/h8-9H,1-7H2","AXRTUWDQQWPLQU-UHFFFAOYSA-N"
"NCC(O)=O","InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)","DHMQDGOQFOQNFH-UHFFFAOYSA-N"
"CC(N)C(O)=O","InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1","QNAYBMKLOCPYGJ-REOHCLBHSA-N"
"NCC(=O)NCC(O)=O","InChI=1S/C4H8N2O3/c5-1-3(7)6-2-4(8)9/h1-2,5H2,(H,6,7)(H,8,9)","YMAWOPBAYDPSLA-UHFFFAOYSA-N"
"OC(=O)C([H])(C)NC(=O)C([H])(C)N","InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-,4+/m1/s1","DEFJQIDDEAULHB-DMTCNVIQSA-N"
"NCC(=O)NCC(=O)NCC(=O)NCC(O)=O","InChI=1S/C8H14N4O5/c9-1-5(13)10-2-6(14)11-3-7(15)12-4-8(16)17/h1-4,9H2,(H,10,13)(H,11,14)(H,12,15)(H,16,17)","QMOQBVOBWVNSNO-UHFFFAOYSA-N"
"COC(=O)CNC(=O)CNC(=O)CNC(=O)CNC(C)=O","InChI=1S/C11H18N4O6/c1-7(16)12-3-8(17)13-4-9(18)14-5-10(19)15-6-11(20)21-2/h3-6H2,1-2H3,(H,12,16)(H,13,17)(H,14,18)(H,15,19)","CHYHTJZWWCIMGM-UHFFFAOYSA-N"
"O=CC([H])=C([H])c(c1)cccc1","InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+","KJPRLNWUNMBNBZ-QPJJXVBHSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(ccc1)O[Si](C)(C)C","InChI=1S/C13H22O3Si2/c1-17(2,3)15-12-10-8-7-9-11(12)13(14)16-18(4,5)6/h7-10H,1-6H3","BNAGIDDOEKUJRZ-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)C(C1)CN(CC1)[Si](C)(C)C","InChI=1S/C12H27NO2Si2/c1-16(2,3)13-9-7-8-11(10-13)12(14)15-17(4,5)6/h11H,7-10H2,1-6H3","WCOKGOUKDLOCER-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)C(C1)CCN(C1)[Si](C)(C)C","InChI=1S/C12H27NO2Si2/c1-16(2,3)13-9-7-11(8-10-13)12(14)15-17(4,5)6/h11H,7-10H2,1-6H3","MXZYZEAYOWHFPB-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)c(c1)nccc1","InChI=1S/C9H13NO2Si/c1-13(2,3)12-9(11)8-6-4-5-7-10-8/h4-7H,1-3H3","MKGLHHAHWDNTEJ-UHFFFAOYSA-N"
"CCCOc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C13H20O3Si/c1-5-10-15-12-8-6-11(7-9-12)13(14)16-17(2,3)4/h6-9H,5,10H2,1-4H3","KDBNKAABHTUJBG-UHFFFAOYSA-N"
"CCCCCCC(CC=CCCCCCCCC(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C24H50O3Si2/c1-8-9-10-17-20-23(26-28(2,3)4)21-18-15-13-11-12-14-16-19-22-24(25)27-29(5,6)7/h15,18,23H,8-14,16-17,19-22H2,1-7H3/b18-15-","LBRTWLSBAWJDOP-SDXDJHTJSA-N"
"c(c2)ccc(c2)N=Nc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C16H18N2O2Si/c1-21(2,3)20-16(19)13-9-11-15(12-10-13)18-17-14-7-5-4-6-8-14/h4-12H,1-3H3/b18-17+","AVYNALGDJMJGPJ-ISLYRVAYSA-N"
"[O-1][N+1](=O)c(c1)c(C(=O)O[Si](C)(C)C)c(cc1)C(=O)O[Si](C)(C)C","InChI=1S/C14H21NO6Si2/c1-22(2,3)20-13(16)10-8-7-9-11(15(18)19)12(10)14(17)21-23(4,5)6/h7-9H,1-6H3","SOQMOBLTNMMSNJ-UHFFFAOYSA-N"
"O=C(CCCc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C13H20O2Si/c1-16(2,3)15-13(14)11-7-10-12-8-5-4-6-9-12/h4-6,8-9H,7,10-11H2,1-3H3","ZYYPVAODSQWOQR-UHFFFAOYSA-N"
"O=C(CCC(CCC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C)O[Si](C)(C)C","InChI=1S/C17H36O6Si3/c1-24(2,3)21-15(18)12-10-14(17(20)23-26(7,8)9)11-13-16(19)22-25(4,5)6/h14H,10-13H2,1-9H3","BTMRCUTZCUEEAP-UHFFFAOYSA-N"
"CCCCCCCCC(CCCCCC)C(=O)O[Si](C)(C)C","InChI=1S/C19H40O2Si/c1-6-8-10-12-13-15-17-18(16-14-11-9-7-2)19(20)21-22(3,4)5/h18H,6-17H2,1-5H3","OREZFLQJLWRJCG-UHFFFAOYSA-N"
"CCCCCCCCOc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C18H30O3Si/c1-5-6-7-8-9-10-15-20-17-13-11-16(12-14-17)18(19)21-22(2,3)4/h11-14H,5-10,15H2,1-4H3","RXUQZVOEMQCPKB-UHFFFAOYSA-N"
"CC(=O)CCC(=O)O[Si](C)(C)C","InChI=1S/C8H16O3Si/c1-7(9)5-6-8(10)11-12(2,3)4/h5-6H2,1-4H3","SKSOOBJAPLSIMV-UHFFFAOYSA-N"
"CCCC(=O)C(=O)O[Si](C)(C)C","InChI=1S/C8H16O3Si/c1-5-6-7(9)8(10)11-12(2,3)4/h5-6H2,1-4H3","KXURKMKWKFOXLN-UHFFFAOYSA-N"
"CCC=C(O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C11H24O3Si2/c1-8-9-10(13-15(2,3)4)11(12)14-16(5,6)7/h9H,8H2,1-7H3/b10-9-","OHSILHRTQNZRQH-KTKRTIGZSA-N"
"CC(=O)CCCC(=O)O[Si](C)(C)C","InChI=1S/C9H18O3Si/c1-8(10)6-5-7-9(11)12-13(2,3)4/h5-7H2,1-4H3","PXSCQEMSXNKQJK-UHFFFAOYSA-N"
"[H]C(C(=O)O[Si](C)(C)C)=C(C)C(=O)O[Si](C)(C)C","InChI=1S/C11H22O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h8H,1-7H3/b9-8+","SXLJYBIAHQEULW-CMDGGOBGSA-N"
"C(C1)CCC(C)(C1)C(=O)O[Si](C)(C)C","InChI=1S/C11H22O2Si/c1-11(8-6-5-7-9-11)10(12)13-14(2,3)4/h5-9H2,1-4H3","SAXHDPVVKDOYBT-UHFFFAOYSA-N"
"[H]C(C)=C(C)C(=O)O[Si](C)(C)C","InChI=1S/C8H16O2Si/c1-6-7(2)8(9)10-11(3,4)5/h6H,1-5H3/b7-6+","GZQWHCAXPCOMTD-VOTSOKGWSA-N"
"CCCC(C)C(=O)O[Si](C)(C)C","InChI=1S/C9H20O2Si/c1-6-7-8(2)9(10)11-12(3,4)5/h8H,6-7H2,1-5H3","IAHOCIHIHKVJIW-UHFFFAOYSA-N"
"CC(C)C=CC(=O)O[Si](C)(C)C","InChI=1S/C9H18O2Si/c1-8(2)6-7-9(10)11-12(3,4)5/h6-8H,1-5H3/b7-6+","WDZGZGHIOXHTBN-VOTSOKGWSA-N"
"O=C(O[Si](C)(C)C)C(C)S[Si](C)(C)C","InChI=1S/C9H22O2SSi2/c1-8(12-14(5,6)7)9(10)11-13(2,3)4/h8H,1-7H3","BDZFEVXFJFUWAV-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)nc(O[Si](C)(C)C)nc(O[Si](C)(C)C)1","InChI=1S/C14H28N2O4Si3/c1-21(2,3)18-12-10-11(13(17)19-22(4,5)6)15-14(16-12)20-23(7,8)9/h10H,1-9H3","QOXWEKWDMOZSFV-UHFFFAOYSA-N"
"O=C(COc(c1)c(Cl)cc(Cl)c(Cl)1)O[Si](C)(C)C","InChI=1S/C11H13Cl3O3Si/c1-18(2,3)17-11(15)6-16-10-5-8(13)7(12)4-9(10)14/h4-5H,6H2,1-3H3","DXJQCDVGISANSY-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(ccc1)S[Si](C)(C)C","InChI=1S/C13H22O2SSi2/c1-17(2,3)15-13(14)11-9-7-8-10-12(11)16-18(4,5)6/h7-10H,1-6H3","BYCZOPBRJLQLGV-UHFFFAOYSA-N"
"O=C(CSc(c1)cccc1)O[Si](C)(C)C","InChI=1S/C11H16O2SSi/c1-15(2,3)13-11(12)9-14-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3","XVQPISUQLXNRHH-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)c(O[Si](C)(C)C)c(O[Si](C)(C)C)c(O[Si](C)(C)C)c1","InChI=1S/C19H38O5Si4/c1-25(2,3)21-16-14-13-15(19(20)24-28(10,11)12)17(22-26(4,5)6)18(16)23-27(7,8)9/h13-14H,1-12H3","GWWLYEXBIBGVGY-UHFFFAOYSA-N"
"C[Si](C)(C)OC(=O)c(c1)cc(O[Si](C)(C)C)c(O[Si](C)(C)C)c(O[Si](C)(C)C)1","InChI=1S/C19H38O5Si4/c1-25(2,3)21-16-13-15(19(20)24-28(10,11)12)14-17(22-26(4,5)6)18(16)23-27(7,8)9/h13-14H,1-12H3","KCIFUQKNKZTHGI-UHFFFAOYSA-N"
"C[Si](C)(C)Oc(c1)cc(O[Si](C)(C)C)c(C(=O)O[Si](C)(C)C)c(O[Si](C)(C)C)1","InChI=1S/C19H38O5Si4/c1-25(2,3)21-15-13-16(22-26(4,5)6)18(19(20)24-28(10,11)12)17(14-15)23-27(7,8)9/h13-14H,1-12H3","UEYBDMIEPBZEAR-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(cc1)CC(=O)O[Si](C)(C)C","InChI=1S/C11H15NO4Si/c1-17(2,3)16-11(13)8-9-5-4-6-10(7-9)12(14)15/h4-7H,8H2,1-3H3","XTPSTALVFAMKRF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(ccc1)CC(=O)O[Si](C)(C)C","InChI=1S/C11H15NO4Si/c1-17(2,3)16-11(13)8-9-6-4-5-7-10(9)12(14)15/h4-7H,8H2,1-3H3","YNUKRVITZFGRCW-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)CC(=O)O[Si](C)(C)C","InChI=1S/C11H15NO4Si/c1-17(2,3)16-11(13)8-9-4-6-10(7-5-9)12(14)15/h4-7H,8H2,1-3H3","PWLZPIFYJDAYBA-UHFFFAOYSA-N"
"CCCCCCCCc(c1)ccc(c1)C(=O)O[Si](C)(C)C","InChI=1S/C18H30O2Si/c1-5-6-7-8-9-10-11-16-12-14-17(15-13-16)18(19)20-21(2,3)4/h12-15H,5-11H2,1-4H3","HHEVFDHEVDTPGV-UHFFFAOYSA-N"
"CCCCCC=CC(=O)O[Si](C)(C)C","InChI=1S/C11H22O2Si/c1-5-6-7-8-9-10-11(12)13-14(2,3)4/h9-10H,5-8H2,1-4H3/b10-9+","YYMCWFXIWNIWDG-MDZDMXLPSA-N"
"CC(CC(C)(C)C)CC(=O)O[Si](C)(C)C","InChI=1S/C12H26O2Si/c1-10(9-12(2,3)4)8-11(13)14-15(5,6)7/h10H,8-9H2,1-7H3","MHLBKYCBTSBDCF-UHFFFAOYSA-N"
"CCCCCC=CCC(=O)O[Si](C)(C)C","InChI=1S/C12H24O2Si/c1-5-6-7-8-9-10-11-12(13)14-15(2,3)4/h9-10H,5-8,11H2,1-4H3/b10-9+","CLMHUCMNZKBMPA-MDZDMXLPSA-N"
"O=C(O[Si](C)(C)C)c(c1)cncc1","InChI=1S/C9H13NO2Si/c1-13(2,3)12-9(11)8-5-4-6-10-7-8/h4-7H,1-3H3","PYFBRRMHOWLGJH-UHFFFAOYSA-N"
"O=C(O[Si](C)(C)C)c(c1)ccnc1","InChI=1S/C9H13NO2Si/c1-13(2,3)12-9(11)8-4-6-10-7-5-8/h4-7H,1-3H3","VQVREJHPRSVZBD-UHFFFAOYSA-N"
"CC(CC(=O)O[Si](C)(C)C)C(=O)O[Si](C)(C)C","InChI=1S/C11H24O4Si2/c1-9(11(13)15-17(5,6)7)8-10(12)14-16(2,3)4/h9H,8H2,1-7H3","OAMWTEBQZKRCMA-UHFFFAOYSA-N"
"CC(Oc(c1)cccc1)C(=O)O[Si](C)(C)C","InChI=1S/C12H18O3Si/c1-10(12(13)15-16(2,3)4)14-11-8-6-5-7-9-11/h5-10H,1-4H3","NXGVSPLHWFXLIA-UHFFFAOYSA-N"
"O=C(Cc(c1)cc(c2)c(ccc2)c1)O[Si](C)(C)C","InChI=1S/C15H18O2Si/c1-18(2,3)17-15(16)11-12-8-9-13-6-4-5-7-14(13)10-12/h4-10H,11H2,1-3H3","JDDRRLKCWBOIEK-UHFFFAOYSA-N"
"c(c1)ccc(c1)CC(=O)N(CC(=O)O[Si](C)(C)C)[Si](C)(C)C","InChI=1S/C16H27NO3Si2/c1-21(2,3)17(13-16(19)20-22(4,5)6)15(18)12-14-10-8-7-9-11-14/h7-11H,12-13H2,1-6H3","ANMSCIPIBILVCV-UHFFFAOYSA-N"
"CC(Oc(c1)c(Cl)cc(Cl)c(Cl)1)C(=O)O[Si](C)(C)C","InChI=1S/C12H15Cl3O3Si/c1-7(12(16)18-19(2,3)4)17-11-6-9(14)8(13)5-10(11)15/h5-7H,1-4H3","NQIWQVQFFUQDCC-UHFFFAOYSA-N"
"Cc(c1)cc(cc1)CC(=O)O[Si](C)(C)C","InChI=1S/C12H18O2Si/c1-10-6-5-7-11(8-10)9-12(13)14-15(2,3)4/h5-8H,9H2,1-4H3","DSHGJKVPWKCBSY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(OCC(=O)O[Si](C)(C)C)c1","InChI=1S/C11H15NO5Si/c1-18(2,3)17-11(13)8-16-10-6-4-9(5-7-10)12(14)15/h4-7H,8H2,1-3H3","BQGPLKHQGVWGMH-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(C)cc(c2)OCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C14H8F5NO3/c1-6-4-7(2-3-9(6)20(21)22)23-5-8-10(15)12(17)14(19)13(18)11(8)16/h2-4H,5H2,1H3","WDUOVUNTQFSXIO-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)OCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C13H6F5NO3/c14-9-8(10(15)12(17)13(18)11(9)16)5-22-7-3-1-6(2-4-7)19(20)21/h1-4H,5H2","ZBEFSXOWVLJJQM-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)ccc1","InChI=1S/C8H7ClO2/c1-6(10)11-8-5-3-2-4-7(8)9/h2-5H,1H3","CJPVPOYTTALCNX-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(Cl)cc1","InChI=1S/C8H7ClO2/c1-6(10)11-8-4-2-3-7(9)5-8/h2-5H,1H3","GQTKYLQYHPTULY-UHFFFAOYSA-N"
"CC(=O)Oc(c1)ccc(Cl)c1","InChI=1S/C8H7ClO2/c1-6(10)11-8-4-2-7(9)3-5-8/h2-5H,1H3","KEUPLGRNURQXAR-UHFFFAOYSA-N"
"CC(=O)Oc(c(Cl)1)c(Cl)ccc1","InChI=1S/C8H6Cl2O2/c1-5(11)12-8-6(9)3-2-4-7(8)10/h2-4H,1H3","YNSMUWSJRXDNLN-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)ccc(Cl)1","InChI=1S/C8H6Cl2O2/c1-5(11)12-8-4-6(9)2-3-7(8)10/h2-4H,1H3","XSJDGJRHRDWQOR-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)cc(Cl)c1","InChI=1S/C8H6Cl2O2/c1-5(11)12-8-3-2-6(9)4-7(8)10/h2-4H,1H3","KGXUYVOKSRCTEK-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(Cl)c(Cl)c1","InChI=1S/C8H6Cl2O2/c1-5(11)12-6-2-3-7(9)8(10)4-6/h2-4H,1H3","OSKGYRIYNMZFSJ-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)c(Cl)cc1","InChI=1S/C8H6Cl2O2/c1-5(11)12-7-4-2-3-6(9)8(7)10/h2-4H,1H3","UGURLMCNLGTRCL-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(Cl)cc(Cl)1","InChI=1S/C8H6Cl2O2/c1-5(11)12-8-3-6(9)2-7(10)4-8/h2-4H,1H3","DPHLEWZTIXLUGZ-UHFFFAOYSA-N"
"CC(=O)Oc(c(Cl)1)c(Cl)cc(Cl)c1","InChI=1S/C8H5Cl3O2/c1-4(12)13-8-6(10)2-5(9)3-7(8)11/h2-3H,1H3","RFOCPJZGJNKBOI-UHFFFAOYSA-N"
"CC(=O)Oc(c(Cl)1)c(Cl)c(Cl)cc1","InChI=1S/C8H5Cl3O2/c1-4(12)13-8-6(10)3-2-5(9)7(8)11/h2-3H,1H3","NIXCFOKFBOFURO-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)c(Cl)cc(Cl)1","InChI=1S/C8H5Cl3O2/c1-4(12)13-7-3-5(9)2-6(10)8(7)11/h2-3H,1H3","YHKQUZSHMROARS-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C8H5Cl3O2/c1-4(12)13-8-3-6(10)5(9)2-7(8)11/h2-3H,1H3","IRMIPIZHLIHQST-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)c(Cl)c(Cl)c1","InChI=1S/C8H5Cl3O2/c1-4(12)13-6-3-2-5(9)7(10)8(6)11/h2-3H,1H3","PCXZOWRGWZCTLG-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(Cl)c(Cl)c(Cl)1","InChI=1S/C8H5Cl3O2/c1-4(12)13-5-2-6(9)8(11)7(10)3-5/h2-3H,1H3","XVARLELSNCXVLM-UHFFFAOYSA-N"
"CC(=O)Oc(c(Cl)1)c(Cl)c(Cl)cc(Cl)1","InChI=1S/C8H4Cl4O2/c1-3(13)14-8-6(11)4(9)2-5(10)7(8)12/h2H,1H3","NHBOZDKIYJWIIT-UHFFFAOYSA-N"
"CC(=O)Oc(c(Cl)1)c(Cl)c(Cl)c(Cl)c1","InChI=1S/C8H4Cl4O2/c1-3(13)14-8-5(10)2-4(9)6(11)7(8)12/h2H,1H3","RHZFLXLMXCNOHX-UHFFFAOYSA-N"
"CC(=O)Oc(c1)c(Cl)c(Cl)c(Cl)c(Cl)1","InChI=1S/C8H4Cl4O2/c1-3(13)14-5-2-4(9)6(10)8(12)7(5)11/h2H,1H3","QHRJCQOAJGBWRV-UHFFFAOYSA-N"
"CC(=O)Oc(c(Cl)1)c(Cl)c(Cl)c(Cl)c(Cl)1","InChI=1S/C8H3Cl5O2/c1-2(14)15-8-6(12)4(10)3(9)5(11)7(8)13/h1H3","RRYATXLRCBOQTJ-UHFFFAOYSA-N"
"CCC(C)c(c1)c(ccc1)OC(=O)N(C)[Si](C)(C)C","InChI=1S/C15H25NO2Si/c1-7-12(2)13-10-8-9-11-14(13)18-15(17)16(3)19(4,5)6/h8-12H,7H2,1-6H3","SAHJVCUSCHXJPX-UHFFFAOYSA-N"
"O=C(Oc(c1)c(c2)c(ccc2)cc1)N(C)[Si](C)(C)C","InChI=1S/C15H19NO2Si/c1-16(19(2,3)4)15(17)18-14-11-7-9-12-8-5-6-10-13(12)14/h5-11H,1-4H3","SLCYRFLZSPSLSO-UHFFFAOYSA-N"
"CNC(=O)Oc(c1)c(ccc1)C(C)CC","InChI=1S/C12H17NO2/c1-4-9(2)10-7-5-6-8-11(10)15-12(14)13-3/h5-9H,4H2,1-3H3,(H,13,14)","DIRFUJHNVNOBMY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(C)cc(c1)OP(=S)(OC)OC","InChI=1S/C9H12NO5PS/c1-7-6-8(4-5-9(7)10(11)12)15-16(17,13-2)14-3/h4-6H,1-3H3","ZNOLGFHPUIJIMJ-UHFFFAOYSA-N"
"CNC(=O)Oc(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H11NO2/c1-13-12(14)15-11-8-4-6-9-5-2-3-7-10(9)11/h2-8H,1H3,(H,13,14)","CVXBEEMKQHEXEN-UHFFFAOYSA-N"
"CSc(c1)c(C)cc(c1)OP(=S)(OC)OC","InChI=1S/C10H15O3PS2/c1-8-7-9(5-6-10(8)16-4)13-14(15,11-2)12-3/h5-7H,1-4H3","PNVJTZOFSHSLTO-UHFFFAOYSA-N"
"CCOP(=O)(Sc(c2)cccc2)Sc(c1)cccc1","InChI=1S/C14H15O2PS2/c1-2-16-17(15,18-13-9-5-3-6-10-13)19-14-11-7-4-8-12-14/h3-12H,2H2,1H3","AWZOLILCOUMRDG-UHFFFAOYSA-N"
"[H]C(C)(C3)C(C2)(C1)C(C3)C(C)(C)C([H])(C(C)(O)C2)1","InChI=1S/C15H26O/c1-10-5-6-11-13(2,3)12-9-15(10,11)8-7-14(12,4)16/h10-12,16H,5-9H2,1-4H3/t10-,11?,12-,14-,15?/m1/s1","SVURIXNDRWRAFU-OWAXCYOXSA-N"
"CC(C)C(C1)(C2)OC(C)(C2)C1","InChI=1S/C10H18O/c1-8(2)10-6-4-9(3,11-10)5-7-10/h8H,4-7H2,1-3H3","RFFOTVCVTJUTAD-UHFFFAOYSA-N"
"O=CCC(C)CCC=C(C)C","InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3","NEHNMFOYXAPHSD-UHFFFAOYSA-N"
"OCCC(C)CCC=C(C)C","InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3","QMVPMAAFGQKVCJ-UHFFFAOYSA-N"
"CC(C)=CCCC(C)CCOC(=O)CC(C)C","InChI=1S/C15H28O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,13-14H,6,8-11H2,1-5H3","WZTNQQJXPYEGAF-UHFFFAOYSA-N"
"CCCCCCC(=C([H])1)C(=O)CC1","InChI=1S/C11H18O/c1-2-3-4-5-7-10-8-6-9-11(10)12/h8H,2-7,9H2,1H3","VGECIEOJXLMWGO-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O)C=C","InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3","CDOSHBSSFJOMGT-UHFFFAOYSA-N"
"C=CC(=C)CCC=C(C)C","InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3","UAHWPYUMFXYFJY-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCOC(=O)CC(C)C","InChI=1S/C15H26O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,9,13H,6,8,10-11H2,1-5H3/b14-9-","SOUKTGNMIRUIQN-ZROIWOOFSA-N"
"O=CC(C1)=CCC(C(C)=C)C1","InChI=1S/C10H14O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,7,10H,1,4-6H2,2H3","RUMOYJJNUMEFDD-UHFFFAOYSA-N"
"CC(C)C(C1)=C([H])CC(C)(O)C1","InChI=1S/C10H18O/c1-8(2)9-4-6-10(3,11)7-5-9/h4,8,11H,5-7H2,1-3H3","XJWZDXFFNOMMTD-UHFFFAOYSA-N"
"CC(=O)OC(C)(C)C(C1)CCC(=C)C1","InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h11H,1,5-8H2,2-4H3","IWKXKWUCSZHJEK-UHFFFAOYSA-N"
"CC=Cc(c1)c(O)c(OC)cc1","InChI=1S/C10H12O2/c1-3-5-8-6-4-7-9(12-2)10(8)11/h3-7,11H,1-2H3/b5-3+","GRZNDCXMPLQWIH-HWKANZROSA-N"
"C=CC(=C)CCC([H])=C(C)CCC=C(C)C","InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,1,4,7-8,10-11H2,2-3,5H3/b15-12+","JSNRRGGBADWTMC-NTCAYCPXSA-N"
"CC(C)CCCCC(C)CCCC(C)C","InChI=1S/C15H32/c1-13(2)9-6-7-11-15(5)12-8-10-14(3)4/h13-15H,6-12H2,1-5H3","FONXOARHSFUBAN-UHFFFAOYSA-N"
"CCCCC(CC)CCC(=O)CC(C)C","InChI=1S/C14H28O/c1-5-7-8-13(6-2)9-10-14(15)11-12(3)4/h12-13H,5-11H2,1-4H3","RLGPVWMQXJXBGR-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)CC","InChI=1S/C14H28O/c1-3-5-6-7-8-9-10-11-12-13-14(15)4-2/h3-13H2,1-2H3","OCHYRSKMMMYUMI-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(O)C(=O)c(c1)cccc1","InChI=1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13,15H","ISAOCJYIOMOJEB-UHFFFAOYSA-N"
"Cc(c2)c(ccc2)OC(=O)c(c1)cccc1","InChI=1S/C14H12O2/c1-11-7-5-6-10-13(11)16-14(15)12-8-3-2-4-9-12/h2-10H,1H3","YPMKPCAILYDVBN-UHFFFAOYSA-N"
"Oc(c2)c(C)cc(c2)C(=O)c(c1)cccc1","InChI=1S/C14H12O2/c1-10-9-12(7-8-13(10)15)14(16)11-5-3-2-4-6-11/h2-9,15H,1H3","UDGHTNPEJPFNIP-UHFFFAOYSA-N"
"COC(=O)c(c(C)1)c(O)c(C=O)c(O)c1","InChI=1S/C10H10O5/c1-5-3-7(12)6(4-11)9(13)8(5)10(14)15-2/h3-4,12-13H,1-2H3","PXFMUVDLJWXOQM-UHFFFAOYSA-N"
"CC=CCCCCCCCCC(=O)OC","InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h3-4H,5-12H2,1-2H3/b4-3+","QJHOPHQYFINBQM-ONEGZZNKSA-N"
"CCCC(C)(C(=O)OC)C(C1)CCCC1","InChI=1S/C13H24O2/c1-4-10-13(2,12(14)15-3)11-8-6-5-7-9-11/h11H,4-10H2,1-3H3","VCCZXUFUICXVRJ-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(COC(C)=O)c1","InChI=1S/C11H14O4/c1-8(12)15-7-9-4-5-10(13-2)11(6-9)14-3/h4-6H,7H2,1-3H3","KQWHHDCWLCCRLQ-UHFFFAOYSA-N"
"CC(=O)CC(=O)OC(CC)(C1)CCCC1","InChI=1S/C12H20O3/c1-3-12(7-5-4-6-8-12)15-11(14)9-10(2)13/h3-9H2,1-2H3","AOJQJEGJPJOEOG-UHFFFAOYSA-N"
"CCCCC(CC)CCCCC(C)CO","InChI=1S/C14H30O/c1-4-6-10-14(5-2)11-8-7-9-13(3)12-15/h13-15H,4-12H2,1-3H3","GWLGHNGTPVNKTG-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(C)O","InChI=1S/C14H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14-15H,3-13H2,1-2H3","BRGJIIMZXMWMCC-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(C(=O)OC)c(C)1","InChI=1S/C11H14O4/c1-7-5-8(13-2)6-9(14-3)10(7)11(12)15-4/h5-6H,1-4H3","QCEODMDPMRZZDI-UHFFFAOYSA-N"
"COC(=O)Cc(c1)cc(OC)c(OC)c1","InChI=1S/C11H14O4/c1-13-9-5-4-8(6-10(9)14-2)7-11(12)15-3/h4-6H,7H2,1-3H3","DILOFCBIBDMHAY-UHFFFAOYSA-N"
"COC(=O)CNC(=O)C([H])(Cc(c1)cccc1)NC(=O)C([H])(C)NC(C)=O","InChI=1S/C17H23N3O5/c1-11(19-12(2)21)16(23)20-14(9-13-7-5-4-6-8-13)17(24)18-10-15(22)25-3/h4-8,11,14H,9-10H2,1-3H3,(H,18,24)(H,19,21)(H,20,23)/t11-,14+/m0/s1","YJHFROAAFUSFCE-SMDDNHRTSA-N"
"COC(=O)C([H])(C(C)C)NC(=O)CNC(=O)CNC(=O)C([H])(NC(C)=O)C(C)C","InChI=1S/C17H30N4O6/c1-9(2)14(20-11(5)22)16(25)19-7-12(23)18-8-13(24)21-15(10(3)4)17(26)27-6/h9-10,14-15H,7-8H2,1-6H3,(H,18,23)(H,19,25)(H,20,22)(H,21,24)/t14-,15-/m0/s1","RSXULDVSVHULPE-GJZGRUSLSA-N"
"COC(=O)CNC(=O)C(NC(=O)CNC(C)=O)Cc(c1)cccc1","InChI=1S/C16H21N3O5/c1-11(20)17-9-14(21)19-13(8-12-6-4-3-5-7-12)16(23)18-10-15(22)24-2/h3-7,13H,8-10H2,1-2H3,(H,17,20)(H,18,23)(H,19,21)/t13-/m0/s1","ZTAIDJDGBMPCMR-ZDUSSCGKSA-N"
"CCOC(=O)CNC(=O)C(CCSC)NC(=O)CNC(C)=O","InChI=1S/C13H23N3O5S/c1-4-21-12(19)8-15-13(20)10(5-6-22-3)16-11(18)7-14-9(2)17/h10H,4-8H2,1-3H3,(H,14,17)(H,15,20)(H,16,18)/t10-/m0/s1","HHRQOICKOIKRLM-JTQLQIEISA-N"
"O=C(C(C)21)C(C)(C)C([H])(CC2)C1","InChI=1S/C10H16O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7H,4-6H2,1-3H3/t7-,10+/m0/s1","LHXDLQBQYFFVNW-OIBJUYFYSA-N"
"COC(C)=C","InChI=1S/C4H8O/c1-4(2)5-3/h1H2,2-3H3","YOWQWFMSQCOSBA-UHFFFAOYSA-N"
"CC(O)COc(c1)cccc1","InChI=1S/C9H12O2/c1-8(10)7-11-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3","IBLKWZIFZMJLFL-UHFFFAOYSA-N"
"c(c1)ccc(I)c1","InChI=1S/C6H5I/c7-6-4-2-1-3-5-6/h1-5H","SNHMUERNLJLMHN-UHFFFAOYSA-N"
"CCOC=C","InChI=1S/C4H8O/c1-3-5-4-2/h3H,1,4H2,2H3","FJKIXWOMBXYWOQ-UHFFFAOYSA-N"
"CCc(c1)ccc(C)c1","InChI=1S/C9H12/c1-3-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3","JRLPEMVDPFPYPJ-UHFFFAOYSA-N"
"C(C2)Cc(c1)c(C2)ccc1","InChI=1S/C10H12/c1-2-6-10-8-4-3-7-9(10)5-1/h1-2,5-6H,3-4,7-8H2","CXWXQJXEFPUFDZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCBr","InChI=1S/C12H25Br/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-12H2,1H3","PBLNBZIONSLZBU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCBr","InChI=1S/C13H27Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h2-13H2,1H3","BFDNZQUBFCYTIC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCBr","InChI=1S/C14H29Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h2-14H2,1H3","KOFZTCSTGIWCQG-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCBr","InChI=1S/C15H31Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h2-15H2,1H3","JKOTZBXSNOGCIF-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCBr","InChI=1S/C16H33Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-16H2,1H3","HNTGIJLWHDPAFN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCBr","InChI=1S/C18H37Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-18H2,1H3","WSULSMOGMLRGKU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCO","InChI=1S/C15H32O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h16H,2-15H2,1H3","REIUXOLGHVXAEO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCO","InChI=1S/C17H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h18H,2-17H2,1H3","GOQYKNQRPGWPLP-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCO","InChI=1S/C18H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h19H,2-18H2,1H3","GLDOVTGHNKAZLK-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCO","InChI=1S/C19H40O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h20H,2-19H2,1H3","XGFDHKJUZCCPKQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCO","InChI=1S/C22H46O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23/h23H,2-22H2,1H3","NOPFSRXAKWQILS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C20H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-2/h3-19H2,1-2H3","BDXAHSJUDUZLDU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCOC(C)=O","InChI=1S/C16H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h3-15H2,1-2H3","IOUUIFSIQMVYKP-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCOC(C)=O","InChI=1S/C18H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18(2)19/h3-17H2,1-2H3","LSTDYDRCKUBPDI-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCOC(C)=O","InChI=1S/C20H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h3-19H2,1-2H3","OIZXRZCQJDXPFO-UHFFFAOYSA-N"
"CCC([H])=C([H])CC(=C(C)1)C(=O)CC1","InChI=1S/C11H16O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5H,3,6-8H2,1-2H3/b5-4-","XMLSXPIVAXONDL-PLNGDYQASA-N"
"CC(C)=CCCC(C)=C([H])CCC(C)(O)C=C","InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11-/t15-/m1/s1","FQTLCLSUCSAZDY-QKXCFHHRSA-N"
"Cc(c1)occ1","InChI=1S/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H3","VQKFNUFAXTZWDK-UHFFFAOYSA-N"
"CCc(c1)occ1","InChI=1S/C6H8O/c1-2-6-4-3-5-7-6/h3-5H,2H2,1H3","HLPIHRDZBHXTFJ-UHFFFAOYSA-N"
"Cc(c1)oc(C)c1","InChI=1S/C6H8O/c1-5-3-4-6(2)7-5/h3-4H,1-2H3","GSNUFIFRDBKVIE-UHFFFAOYSA-N"
"CCc(c1)oc(C)c1","InChI=1S/C7H10O/c1-3-7-5-4-6(2)8-7/h4-5H,3H2,1-2H3","NBXLPPVOZWYADY-UHFFFAOYSA-N"
"CCCc(c1)occ1","InChI=1S/C7H10O/c1-2-4-7-5-3-6-8-7/h3,5-6H,2,4H2,1H3","CPLJMYOQYRCCBY-UHFFFAOYSA-N"
"CCCCc(c1)occ1","InChI=1S/C8H12O/c1-2-3-5-8-6-4-7-9-8/h4,6-7H,2-3,5H2,1H3","NWZIYQNUCXUJJJ-UHFFFAOYSA-N"
"CCCCCc(c1)occ1","InChI=1S/C9H14O/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3","YVBAUDVGOFCUSG-UHFFFAOYSA-N"
"CCCCCCc(c1)occ1","InChI=1S/C10H16O/c1-2-3-4-5-7-10-8-6-9-11-10/h6,8-9H,2-5,7H2,1H3","XBLCAKKYMZVLPU-UHFFFAOYSA-N"
"CCCCCCCc(c1)occ1","InChI=1S/C11H18O/c1-2-3-4-5-6-8-11-9-7-10-12-11/h7,9-10H,2-6,8H2,1H3","BHTUFJXTYNLISA-UHFFFAOYSA-N"
"CCCCCCCCc(c1)occ1","InChI=1S/C12H20O/c1-2-3-4-5-6-7-9-12-10-8-11-13-12/h8,10-11H,2-7,9H2,1H3","RADIRWIUSSENFC-UHFFFAOYSA-N"
"CCC(=O)c(o1)c([H])c([H])c([H])1","InChI=1S/C7H8O2/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3","HCPORNAVHSWTOJ-UHFFFAOYSA-N"
"CCCC(=O)c(o1)c([H])c([H])c([H])1","InChI=1S/C8H10O2/c1-2-4-7(9)8-5-3-6-10-8/h3,5-6H,2,4H2,1H3","GONWJZJNVDRECJ-UHFFFAOYSA-N"
"CCC(=O)c(c1)oc(C)c1","InChI=1S/C8H10O2/c1-3-7(9)8-5-4-6(2)10-8/h4-5H,3H2,1-2H3","BXLPZYAVKVFXEO-UHFFFAOYSA-N"
"CCCC(=O)c(c1)oc(C)c1","InChI=1S/C9H12O2/c1-3-4-8(10)9-6-5-7(2)11-9/h5-6H,3-4H2,1-2H3","IFHKZUYQKMDHIN-UHFFFAOYSA-N"
"CCCCCCC(=O)c(c1)occ1","InChI=1S/C11H16O2/c1-2-3-4-5-7-10(12)11-8-6-9-13-11/h6,8-9H,2-5,7H2,1H3","BTNRWSUWLFMXEL-UHFFFAOYSA-N"
"CCCCCCCC(=O)c(o1)c([H])c([H])c([H])1","InChI=1S/C12H18O2/c1-2-3-4-5-6-8-11(13)12-9-7-10-14-12/h7,9-10H,2-6,8H2,1H3","OQMUCISCOICEGC-UHFFFAOYSA-N"
"COC(=O)c(c1)occ1","InChI=1S/C6H6O3/c1-8-6(7)5-3-2-4-9-5/h2-4H,1H3","HDJLSECJEQSPKW-UHFFFAOYSA-N"
"CCOC(=O)c(c1)occ1","InChI=1S/C7H8O3/c1-2-9-7(8)6-4-3-5-10-6/h3-5H,2H2,1H3","NHXSTXWKZVAVOQ-UHFFFAOYSA-N"
"C=CCOC(=O)c(c1)occ1","InChI=1S/C8H8O3/c1-2-5-11-8(9)7-4-3-6-10-7/h2-4,6H,1,5H2","SJRQTHAMRUOPBJ-UHFFFAOYSA-N"
"CC(C)CCOC(=O)c(c1)occ1","InChI=1S/C10H14O3/c1-8(2)5-7-13-10(11)9-4-3-6-12-9/h3-4,6,8H,5,7H2,1-2H3","FPBZWZKAUPNMMV-UHFFFAOYSA-N"
"CC(C)COC(=O)C(=C)c(c1)occ1","InChI=1S/C11H14O3/c1-8(2)7-14-11(12)9(3)10-5-4-6-13-10/h4-6,8H,3,7H2,1-2H3","UNJCKZCPEQJIIL-UHFFFAOYSA-N"
"CCCCOC(=O)CCc(c1)occ1","InChI=1S/C11H16O3/c1-2-3-8-14-11(12)7-6-10-5-4-9-13-10/h4-5,9H,2-3,6-8H2,1H3","LROHTRXJWCXATD-UHFFFAOYSA-N"
"CCCCCC(=O)OCc(c1)occ1","InChI=1S/C11H16O3/c1-2-3-4-7-11(12)14-9-10-6-5-8-13-10/h5-6,8H,2-4,7,9H2,1H3","IBIDUABZZSJJNF-UHFFFAOYSA-N"
"CCCCCOC(=O)CCc(c1)occ1","InChI=1S/C12H18O3/c1-2-3-4-9-15-12(13)8-7-11-6-5-10-14-11/h5-6,10H,2-4,7-9H2,1H3","MRNLJBGPIOBGFP-UHFFFAOYSA-N"
"CC(C)CCOC(=O)C(C)c(c1)occ1","InChI=1S/C12H18O3/c1-9(2)6-8-15-12(13)10(3)11-5-4-7-14-11/h4-5,7,9-10H,6,8H2,1-3H3","RPMOJCVAPZDVNG-UHFFFAOYSA-N"
"CCc(n1)oc(C)c(C)1","InChI=1S/C7H11NO/c1-4-7-8-5(2)6(3)9-7/h4H2,1-3H3","LCYOFVYHDBWYSI-UHFFFAOYSA-N"
"CCCCc(o1)nc(CC)c(C)1","InChI=1S/C10H17NO/c1-4-6-7-10-11-9(5-2)8(3)12-10/h4-7H2,1-3H3","PGYVZKVDXNIABS-UHFFFAOYSA-N"
"CC(C)Cc(n1)oc(C)c(C)1","InChI=1S/C9H15NO/c1-6(2)5-9-10-7(3)8(4)11-9/h6H,5H2,1-4H3","SNRVAFQIIFPYDR-UHFFFAOYSA-N"
"CCc(n1)c(C)oc(CC(C)C)1","InChI=1S/C10H17NO/c1-5-9-8(4)12-10(11-9)6-7(2)3/h7H,5-6H2,1-4H3","KGIIOPAYOWPZLL-UHFFFAOYSA-N"
"CCc(n1)c(C)oc(C)1","InChI=1S/C7H11NO/c1-4-7-5(2)9-6(3)8-7/h4H2,1-3H3","YZZBROGKUWYQOL-UHFFFAOYSA-N"
"CCc(o1)nc(CC)c(C)1","InChI=1S/C8H13NO/c1-4-7-6(3)10-8(5-2)9-7/h4-5H2,1-3H3","PEVDCYWBTUDNKS-UHFFFAOYSA-N"
"Cc(n1)oc(C)c(C)1","InChI=1S/C6H9NO/c1-4-5(2)8-6(3)7-4/h1-3H3","ZRLDBDZSLLGDOX-UHFFFAOYSA-N"
"CCCc(o1)nc(CC)c(C)1","InChI=1S/C9H15NO/c1-4-6-9-10-8(5-2)7(3)11-9/h4-6H2,1-3H3","NUKWARDPXKRLRG-UHFFFAOYSA-N"
"CCc(n1)c(C)oc(C(C)C)1","InChI=1S/C9H15NO/c1-5-8-7(4)11-9(10-8)6(2)3/h6H,5H2,1-4H3","SGEREWZCOUDFEM-UHFFFAOYSA-N"
"CCCc(n1)oc(C)c(C)1","InChI=1S/C8H13NO/c1-4-5-8-9-6(2)7(3)10-8/h4-5H2,1-3H3","SDRFPOFMNGISHT-UHFFFAOYSA-N"
"CC(C)c(n1)oc(C)c(C)1","InChI=1S/C8H13NO/c1-5(2)8-9-6(3)7(4)10-8/h5H,1-4H3","OHMVVHYBMWXHSY-UHFFFAOYSA-N"
"Cc(c1)nccn1","InChI=1S/C5H6N2/c1-5-4-6-2-3-7-5/h2-4H,1H3","CAWHJQAVHZEVTJ-UHFFFAOYSA-N"
"Cc(c1)ncc(C)n1","InChI=1S/C6H8N2/c1-5-3-8-6(2)4-7-5/h3-4H,1-2H3","LCZUOKDVTBMCMX-UHFFFAOYSA-N"
"Cc(n1)c(C)ncc1","InChI=1S/C6H8N2/c1-5-6(2)8-4-3-7-5/h3-4H,1-2H3","OXQOBQJCDNLAPO-UHFFFAOYSA-N"
"Cc(c1)nc(C)c(C)n1","InChI=1S/C7H10N2/c1-5-4-8-6(2)7(3)9-5/h4H,1-3H3","IAEGWXHKWJGQAZ-UHFFFAOYSA-N"
"Cc(n1)c(C)nc(C)c(C)1","InChI=1S/C8H12N2/c1-5-6(2)10-8(4)7(3)9-5/h1-4H3","FINHMKGKINIASC-UHFFFAOYSA-N"
"CC(C)c(n1)c(C)ncc1","InChI=1S/C8H12N2/c1-6(2)8-7(3)9-4-5-10-8/h4-6H,1-3H3","LNSYLBDZKBWDNL-UHFFFAOYSA-N"
"CCc(n1)c(C)ncc1","InChI=1S/C7H10N2/c1-3-7-6(2)8-4-5-9-7/h4-5H,3H2,1-2H3","LNIMMWYNSBZESE-UHFFFAOYSA-N"
"CCc(c1)scc1","InChI=1S/C6H8S/c1-2-6-4-3-5-7-6/h3-5H,2H2,1H3","JCCCMAAJYSNBPR-UHFFFAOYSA-N"
"CCCCc(c1)scc1","InChI=1S/C8H12S/c1-2-3-5-8-6-4-7-9-8/h4,6-7H,2-3,5H2,1H3","MNDZHERKKXUTOE-UHFFFAOYSA-N"
"CCCCCc(c1)scc1","InChI=1S/C9H14S/c1-2-3-4-6-9-7-5-8-10-9/h5,7-8H,2-4,6H2,1H3","NOYVOSGVFSEKPR-UHFFFAOYSA-N"
"CCCCCCc(c1)scc1","InChI=1S/C10H16S/c1-2-3-4-5-7-10-8-6-9-11-10/h6,8-9H,2-5,7H2,1H3","QZVHYFUVMQIGGM-UHFFFAOYSA-N"
"CCCCCCCc(c1)scc1","InChI=1S/C11H18S/c1-2-3-4-5-6-8-11-9-7-10-12-11/h7,9-10H,2-6,8H2,1H3","FGGZOCMVJAJPMH-UHFFFAOYSA-N"
"CC(=O)c(c1)scc1","InChI=1S/C6H6OS/c1-5(7)6-3-2-4-8-6/h2-4H,1H3","WYJOVVXUZNRJQY-UHFFFAOYSA-N"
"CCC(=O)c(c1)scc1","InChI=1S/C7H8OS/c1-2-6(8)7-4-3-5-9-7/h3-5H,2H2,1H3","MFPZQZZWAMAHOY-UHFFFAOYSA-N"
"CCCC(=O)c(c1)scc1","InChI=1S/C8H10OS/c1-2-4-7(9)8-5-3-6-10-8/h3,5-6H,2,4H2,1H3","YXHIINNJOGKPLF-UHFFFAOYSA-N"
"CCCCCC(=O)c(c1)scc1","InChI=1S/C10H14OS/c1-2-3-4-6-9(11)10-7-5-8-12-10/h5,7-8H,2-4,6H2,1H3","CVDZQNUYYOLFOO-UHFFFAOYSA-N"
"CCCCCCC(=O)c(c1)scc1","InChI=1S/C11H16OS/c1-2-3-4-5-7-10(12)11-8-6-9-13-11/h6,8-9H,2-5,7H2,1H3","BDNFJEMAAFFMFH-UHFFFAOYSA-N"
"CCCCCCCC(=O)c(c1)scc1","InChI=1S/C12H18OS/c1-2-3-4-5-6-8-11(13)12-9-7-10-14-12/h7,9-10H,2-6,8H2,1H3","QRJZCQOLJVIBDE-UHFFFAOYSA-N"
"CC(=O)c(c1)sc(C)c1","InChI=1S/C7H8OS/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3","YOSDTJYMDAEEAZ-UHFFFAOYSA-N"
"CCC(=O)c(c1)sc(C)c1","InChI=1S/C8H10OS/c1-3-7(9)8-5-4-6(2)10-8/h4-5H,3H2,1-2H3","ROPOMQPSWIOWSN-UHFFFAOYSA-N"
"Cc(n1)csc1","InChI=1S/C4H5NS/c1-4-2-6-3-5-4/h2-3H,1H3","QMHIMXFNBOYPND-UHFFFAOYSA-N"
"CCc(n1)scc1","InChI=1S/C5H7NS/c1-2-5-6-3-4-7-5/h3-4H,2H2,1H3","CGZDWVZMOMDGBN-UHFFFAOYSA-N"
"CCCc(n1)scc1","InChI=1S/C6H9NS/c1-2-3-6-7-4-5-8-6/h4-5H,2-3H2,1H3","CMOIEFFAOUQJPS-UHFFFAOYSA-N"
"CCc(n1)c(C)sc1","InChI=1S/C6H9NS/c1-3-6-5(2)8-4-7-6/h4H,3H2,1-2H3","QCIOXFPPEGZRFY-UHFFFAOYSA-N"
"CCc(s1)nc(C)c1","InChI=1S/C6H9NS/c1-3-6-7-5(2)4-8-6/h4H,3H2,1-2H3","VGRVKVGGUPOCMT-UHFFFAOYSA-N"
"CCc(n1)sc(C)c(C)1","InChI=1S/C7H11NS/c1-4-7-8-5(2)6(3)9-7/h4H2,1-3H3","BVOKJOZBJOWZNJ-UHFFFAOYSA-N"
"CCCc(s1)nc(C)c1","InChI=1S/C7H11NS/c1-3-4-7-8-6(2)5-9-7/h5H,3-4H2,1-2H3","WUISKNCHCVXERE-UHFFFAOYSA-N"
"CC(C)Cc(n1)scc1","InChI=1S/C7H11NS/c1-6(2)5-7-8-3-4-9-7/h3-4,6H,5H2,1-2H3","CMPVUVUNJQERIT-UHFFFAOYSA-N"
"CC(C)Cc(s1)nc(C)c1","InChI=1S/C8H13NS/c1-6(2)4-8-9-7(3)5-10-8/h5-6H,4H2,1-3H3","JBUCYVMFLWLDIO-UHFFFAOYSA-N"
"CCCCc(s1)nc(C)c1","InChI=1S/C8H13NS/c1-3-4-5-8-9-7(2)6-10-8/h6H,3-5H2,1-2H3","HVRMJTCTZVGJDO-UHFFFAOYSA-N"
"CCCCc(n1)sc(C)c(C)1","InChI=1S/C9H15NS/c1-4-5-6-9-10-7(2)8(3)11-9/h4-6H2,1-3H3","OHJFDYDPHXVQBC-UHFFFAOYSA-N"
"CC(C)Cc(n1)sc(C)c(C)1","InChI=1S/C9H15NS/c1-6(2)5-9-10-7(3)8(4)11-9/h6H,5H2,1-4H3","NSVPHVLZAKJSGV-UHFFFAOYSA-N"
"OCCc(s1)c(C)nc1","InChI=1S/C6H9NOS/c1-5-6(2-3-8)9-4-7-5/h4,8H,2-3H2,1H3","BKAWJIRCKVUVED-UHFFFAOYSA-N"
"CC(=O)c(n1)scc1","InChI=1S/C5H5NOS/c1-4(7)5-6-2-3-8-5/h2-3H,1H3","MOMFXATYAINJML-UHFFFAOYSA-N"
"CC(=O)c(s1)c(C)nc(C)1","InChI=1S/C7H9NOS/c1-4-7(5(2)9)10-6(3)8-4/h1-3H3","BLQOKWQUTLNKON-UHFFFAOYSA-N"
"N#Cc(c1)c(C2)c(CCC2)cc1","InChI=1S/C11H11N/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h3,5-6H,1-2,4,7H2","PYPOBLLWIOJZEJ-UHFFFAOYSA-N"
"N#Cc(c1)cc(C2)c(CCC2)c1","InChI=1S/C11H11N/c12-8-9-5-6-10-3-1-2-4-11(10)7-9/h5-7H,1-4H2","TWDAXWPAXMGRAF-UHFFFAOYSA-N"
"CCc(c1)nc(c2)c(ccc2)c1","InChI=1S/C11H11N/c1-2-10-8-7-9-5-3-4-6-11(9)12-10/h3-8H,2H2,1H3","XCIZVKSCLVSDHN-UHFFFAOYSA-N"
"Cc(c2)cc(c1)c(c2)ncc(C)1","InChI=1S/C11H11N/c1-8-3-4-11-10(5-8)6-9(2)7-12-11/h3-7H,1-2H3","XEDLZYLCKAHYHR-UHFFFAOYSA-N"
"CCc(c1)cc(c2)c(ccc2)n1","InChI=1S/C11H11N/c1-2-9-7-10-5-3-4-6-11(10)12-8-9/h3-8H,2H2,1H3","WLWBKLRAHBGNIU-UHFFFAOYSA-N"
"Cc(c2)c(c1)c(nc2)c(C)cc1","InChI=1S/C11H11N/c1-8-6-7-12-11-9(2)4-3-5-10(8)11/h3-7H,1-2H3","DULGUAMZWACUFO-UHFFFAOYSA-N"
"CCc(c1)c(c2)c(ccc2)nc1","InChI=1S/C11H11N/c1-2-9-7-8-12-11-6-4-3-5-10(9)11/h3-8H,2H2,1H3","UOYJBGYNFMPCLV-UHFFFAOYSA-N"
"Cc(c1)c(c2)c(ncc2)c(C)c1","InChI=1S/C11H11N/c1-8-5-6-9(2)11-10(8)4-3-7-12-11/h3-7H,1-2H3","VVLZEQKZPNOPNS-UHFFFAOYSA-N"
"CCc(c1)cc(c2)c(ncc2)c1","InChI=1S/C11H11N/c1-2-9-5-6-11-10(8-9)4-3-7-12-11/h3-8H,2H2,1H3","VDOYSQQOKJDYDR-UHFFFAOYSA-N"
"CCc(c1)cc(n2)c(ccc2)c1","InChI=1S/C11H11N/c1-2-9-5-6-10-4-3-7-12-11(10)8-9/h3-8H,2H2,1H3","UHZSEKVLMCZMTR-UHFFFAOYSA-N"
"CCc(c1)c(n2)c(ccc2)cc1","InChI=1S/C11H11N/c1-2-9-5-3-6-10-7-4-8-12-11(9)10/h3-8H,2H2,1H3","WSNATRDCOFYLCB-UHFFFAOYSA-N"
"OCc(c1)nc(c2)c(ccc2)c1","InChI=1S/C10H9NO/c12-7-9-6-5-8-3-1-2-4-10(8)11-9/h1-6,12H,7H2","HREHOXSRYOZKNT-UHFFFAOYSA-N"
"Cc(c2)c(c1)c(nc2)c(O)cc1","InChI=1S/C10H9NO/c1-7-5-6-11-10-8(7)3-2-4-9(10)12/h2-6,12H,1H3","OYUKRQOCPFZNHR-UHFFFAOYSA-N"
"Cc(c1)c(O)c(n2)c(ccc2)c1","InChI=1S/C10H9NO/c1-7-4-5-8-3-2-6-11-9(8)10(7)12/h2-6,12H,1H3","LUOZEWPJSYBORW-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)NC(=C2)C","InChI=1S/C10H11N/c1-7-3-4-10-9(5-7)6-8(2)11-10/h3-6,11H,1-2H3","ZFLFWZRPMDXJCW-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)C=C(N2)C","InChI=1S/C10H11N/c1-7-3-4-9-6-8(2)11-10(9)5-7/h3-6,11H,1-2H3","IVEOPBYBMLADDC-UHFFFAOYSA-N"
"CC1=CC(=C2C(=C1)C=CN2)C","InChI=1S/C10H11N/c1-7-5-8(2)10-9(6-7)3-4-11-10/h3-6,11H,1-2H3","DVHNMQQXLMOZKB-UHFFFAOYSA-N"
"[H]c(c(C)1)n(C)c(c2)c(ccc2)1","InChI=1S/C10H11N/c1-8-7-11(2)10-6-4-3-5-9(8)10/h3-7H,1-2H3","NAPPMSNSLWACIV-UHFFFAOYSA-N"
"Cc(c([H])1)n(C)c(c2)c(ccc2)1","InChI=1S/C10H11N/c1-8-7-9-5-3-4-6-10(9)11(8)2/h3-7H,1-2H3","BJMUOUXGBFNLSN-UHFFFAOYSA-N"
"Cc(c2)c(c([H])1)c(cc2)n(C)c([H])1","InChI=1S/C10H11N/c1-8-4-3-5-10-9(8)6-7-11(10)2/h3-7H,1-2H3","YQYZZTOIMUEGDJ-UHFFFAOYSA-N"
"[H]c(c([H])1)n(C)c(c(C)2)c(ccc2)1","InChI=1S/C10H11N/c1-8-4-3-5-9-6-7-11(2)10(8)9/h3-7H,1-2H3","DQQBLGJGQJEAAQ-UHFFFAOYSA-N"
"CCn(c([H])1)c(c2)c(ccc2)c([H])1","InChI=1S/C10H11N/c1-2-11-8-7-9-5-3-4-6-10(9)11/h3-8H,2H2,1H3","QRRKZFCXXBFHSV-UHFFFAOYSA-N"
"CC1=CNC2=CC=CC=C12","InChI=1S/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3","ZFRKQXVRDFCRJG-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)NC=C2","InChI=1S/C9H9N/c1-7-2-3-9-8(6-7)4-5-10-9/h2-6,10H,1H3","YPKBCLZFIYBSHK-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)C=CN2","InChI=1S/C9H9N/c1-7-2-3-8-4-5-10-9(8)6-7/h2-6,10H,1H3","ONYNOPPOVKYGRS-UHFFFAOYSA-N"
"[H]c(c([H])1)n(C)c(c2)c(ccc2)1","InChI=1S/C9H9N/c1-10-7-6-8-4-2-3-5-9(8)10/h2-7H,1H3","BLRHMMGNCXNXJL-UHFFFAOYSA-N"
"CC(C1)c(c2)c(ccc2)C(C)(C)1","InChI=1S/C12H16/c1-9-8-12(2,3)11-7-5-4-6-10(9)11/h4-7,9H,8H2,1-3H3","CPLBLNGVYBSVPU-UHFFFAOYSA-N"
"Cc(c2)c(C1)c(cc2)C(C)(C)C1","InChI=1S/C12H16/c1-9-5-4-6-11-10(9)7-8-12(11,2)3/h4-6H,7-8H2,1-3H3","USZSMCUXEWREKR-UHFFFAOYSA-N"
"Cc(c2)cc(C1)c(c2)C(C)(C)C1","InChI=1S/C12H16/c1-9-4-5-11-10(8-9)6-7-12(11,2)3/h4-5,8H,6-7H2,1-3H3","JIHZHLCOASGNCG-UHFFFAOYSA-N"
"Cc(c2)cc(c(c2)1)C(C)(C)CC1","InChI=1S/C12H16/c1-9-4-5-10-6-7-12(2,3)11(10)8-9/h4-5,8H,6-7H2,1-3H3","OEAUYEGWUJMPQQ-UHFFFAOYSA-N"
"Cc(c2)c(C1)c(c(C)c2)C(C)C1","InChI=1S/C12H16/c1-8-4-5-9(2)12-10(3)6-7-11(8)12/h4-5,10H,6-7H2,1-3H3","VPYDMFMIOKBZIO-UHFFFAOYSA-N"
"Cc(c1)cc(C2)c(C(C)C2)c(C)1","InChI=1S/C12H16/c1-8-6-10(3)12-9(2)4-5-11(12)7-8/h6-7,9H,4-5H2,1-3H3","NHUDOXBAZXTOGS-UHFFFAOYSA-N"
"CCCc(c1)ccnc1","InChI=1S/C8H11N/c1-2-3-8-4-6-9-7-5-8/h4-7H,2-3H2,1H3","JAWZAONCXMJLFT-UHFFFAOYSA-N"
"CCc(c1)c(C)ccn1","InChI=1S/C8H11N/c1-3-8-6-9-5-4-7(8)2/h4-6H,3H2,1-2H3","JDQNYWYMNFRKNQ-UHFFFAOYSA-N"
"CCc(c1)cc(C)cn1","InChI=1S/C8H11N/c1-3-8-4-7(2)5-9-6-8/h4-6H,3H2,1-2H3","XTLUAAHBKVFNPF-UHFFFAOYSA-N"
"CCCc(c1)cc(C)cn1","InChI=1S/C9H13N/c1-3-4-9-5-8(2)6-10-7-9/h5-7H,3-4H2,1-2H3","HVSAUQKNIJRYSR-UHFFFAOYSA-N"
"CC(C)(C)c(c1)cncc1","InChI=1S/C9H13N/c1-9(2,3)8-5-4-6-10-7-8/h4-7H,1-3H3","FBUIIWHYTLCORM-UHFFFAOYSA-N"
"CCCCc(c1)cncc1","InChI=1S/C9H13N/c1-2-3-5-9-6-4-7-10-8-9/h4,6-8H,2-3,5H2,1H3","QSNMFWFDOFQASV-UHFFFAOYSA-N"
"CCC(=O)c(c1)cncc1","InChI=1S/C8H9NO/c1-2-8(10)7-4-3-5-9-6-7/h3-6H,2H2,1H3","VDNKJMUNLKAGAM-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=O)c(c1)nccc1","InChI=1S/C12H9NO/c14-12(10-6-2-1-3-7-10)11-8-4-5-9-13-11/h1-9H","GCSHUYKULREZSJ-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=O)c(c1)cncc1","InChI=1S/C12H9NO/c14-12(10-5-2-1-3-6-10)11-7-4-8-13-9-11/h1-9H","RYMBAPVTUHZCNF-UHFFFAOYSA-N"
"C=Cc(c1)nccc1","InChI=1S/C7H7N/c1-2-7-5-3-4-6-8-7/h2-6H,1H2","KGIGUEBEKRSTEW-UHFFFAOYSA-N"
"CCOC(=O)C(C(C)C)C(=O)OCC","InChI=1S/C10H18O4/c1-5-13-9(11)8(7(3)4)10(12)14-6-2/h7-8H,5-6H2,1-4H3","BYQFBFWERHXONI-UHFFFAOYSA-N"
"CCCCCC(OC(C)=O)C(=O)OC","InChI=1S/C10H18O4/c1-4-5-6-7-9(10(12)13-3)14-8(2)11/h9H,4-7H2,1-3H3","WTKFTHZYAPZCAU-UHFFFAOYSA-N"
"COC(=O)CCC(C)CCC(=O)OC","InChI=1S/C10H18O4/c1-8(4-6-9(11)13-2)5-7-10(12)14-3/h8H,4-7H2,1-3H3","YBRNYBYNRKCRCW-UHFFFAOYSA-N"
"COC(=O)CCCC(C)CC(=O)OC","InChI=1S/C10H18O4/c1-8(7-10(12)14-3)5-4-6-9(11)13-2/h8H,4-7H2,1-3H3","HJRDWNWLAOQATD-UHFFFAOYSA-N"
"CCCC(C(=O)OCC)C(=O)OCC","InChI=1S/C10H18O4/c1-4-7-8(9(11)13-5-2)10(12)14-6-3/h8H,4-7H2,1-3H3","GRRSDGHTSMJICM-UHFFFAOYSA-N"
"CC(N)Cc(c(C)1)c(c3)c(c2cc3)n(CCC2)1","InChI=1S/C15H20N2/c1-10(16)9-14-11(2)17-8-4-6-12-5-3-7-13(14)15(12)17/h3,5,7,10H,4,6,8-9,16H2,1-2H3","QSMNZYBRAMFCAK-UHFFFAOYSA-N"
"C(C4)CC(C)(c31)C(C)(N4)N(C2)c(c(ccc3)C2)1","InChI=1S/C15H20N2/c1-14-8-4-9-16-15(14,2)17-10-7-11-5-3-6-12(14)13(11)17/h3,5-6,16H,4,7-10H2,1-2H3","YLSBELUGIAXPNW-UHFFFAOYSA-N"
"CC(=O)N(C3)C(C)(N(C(C)=O)1)C(C)(C3)c(c2)c(ccc2)1","InChI=1S/C16H20N2O2/c1-11(19)17-10-9-15(3)13-7-5-6-8-14(13)18(12(2)20)16(15,17)4/h5-8H,9-10H2,1-4H3","NORSOMFTOWCIQC-UHFFFAOYSA-N"
"c(c3)ccc(c3)Cn(c(C)1)c(c2)c(ccc2)c(C)1","InChI=1S/C17H17N/c1-13-14(2)18(12-15-8-4-3-5-9-15)17-11-7-6-10-16(13)17/h3-11H,12H2,1-2H3","RTGHTGMXWBWQIQ-UHFFFAOYSA-N"
"NCCc(c(C)1)c(c3)c(ccc3)n(c(c2)cccc2)1","InChI=1S/C17H18N2/c1-13-15(11-12-18)16-9-5-6-10-17(16)19(13)14-7-3-2-4-8-14/h2-10H,11-12,18H2,1H3","PQXYDILHRHTDJI-UHFFFAOYSA-N"
"CCCCCCCCCCCCn(n1)c(C)c([H])c(C)1","InChI=1S/C17H32N2/c1-4-5-6-7-8-9-10-11-12-13-14-19-17(3)15-16(2)18-19/h15H,4-14H2,1-3H3","BXYFENZNKPBVNG-UHFFFAOYSA-N"
"NCCc(c(C)1)c(c3)c(ccc3)n(Cc(c2)cccc2)1","InChI=1S/C18H20N2/c1-14-16(11-12-19)17-9-5-6-10-18(17)20(14)13-15-7-3-2-4-8-15/h2-10H,11-13,19H2,1H3","CDOSZLVHAXMESL-UHFFFAOYSA-N"
"c(c4)ccc(c4)CN(c21)C(C)(N3)C(C)(CC3)c(cccc2)1","InChI=1S/C19H22N2/c1-18-12-13-20-19(18,2)21(14-15-8-4-3-5-9-15)17-11-7-6-10-16(17)18/h3-11,20H,12-14H2,1-2H3","YQUYOXMYEZGTSD-UHFFFAOYSA-N"
"c(c3)ccc(c3)CC(Cc(c2)cccc2)(C(C)=1)C(C)=NN1","InChI=1S/C19H20N2/c1-15-19(16(2)21-20-15,13-17-9-5-3-6-10-17)14-18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3","URFRTPANSKYVIW-UHFFFAOYSA-N"
"c(c3)ccc(c3)Cc(c(C)1)c(C)n(Cc(c2)cccc2)n1","InChI=1S/C19H20N2/c1-15-19(13-17-9-5-3-6-10-17)16(2)21(20-15)14-18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3","ASZULXHUEVXEKB-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=CC=CC3=C2NC(=C3)C4=CC=CC=C4","InChI=1S/C20H15N/c1-3-8-15(9-4-1)18-13-7-12-17-14-19(21-20(17)18)16-10-5-2-6-11-16/h1-14,21H","WMQAZXDFRMNFDJ-UHFFFAOYSA-N"
"c(c4)ccc(c4)c(n1)c([H])c(c(c3)cccc3)n(c(c2)cccc2)1","InChI=1S/C21H16N2/c1-4-10-17(11-5-1)20-16-21(18-12-6-2-7-13-18)23(22-20)19-14-8-3-9-15-19/h1-16H","YQDSXDPQYUXRDP-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=C(NN=C2C3=CC=CC=C3)C4=CC=CC=C4","InChI=1S/C21H16N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)22-23-21(19)18-14-8-3-9-15-18/h1-15H,(H,22,23)","NAFYHLQTAPLJKI-UHFFFAOYSA-N"
"CC1=C(C2=C(N1)C(=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4","InChI=1S/C21H17N/c1-15-20(17-11-6-3-7-12-17)19-14-8-13-18(21(19)22-15)16-9-4-2-5-10-16/h2-14,22H,1H3","UVSLNEIIASUBJT-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCn(n1)c(C)c([H])c(C)1","InChI=1S/C21H40N2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-21(3)19-20(2)22-23/h19H,4-18H2,1-3H3","CXLQVJKUUGHVAQ-UHFFFAOYSA-N"
"NCCc(c21)c(c(c4)cccc4)n(c(c3)cccc3)c(cccc2)1","InChI=1S/C22H20N2/c23-16-15-20-19-13-7-8-14-21(19)24(18-11-5-2-6-12-18)22(20)17-9-3-1-4-10-17/h1-14H,15-16,23H2","RUAJRKRPPGDWBK-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C2=CC=CC3=C2NC(=C3C4=CC=CC=C4)C5=CC=CC=C5","InChI=1S/C26H19N/c1-4-11-19(12-5-1)22-17-10-18-23-24(20-13-6-2-7-14-20)25(27-26(22)23)21-15-8-3-9-16-21/h1-18,27H","YTVWMYIAUIKCCS-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C=2)C(C=C(C)C2)=N1","InChI=1S/C13H14N2O3/c1-3-18-12(16)7-10-8-14-11-6-9(2)4-5-15(11)13(10)17/h4-6,8H,3,7H2,1-2H3","YHIQSHZYBRSRJO-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C=2)C(C=CC(C)2)=N1","InChI=1S/C13H14N2O3/c1-3-18-12(16)6-10-7-14-11-5-4-9(2)8-15(11)13(10)17/h4-5,7-8H,3,6H2,1-2H3","VHLUXOYRWOXMSL-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C(C)=2)C(C=CC2)=N1","InChI=1S/C13H14N2O3/c1-3-18-12(16)7-10-8-14-11-6-4-5-9(2)15(11)13(10)17/h4-6,8H,3,7H2,1-2H3","FHSCYCCXMSMREH-UHFFFAOYSA-N"
"CCOC(=O)C(=C1)C(=O)N(C(C)=2)C(C=C(C)C2)=N1","InChI=1S/C13H14N2O3/c1-4-18-13(17)10-7-14-11-6-8(2)5-9(3)15(11)12(10)16/h5-7H,4H2,1-3H3","YJTMOGMHROYTOO-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(n2)c(N)c(nc2)c(c1)cccc1","InChI=1S/C16H13N3/c17-14-15(12-7-3-1-4-8-12)18-11-19-16(14)13-9-5-2-6-10-13/h1-11H,17H2","UVAWOHSHUUQNHC-UHFFFAOYSA-N"
"CCOC(=O)CC(=C2)C(=O)N(C=1)C(=N2)C(O)=CC1","InChI=1S/C12H12N2O4/c1-2-18-10(16)6-8-7-13-11-9(15)4-3-5-14(11)12(8)17/h3-5,7,15H,2,6H2,1H3","MONGEZKNMGDLAX-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C(O)=2)C(C=CC2)=N1","InChI=1S/C12H12N2O4/c1-2-18-11(16)6-8-7-13-9-4-3-5-10(15)14(9)12(8)17/h3-5,7,15H,2,6H2,1H3","JXXBRIKWBBNBTE-UHFFFAOYSA-N"
"CCOC(=O)C(=C([H])1)C(=O)N(C(C)2)C(=C([H])CC2)N(C)1","InChI=1S/C13H18N2O3/c1-4-18-13(17)10-8-14(3)11-7-5-6-9(2)15(11)12(10)16/h7-9H,4-6H2,1-3H3","AEKDFTDASFSIAS-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C2)C(CCC(C)2)=N1","InChI=1S/C13H18N2O3/c1-3-18-12(16)6-10-7-14-11-5-4-9(2)8-15(11)13(10)17/h7,9H,3-6,8H2,1-2H3","DQDHORMHBVVMMG-UHFFFAOYSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C(C)2)C(CCC2)=N1","InChI=1S/C13H18N2O3/c1-3-18-12(16)7-10-8-14-11-6-4-5-9(2)15(11)13(10)17/h8-9H,3-7H2,1-2H3","GVEKOTSOWVJLFX-UHFFFAOYSA-N"
"Fc(c3)ccc(c3)c(n2)nc(cc2)c(c1)cccc1","InChI=1S/C16H11FN2/c17-14-8-6-13(7-9-14)16-18-11-10-15(19-16)12-4-2-1-3-5-12/h1-11H","UZMUNUXFDXKYTM-UHFFFAOYSA-N"
"Fc(c3)cc(cc3)c(n2)nc(cc2)c(c1)cccc1","InChI=1S/C16H11FN2/c17-14-8-4-7-13(11-14)16-18-10-9-15(19-16)12-5-2-1-3-6-12/h1-11H","CZBRVZRPXXJFRX-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)c(n1)nc(Br)cc1","InChI=1S/C10H6BrFN2/c11-9-5-6-13-10(14-9)7-1-3-8(12)4-2-7/h1-6H","GSYPOPGUJPCOCY-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)c(n1)cc(Br)nc1","InChI=1S/C10H6BrFN2/c11-10-5-9(13-6-14-10)7-1-3-8(12)4-2-7/h1-6H","VVLXBRIIRDGDMQ-UHFFFAOYSA-N"
"CCOC(=O)C(=C([H])1)C(=O)N(C(C)2)C(CCC2)N(C)1","InChI=1S/C13H20N2O3/c1-4-18-13(17)10-8-14(3)11-7-5-6-9(2)15(11)12(10)16/h8-9,11H,4-7H2,1-3H3","GLHCZAOYBZLTCB-UHFFFAOYSA-N"
"COC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)C=C1","InChI=1S/C14H10N2O3/c1-19-14(18)10-8-15-12-7-6-9-4-2-3-5-11(9)16(12)13(10)17/h2-8H,1H3","RUCUMXZHBMUJIL-UHFFFAOYSA-N"
"C(C3)CCN(C3)c(c2)nc(nc2)c(c1)c(O)ccc1","InChI=1S/C15H17N3O/c19-13-7-3-2-6-12(13)15-16-9-8-14(17-15)18-10-4-1-5-11-18/h2-3,6-9,19H,1,4-5,10-11H2","ONTRPRJREWCYNU-UHFFFAOYSA-N"
"COC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)CC1","InChI=1S/C14H12N2O3/c1-19-14(18)10-8-15-12-7-6-9-4-2-3-5-11(9)16(12)13(10)17/h2-5,8H,6-7H2,1H3","DSYTVTCQTXYCFF-UHFFFAOYSA-N"
"CCCCCCCc(c(Cl)1)c(Cl)nc(C)n1","InChI=1S/C12H18Cl2N2/c1-3-4-5-6-7-8-10-11(13)15-9(2)16-12(10)14/h3-8H2,1-2H3","ZUEZUFNWYSUGEG-UHFFFAOYSA-N"
"CCOC(=O)CC(=C2)C(=O)N(C(C)=1)C(=N2)C=C(C)C1","InChI=1S/C14H16N2O3/c1-4-19-13(17)7-11-8-15-12-6-9(2)5-10(3)16(12)14(11)18/h5-6,8H,4,7H2,1-3H3","IAENEZBDQUPXCU-UHFFFAOYSA-N"
"CCOC(=O)CCC(=C1)C(=O)N(C(C)=2)C(C=CC2)=N1","InChI=1S/C14H16N2O3/c1-3-19-13(17)8-7-11-9-15-12-6-4-5-10(2)16(12)14(11)18/h4-6,9H,3,7-8H2,1-2H3","QFRPXRGYTOYELI-UHFFFAOYSA-N"
"Nc(n1)[n+1]([O-1])cc(Br)c1c(c2)cccc2","InChI=1S/C10H8BrN3O/c11-8-6-14(15)10(12)13-9(8)7-4-2-1-3-5-7/h1-6H,(H2,12,13)","FCWOUCCHYBFFKR-UHFFFAOYSA-N"
"CCOC(=O)C(=C2)C(=O)N(C(C)1)C(=N2)C(=NO)CC1","InChI=1S/C12H15N3O4/c1-3-19-12(17)8-6-13-10-9(14-18)5-4-7(2)15(10)11(8)16/h6-7,18H,3-5H2,1-2H3/b14-9+","VWYJPUYRCOGBKZ-NTEUORMPSA-N"
"CCOC(=O)CC(=C1)C(=O)N(C=2)C(C=CC(Cl)2)=N1","InChI=1S/C12H11ClN2O3/c1-2-18-11(16)5-8-6-14-10-4-3-9(13)7-15(10)12(8)17/h3-4,6-7H,2,5H2,1H3","UGSTZPVMZHXYRW-UHFFFAOYSA-N"
"CCOC(=O)C(=C([H])1)C(=O)N(C(C)2)C(CCC2)N(CC)1","InChI=1S/C14H22N2O3/c1-4-15-9-11(14(18)19-5-2)13(17)16-10(3)7-6-8-12(15)16/h9-10,12H,4-8H2,1-3H3","DZCPIPIKEVVNLF-UHFFFAOYSA-N"
"CCOC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)C=C1","InChI=1S/C15H12N2O3/c1-2-20-15(19)11-9-16-13-8-7-10-5-3-4-6-12(10)17(13)14(11)18/h3-9H,2H2,1H3","SDMSGNXFHZBVSF-UHFFFAOYSA-N"
"CCOC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)CC1","InChI=1S/C15H14N2O3/c1-2-20-15(19)11-9-16-13-8-7-10-5-3-4-6-12(10)17(13)14(11)18/h3-6,9H,2,7-8H2,1H3","MCLUTGHWMIHTGC-UHFFFAOYSA-N"
"CCOC(=O)C(=C3)C(=O)N(C1N3)c(c2)c(ccc2)CC1","InChI=1S/C15H16N2O3/c1-2-20-15(19)11-9-16-13-8-7-10-5-3-4-6-12(10)17(13)14(11)18/h3-6,9,13,16H,2,7-8H2,1H3","SMLHOYYNUFCDHK-UHFFFAOYSA-N"
"O=C(N3)NC(=O)C(=C3)C(=N2)C=C(NC(=O)2)c(c1)cccc1","InChI=1S/C14H10N4O3/c19-12-9(7-15-13(20)18-12)11-6-10(16-14(21)17-11)8-4-2-1-3-5-8/h1-7H,(H,16,17,21)(H2,15,18,19,20)","ZBPPVCOFAWPGSG-UHFFFAOYSA-N"
"Oc(c3)c(ccc3)c(n2)nc(Cl)c(c2)c(c1)cccc1","InChI=1S/C16H11ClN2O/c17-15-13(11-6-2-1-3-7-11)10-18-16(19-15)12-8-4-5-9-14(12)20/h1-10,20H","LXVBVEUBEWFAIM-UHFFFAOYSA-N"
"CC(C)OC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)C=C1","InChI=1S/C16H14N2O3/c1-10(2)21-16(20)12-9-17-14-8-7-11-5-3-4-6-13(11)18(14)15(12)19/h3-10H,1-2H3","FKFQNAKEKPOTSM-UHFFFAOYSA-N"
"CCCOC(=O)C(=C3)C(=O)N(C1=N3)c(c2)c(ccc2)C=C1","InChI=1S/C16H14N2O3/c1-2-9-21-16(20)12-10-17-14-8-7-11-5-3-4-6-13(11)18(14)15(12)19/h3-8,10H,2,9H2,1H3","YTDVVJLYXSIROL-UHFFFAOYSA-N"
"CCOC(=O)CC(=C([H])3)C(=O)N(c21)C(=N3)C([H])=C([H])c(cccc2)1","InChI=1S/C16H14N2O3/c1-2-21-15(19)9-12-10-17-14-8-7-11-5-3-4-6-13(11)18(14)16(12)20/h3-8,10H,2,9H2,1H3","GKZJDLVDRPMCOY-UHFFFAOYSA-N"
"C1=CC2=C(C=C1C(F)(F)F)NC(=N2)C(F)(F)F","InChI=1S/C9H4F6N2/c10-8(11,12)4-1-2-5-6(3-4)17-7(16-5)9(13,14)15/h1-3H,(H,16,17)","BKFXAUQYNCJXIZ-UHFFFAOYSA-N"
"C1=CC2=C(C=C1C(F)(F)F)NC(=N2)C(C(C(F)(F)F)(F)F)(F)F","InChI=1S/C11H4F10N2/c12-8(13,10(17,18)11(19,20)21)7-22-5-2-1-4(9(14,15)16)3-6(5)23-7/h1-3H,(H,22,23)","CUIYQHZRAVZIPS-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)NC(=N2)C(C(C(F)(F)F)(F)F)(F)F","InChI=1S/C10H5F7N2/c11-8(12,9(13,14)10(15,16)17)7-18-5-3-1-2-4-6(5)19-7/h1-4H,(H,18,19)","VZEYKZFVOPCTLV-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)NC(=N2)C(C(F)(F)F)(F)F","InChI=1S/C9H5F5N2/c10-8(11,9(12,13)14)7-15-5-3-1-2-4-6(5)16-7/h1-4H,(H,15,16)","MRDUDGYTAUTZQP-UHFFFAOYSA-N"
"CCCC(CC(O)=O)NCc(c1)cccc1","InChI=1S/C13H19NO2/c1-2-6-12(9-13(15)16)14-10-11-7-4-3-5-8-11/h3-5,7-8,12,14H,2,6,9-10H2,1H3,(H,15,16)","JQKKEYCMOYWIOU-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(CC(O)=O)NCc(c1)cccc1","InChI=1S/C22H37NO2/c1-2-3-4-5-6-7-8-9-10-14-17-21(18-22(24)25)23-19-20-15-12-11-13-16-20/h11-13,15-16,21,23H,2-10,14,17-19H2,1H3,(H,24,25)","URBZNYXWHOGCJC-UHFFFAOYSA-N"
"C1=CC2=C(C=C1Br)N/C(=C/3\C(=O)C4=C(N3)C=C(C=C4)Br)/C2=O","InChI=1S/C16H8Br2N2O2/c17-7-1-3-9-11(5-7)19-13(15(9)21)14-16(22)10-4-2-8(18)6-12(10)20-14/h1-6,19-20H/b14-13+","ZVAPIIDBWWULJN-BUHFOSPRSA-N"
"O=C(NC(C2)CCCC2)NC(C1)CCCC1","InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)","ADFXKUOMJKEIND-UHFFFAOYSA-N"
"OC(=C1)C(=O)C=CC=C1","InChI=1S/C7H6O2/c8-6-4-2-1-3-5-7(6)9/h1-5H,(H,8,9)","MDYOLVRUBBJPFM-UHFFFAOYSA-N"
"C1[C@H](NCC2=C1C3=CC=CC=C3N2)C(=O)O","InChI=1S/C12H12N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-4,10,13-14H,5-6H2,(H,15,16)/t10-/m0/s1","FSNCEEGOMTYXKY-JTQLQIEISA-N"
"c(c4)ccc(c4)N(C31)C(C(=O)C=C3)c(c2)c(ccc2)1","InChI=1S/C17H13NO/c19-16-11-10-15-13-8-4-5-9-14(13)17(16)18(15)12-6-2-1-3-7-12/h1-11,15,17H","HBVLHVPIKRRHKB-UHFFFAOYSA-N"
"COc(c1)c(SC)nc(c2)c(ccc(Br)2)1","InChI=1S/C11H10BrNOS/c1-14-10-5-7-3-4-8(12)6-9(7)13-11(10)15-2/h3-6H,1-2H3","HWNKEJGGLOFWDE-UHFFFAOYSA-N"
"ON=Cc(c1)c([N+1]([O-1])=O)cc(Br)c1","InChI=1S/C7H5BrN2O3/c8-6-2-1-5(4-9-11)7(3-6)10(12)13/h1-4,11H/b9-4+","ZLTOIUHNPLXEBN-RUDMXATFSA-N"
"CC(C)=CCCC(C)=C([H])COC(=O)CC(C)C","InChI=1S/C15H26O2/c1-12(2)7-6-8-14(5)9-10-17-15(16)11-13(3)4/h7,9,13H,6,8,10-11H2,1-5H3/b14-9+","SOUKTGNMIRUIQN-NTEUORMPSA-N"
"CCCCCC(=O)OCC([H])=C(C)CCC=C(C)C","InChI=1S/C16H28O2/c1-5-6-7-11-16(17)18-13-12-15(4)10-8-9-14(2)3/h9,12H,5-8,10-11,13H2,1-4H3/b15-12+","ARVSCQUZFFSNKF-NTCAYCPXSA-N"
"CC(C)=CCCC(C)=C([H])COC(=O)c(c1)cccc1","InChI=1S/C17H22O2/c1-14(2)8-7-9-15(3)12-13-19-17(18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12+","YDVXYTIIPGKIJP-NTCAYCPXSA-N"
"CC(C)(C)c(c2)c(C(=O)1)c(cc2)C(C)(C)C1","InChI=1S/C15H20O/c1-14(2,3)10-7-6-8-11-13(10)12(16)9-15(11,4)5/h6-8H,9H2,1-5H3","GCHHIKFGXIVDIF-UHFFFAOYSA-N"
"CCCCCCCCC(OCC)OCC","InChI=1S/C13H28O2/c1-4-7-8-9-10-11-12-13(14-5-2)15-6-3/h13H,4-12H2,1-3H3","RJMSGTVQHHFVLK-UHFFFAOYSA-N"
"Oc(c2)c(ccc2)SCc(c1)cccc1","InChI=1S/C13H12OS/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-9,14H,10H2","OWZPCVGKLYOVLV-UHFFFAOYSA-N"
"COc(c21)c(C=3)c(OC(=O)C3)cc(occ2)1","InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3","BGEBZHIAGXMEMV-UHFFFAOYSA-N"
"COC(=O)CCC(C)(C)CCC(=O)OC","InChI=1S/C11H20O4/c1-11(2,7-5-9(12)14-3)8-6-10(13)15-4/h5-8H2,1-4H3","FGULTYTXAJHZMS-UHFFFAOYSA-N"
"CCCCOC(=O)C(C)OC(=O)CCC","InChI=1S/C11H20O4/c1-4-6-8-14-11(13)9(3)15-10(12)7-5-2/h9H,4-8H2,1-3H3","NORZZKKLCYMBBF-UHFFFAOYSA-N"
"O=C(O1)N(C)C(=O)C(C)(C)1","InChI=1S/C6H9NO3/c1-6(2)4(8)7(3)5(9)10-6/h1-3H3","IRYJRGCIQBGHIV-UHFFFAOYSA-N"
"CCC(C)(C1)C(=O)NC(=O)1","InChI=1S/C7H11NO2/c1-3-7(2)4-5(9)8-6(7)10/h3-4H2,1-2H3,(H,8,9,10)","HAPOVYFOVVWLRS-UHFFFAOYSA-N"
"CCC(C)(O1)C(=O)N(C)C(=O)1","InChI=1S/C7H11NO3/c1-4-7(2)5(9)8(3)6(10)11-7/h4H2,1-3H3","VQASKUSHBVDKGU-UHFFFAOYSA-N"
"O=C(C1)N(C)C(=O)C(C)1c(c2)cccc2","InChI=1S/C12H13NO2/c1-12(9-6-4-3-5-7-9)8-10(14)13(2)11(12)15/h3-7H,8H2,1-2H3","AJXPJJZHWIXJCJ-UHFFFAOYSA-N"
"CC(N)COc(c(C)1)c(C)ccc1","InChI=1S/C11H17NO/c1-8-5-4-6-9(2)11(8)13-7-10(3)12/h4-6,10H,7,12H2,1-3H3","VLPIATFUUWWMKC-UHFFFAOYSA-N"
"CC(N)COc(c(C)1)c(C)cc(C)c1","InChI=1S/C12H19NO/c1-8-5-9(2)12(10(3)6-8)14-7-11(4)13/h5-6,11H,7,13H2,1-4H3","QDZOEZPRNQIPHY-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C)(CC2)C(CCC(C)=C([H])C(O)=O)=C(C)C1","InChI=1S/C25H40O2/c1-18(2)9-7-14-24(5)15-8-16-25(6)21(20(4)11-13-22(24)25)12-10-19(3)17-23(26)27/h9,17,22H,7-8,10-16H2,1-6H3,(H,26,27)/b19-17-/t22-,24+,25+/m0/s1","VMXBEUNFNFIWLY-NHLIJQSASA-N"
"CC(CCC=C(C)C)(C([H])12)CCCC(C)1C(CCC(C)=CC(=O)OCC)=C(CC2)C","InChI=1S/C27H44O2/c1-8-29-25(28)19-21(4)12-14-23-22(5)13-15-24-26(6,16-9-11-20(2)3)17-10-18-27(23,24)7/h11,19,24H,8-10,12-18H2,1-7H3/b21-19+/t24-,26+,27+/m0/s1","OZGYOMIOZULOOP-IONFVZKMSA-N"
"","InChI=1S/C25H44O3/c1-18(2)8-7-12-23(5)13-11-19(3)22-21(23)10-9-20(4)25(22,26)15-14-24(6)27-16-17-28-24/h8,19-22,26H,7,9-17H2,1-6H3/t19-,20-,21+,22+,23-,25?/m1/s1","OHSDHPLKGVDPKJ-JHEMSPQDSA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C)(CC2)C(=O)CC1","InChI=1S/C18H30O/c1-14(2)8-6-11-17(3)12-7-13-18(4)15(17)9-5-10-16(18)19/h8,15H,5-7,9-13H2,1-4H3/t15-,17+,18-/m0/s1","XHDVQLNRSVLERR-JQHSSLGASA-N"
"CC(C)=CCCC(C)(C3)C([H])(C1)C(C)(CC3)C(=O)C(C(O2)OCC2)=C([H])1","InChI=1S/C21H32O3/c1-15(2)7-5-10-20(3)11-6-12-21(4)17(20)9-8-16(18(21)22)19-23-13-14-24-19/h7-8,17,19H,5-6,9-14H2,1-4H3/t17-,20+,21?/m0/s1","QKVWYHHJSLEUNS-DVUUQMMQSA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C)(CC2)C(=O)C(C=O)=C([H])1","InChI=1S/C19H28O2/c1-14(2)7-5-10-18(3)11-6-12-19(4)16(18)9-8-15(13-20)17(19)21/h7-8,13,16H,5-6,9-12H2,1-4H3/t16-,18+,19?/m0/s1","OJVMWXAYNQWVOS-CXEJCQMISA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C)(CC2)C(=O)C(C=O)C1","InChI=1S/C19H30O2/c1-14(2)7-5-10-18(3)11-6-12-19(4)16(18)9-8-15(13-20)17(19)21/h7,13,15-16H,5-6,8-12H2,1-4H3/t15?,16-,18+,19-/m0/s1","DBOUDQHWPFHKMO-ATQPIAHYSA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C)(CC2)C([H])(C=O)C(C=O)=C([H])1","InChI=1S/C20H30O2/c1-15(2)7-5-10-19(3)11-6-12-20(4)17(14-22)16(13-21)8-9-18(19)20/h7-8,13-14,17-18H,5-6,9-12H2,1-4H3/t17-,18-,19+,20+/m0/s1","CJRSLLMDIKKFIM-VNTMZGSJSA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C)(CC2)C([H])(C=O)C(C=O)=C([H])1","InChI=1S/C20H30O2/c1-15(2)7-5-10-19(3)11-6-12-20(4)17(14-22)16(13-21)8-9-18(19)20/h7-8,13-14,17-18H,5-6,9-12H2,1-4H3/t17-,18+,19-,20-/m1/s1","CJRSLLMDIKKFIM-IYWMVGAKSA-N"
"C=CCC(C)(C3)C([H])(C1)C(C)(CC3)C(O2)(OCC2)CC1","InChI=1S/C17H28O2/c1-4-8-15(2)9-6-10-16(3)14(15)7-5-11-17(16)18-12-13-19-17/h4,14H,1,5-13H2,2-3H3/t14-,15+,16-/m0/s1","UCBVADQAJVJIJU-XHSDSOJGSA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C)(CC2)C(=O)C(C(=O)OC)C1","InChI=1S/C20H32O3/c1-14(2)8-6-11-19(3)12-7-13-20(4)16(19)10-9-15(17(20)21)18(22)23-5/h8,15-16H,6-7,9-13H2,1-5H3/t15?,16-,19+,20-/m0/s1","JRJJWSRANBMWST-HKPCIYPDSA-N"
"CC(C)=CCCC(C)(C3)C([H])(C1)C(C)(CC3)C(O2)(OCC2)CC1","InChI=1S/C20H34O2/c1-16(2)8-5-10-18(3)11-7-12-19(4)17(18)9-6-13-20(19)21-14-15-22-20/h8,17H,5-7,9-15H2,1-4H3/t17-,18+,19-/m0/s1","NNNJBVICGSMWIP-OTWHNJEPSA-N"
"COC(=O)CCCC(=O)c(c1)cccc1","InChI=1S/C12H14O3/c1-15-12(14)9-5-8-11(13)10-6-3-2-4-7-10/h2-4,6-7H,5,8-9H2,1H3","GRIWFUFDJOESIC-UHFFFAOYSA-N"
"O=CC(=C(C)2)C(C)(CCC2)C(O1)OCC1","InChI=1S/C12H18O3/c1-9-4-3-5-12(2,10(9)8-13)11-14-6-7-15-11/h8,11H,3-7H2,1-2H3","SBAZHOZEPDPTMC-UHFFFAOYSA-N"
"COCOCC(C1)(C(=O)2)C([H])(CCC(C(=O)OC)2)C(C)(CCC=C(C)C)CC1","InChI=1S/C22H36O5/c1-16(2)8-6-11-21(3)12-7-13-22(14-27-15-25-4)18(21)10-9-17(19(22)23)20(24)26-5/h8,17-18H,6-7,9-15H2,1-5H3/t17?,18-,21+,22+/m0/s1","QKTVLWRPCBPYHA-JAIRSQACSA-N"
"COCOCC(C1)(C(=O)2)C([H])(CCC(C)(C(=O)OC)2)C(C)(CCC=C(C)C)CC1","InChI=1S/C23H38O5/c1-17(2)9-7-11-21(3)12-8-13-23(15-28-16-26-5)18(21)10-14-22(4,19(23)24)20(25)27-6/h9,18H,7-8,10-16H2,1-6H3/t18-,21+,22?,23+/m0/s1","SEHBVQAQRDVIAV-GHNMSDBSSA-N"
"COCOCC(C1)(C(=O)2)C([H])(CCC2)C(C)(CC=C)CC1","InChI=1S/C17H28O3/c1-4-9-16(2)10-6-11-17(12-20-13-19-3)14(16)7-5-8-15(17)18/h4,14H,1,5-13H2,2-3H3/t14-,16+,17+/m0/s1","DVXOTRKZFRKQIQ-USXIJHARSA-N"
"COCOCC(C1)(C(O3)(OCC3)2)C([H])(CCC2)C(C)(CCCO)CC1","InChI=1S/C19H34O5/c1-17(8-5-11-20)7-4-9-18(14-22-15-21-2)16(17)6-3-10-19(18)23-12-13-24-19/h16,20H,3-15H2,1-2H3/t16-,17-,18+/m0/s1","FPQZNWVXFIBKMY-OKZBNKHCSA-N"
"COCOCC(C1)(C(O3)(OCC3)2)C([H])(CCC2)C(C)(CCC=O)CC1","InChI=1S/C19H32O5/c1-17(8-5-11-20)7-4-9-18(14-22-15-21-2)16(17)6-3-10-19(18)23-12-13-24-19/h11,16H,3-10,12-15H2,1-2H3/t16-,17-,18+/m0/s1","PHAHWBNBFFHHAV-OKZBNKHCSA-N"
"COCOCC(C1)(C(O3)(OCC3)2)C([H])(CCC2)C(C)(CCC=C(C)C)CC1","InChI=1S/C22H38O4/c1-18(2)8-5-10-20(3)11-7-12-21(16-24-17-23-4)19(20)9-6-13-22(21)25-14-15-26-22/h8,19H,5-7,9-17H2,1-4H3/t19-,20+,21+/m0/s1","TXPPLIRRCBCMHO-PWRODBHTSA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C=O)(CC2)C(=O)CC1","InChI=1S/C18H28O2/c1-14(2)7-5-10-17(3)11-6-12-18(13-19)15(17)8-4-9-16(18)20/h7,13,15H,4-6,8-12H2,1-3H3/t15-,17+,18+/m0/s1","CWBJWMNSYTUYMG-CGTJXYLNSA-N"
"COCOCC(C1)(C(=O)2)C([H])(CCC(C)2)C(C)(CCC=C(C)C)CC1","InChI=1S/C21H36O3/c1-16(2)8-6-11-20(4)12-7-13-21(14-24-15-23-5)18(20)10-9-17(3)19(21)22/h8,17-18H,6-7,9-15H2,1-5H3/t17?,18-,20+,21+/m0/s1","AHDSEBVMDMJCBB-LSMWDBJESA-N"
"CC(C)=CCCC(C)(C2)C([H])(C1)C(C=O)(CC2)C(=O)C(C)C1","InChI=1S/C19H30O2/c1-14(2)7-5-10-18(4)11-6-12-19(13-20)16(18)9-8-15(3)17(19)21/h7,13,15-16H,5-6,8-12H2,1-4H3/t15?,16-,18+,19+/m0/s1","QPBPFGSCXQOAFN-KHBMUKGWSA-N"
"C=CC(=O)CCC(C(=O)1)C(C)(C)CC(C)=C1","InChI=1S/C14H20O2/c1-5-11(15)6-7-12-13(16)8-10(2)9-14(12,3)4/h5,8,12H,1,6-7,9H2,2-4H3","HYRPKMBIQXSAKW-UHFFFAOYSA-N"
"O=C(C2)CCC(C2)(O1)OCC(C)(C)C1","InChI=1S/C11H18O3/c1-10(2)7-13-11(14-8-10)5-3-9(12)4-6-11/h3-8H2,1-2H3","COKVDTKAWIFNTH-UHFFFAOYSA-N"
"COC(=O)C([H])(C1)C([H])(C2)C([H])(CCC2)C(=O)C1","InChI=1S/C12H18O3/c1-15-12(14)10-6-7-11(13)9-5-3-2-4-8(9)10/h8-10H,2-7H2,1H3/t8-,9+,10+/m1/s1","JPFUEZPXKCRLTQ-UTLUCORTSA-N"
"O=C(C3)C(C1)C(C2)C(C3)C(=O)C(CC2)1","InChI=1S/C12H16O2/c13-11-5-4-9-8-3-1-2-7(12(9)14)6-10(8)11/h7-10H,1-6H2","XIIQXOFOUYTYTF-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCOC","InChI=1S/C17H36O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-2/h3-17H2,1-2H3","YOTHBMSACCHRLC-UHFFFAOYSA-N"
"CCCCCCCCC=CCCCCCCCCOC","InChI=1S/C19H38O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-2/h10-11H,3-9,12-19H2,1-2H3/b11-10+","IDBPDXGUJPANFU-ZHACJKMWSA-N"
"CCCCCCCCCCCCCCCCCCOC","InChI=1S/C19H40O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-2/h3-19H2,1-2H3","RVJIJWSQYZTQBW-UHFFFAOYSA-N"
"Clc(c2)cc(cc2)NCc(c1)cccc1","InChI=1S/C13H12ClN/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-9,15H,10H2","NQIJQQDDQDHYJK-UHFFFAOYSA-N"
"CCN(C(C)1)c(c2)c(ccc2)C1","InChI=1S/C11H15N/c1-3-12-9(2)8-10-6-4-5-7-11(10)12/h4-7,9H,3,8H2,1-2H3","IUPDNKDLTMMZSD-UHFFFAOYSA-N"
"CC(Nc(c2)cccc2)c(c1)cccc1","InChI=1S/C14H15N/c1-12(13-8-4-2-5-9-13)15-14-10-6-3-7-11-14/h2-12,15H,1H3","IUERBKSXAYWVGE-UHFFFAOYSA-N"
"CN(C2)CC([H])(C3)C(=C([H])1)N(CC([H])23)C(=O)C([H])=C([H])1","InChI=1S/C12H16N2O/c1-13-6-9-5-10(8-13)11-3-2-4-12(15)14(11)7-9/h2-4,9-10H,5-8H2,1H3","CULUKMPMGVXCEI-UHFFFAOYSA-N"
"COc(c1)c(C(O)=O)c(C)cc1","InChI=1S/C9H10O3/c1-6-4-3-5-7(12-2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)","MICCJGFEXKNBLU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCc(c1)c(C(O)=O)c(O)cc1","InChI=1S/C21H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-16-14-17-19(22)20(18)21(23)24/h14,16-17,22H,2-13,15H2,1H3,(H,23,24)","DNTSXRMSSGNLFL-UHFFFAOYSA-N"
"OC(=O)c(c(C)1)c(O)ccc1","InChI=1S/C8H8O3/c1-5-3-2-4-6(9)7(5)8(10)11/h2-4,9H,1H3,(H,10,11)","HCJMNOSIAGSZBM-UHFFFAOYSA-N"
"S=C(NNc(c2)cccc2)c(c1)cccc1","InChI=1S/C13H12N2S/c16-13(11-7-3-1-4-8-11)15-14-12-9-5-2-6-10-12/h1-10,14H,(H,15,16)","AWAWNMNDLBQMDV-UHFFFAOYSA-N"
"CCCCCC=CCC=CCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C24H37NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h6-7,9-10,17-18,20-21H,2-5,8,11-16,19,22H2,1H3/b7-6-,10-9-","CBIJRFCIJWDVAB-HZJYTTRNSA-N"
"CCCCCC=CCC=CCC=CCC=CCCCC(=O)N(C1)CCC1","InChI=1S/C24H39NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(26)25-22-19-20-23-25/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-23H2,1H3/b7-6+,10-9+,13-12+,16-15+","JCCULSFRZNYFOY-CGRWFSSPSA-N"
"CCC=CCC=CCC=CCCCCCCCC(=O)N(C1)CCC1","InChI=1S/C22H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22(24)23-20-17-18-21-23/h3-4,6-7,9-10H,2,5,8,11-21H2,1H3/b4-3+,7-6+,10-9+","HCNBGIBBJGULOU-IUQGRGSQSA-N"
"CCCCCCCCC=CCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C24H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h9-10,17-18,20-21H,2-8,11-16,19,22H2,1H3/b10-9-","FBPJZADLPOSZEO-KTKRTIGZSA-N"
"CCC=CCC=CCC=CCCCCCCCC(=O)OCc(c1)cncc1","InChI=1S/C24H35NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24(26)27-22-23-18-17-20-25-21-23/h3-4,6-7,9-10,17-18,20-21H,2,5,8,11-16,19,22H2,1H3/b4-3-,7-6-,10-9-","VMDODSILOLPSBY-PDBXOOCHSA-N"
"CCCCCCCCCCCCCCc(c1)c(C(O)=O)c(OC)cc1","InChI=1S/C22H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(25-2)21(19)22(23)24/h15,17-18H,3-14,16H2,1-2H3,(H,23,24)","DISDVNGQYZSKAL-UHFFFAOYSA-N"
"COCC(C(=O)1)=C(NCc(c2)cccc2)CO1","InChI=1S/C13H15NO3/c1-16-8-11-12(9-17-13(11)15)14-7-10-5-3-2-4-6-10/h2-6,14H,7-9H2,1H3","ZGIPNWNTIQGITH-UHFFFAOYSA-N"
"OCCCCCCCCCCCC(C)C","InChI=1S/C14H30O/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15/h14-15H,3-13H2,1-2H3","ZXUOFCUEFQCKKH-UHFFFAOYSA-N"
"OCCCCCCCCCCCCCC(C)C","InChI=1S/C16H34O/c1-16(2)14-12-10-8-6-4-3-5-7-9-11-13-15-17/h16-17H,3-15H2,1-2H3","CFSSWEQYBLCBLH-UHFFFAOYSA-N"
"OCCCCCCCCCCCC(C)CC","InChI=1S/C15H32O/c1-3-15(2)13-11-9-7-5-4-6-8-10-12-14-16/h15-16H,3-14H2,1-2H3","YZDVUBNICGIJPD-UHFFFAOYSA-N"
"COCCCCCCCCCCCC(C)CC","InChI=1S/C16H34O/c1-4-16(2)14-12-10-8-6-5-7-9-11-13-15-17-3/h16H,4-15H2,1-3H3","XNPXXFSEKFPQRW-UHFFFAOYSA-N"
"COCCCCCCCCCCCC(C)C","InChI=1S/C15H32O/c1-15(2)13-11-9-7-5-4-6-8-10-12-14-16-3/h15H,4-14H2,1-3H3","ZFOYRSUKDLQYSB-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCOC","InChI=1S/C15H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-2/h3-15H2,1-2H3","WBALMRMHNRFSSF-UHFFFAOYSA-N"
"CCCCCCCCCCCCCOC","InChI=1S/C14H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-2/h3-14H2,1-2H3","RTWPRSVAQZJISO-UHFFFAOYSA-N"
"OCCCCCCCCCC(C)CC","InChI=1S/C13H28O/c1-3-13(2)11-9-7-5-4-6-8-10-12-14/h13-14H,3-12H2,1-2H3","PVVKVEDVVCORDX-UHFFFAOYSA-N"
"COCCCCCCCCCCCCCC(C)C","InChI=1S/C17H36O/c1-17(2)15-13-11-9-7-5-4-6-8-10-12-14-16-18-3/h17H,4-16H2,1-3H3","LSPYOLLUBFKFEP-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCOC","InChI=1S/C16H34O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-2/h3-16H2,1-2H3","QTAFOTOCTOIEKW-UHFFFAOYSA-N"
"O=C(C=4)N(C1)C(=CC4)C(C2)CC1C(C3)N(CCC3)2","InChI=1S/C15H20N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h3,5-6,11-13H,1-2,4,7-10H2","FQEQMASDZFXSJI-UHFFFAOYSA-N"
"O=Cc(c1)c(OCc(c3)cccc3)cc(OCc(c2)cccc2)c1","InChI=1S/C21H18O3/c22-14-19-11-12-20(23-15-17-7-3-1-4-8-17)13-21(19)24-16-18-9-5-2-6-10-18/h1-14H,15-16H2","DMYYTMVFUMDOGC-UHFFFAOYSA-N"
"O=Cc(c1)c(OCc(c2)cccc2)c(OC)cc1","InChI=1S/C15H14O3/c1-17-14-9-5-8-13(10-16)15(14)18-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3","KXBGOVZWCRLLOR-UHFFFAOYSA-N"
"CCOc(c1)c(OCc(c2)cccc2)c(C=O)cc1","InChI=1S/C16H16O3/c1-2-18-15-10-6-9-14(11-17)16(15)19-12-13-7-4-3-5-8-13/h3-11H,2,12H2,1H3","QPOIBFQNRYMSCP-UHFFFAOYSA-N"
"O=C(O1)C(C)=C(NCc(c2)cccc2)C1","InChI=1S/C12H13NO2/c1-9-11(8-15-12(9)14)13-7-10-5-3-2-4-6-10/h2-6,13H,7-8H2,1H3","ZZOBBYGZFYBUQE-UHFFFAOYSA-N"
"O=C(O2)C(C)=C(C2)N(C)c(c1)cccc1","InChI=1S/C12H13NO2/c1-9-11(8-15-12(9)14)13(2)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3","KSQNRBUGSVRPHY-UHFFFAOYSA-N"
"COCC(C(=O)1)=C(CO1)N(C)C","InChI=1S/C8H13NO3/c1-9(2)7-5-12-8(10)6(7)4-11-3/h4-5H2,1-3H3","RGWNVTBGNOHVBO-UHFFFAOYSA-N"
"N#CCC(C(=O)1)=C(NC)CO1","InChI=1S/C7H8N2O2/c1-9-6-4-11-7(10)5(6)2-3-8/h9H,2,4H2,1H3","OVJFESRPJIBLLE-UHFFFAOYSA-N"
"CNC(C1)=C(CN(C)C)C(=O)O1","InChI=1S/C8H14N2O2/c1-9-7-5-12-8(11)6(7)4-10(2)3/h9H,4-5H2,1-3H3","GILQMCKXNBCQAD-UHFFFAOYSA-N"
"N#CCC(C(=O)1)=C(NCc(c2)cccc2)CO1","InChI=1S/C13H12N2O2/c14-7-6-11-12(9-17-13(11)16)15-8-10-4-2-1-3-5-10/h1-5,15H,6,8-9H2","BZIOKUMHDIBMJI-UHFFFAOYSA-N"
"OCCCCCCC([H])=C([H])CCC([H])=C([H])CCCC","InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-6,9-10,17H,2-4,7-8,11-16H2,1H3/b6-5+,10-9-","ZWMPSFHVSWYKPO-QMRMAQATSA-N"
"C(CCCCCCCCCCCCC(=O)OCCCCCCCCCCCC)CCCC","InChI=1S/C30H60O2/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30(31)32-29-27-25-23-21-14-12-10-8-6-4-2/h3-29H2,1-2H3","JRTVEUGOGWTHTR-UHFFFAOYSA-N"
"CCCCCCCCCCCCOC(=O)CCCCCCCCCCC","InChI=1S/C24H48O2/c1-3-5-7-9-11-13-15-17-19-21-23-26-24(25)22-20-18-16-14-12-10-8-6-4-2/h3-23H2,1-2H3","CYUUZGXOQDCCGH-UHFFFAOYSA-N"
"O=CCCCCCCCCCC([H])=C([H])CCCC","InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h5-6,16H,2-4,7-15H2,1H3/b6-5-","AMTITFMUKRZZEE-WAYWQWQTSA-N"
"OCCCCCCCCCCCCCCCCF","InChI=1S/C16H33FO/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h18H,1-16H2","JQVPLGFCCJDSLS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C22H46/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3-22H2,1-2H3","HOWGUJZVBDQJKV-UHFFFAOYSA-N"
"CCCCCCC([H])=C([H])CCCCCCCC=O","InChI=1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h7-8,16H,2-6,9-15H2,1H3/b8-7-","QFPVVMKZTVQDTL-FPLPWBNLSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C26H54/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-26H2,1-2H3","HMSWAIKSFDFLKN-UHFFFAOYSA-N"
"C(CCCCCCCCCCCCCCCCC([H])=C([H])CC([H])=C([H])CCCCC)CCCC","InChI=1S/C31H60/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-31H2,1-2H3/b13-11-,19-17-","RNAQFDIFLHTKJB-OHNCOSGTSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C29H60/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-29H2,1-2H3","IGGUPRCHHJZPBS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C25H52/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h3-25H2,1-2H3","YKNWIILGEFFOPE-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC([H])=C([H])CCCCCCCC","InChI=1S/C27H54/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-26-24-22-20-18-16-14-12-10-8-6-4-2/h17,19H,3-16,18,20-27H2,1-2H3/b19-17-","WWHBGRQNRIORRZ-ZPHPHTNESA-N"
"CCCCCCCCCCCCCC([H])=C([H])CC([H])=C([H])CCCCC","InChI=1S/C23H44/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-23H2,1-2H3/b13-11-,19-17-","QVTSRBNFHQATMF-OHNCOSGTSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C23H48/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h3-23H2,1-2H3","FIGVVZUWCLSUEI-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC([H])=C([H])CC([H])=C([H])CCCCC","InChI=1S/C25H48/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-25H2,1-2H3/b13-11-,19-17-","HEDSUJXTHUJEDT-OHNCOSGTSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCCCC","InChI=1S/C27H56/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-27H2,1-2H3","BJQWYEJQWHSSCJ-UHFFFAOYSA-N"
"CC(=O)OC([H])(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C([H])(O)2)C([H])(CC([H])=C([H])2)C1","InChI=1S/C21H32O3/c1-13(22)24-19-10-9-16-15-8-7-14-5-4-6-18(23)21(14,3)17(15)11-12-20(16,19)2/h4,6,14-19,23H,5,7-12H2,1-3H3/t14-,15+,16+,17+,18+,19+,20+,21+/m1/s1","DKRVGISYZLHNHZ-NDUYDNQLSA-N"
"CC(=O)OC(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C(O)2)C([H])(CC=C2)C1","InChI=1S/C21H32O3/c1-13(22)24-19-10-9-16-15-8-7-14-5-4-6-18(23)21(14,3)17(15)11-12-20(16,19)2/h4,6,14-19,23H,5,7-12H2,1-3H3/t14-,15+,16+,17+,18-,19+,20+,21+/m1/s1","DKRVGISYZLHNHZ-WKBNOSBISA-N"
"CC(=O)OC([H])(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C([H])(O)2)C([H])(CCC2)C1","InChI=1S/C21H34O3/c1-13(22)24-19-10-9-16-15-8-7-14-5-4-6-18(23)21(14,3)17(15)11-12-20(16,19)2/h14-19,23H,4-12H2,1-3H3/t14-,15+,16+,17+,18+,19+,20+,21+/m1/s1","GJKFQYIGKDMSEN-NDUYDNQLSA-N"
"CC(=O)OC(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C(O)2)C([H])(CCC2)C1","InChI=1S/C21H34O3/c1-13(22)24-19-10-9-16-15-8-7-14-5-4-6-18(23)21(14,3)17(15)11-12-20(16,19)2/h14-19,23H,4-12H2,1-3H3/t14-,15+,16+,17+,18-,19+,20+,21+/m1/s1","GJKFQYIGKDMSEN-WKBNOSBISA-N"
"[H]C(C4)=C([H])C([H])(O)C(C)(C([H])43)C([H])(C2)C([H])(CC3)C([H])(C1)C(C)(C2)C([H])(O)C1","InChI=1S/C19H30O2/c1-18-11-10-15-13(14(18)8-9-16(18)20)7-6-12-4-3-5-17(21)19(12,15)2/h3,5,12-17,20-21H,4,6-11H2,1-2H3/t12-,13+,14+,15+,16+,17+,18+,19+/m1/s1","RUUMDVOLWARSAZ-VXZRPZIYSA-N"
"OC(=O)c(c1)cc(O2)c(OC2)c1","InChI=1S/C8H6O4/c9-8(10)5-1-2-6-7(3-5)12-4-11-6/h1-3H,4H2,(H,9,10)","VDVJGIYXDVPQLP-UHFFFAOYSA-N"
"NC(=S)c(c(Cl)1)c(Cl)ccc1","InChI=1S/C7H5Cl2NS/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)","KGKGSIUWJCAFPX-UHFFFAOYSA-N"
"O=Nc(c(C)1)c(C)c(C)cc(C)1","InChI=1S/C10H13NO/c1-6-5-7(2)9(4)10(11-12)8(6)3/h5H,1-4H3","UDOPFAXNNPAWQS-UHFFFAOYSA-N"
"OC(=O)C(C)(C)c(c1)cccc1","InChI=1S/C10H12O2/c1-10(2,9(11)12)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)","YYEROYLAYAVZNW-UHFFFAOYSA-N"
"c(c1)ccc(C3=O)c(C(C(C32C)(CC([H])=C(CCCC(C)CCCC(C)CCCC(C)C)C)O2)=O)1","InChI=1S/C31H46O3/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-31-29(33)27-19-8-7-18-26(27)28(32)30(31,6)34-31/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+","KUTXFBIHPWIDJQ-LKUDQCMESA-N"
"OCc(c1)oc(C=O)c1","InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2","NOEGNKMFWQHSLB-UHFFFAOYSA-N"
"","InChI=1S/C31H52O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h11,20-21,23,25-29H,8-10,12-19H2,1-7H3/t21-,23+,25+,26+,27-,28+,29+,30+,31-/m1/s1","PBWOIPCULUXTNY-UMKHIFOFSA-N"
"CC(=CCCC(=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCc(c1C)c(=O)c(c2)c(ccc2)c(=O)1)C)CCC=C(C)CCC=C(C)C","InChI=1S/C56H80O2/c1-42(2)22-14-23-43(3)24-15-25-44(4)26-16-27-45(5)28-17-29-46(6)30-18-31-47(7)32-19-33-48(8)34-20-35-49(9)36-21-37-50(10)40-41-52-51(11)55(57)53-38-12-13-39-54(53)56(52)58/h12-13,22,24,26,28,30,32,34,36,38-40H,14-21,23,25,27,29,31,33,35,37,41H2,1-11H3/b43-24+,44-26+,45-28+,46-30+,47-32+,48-34+,49-36+,50-40+","WCRXHNIUHQUASO-UVZVDVBNSA-N"
"C(CCC(C)=CCc(c2=O)c(c(=O)c(c21)cccc1)C)=C(C)CCC=C(CCC=C(CCC=C(C)CCC=C(C)C)C)C","InChI=1S/C41H56O2/c1-30(2)16-11-17-31(3)18-12-19-32(4)20-13-21-33(5)22-14-23-34(6)24-15-25-35(7)28-29-37-36(8)40(42)38-26-9-10-27-39(38)41(37)43/h9-10,16,18,20,22,24,26-28H,11-15,17,19,21,23,25,29H2,1-8H3/b31-18+,32-20+,33-22+,34-24+,35-28+","PFRQBZFETXBLTP-RCIYGOBDSA-N"
"C(C=C(CCC=C(CCC=C(CCC=C(CCC=C(CCC=C(C)C)C)C)C)C)C)CC(C)=CCc(c(=O)1)c(C)c(=O)c(c2)c1ccc2","InChI=1S/C46H64O2/c1-34(2)18-12-19-35(3)20-13-21-36(4)22-14-23-37(5)24-15-25-38(6)26-16-27-39(7)28-17-29-40(8)32-33-42-41(9)45(47)43-30-10-11-31-44(43)46(42)48/h10-11,18,20,22,24,26,28,30-32H,12-17,19,21,23,25,27,29,33H2,1-9H3/b35-20+,36-22+,37-24+,38-26+,39-28+,40-32+","RAKQPZMEYJZGPI-LJWNYQGCSA-N"
"COCOC(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C2)C(=CC(=O)C2)C1","InChI=1S/C21H32O3/c1-20-10-8-15(22)12-14(20)4-5-16-17-6-7-19(24-13-23-3)21(17,2)11-9-18(16)20/h12,16-19H,4-11,13H2,1-3H3/t16-,17-,18-,19-,20-,21-/m0/s1","DQEDBYWBOBVTFT-PXQJOHHUSA-N"
"CCC(=O)OC(=O)CC","InChI=1S/C6H10O3/c1-3-5(7)9-6(8)4-2/h3-4H2,1-2H3","WYVAMUWZEOHJOQ-UHFFFAOYSA-N"
"N#CCc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C8H6N2O2/c9-6-5-7-1-3-8(4-2-7)10(11)12/h1-4H,5H2","PXNJGLAVKOXITN-UHFFFAOYSA-N"
"CC(C)(Cl)Cl","InChI=1S/C3H6Cl2/c1-3(2,4)5/h1-2H3","ZEOVXNVKXIPWMS-UHFFFAOYSA-N"
"c(c3)cc(C1)c(c3)Sc(c2)c(ccc2)1","InChI=1S/C13H10S/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8H,9H2","PQJUJGAVDBINPI-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(ccc1)S(O)(=O)=O","InChI=1S/C6H5NO5S/c8-7(9)5-3-1-2-4-6(5)13(10,11)12/h1-4H,(H,10,11,12)","HWTDMFJYBAURQR-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(c(C)1)S(O)(=O)=O","InChI=1S/C9H12O3S/c1-6-4-7(2)9(8(3)5-6)13(10,11)12/h4-5H,1-3H3,(H,10,11,12)","LXFQSRIDYRFTJW-UHFFFAOYSA-N"
"Cc(c1)c(=O)c(c2)c(ccc2)c(=O)1","InChI=1S/C11H8O2/c1-7-6-10(12)8-4-2-3-5-9(8)11(7)13/h2-6H,1H3","MJVAVZPDRWSRRC-UHFFFAOYSA-N"
"CC(C4([H])C([H])(C)CCC(=CC)C(C)C)(C([H])3CC4)CCC(C([H])23)([H])C(C)(C1=CC2)CCC(C1)O","InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h7,10,19-20,23-27,30H,8-9,11-18H2,1-6H3/b21-7+/t20-,23+,24+,25-,26+,27+,28+,29-/m1/s1","OSELKOCHBMDKEJ-JUGJNGJRSA-N"
"ON=Cc(c1)ccc(C#N)c1","InChI=1S/C8H6N2O/c9-5-7-1-3-8(4-2-7)6-10-11/h1-4,6,11H/b10-6+","XUPNOABKAQYYOD-UXBLZVDNSA-N"
"COC(=O)C(=C2)C([H])(C1)C([H])(C(O)O2)C(CO)=C1","InChI=1S/C11H14O5/c1-15-10(13)8-5-16-11(14)9-6(4-12)2-3-7(8)9/h2,5,7,9,11-12,14H,3-4H2,1H3/t7-,9-,11-/m1/s1","AZKVWQKMDGGDSV-BCMRRPTOSA-N"
"CC(C1)OCC1","InChI=1S/C5H10O/c1-5-3-2-4-6-5/h5H,2-4H2,1H3","JWUJQDFVADABEY-UHFFFAOYSA-N"
"c(c3)cc(C1)c(c3)c(c2)c(ccc2)C1","InChI=1S/C14H12/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)13/h1-8H,9-10H2","XXPBFNVKTVJZKF-UHFFFAOYSA-N"
"OCC(O)CO","InChI=1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2","PEDCQBHIVMGVHV-UHFFFAOYSA-N"
"CCOP(=S)(Cl)OCC","InChI=1S/C4H10ClO2PS/c1-3-6-8(5,9)7-4-2/h3-4H2,1-2H3","KMJJJTCKNZYTEY-UHFFFAOYSA-N"
"CN=C=S","InChI=1S/C2H3NS/c1-3-2-4/h1H3","LGDSHSYDSCRFAB-UHFFFAOYSA-N"
"COc(c1)c(O)ccc(C(O)=O)1","InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)","WKOLLVMJNQIZCI-UHFFFAOYSA-N"
"CC(=C)C(C)=O","InChI=1S/C5H8O/c1-4(2)5(3)6/h1H2,2-3H3","ZGHFDIIVVIFNPS-UHFFFAOYSA-N"
"O=CC=C(C)C","InChI=1S/C5H8O/c1-5(2)3-4-6/h3-4H,1-2H3","SEPQTYODOKLVSB-UHFFFAOYSA-N"
"CCC=CCO","InChI=1S/C5H10O/c1-2-3-4-5-6/h3-4,6H,2,5H2,1H3/b4-3+","BTSIZIIPFNVMHF-ONEGZZNKSA-N"
"CCCC([H])=C([H])C=O","InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+","MBDOYVRWFFCFHM-SNAWJCMRSA-N"
"CCC([H])=C([H])CCO","InChI=1S/C6H12O/c1-2-3-4-5-6-7/h3-4,7H,2,5-6H2,1H3/b4-3-","UFLHIIWVXFIJGU-ARJAWSKDSA-N"
"CCCCCC(O)C=C","InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h4,8-9H,2-3,5-7H2,1H3","VSMOENVRRABVKN-UHFFFAOYSA-N"
"CCC=CC=CC=O","InChI=1S/C7H10O/c1-2-3-4-5-6-7-8/h3-7H,2H2,1H3/b4-3+,6-5+","SATICYYAWWYRAM-VNKDHWASSA-N"
"CCCCCC=CC=O","InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h6-8H,2-5H2,1H3/b7-6+","LVBXEMGDVWVTGY-VOTSOKGWSA-N"
"CCCCCC=CCO","InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h6-7,9H,2-5,8H2,1H3/b7-6+","AYQPVPFZWIQERS-VOTSOKGWSA-N"
"CCC([H])=C([H])CCC([H])=C([H])C=O","InChI=1S/C9H14O/c1-2-3-4-5-6-7-8-9-10/h3-4,7-9H,2,5-6H2,1H3/b4-3+,8-7-","HZYHMHHBBBSGHB-UTUPVWNLSA-N"
"CCCCCCC=CC=O","InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h7-9H,2-6H2,1H3/b8-7+","BSAIUMLZVGUGKX-BQYQJAHWSA-N"
"CCC=CCC=CCCO","InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h3-4,6-7,10H,2,5,8-9H2,1H3/b4-3+,7-6+","PICGPEBVZGCYBV-FZWLCVONSA-N"
"CCC([H])=C([H])CCC([H])=C([H])CO","InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h3-4,7-8,10H,2,5-6,9H2,1H3/b4-3+,8-7-","AMXYRHBJZOVHOL-UTUPVWNLSA-N"
"O=CC(=C(C)1)C(C)(C)CCC1","InChI=1S/C10H16O/c1-8-5-4-6-10(2,3)9(8)7-11/h7H,4-6H2,1-3H3","MOQGCGNUWBPGTQ-UHFFFAOYSA-N"
"CCCCCCCCC(O)=O","InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)","FBUKVWPVBMHYJY-UHFFFAOYSA-N"
"O=CCC(=C(C)1)C(C)(C)CCC1","InChI=1S/C11H18O/c1-9-5-4-7-11(2,3)10(9)6-8-12/h8H,4-7H2,1-3H3","VHTFHZGAMYUZEP-UHFFFAOYSA-N"
"CCCCCC=CC=CC=O","InChI=1S/C10H16O/c1-2-3-4-5-6-7-8-9-10-11/h6-10H,2-5H2,1H3/b7-6+,9-8+","JZQKTMZYLHNFPL-BLHCBFLLSA-N"
"CCCCCCCCCCCCC=O","InChI=1S/C13H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h13H,2-12H2,1H3","BGEHHAVMRVXCGR-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC=O","InChI=1S/C14H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h14H,2-13H2,1H3","UHUFTBALEZWWIH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC=O","InChI=1S/C15H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h15H,2-14H2,1H3","XGQJZNCFDLXSIJ-UHFFFAOYSA-N"
"N#CC#N","InChI=1S/C2N2/c3-1-2-4","JMANVNJQNLATNU-UHFFFAOYSA-N"
"NCCC#N","InChI=1S/C3H6N2/c4-2-1-3-5/h1-2,4H2","AGSPXMVUFBBBMO-UHFFFAOYSA-N"
"O=C(C1)NCCCCCCCCCC1","InChI=1S/C12H23NO/c14-12-10-8-6-4-2-1-3-5-7-9-11-13-12/h1-11H2,(H,13,14)","JHWNWJKBPDFINM-UHFFFAOYSA-N"
"O=Cc(c2)ccc(c2)OCc(c1)cccc1","InChI=1S/C14H12O2/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-10H,11H2","ZVTWZSXLLMNMQC-UHFFFAOYSA-N"
"O=C(C1)OCCCCCCOC(=O)CCCCCCCCC1","InChI=1S/C18H32O4/c19-17-13-9-5-3-1-2-4-6-10-14-18(20)22-16-12-8-7-11-15-21-17/h1-16H2","VPNRJIKJACGVJW-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(C(=O)OC)cc(C(=O)OC)1","InChI=1S/C12H12O6/c1-16-10(13)7-4-8(11(14)17-2)6-9(5-7)12(15)18-3/h4-6H,1-3H3","RGCHNYAILFZUPL-UHFFFAOYSA-N"
"CSC1=NNN=N1","InChI=1S/C2H4N4S/c1-7-2-3-5-6-4-2/h1H3,(H,3,4,5,6)","ZBXNFTFKKOSPLD-UHFFFAOYSA-N"
"O=C(C=1)NC(=O)NC1","InChI=1S/C4H4N2O2/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)","ISAKRJDGNUQOIC-UHFFFAOYSA-N"
"O=C(C=1)N(C)C(=O)NC1","InChI=1S/C5H6N2O2/c1-7-4(8)2-3-6-5(7)9/h2-3H,1H3,(H,6,9)","VPLZGVOSFFCKFC-UHFFFAOYSA-N"
"C1(=S)NNN=N1","InChI=1S/CH2N4S/c6-1-2-4-5-3-1/h(H2,2,3,4,5,6)","JAAIPIWKKXCNOC-UHFFFAOYSA-N"
"C=COC(=O)CCCCCCCCCCCC(O)=O","InChI=1S/C15H26O4/c1-2-19-15(18)13-11-9-7-5-3-4-6-8-10-12-14(16)17/h2H,1,3-13H2,(H,16,17)","SXFXZRUEZJONJH-UHFFFAOYSA-N"
"O=CC(C)Cc(c1)ccc(c1)C(C)(C)C","InChI=1S/C14H20O/c1-11(10-15)9-12-5-7-13(8-6-12)14(2,3)4/h5-8,10-11H,9H2,1-4H3","SDQFDHOLCGWZPU-UHFFFAOYSA-N"
"O=C(C1)OCCCCCCCCCCCCCC1","InChI=1S/C16H30O2/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-18-16/h1-15H2","LOKPJYNMYCVCRM-UHFFFAOYSA-N"
"CCCCCCCCCC#N","InChI=1S/C10H19N/c1-2-3-4-5-6-7-8-9-10-11/h2-9H2,1H3","HBZDPWBWBJMYRY-UHFFFAOYSA-N"
"CCCCCCCCCCCC#N","InChI=1S/C12H23N/c1-2-3-4-5-6-7-8-9-10-11-12-13/h2-11H2,1H3","VXCUURYYWGCLIH-UHFFFAOYSA-N"
"COC(=O)C(O1)C(OC(=O)CCC(=O)1)C(=O)OC","InChI=1S/C10H12O8/c1-15-9(13)7-8(10(14)16-2)18-6(12)4-3-5(11)17-7/h7-8H,3-4H2,1-2H3","QAMRXMRHRZVZGF-UHFFFAOYSA-N"
"CCOC(=O)C(O1)C(OC(=O)CCC(=O)1)C(=O)OCC","InChI=1S/C12H16O8/c1-3-17-11(15)9-10(12(16)18-4-2)20-8(14)6-5-7(13)19-9/h9-10H,3-6H2,1-2H3","PIHBRGVADPXIIF-UHFFFAOYSA-N"
"C(CCCCCCCCCCC(NCCNC(CCCCCCCCCCCCCCCCC)=O)=O)CCCCCC","InChI=1S/C38H76N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37(41)39-35-36-40-38(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3,(H,39,41)(H,40,42)","RKISUIUJZGSLEV-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(N)=O","InChI=1S/C18H37NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H2,19,20)","LYRFLYHAGKPMFH-UHFFFAOYSA-N"
"C(CNC(CCCCC(=O)NCCCCCCCCCCCCCCCCCC)=O)CCCCCCCCCCCCCCCC","InChI=1S/C42H84N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-39-43-41(45)37-33-34-38-42(46)44-40-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-40H2,1-2H3,(H,43,45)(H,44,46)","QIJSQGXDFAYEAF-UHFFFAOYSA-N"
"O=COCC(=C2)C(C1)C(C)(C)C(C2)1","InChI=1S/C11H16O2/c1-11(2)9-4-3-8(6-13-7-12)10(11)5-9/h3,7,9-10H,4-6H2,1-2H3","QHPJGDWWLWJMPM-UHFFFAOYSA-N"
"CCCC=CC(=O)OCc(c1)cccc1","InChI=1S/C13H16O2/c1-2-3-5-10-13(14)15-11-12-8-6-4-7-9-12/h4-10H,2-3,11H2,1H3/b10-5+","DLYYFHZPEQEPLG-BJMVGYQFSA-N"
"CCCC=CC(=O)OCCc(c1)cccc1","InChI=1S/C14H18O2/c1-2-3-5-10-14(15)16-12-11-13-8-6-4-7-9-13/h4-10H,2-3,11-12H2,1H3/b10-5+","CPLGJUPSPDLRLM-BJMVGYQFSA-N"
"CCCCCC(OC(=O)CC)C([H])=C([H])c(c1)cccc1","InChI=1S/C17H24O2/c1-3-5-7-12-16(19-17(18)4-2)14-13-15-10-8-6-9-11-15/h6,8-11,13-14,16H,3-5,7,12H2,1-2H3/b14-13+","RAADGNMQUXTRCK-BUHFOSPRSA-N"
"CC(C)=CC(O1)CC(C)=CC1","InChI=1S/C10H16O/c1-8(2)6-10-7-9(3)4-5-11-10/h4,6,10H,5,7H2,1-3H3","FRISMOQHTLZZRP-UHFFFAOYSA-N"
"CC(C)=CC([H])(O1)CC([H])(C)CC1","InChI=1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,9-10H,4-5,7H2,1-3H3/t9-,10-/m1/s1","CZCBTSFUTPZVKJ-NXEZZACHSA-N"
"CC(C)=CC([H])(O1)CC([H])(C)CC1","InChI=1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,9-10H,4-5,7H2,1-3H3/t9-,10+/m1/s1","CZCBTSFUTPZVKJ-ZJUUUORDSA-N"
"CC(C1)C(=O)C(=O)C1","InChI=1S/C6H8O2/c1-4-2-3-5(7)6(4)8/h4H,2-3H2,1H3","OACYKCIZDVVNJL-UHFFFAOYSA-N"
"CCC(C)=C([H])CCC(C)(C=C)OC(C)=O","InChI=1S/C13H22O2/c1-6-11(3)9-8-10-13(5,7-2)15-12(4)14/h7,9H,2,6,8,10H2,1,3-5H3/b11-9-","IVSZEHYDOLAREK-LUAWRHEFSA-N"
"CCC(C)=C([H])CCC(C)(C=C)OC(C)=O","InChI=1S/C13H22O2/c1-6-11(3)9-8-10-13(5,7-2)15-12(4)14/h7,9H,2,6,8,10H2,1,3-5H3/b11-9+","IVSZEHYDOLAREK-PKNBQFBNSA-N"
"CCC(C)C(=O)OCC=C(C)CCC=C(C)C","InChI=1S/C15H26O2/c1-6-14(5)15(16)17-11-10-13(4)9-7-8-12(2)3/h8,10,14H,6-7,9,11H2,1-5H3/b13-10+","PEQMAZJTEUEQJP-JLHYYAGUSA-N"
"CCC(C)C(=O)OC(C)(C=C)CCC=C(C)C","InChI=1S/C15H26O2/c1-7-13(5)14(16)17-15(6,8-2)11-9-10-12(3)4/h8,10,13H,2,7,9,11H2,1,3-6H3","MLJNGBGMEMFTPV-UHFFFAOYSA-N"
"CCC(=O)OCCc(c1)cccc1","InChI=1S/C11H14O2/c1-2-11(12)13-9-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3","HVGZQCSMLUDISR-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O)CC","InChI=1S/C10H20O/c1-5-10(4,11)8-6-7-9(2)3/h7,11H,5-6,8H2,1-4H3","JRTBBCBDKSRRCY-UHFFFAOYSA-N"
"CCC(C)=CCCC(C)(O)C=C","InChI=1S/C11H20O/c1-5-10(3)8-7-9-11(4,12)6-2/h6,8,12H,2,5,7,9H2,1,3-4H3/b10-8+","KRLBLPBPZSSIGH-CSKARUKUSA-N"
"CCOC(=O)CC(C)(O1)OCC1","InChI=1S/C8H14O4/c1-3-10-7(9)6-8(2)11-4-5-12-8/h3-6H2,1-2H3","XWEOGMYZFCHQNT-UHFFFAOYSA-N"
"CC(=O)OC(=C(C)1)C(=O)CC1","InChI=1S/C8H10O3/c1-5-3-4-7(10)8(5)11-6(2)9/h3-4H2,1-2H3","NNYIMCWMHNKLNZ-UHFFFAOYSA-N"
"CC(=O)OC(C1)Cc(c2)c(ccc2)C1","InChI=1S/C12H14O2/c1-9(13)14-12-7-6-10-4-2-3-5-11(10)8-12/h2-5,12H,6-8H2,1H3","DQIGNECJOYIPLE-UHFFFAOYSA-N"
"C=CCOC(=O)CC(C1)CCCC1","InChI=1S/C11H18O2/c1-2-8-13-11(12)9-10-6-4-3-5-7-10/h2,10H,1,3-9H2","UECFOOSFSUDPOR-UHFFFAOYSA-N"
"C=CC(C)(C1)OC(C1)C(C)(C)O","InChI=1S/C10H18O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h5,8,11H,1,6-7H2,2-4H3/t8-,10+/m0/s1","BRHDDEIRQPDPMG-WCBMZHEXSA-N"
"O=CCC(C)CCCC(C)(C)O","InChI=1S/C10H20O2/c1-9(6-8-11)5-4-7-10(2,3)12/h8-9,12H,4-7H2,1-3H3","WPFVBOQKRVRMJB-UHFFFAOYSA-N"
"COC(OC)CC(C)CCCC(C)(C)O","InChI=1S/C12H26O3/c1-10(9-11(14-4)15-5)7-6-8-12(2,3)13/h10-11,13H,6-9H2,1-5H3","QCJVKUULZGKQDG-UHFFFAOYSA-N"
"CC(C2)Cc(o1)c(C2)c(C)c1","InChI=1S/C10H14O/c1-7-3-4-9-8(2)6-11-10(9)5-7/h6-7H,3-5H2,1-2H3","YGWKXXYGDYYFJU-UHFFFAOYSA-N"
"CCCCCC(OC(C)=O)C=Cc(c1)cccc1","InChI=1S/C16H22O2/c1-3-4-6-11-16(18-14(2)17)13-12-15-9-7-5-8-10-15/h5,7-10,12-13,16H,3-4,6,11H2,1-2H3/b13-12+","PHOQNPPEIYLGSI-OUKQBFOZSA-N"
"CCC(C)=CCCC(C)=CCCC(C)=O","InChI=1S/C14H24O/c1-5-12(2)8-6-9-13(3)10-7-11-14(4)15/h8,10H,5-7,9,11H2,1-4H3/b12-8+,13-10+","HSRQHSFPIKREMB-SDCOAONHSA-N"
"CC(C)CC(C)CC(CC(C)C)OC(C)=O","InChI=1S/C14H28O2/c1-10(2)7-12(5)9-14(8-11(3)4)16-13(6)15/h10-12,14H,7-9H2,1-6H3","HPFLRIHGHUFYEG-UHFFFAOYSA-N"
"CCCC=CCCO","InChI=1S/C7H14O/c1-2-3-4-5-6-7-8/h4-5,8H,2-3,6-7H2,1H3/b5-4+","SDZQUCJFTUULJX-SNAWJCMRSA-N"
"CCC(=O)C(C1)C(C)=C([H])CC(C(C)C)1","InChI=1S/C13H22O/c1-5-13(14)12-8-11(9(2)3)7-6-10(12)4/h6,9,11-12H,5,7-8H2,1-4H3","DZSVIVLGBJKQAP-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCCC(C)=O","InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3/b12-9+","HNZUNIKWNYHEJJ-FMIVXFBMSA-N"
"CCC(C)=CCCC(C)=O","InChI=1S/C9H16O/c1-4-8(2)6-5-7-9(3)10/h6H,4-5,7H2,1-3H3/b8-6+","SAXWRVSDVXCTEL-SOFGYWHQSA-N"
"CCC(C)(C)C(C1)CCC(O)C1","InChI=1S/C11H22O/c1-4-11(2,3)9-5-7-10(12)8-6-9/h9-10,12H,4-8H2,1-3H3","VDQZABQVXYELSI-UHFFFAOYSA-N"
"CCC(C)C(C)O","InChI=1S/C6H14O/c1-4-5(2)6(3)7/h5-7H,4H2,1-3H3","ZXNBBWHRUSXUFZ-UHFFFAOYSA-N"
"C(CCCCCCOC(CCSCCC(OCCCCCCCCCCCCCCCCCC)=O)=O)CCCCC","InChI=1S/C36H70O4S/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-32-40-36(38)30-34-41-33-29-35(37)39-31-27-25-23-21-14-12-10-8-6-4-2/h3-34H2,1-2H3","RRZCFXQTVDJDGF-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(c1)C([H])=C([H])C","InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+","NNWHUJCUHAELCL-SNAWJCMRSA-N"
"CCOc(c1)c(O)ccc1","InChI=1S/C8H10O2/c1-2-10-8-6-4-3-5-7(8)9/h3-6,9H,2H2,1H3","MOEFFSWKSMRFRQ-UHFFFAOYSA-N"
"COc(c1)cc(c(O)c1)C(C)(C)C","InChI=1S/C11H16O2/c1-11(2,3)9-7-8(13-4)5-6-10(9)12/h5-7,12H,1-4H3","MRBKEAMVRSLQPH-UHFFFAOYSA-N"
"COc(c1)c(O)c(OC)cc1","InChI=1S/C8H10O3/c1-10-6-4-3-5-7(11-2)8(6)9/h3-5,9H,1-2H3","KLIDCXVFHGNTTM-UHFFFAOYSA-N"
"O=Cc(c1)cc(O)cc1","InChI=1S/C7H6O2/c8-5-6-2-1-3-7(9)4-6/h1-5,9H","IAVREABSGIHHMO-UHFFFAOYSA-N"
"O=Cc(c1)cc(O)c(OC)c1","InChI=1S/C8H8O3/c1-11-8-3-2-6(5-9)4-7(8)10/h2-5,10H,1H3","JVTZFYYHCGSXJV-UHFFFAOYSA-N"
"O=COC(C1)CCCCCCCC1","InChI=1S/C11H20O2/c12-10-13-11-8-6-4-2-1-3-5-7-9-11/h10-11H,1-9H2","GWTPFNCVVFCJJK-UHFFFAOYSA-N"
"CCC(=O)OCCOc(c1)cccc1","InChI=1S/C11H14O3/c1-2-11(12)14-9-8-13-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3","FKTSMIXZGPUSJB-UHFFFAOYSA-N"
"CC(C)CCOCc(c1)cccc1","InChI=1S/C12H18O/c1-11(2)8-9-13-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3","RXXCIBALSKQCAE-UHFFFAOYSA-N"
"CCCCCOCCc(c1)cccc1","InChI=1S/C13H20O/c1-2-3-7-11-14-12-10-13-8-5-4-6-9-13/h4-6,8-9H,2-3,7,10-12H2,1H3","HNIRLTDJIGVHOG-UHFFFAOYSA-N"
"COC(OC)CC(C)CC(C)(C)C","InChI=1S/C11H24O2/c1-9(8-11(2,3)4)7-10(12-5)13-6/h9-10H,7-8H2,1-6H3","OKMANJUJOSTZGX-UHFFFAOYSA-N"
"CCCC=CC(OC)OC","InChI=1S/C8H16O2/c1-4-5-6-7-8(9-2)10-3/h6-8H,4-5H2,1-3H3/b7-6+","OSVRJMZINDGZFB-VOTSOKGWSA-N"
"CCCCCCC(OCC)OCC","InChI=1S/C11H24O2/c1-4-7-8-9-10-11(12-5-2)13-6-3/h11H,4-10H2,1-3H3","UGOCNHASEZIJFQ-UHFFFAOYSA-N"
"CCOC(OCC)CC(C)CC(C)(C)C","InChI=1S/C13H28O2/c1-7-14-12(15-8-2)9-11(3)10-13(4,5)6/h11-12H,7-10H2,1-6H3","SXOLJHFGARCGQT-UHFFFAOYSA-N"
"CCCCCCCCCC(OCC)OCC","InChI=1S/C14H30O2/c1-4-7-8-9-10-11-12-13-14(15-5-2)16-6-3/h14H,4-13H2,1-3H3","GDDPLWAEEWIQKZ-UHFFFAOYSA-N"
"CCCOC(C)OCCC","InChI=1S/C8H18O2/c1-4-6-9-8(3)10-7-5-2/h8H,4-7H2,1-3H3","MISTZQJSHHTDCF-UHFFFAOYSA-N"
"CC(C)CCOC(C)OCCC(C)C","InChI=1S/C12H26O2/c1-10(2)6-8-13-12(5)14-9-7-11(3)4/h10-12H,6-9H2,1-5H3","LXKCTPBHCJDSKC-UHFFFAOYSA-N"
"CCCCCCOC(CCCC)OCCCCCC","InChI=1S/C17H36O2/c1-4-7-10-12-15-18-17(14-9-6-3)19-16-13-11-8-5-2/h17H,4-16H2,1-3H3","JQWXFZZZKPDRKK-UHFFFAOYSA-N"
"COC(C)(OC)c(c1)cccc1","InChI=1S/C10H14O2/c1-10(11-2,12-3)9-7-5-4-6-8-9/h4-8H,1-3H3","XKSUVRWJZCEYQQ-UHFFFAOYSA-N"
"COC(OC)C=Cc(c1)cccc1","InChI=1S/C11H14O2/c1-12-11(13-2)9-8-10-6-4-3-5-7-10/h3-9,11H,1-2H3/b9-8+","MBAOABFNWSOOLU-CMDGGOBGSA-N"
"CCOC(OCC)C=Cc(c1)cccc1","InChI=1S/C13H18O2/c1-3-14-13(15-4-2)11-10-12-8-6-5-7-9-12/h5-11,13H,3-4H2,1-2H3/b11-10+","VYKDEWVAUWARRX-ZHACJKMWSA-N"
"CCOC(C)(OCC)c(c1)cccc1","InChI=1S/C12H18O2/c1-4-13-12(3,14-5-2)11-9-7-6-8-10-11/h6-10H,4-5H2,1-3H3","BWZAUXRKSMJLMH-UHFFFAOYSA-N"
"CC(C)CC(=O)OC(C)c(c1)cccc1","InChI=1S/C13H18O2/c1-10(2)9-13(14)15-11(3)12-7-5-4-6-8-12/h4-8,10-11H,9H2,1-3H3","WYWVAOQKWGNZHN-UHFFFAOYSA-N"
"CCCCCCCCCCCCOC(=O)CC(C)C","InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-19-17(18)15-16(2)3/h16H,4-15H2,1-3H3","DEHIFZZMFPRYNH-UHFFFAOYSA-N"
"CCCCCCC(=O)OCC([H])=C(C)CCC=C(C)C","InChI=1S/C17H30O2/c1-5-6-7-8-12-17(18)19-14-13-16(4)11-9-10-15(2)3/h10,13H,5-9,11-12,14H2,1-4H3/b16-13-","NSMHPPLPBQPIQJ-SSZFMOIBSA-N"
"CCCCCCC(=O)OCC([H])=C(C)CCC=C(C)C","InChI=1S/C17H30O2/c1-5-6-7-8-12-17(18)19-14-13-16(4)11-9-10-15(2)3/h10,13H,5-9,11-12,14H2,1-4H3/b16-13+","NSMHPPLPBQPIQJ-DTQAZKPQSA-N"
"CCCCCCCCCCCCCC(=O)OCCC(C)CCC=C(C)C","InChI=1S/C24H46O2/c1-5-6-7-8-9-10-11-12-13-14-15-19-24(25)26-21-20-23(4)18-16-17-22(2)3/h17,23H,5-16,18-21H2,1-4H3","MIBQSCZCOKDSJG-UHFFFAOYSA-N"
"CC(=O)OCCC(=C)c(c1)cccc1","InChI=1S/C12H14O2/c1-10(8-9-14-11(2)13)12-6-4-3-5-7-12/h3-7H,1,8-9H2,2H3","RIKRCGVPSVKZJW-UHFFFAOYSA-N"
"CC(C)C(=O)OC(C1)CCCC1","InChI=1S/C10H18O2/c1-8(2)10(11)12-9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3","IYYXBWAISHVFEX-UHFFFAOYSA-N"
"CCCC(=O)OC(C1)CC(C)(C)CC(C)1","InChI=1S/C13H24O2/c1-5-6-12(14)15-11-7-10(2)8-13(3,4)9-11/h10-11H,5-9H2,1-4H3","UIFRJGOCMUXTRV-UHFFFAOYSA-N"
"CCCC(=O)OCC(C1)OCC1","InChI=1S/C9H16O3/c1-2-4-9(10)12-7-8-5-3-6-11-8/h8H,2-7H2,1H3","DPZVDLFOAZNCBU-UHFFFAOYSA-N"
"CCCCCC(=O)OCC([H])=C(C)CCC=C(C)C","InChI=1S/C16H28O2/c1-5-6-7-11-16(17)18-13-12-15(4)10-8-9-14(2)3/h9,12H,5-8,10-11,13H2,1-4H3/b15-12-","ARVSCQUZFFSNKF-QINSGFPZSA-N"
"CCCCCC(=O)OCC=Cc(c1)cccc1","InChI=1S/C15H20O2/c1-2-3-5-12-15(16)17-13-8-11-14-9-6-4-7-10-14/h4,6-11H,2-3,5,12-13H2,1H3/b11-8+","BHXVENZBMFLCKE-DHZHZOJOSA-N"
"CCOC(=O)C(CC)CC","InChI=1S/C8H16O2/c1-4-7(5-2)8(9)10-6-3/h7H,4-6H2,1-3H3","MJGSLNIPTRPYJV-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)OCCCCC","InChI=1S/C17H34O2/c1-3-5-7-8-9-10-11-12-13-15-17(18)19-16-14-6-4-2/h3-16H2,1-2H3","PQWBDPUBNMEITD-UHFFFAOYSA-N"
"OC(=O)CC(C)CC(C)(C)C","InChI=1S/C9H18O2/c1-7(5-8(10)11)6-9(2,3)4/h7H,5-6H2,1-4H3,(H,10,11)","OILUAKBAMVLXGF-UHFFFAOYSA-N"
"C=CCOC(=O)c(c1)cccc1","InChI=1S/C10H10O2/c1-2-8-12-10(11)9-6-4-3-5-7-9/h2-7H,1,8H2","LYJHVEDILOKZCG-UHFFFAOYSA-N"
"CC(=C)CCOC(=O)c(c1)cccc1","InChI=1S/C12H14O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3","BBTRQSDRTFFNSW-UHFFFAOYSA-N"
"CCC=CCCOC(=O)c(c1)cccc1","InChI=1S/C13H16O2/c1-2-3-4-8-11-15-13(14)12-9-6-5-7-10-12/h3-7,9-10H,2,8,11H2,1H3/b4-3-","BCOXBEHFBZOJJZ-ARJAWSKDSA-N"
"CCCCCCCCOC(=O)c(c1)cccc1","InChI=1S/C15H22O2/c1-2-3-4-5-6-10-13-17-15(16)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3","VECVSKFWRQYTAL-UHFFFAOYSA-N"
"O=C(OCCc(c2)cccc2)c(c1)cccc1","InChI=1S/C15H14O2/c16-15(14-9-5-2-6-10-14)17-12-11-13-7-3-1-4-8-13/h1-10H,11-12H2","OSORMYZMWHVFOZ-UHFFFAOYSA-N"
"CCCOC(=O)Cc(c1)cccc1","InChI=1S/C11H14O2/c1-2-8-13-11(12)9-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3","GXXFZZLGPFNITM-UHFFFAOYSA-N"
"CC(C)OC(=O)Cc(c1)cccc1","InChI=1S/C11H14O2/c1-9(2)13-11(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","SSMBXPJYHMZLOJ-UHFFFAOYSA-N"
"CCCCOC(=O)Cc(c1)cccc1","InChI=1S/C12H16O2/c1-2-3-9-14-12(13)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3","LDOXTQYWWYXYSQ-UHFFFAOYSA-N"
"CCCCCOC(=O)Cc(c1)cccc1","InChI=1S/C13H18O2/c1-2-3-7-10-15-13(14)11-12-8-5-4-6-9-12/h4-6,8-9H,2-3,7,10-11H2,1H3","LRVLBFSVAFUOGO-UHFFFAOYSA-N"
"CCC=CCCOC(=O)Cc(c1)cccc1","InChI=1S/C14H18O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h3-7,9-10H,2,8,11-12H2,1H3/b4-3-","FJKFIIYSBXHBCT-ARJAWSKDSA-N"
"CCCCCCOC(=O)Cc(c1)cccc1","InChI=1S/C14H20O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3","MTAHGWGAEGVCLS-UHFFFAOYSA-N"
"CCCCCCCOC(=O)Cc(c1)cccc1","InChI=1S/C15H22O2/c1-2-3-4-5-9-12-17-15(16)13-14-10-7-6-8-11-14/h6-8,10-11H,2-5,9,12-13H2,1H3","MFCMCQJYPOAXCB-UHFFFAOYSA-N"
"CCCCCCCCOC(=O)Cc(c1)cccc1","InChI=1S/C16H24O2/c1-2-3-4-5-6-10-13-18-16(17)14-15-11-8-7-9-12-15/h7-9,11-12H,2-6,10,13-14H2,1H3","VGYPAVUJUMQTGE-UHFFFAOYSA-N"
"CCCOC(=O)C=Cc(c1)cccc1","InChI=1S/C12H14O2/c1-2-10-14-12(13)9-8-11-6-4-3-5-7-11/h3-9H,2,10H2,1H3/b9-8+","OLLPXZHNCXACMM-CMDGGOBGSA-N"
"CC(C)OC(=O)C([H])=C([H])c(c1)cccc1","InChI=1S/C12H14O2/c1-10(2)14-12(13)9-8-11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8+","RGACABDFLVLVCT-CMDGGOBGSA-N"
"CCCCOC(=O)C=Cc(c1)cccc1","InChI=1S/C13H16O2/c1-2-3-11-15-13(14)10-9-12-7-5-4-6-8-12/h4-10H,2-3,11H2,1H3/b10-9+","OHHIVLJVBNCSHV-MDZDMXLPSA-N"
"CC(C)COC(=O)C=Cc(c1)cccc1","InChI=1S/C13H16O2/c1-11(2)10-15-13(14)9-8-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3/b9-8+","IQZUZPKOFSOVET-CMDGGOBGSA-N"
"CCC=CCCOC(=O)C=Cc(c1)cccc1","InChI=1S/C15H18O2/c1-2-3-4-8-13-17-15(16)12-11-14-9-6-5-7-10-14/h3-7,9-12H,2,8,13H2,1H3/b4-3-,12-11+","FKWGVMQNGUQXDN-FECXASIGSA-N"
"CCCCC(CC)OC=O","InChI=1S/C8H16O2/c1-3-5-6-8(4-2)10-7-9/h7-8H,3-6H2,1-2H3","RJJVYSJFEOFICB-UHFFFAOYSA-N"
"O=COCc(c1)ccc(C)c1","InChI=1S/C9H10O2/c1-8-2-4-9(5-3-8)6-11-7-10/h2-5,7H,6H2,1H3","MWCCNIVWHAWABQ-UHFFFAOYSA-N"
"CCCCCCCCCCCOC(C)=O","InChI=1S/C13H26O2/c1-3-4-5-6-7-8-9-10-11-12-15-13(2)14/h3-12H2,1-2H3","CKQGCFFDQIFZFA-UHFFFAOYSA-N"
"CCCCC=CCOC(C)=O","InChI=1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h6-7H,3-5,8H2,1-2H3/b7-6+","AWCPMVVOGVEPRC-VOTSOKGWSA-N"
"CCCCCCC=CCOC(C)=O","InChI=1S/C11H20O2/c1-3-4-5-6-7-8-9-10-13-11(2)12/h8-9H,3-7,10H2,1-2H3/b9-8+","WFCCNPHGLLPSDJ-CMDGGOBGSA-N"
"CCCCCCCC=CCOC(C)=O","InChI=1S/C12H22O2/c1-3-4-5-6-7-8-9-10-11-14-12(2)13/h9-10H,3-8,11H2,1-2H3/b10-9+","LUMRROIRFJRWNX-MDZDMXLPSA-N"
"CCCCCCCCCC=CCOC(C)=O","InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h11-12H,3-10,13H2,1-2H3/b12-11+","AMIUTTABDVIFDZ-VAWYXSNFSA-N"
"CC(=C)C(C1)CC(O)C(C)=C1","InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3/t9-,10-/m0/s1","BAVONGHXFVOKBV-UWVGGRQHSA-N"
"C=CCCCCCCCCCCOC(C)=O","InChI=1S/C14H26O2/c1-3-4-5-6-7-8-9-10-11-12-13-16-14(2)15/h3H,1,4-13H2,2H3","ANBOMSJGDBBKMR-UHFFFAOYSA-N"
"CCCCCCC(C)(CC)OC(C)=O","InChI=1S/C12H24O2/c1-5-7-8-9-10-12(4,6-2)14-11(3)13/h5-10H2,1-4H3","HVPKIOUHNVOKDK-UHFFFAOYSA-N"
"CC(=O)OC(C1)C(CCC1)C(C)(C)C","InChI=1S/C12H22O2/c1-9(13)14-11-8-6-5-7-10(11)12(2,3)4/h10-11H,5-8H2,1-4H3","FINOAUDUYKVGDS-UHFFFAOYSA-N"
"CC(=O)OCc(c1)oc(C)c1","InChI=1S/C8H10O3/c1-6-3-4-8(11-6)5-10-7(2)9/h3-4H,5H2,1-2H3","WCAYUXKMYBPHIN-UHFFFAOYSA-N"
"CC(=O)OC(C)(C)Cc(c1)cccc1","InChI=1S/C12H16O2/c1-10(13)14-12(2,3)9-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3","FLUWAIIVLCVEKF-UHFFFAOYSA-N"
"CC(=O)OC(C)(C)CCc(c1)cccc1","InChI=1S/C13H18O2/c1-11(14)15-13(2,3)10-9-12-7-5-4-6-8-12/h4-8H,9-10H2,1-3H3","ZXFNOEJFYLQUSB-UHFFFAOYSA-N"
"CC(=O)OC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H14O2/c1-12(16)17-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,15H,1H3","QBKMWJRMLACRJD-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)OC(=O)Cc(c1)cccc1","InChI=1S/C15H14O2/c1-12-7-9-14(10-8-12)17-15(16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3","OJEQSSJFSNLMLB-UHFFFAOYSA-N"
"CCC(C)SSC(C)CC","InChI=1S/C8H18S2/c1-5-7(3)9-10-8(4)6-2/h7-8H,5-6H2,1-4H3","QTWKINKGAHTPFJ-UHFFFAOYSA-N"
"C=CC(C)(C)OC(C)=O","InChI=1S/C7H12O2/c1-5-7(3,4)9-6(2)8/h5H,1H2,2-4H3","ZJVWGOLNVKJRDF-UHFFFAOYSA-N"
"CC(=O)OC(C)C(C)=O","InChI=1S/C6H10O3/c1-4(7)5(2)9-6(3)8/h5H,1-3H3","ZKPTYCJWRHHBOW-UHFFFAOYSA-N"
"CC(=O)COC(C)=O","InChI=1S/C5H8O3/c1-4(6)3-8-5(2)7/h3H2,1-2H3","DBERHVIZRVGDFO-UHFFFAOYSA-N"
"CC(C)CC(CC(C)C)OC(C)=O","InChI=1S/C11H22O2/c1-8(2)6-11(7-9(3)4)13-10(5)12/h8-9,11H,6-7H2,1-5H3","XLJDNKNPKUBQMX-UHFFFAOYSA-N"
"CCCCCCC(C)OC(C)=O","InChI=1S/C10H20O2/c1-4-5-6-7-8-9(2)12-10(3)11/h9H,4-8H2,1-3H3","SJFUDWKNZGXSLV-UHFFFAOYSA-N"
"CCCCCC(CC)OC(=O)CC","InChI=1S/C11H22O2/c1-4-7-8-9-10(5-2)13-11(12)6-3/h10H,4-9H2,1-3H3","SBHJWJMMXVWHCU-UHFFFAOYSA-N"
"CCCCC(CC)OC(=O)CC","InChI=1S/C10H20O2/c1-4-7-8-9(5-2)12-10(11)6-3/h9H,4-8H2,1-3H3","WTSWAVWDIUHBBL-UHFFFAOYSA-N"
"CCCCC(CC)OC(C)=O","InChI=1S/C9H18O2/c1-4-6-7-9(5-2)11-8(3)10/h9H,4-7H2,1-3H3","QICIMADZMWGDTQ-UHFFFAOYSA-N"
"CCC(=O)OC(C)(C)Cc(c1)cccc1","InChI=1S/C13H18O2/c1-4-12(14)15-13(2,3)10-11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3","BLKIYRRGHOQSPP-UHFFFAOYSA-N"
"CCCC(=O)OC(C)(C)CCc(c1)cccc1","InChI=1S/C15H22O2/c1-4-8-14(16)17-15(2,3)12-11-13-9-6-5-7-10-13/h5-7,9-10H,4,8,11-12H2,1-3H3","AIDHEBLAMCYZRU-UHFFFAOYSA-N"
"CCCC(=O)OCC(C)CC","InChI=1S/C9H18O2/c1-4-6-9(10)11-7-8(3)5-2/h8H,4-7H2,1-3H3","MBZKQDXXFMITAC-UHFFFAOYSA-N"
"CCCCC(CC)OC(=O)C(C)C","InChI=1S/C11H22O2/c1-5-7-8-10(6-2)13-11(12)9(3)4/h9-10H,5-8H2,1-4H3","BEOJRFPSYLJBFR-UHFFFAOYSA-N"
"CCCC(=O)Oc(c1)cccc1","InChI=1S/C10H12O2/c1-2-6-10(11)12-9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3","IGVPBCZDHMIOJH-UHFFFAOYSA-N"
"CCCC(C)OC(=O)CCC","InChI=1S/C9H18O2/c1-4-6-8(3)11-9(10)7-5-2/h8H,4-7H2,1-3H3","DJOCFLQKCMWABC-UHFFFAOYSA-N"
"CCCCCCCCCCCCOC(=O)CCC","InChI=1S/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-15-18-16(17)14-4-2/h3-15H2,1-2H3","JEPXJYKYHMEESP-UHFFFAOYSA-N"
"CC(C1)=CC(=O)CC1","InChI=1S/C7H10O/c1-6-3-2-4-7(8)5-6/h5H,2-4H2,1H3","IITQJMYAYSNIMI-UHFFFAOYSA-N"
"C#CC(O)(C1)CCCC1","InChI=1S/C8H12O/c1-2-8(9)6-4-3-5-7-8/h1,9H,3-7H2","QYLFHLNFIHBCPR-UHFFFAOYSA-N"
"CCCCCc(c1)cccc1","InChI=1S/C11H16/c1-2-3-5-8-11-9-6-4-7-10-11/h4,6-7,9-10H,2-3,5,8H2,1H3","PWATWSYOIIXYMA-UHFFFAOYSA-N"
"Oc(c1)c(c2)c(ccc2)cc1","InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H","KJCVRFUGPWSIIH-UHFFFAOYSA-N"
"CC(O)CCc(c1)cccc1","InChI=1S/C10H14O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3","GDWRKZLROIFUML-UHFFFAOYSA-N"
"OCc(c1)ccc(O)c1","InChI=1S/C7H8O2/c8-5-6-1-3-7(9)4-2-6/h1-4,8-9H,5H2","BVJSUAQZOZWCKN-UHFFFAOYSA-N"
"OCC(O)c(c1)cccc1","InChI=1S/C8H10O2/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8-10H,6H2","PWMWNFMRSKOCEY-UHFFFAOYSA-N"
"OCCCCCCCCCCCCO","InChI=1S/C12H26O2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h13-14H,1-12H2","GHLKSLMMWAKNBM-UHFFFAOYSA-N"
"COc(c1)c(O)ccc(C)1","InChI=1S/C8H10O2/c1-6-3-4-7(9)8(5-6)10-2/h3-5,9H,1-2H3","PETRWTHZSKVLRE-UHFFFAOYSA-N"
"C=CC(O)(C1)CCCC1","InChI=1S/C8H14O/c1-2-8(9)6-4-3-5-7-8/h2,9H,1,3-7H2","ZXKHOVDDJMJXQP-UHFFFAOYSA-N"
"CC(O1)OC(C)OC(C)1","InChI=1S/C6H12O3/c1-4-7-5(2)9-6(3)8-4/h4-6H,1-3H3","SQYNKIJPMDEDEG-UHFFFAOYSA-N"
"CCCCOCc(c1)cccc1","InChI=1S/C11H16O/c1-2-3-9-12-10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3","MAYUYFCAPVDYBQ-UHFFFAOYSA-N"
"OCCOc(c1)ccc(C)c1","InChI=1S/C9H12O2/c1-8-2-4-9(5-3-8)11-7-6-10/h2-5,10H,6-7H2,1H3","FFWXHQFJNOGDJE-UHFFFAOYSA-N"
"CC(C)CCOC(C)c(c1)cccc1","InChI=1S/C13H20O/c1-11(2)9-10-14-12(3)13-7-5-4-6-8-13/h4-8,11-12H,9-10H2,1-3H3","IZFQCPDKIZRKSB-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(C)=O","InChI=1S/C14H28O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h3-13H2,1-2H3","POQLVOYRGNFGRM-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(C)=O","InChI=1S/C16H32O/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h3-15H2,1-2H3","XCXKZBWAKKPFCJ-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)CC","InChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12(13)4-2/h3-11H2,1-2H3","PERIHWAPLOBAJM-UHFFFAOYSA-N"
"CCCCCCC(=O)C(C)=O","InChI=1S/C9H16O2/c1-3-4-5-6-7-9(11)8(2)10/h3-7H2,1-2H3","WNVKJGIJHKADAE-UHFFFAOYSA-N"
"CC(=O)CC(C)(C)O","InChI=1S/C6H12O2/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3","SWXVUIWOUIDPGS-UHFFFAOYSA-N"
"CCC(O)C(=O)CC","InChI=1S/C6H12O2/c1-3-5(7)6(8)4-2/h5,7H,3-4H2,1-2H3","SKCYVGUCBRYGTE-UHFFFAOYSA-N"
"COC(OC)CC(C)=O","InChI=1S/C6H12O3/c1-5(7)4-6(8-2)9-3/h6H,4H2,1-3H3","PJCCSZUMZMCWSX-UHFFFAOYSA-N"
"CCCCOC(C)OCCCC","InChI=1S/C10H22O2/c1-4-6-8-11-10(3)12-9-7-5-2/h10H,4-9H2,1-3H3","SWTCCCJQNPGXLQ-UHFFFAOYSA-N"
"CCC=CCCOC(CCCCC)OCCC=CCC","InChI=1S/C18H34O2/c1-4-7-10-13-16-19-18(15-12-9-6-3)20-17-14-11-8-5-2/h7-8,10-11,18H,4-6,9,12-17H2,1-3H3/b10-7-,11-8-","UDANAIGXCGUZTC-DEFDFUCDSA-N"
"CCCCCCOC(CCCCC)OCC=CCCC","InChI=1S/C18H36O2/c1-4-7-10-13-16-19-18(15-12-9-6-3)20-17-14-11-8-5-2/h10,13,18H,4-9,11-12,14-17H2,1-3H3/b13-10+","QXRVBRBGBSCHQO-JLHYYAGUSA-N"
"CCOC(OCC)Cc(c1)cccc1","InChI=1S/C12H18O2/c1-3-13-12(14-4-2)10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3","FYERTDTXGGOMGT-UHFFFAOYSA-N"
"CCOC(OCC)c(c1)ccc(OC)c1","InChI=1S/C12H18O3/c1-4-14-12(15-5-2)10-6-8-11(13-3)9-7-10/h6-9,12H,4-5H2,1-3H3","FTTLMNXOYOVHAG-UHFFFAOYSA-N"
"Cc(c2)c(ccc2)C(=O)c(c1)cccc1","InChI=1S/C14H12O/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h2-10H,1H3","CKGKXGQVRVAKEA-UHFFFAOYSA-N"
"O=C(CCc(c2)cccc2)c(c1)cccc1","InChI=1S/C15H14O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10H,11-12H2","QGGZBXOADPVUPN-UHFFFAOYSA-N"
"COc(c1)ccc(CCC(C)=O)c1","InChI=1S/C11H14O2/c1-9(12)3-4-10-5-7-11(13-2)8-6-10/h5-8H,3-4H2,1-2H3","PCBSXBYCASFXTM-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(C(C)=O)c1","InChI=1S/C10H12O3/c1-7(11)8-4-5-9(12-2)10(6-8)13-3/h4-6H,1-3H3","IQZLUWLMQNGTIW-UHFFFAOYSA-N"
"CCC(=O)C=Cc(c1)ccc(OC)c1","InChI=1S/C12H14O2/c1-3-11(13)7-4-10-5-8-12(14-2)9-6-10/h4-9H,3H2,1-2H3/b7-4+","SLDQOBRACOQXGE-QPJJXVBHSA-N"
"COc(c1)ccc(C=CC(=O)C(C)C)c1","InChI=1S/C13H16O2/c1-10(2)13(14)9-6-11-4-7-12(15-3)8-5-11/h4-10H,1-3H3/b9-6+","ZIXVMEYRFPMOAV-RMKNXTFCSA-N"
"CC(=O)C(=O)c(c1)cccc1","InChI=1S/C9H8O2/c1-7(10)9(11)8-5-3-2-4-6-8/h2-6H,1H3","BVQVLAIMHVDZEL-UHFFFAOYSA-N"
"CCCCCC(=O)OCC=C","InChI=1S/C9H16O2/c1-3-5-6-7-9(10)11-8-4-2/h4H,2-3,5-8H2,1H3","RCSBILYQLVXLJG-UHFFFAOYSA-N"
"O=C(C1)C(CCC1)C(C)(C)C","InChI=1S/C10H18O/c1-10(2,3)8-6-4-5-7-9(8)11/h8H,4-7H2,1-3H3","ZRYDPLOWJSFQAE-UHFFFAOYSA-N"
"CCC(C)(C)C(C1)CCC(=O)C1","InChI=1S/C11H20O/c1-4-11(2,3)9-5-7-10(12)8-6-9/h9H,4-8H2,1-3H3","DCSKAMGZSIRJAQ-UHFFFAOYSA-N"
"CC(=O)CC(C)(C)C(C1)CCCC1","InChI=1S/C12H22O/c1-10(13)9-12(2,3)11-7-5-4-6-8-11/h11H,4-9H2,1-3H3","OAFJAALOFJVHMK-UHFFFAOYSA-N"
"CC(=O)C(C21)C(C)(C)C(CC2)C1","InChI=1S/C11H18O/c1-7(12)10-8-4-5-9(6-8)11(10,2)3/h8-10H,4-6H2,1-3H3","NGTMQRCBACIUES-UHFFFAOYSA-N"
"O=C(C1)CCCC=CCCCCCCCCC1","InChI=1S/C16H28O/c17-16-14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-16/h6,8H,1-5,7,9-15H2/b8-6-","ABRIMXGLNHCLIP-VURMDHGXSA-N"
"CC(=O)CC(C)(C)c(c1)cccc1","InChI=1S/C12H16O/c1-10(13)9-12(2,3)11-7-5-4-6-8-11/h4-8H,9H2,1-3H3","PFDVPCSDZXZDMF-UHFFFAOYSA-N"
"CCC(=O)CC(C)(C)c(c1)cccc1","InChI=1S/C13H18O/c1-4-12(14)10-13(2,3)11-8-6-5-7-9-11/h5-9H,4,10H2,1-3H3","VEZKFOIEZCNFBT-UHFFFAOYSA-N"
"COCC(OC)OC","InChI=1S/C5H12O3/c1-6-4-5(7-2)8-3/h5H,4H2,1-3H3","DYOZNCVZPFIXLU-UHFFFAOYSA-N"
"CCCCCC(OC)OC","InChI=1S/C8H18O2/c1-4-5-6-7-8(9-2)10-3/h8H,4-7H2,1-3H3","ZQUJUCJLDXTKKW-UHFFFAOYSA-N"
"CCCCCCC(OC)OC","InChI=1S/C9H20O2/c1-4-5-6-7-8-9(10-2)11-3/h9H,4-8H2,1-3H3","BBMCNYFBAIUERL-UHFFFAOYSA-N"
"CCCCCCCC(OC)OC","InChI=1S/C10H22O2/c1-4-5-6-7-8-9-10(11-2)12-3/h10H,4-9H2,1-3H3","BZOOCKAFKVYAOZ-UHFFFAOYSA-N"
"CCCCCCCCC(OC)OC","InChI=1S/C11H24O2/c1-4-5-6-7-8-9-10-11(12-2)13-3/h11H,4-10H2,1-3H3","LYLVOCPDQAOQKL-UHFFFAOYSA-N"
"CCCCCCCCCC(OC)OC","InChI=1S/C12H26O2/c1-4-5-6-7-8-9-10-11-12(13-2)14-3/h12H,4-11H2,1-3H3","NCRNCSZWOOYBQF-UHFFFAOYSA-N"
"CCCCCCCCCCCC(OC)OC","InChI=1S/C14H30O2/c1-4-5-6-7-8-9-10-11-12-13-14(15-2)16-3/h14H,4-13H2,1-3H3","AJUWUYJULVYGRA-UHFFFAOYSA-N"
"CCCCCCCCCC(C)C(OC)OC","InChI=1S/C14H30O2/c1-5-6-7-8-9-10-11-12-13(2)14(15-3)16-4/h13-14H,5-12H2,1-4H3","NJXYRZMLVYMJHM-UHFFFAOYSA-N"
"CCC=CCC(OCC)OCC","InChI=1S/C10H20O2/c1-4-7-8-9-10(11-5-2)12-6-3/h7-8,10H,4-6,9H2,1-3H3/b8-7-","IOBHVJHSBREPFR-FPLPWBNLSA-N"
"CCCCC(OCC)OCC","InChI=1S/C9H20O2/c1-4-7-8-9(10-5-2)11-6-3/h9H,4-8H2,1-3H3","XCWKYQWOLSOBCC-UHFFFAOYSA-N"
"CCOC(OCC)CC(C)C","InChI=1S/C9H20O2/c1-5-10-9(11-6-2)7-8(3)4/h8-9H,5-7H2,1-4H3","DDGBOLJFAMEBOE-UHFFFAOYSA-N"
"CCCC=CC(OCC)OCC","InChI=1S/C10H20O2/c1-4-7-8-9-10(11-5-2)12-6-3/h8-10H,4-7H2,1-3H3/b9-8+","WMQKYHTZGYIHHD-CMDGGOBGSA-N"
"CCCCCC(OCC)OCC","InChI=1S/C10H22O2/c1-4-7-8-9-10(11-5-2)12-6-3/h10H,4-9H2,1-3H3","WNHOMUCDFNTSEV-UHFFFAOYSA-N"
"CCC=CCCC(OCC)OCC","InChI=1S/C11H22O2/c1-4-7-8-9-10-11(12-5-2)13-6-3/h7-8,11H,4-6,9-10H2,1-3H3/b8-7-","BOALWZNGHWYCRG-FPLPWBNLSA-N"
"CCCCCC=CC(OCC)OCC","InChI=1S/C12H24O2/c1-4-7-8-9-10-11-12(13-5-2)14-6-3/h10-12H,4-9H2,1-3H3/b11-10+","VTQPINQQQFJLGG-ZHACJKMWSA-N"
"CCCCCCCC(OCC)OCC","InChI=1S/C12H26O2/c1-4-7-8-9-10-11-12(13-5-2)14-6-3/h12H,4-11H2,1-3H3","BRKIPAWFUDCCOO-UHFFFAOYSA-N"
"CCCCCCCC(OCC=C)OCC=C","InChI=1S/C14H26O2/c1-4-7-8-9-10-11-14(15-12-5-2)16-13-6-3/h5-6,14H,2-4,7-13H2,1H3","GPLKLPLXSJSSJE-UHFFFAOYSA-N"
"CCOC(C)OCCC(C)C","InChI=1S/C9H20O2/c1-5-10-9(4)11-7-6-8(2)3/h8-9H,5-7H2,1-4H3","RGNYZOOSNYMRQE-UHFFFAOYSA-N"
"CCCCOC(CCCC)OCCCC","InChI=1S/C13H28O2/c1-4-7-10-13(14-11-8-5-2)15-12-9-6-3/h13H,4-12H2,1-3H3","LDJYPEMHNQONGS-UHFFFAOYSA-N"
"CCOC(C)OCCC([H])=C([H])CC","InChI=1S/C10H20O2/c1-4-6-7-8-9-12-10(3)11-5-2/h6-7,10H,4-5,8-9H2,1-3H3/b7-6+","PAEBAEDUARAOSG-VOTSOKGWSA-N"
"CCCCCCOC(C)OCC","InChI=1S/C10H22O2/c1-4-6-7-8-9-12-10(3)11-5-2/h10H,4-9H2,1-3H3","YJYLJPSYBMNHTG-UHFFFAOYSA-N"
"CCCCCCOC(OCC)CCCCC","InChI=1S/C14H30O2/c1-4-7-9-11-13-16-14(15-6-3)12-10-8-5-2/h14H,4-13H2,1-3H3","DQPCKTBYQXJOFX-UHFFFAOYSA-N"
"CC(C)CCOC(C)OCC(C)C","InChI=1S/C11H24O2/c1-9(2)6-7-12-11(5)13-8-10(3)4/h9-11H,6-8H2,1-5H3","PFGKDSOUFDQBLI-UHFFFAOYSA-N"
"CCCCCCOC(C)OCC(C)C","InChI=1S/C12H26O2/c1-5-6-7-8-9-13-12(4)14-10-11(2)3/h11-12H,5-10H2,1-4H3","IXOVHJJQWYROLC-UHFFFAOYSA-N"
"CCCCCCOC(C)OCCC(C)C","InChI=1S/C13H28O2/c1-5-6-7-8-10-14-13(4)15-11-9-12(2)3/h12-13H,5-11H2,1-4H3","PUXHYFFHRDAFHP-UHFFFAOYSA-N"
"CCC=CCCOC(C)OCCC=CCC","InChI=1S/C14H26O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h6-9,14H,4-5,10-13H2,1-3H3/b8-6-,9-7-","KCPFRJBAXWUXIG-VRHVFUOLSA-N"
"CCCCCCOC(C)OCCCCCC","InChI=1S/C14H30O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h14H,4-13H2,1-3H3","VSFOOCQEJQKBSO-UHFFFAOYSA-N"
"CCCCCCOC(CC)OCCCCCC","InChI=1S/C15H32O2/c1-4-7-9-11-13-16-15(6-3)17-14-12-10-8-5-2/h15H,4-14H2,1-3H3","GAGIWYOKONINOF-UHFFFAOYSA-N"
"CCCCCCOC(CCCCC)OCCCCCC","InChI=1S/C18H38O2/c1-4-7-10-13-16-19-18(15-12-9-6-3)20-17-14-11-8-5-2/h18H,4-17H2,1-3H3","JAMIQGJXDPTFJL-UHFFFAOYSA-N"
"COC(OC)C=C(C)CCC=C(C)C","InChI=1S/C12H22O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,9,12H,6,8H2,1-5H3/b11-9+","ZSKAJFSSXURRGL-PKNBQFBNSA-N"
"COC(OC)C=C(C)CCC=C(C)C","InChI=1S/C12H22O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,9,12H,6,8H2,1-5H3/b11-9-","ZSKAJFSSXURRGL-LUAWRHEFSA-N"
"COC(OC)CC(C)CCC=C(C)C","InChI=1S/C12H24O2/c1-10(2)7-6-8-11(3)9-12(13-4)14-5/h7,11-12H,6,8-9H2,1-5H3","SEXUFKWNUNQRSS-UHFFFAOYSA-N"
"CCOC(OCC)CC(C)CCC=C(C)C","InChI=1S/C14H28O2/c1-6-15-14(16-7-2)11-13(5)10-8-9-12(3)4/h9,13-14H,6-8,10-11H2,1-5H3","HYNXWFKVWMABRM-UHFFFAOYSA-N"
"COC(OC)CCc(c1)cccc1","InChI=1S/C11H16O2/c1-12-11(13-2)9-8-10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3","PQAOFUQAZBGCQK-UHFFFAOYSA-N"
"COC(OC)Cc(c1)cccc1","InChI=1S/C10H14O2/c1-11-10(12-2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3","WNJSKZBEWNVKGU-UHFFFAOYSA-N"
"COC(OC)C(C)c(c1)cccc1","InChI=1S/C11H16O2/c1-9(11(12-2)13-3)10-7-5-4-6-8-10/h4-9,11H,1-3H3","UFOUDYPOSJJEDJ-UHFFFAOYSA-N"
"CCCCCc(c1)c(ccc1)C([H])=C([H])C(OCC)OCC","InChI=1S/C18H28O2/c1-4-7-8-11-16-12-9-10-13-17(16)14-15-18(19-5-2)20-6-3/h9-10,12-15,18H,4-8,11H2,1-3H3/b15-14+","PQARPKGSMQTPKR-CCEZHUSRSA-N"
"CC(C)CCOC(C)OCc(c1)cccc1","InChI=1S/C14H22O2/c1-12(2)9-10-15-13(3)16-11-14-7-5-4-6-8-14/h4-8,12-13H,9-11H2,1-3H3","UROVAOQFAZWTNI-UHFFFAOYSA-N"
"CCCCCCOC(C)OCc(c1)cccc1","InChI=1S/C15H24O2/c1-3-4-5-9-12-16-14(2)17-13-15-10-7-6-8-11-15/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3","NDKDGYQWVJSTOP-UHFFFAOYSA-N"
"CCCCC(CC)C(O1)OCC1","InChI=1S/C10H20O2/c1-3-5-6-9(4-2)10-11-7-8-12-10/h9-10H,3-8H2,1-2H3","LQSZQAHPRJMRET-UHFFFAOYSA-N"
"CCCCCCC(O1)OCC1","InChI=1S/C9H18O2/c1-2-3-4-5-6-9-10-7-8-11-9/h9H,2-8H2,1H3","DDSSJDFXTAYRNO-UHFFFAOYSA-N"
"CC(c(c2)cccc2)C(O1)OCC1","InChI=1S/C11H14O2/c1-9(11-12-7-8-13-11)10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3","SATZAQAJSHXNSJ-UHFFFAOYSA-N"
"CCCC=CC=O","InChI=1S/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+","MBDOYVRWFFCFHM-SNAWJCMRSA-N"
"CCC=CCC=O","InChI=1S/C6H10O/c1-2-3-4-5-6-7/h3-4,6H,2,5H2,1H3/b4-3-","GXANMBISFKBPEX-ARJAWSKDSA-N"
"CCC=C(C)C=O","InChI=1S/C6H10O/c1-3-4-6(2)5-7/h4-5H,3H2,1-2H3/b6-4+","IDEYZABHVQLHAF-GQCTYLIASA-N"
"CCCCC=CC=O","InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3/b6-5+","NDFKTBCGKNOHPJ-AATRIKPKSA-N"
"CCC=CCCC=O","InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h3-4,7H,2,5-6H2,1H3/b4-3-","VVGOCOMZRGWHPI-ARJAWSKDSA-N"
"CCCC=C(CC)C=O","InChI=1S/C8H14O/c1-3-5-6-8(4-2)7-9/h6-7H,3-5H2,1-2H3/b8-6+","PYLMCYQHBRSDND-SOFGYWHQSA-N"
"CCCCC(CC)C=O","InChI=1S/C8H16O/c1-3-5-6-8(4-2)7-9/h7-8H,3-6H2,1-2H3","LGYNIFWIKSEESD-UHFFFAOYSA-N"
"CCCCCCCC=CC=O","InChI=1S/C10H18O/c1-2-3-4-5-6-7-8-9-10-11/h8-10H,2-7H2,1H3/b9-8+","MMFCJPPRCYDLLZ-CMDGGOBGSA-N"
"C=CCCCCCCCCC=O","InChI=1S/C11H20O/c1-2-3-4-5-6-7-8-9-10-11-12/h2,11H,1,3-10H2","OFHHDSQXFXLTKC-UHFFFAOYSA-N"
"CCCCCCCCCCC=O","InChI=1S/C11H22O/c1-2-3-4-5-6-7-8-9-10-11-12/h11H,2-10H2,1H3","KMPQYAYAQWNLME-UHFFFAOYSA-N"
"CCCCCCCCCCCC=O","InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h12H,2-11H2,1H3","HFJRKMMYBMWEAD-UHFFFAOYSA-N"
"CCCCCCCCCC(C)C=O","InChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-12(2)11-13/h11-12H,3-10H2,1-2H3","NFAVNWJJYQAGNB-UHFFFAOYSA-N"
"O=CC(=C2)C([H])(C1)C(C)(C)C([H])(C2)1","InChI=1S/C10H14O/c1-10(2)8-4-3-7(6-11)9(10)5-8/h3,6,8-9H,4-5H2,1-2H3","KMRMUZKLFIEVAO-UHFFFAOYSA-N"
"O=CCC(C)CCCC(C)(C)OC","InChI=1S/C11H22O2/c1-10(7-9-12)6-5-8-11(2,3)13-4/h9-10H,5-8H2,1-4H3","IDWULKZGRNHZNR-UHFFFAOYSA-N"
"O=CCCc(c1)cccc1","InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2","YGCZTXZTJXYWCO-UHFFFAOYSA-N"
"O=CC(C)=Cc(c1)cccc1","InChI=1S/C10H10O/c1-9(8-11)7-10-5-3-2-4-6-10/h2-8H,1H3/b9-7+","VLUMOWNVWOXZAU-VQHVLOKHSA-N"
"O=Cc(c1)ccc(C(C)C)c1","InChI=1S/C10H12O/c1-8(2)10-5-3-9(7-11)4-6-10/h3-8H,1-2H3","WTWBUQJHJGUZCY-UHFFFAOYSA-N"
"CCCCC(C=O)=Cc(c1)cccc1","InChI=1S/C13H16O/c1-2-3-7-13(11-14)10-12-8-5-4-6-9-12/h4-6,8-11H,2-3,7H2,1H3/b13-10+","GFBCBQNBXRPRQD-JLHYYAGUSA-N"
"O=CC(C)Cc(c1)ccc(C(C)C)c1","InChI=1S/C13H18O/c1-10(2)13-6-4-12(5-7-13)8-11(3)9-14/h4-7,9-11H,8H2,1-3H3","ZFNVDHOSLNRHNN-UHFFFAOYSA-N"
"CCCCCC(C=O)=Cc(c1)cccc1","InChI=1S/C14H18O/c1-2-3-5-10-14(12-15)11-13-8-6-4-7-9-13/h4,6-9,11-12H,2-3,5,10H2,1H3/b14-11+","HMKKIXGYKWDQSV-SDNWHVSQSA-N"
"CCCCCCC(C=O)=Cc(c1)cccc1","InChI=1S/C15H20O/c1-2-3-4-6-11-15(13-16)12-14-9-7-5-8-10-14/h5,7-10,12-13H,2-4,6,11H2,1H3/b15-12+","GUUHFMWKWLOQMM-NTCAYCPXSA-N"
"O=C(C1)OCCCCCCCCCCCCC1","InChI=1S/C15H28O2/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17-15/h1-14H2","FKUPPRZPSYCDRS-UHFFFAOYSA-N"
"O=C(C1)OCCOC(=O)CCCCCCCCC1","InChI=1S/C14H24O4/c15-13-9-7-5-3-1-2-4-6-8-10-14(16)18-12-11-17-13/h1-12H2","GJJSUPSPZIZYPM-UHFFFAOYSA-N"
"O=C(C1)Oc(c2)c(ccc2)C1","InChI=1S/C9H8O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-4H,5-6H2","VMUXSMXIQBNMGZ-UHFFFAOYSA-N"
"CC(C1)OC(=O)C1","InChI=1S/C5H8O2/c1-4-2-3-5(6)7-4/h4H,2-3H2,1H3","GAEKPEKOJKCEMS-UHFFFAOYSA-N"
"CCCC(C1)OC(=O)C1","InChI=1S/C7H12O2/c1-2-3-6-4-5-7(8)9-6/h6H,2-5H2,1H3","VLSVVMPLPMNWBH-UHFFFAOYSA-N"
"CCCCC(C1)OC(=O)C1","InChI=1S/C8H14O2/c1-2-3-4-7-5-6-8(9)10-7/h7H,2-6H2,1H3","IPBFYZQJXZJBFQ-UHFFFAOYSA-N"
"CCCCCC(C1)OC(=O)C1","InChI=1S/C9H16O2/c1-2-3-4-5-8-6-7-9(10)11-8/h8H,2-7H2,1H3","OALYTRUKMRCXNH-UHFFFAOYSA-N"
"CCCCCCC(C1)OC(=O)C1","InChI=1S/C10H18O2/c1-2-3-4-5-6-9-7-8-10(11)12-9/h9H,2-8H2,1H3","IFYYFLINQYPWGJ-UHFFFAOYSA-N"
"CCCCCCCCC(C1)OC(=O)C1","InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-11-9-10-12(13)14-11/h11H,2-10H2,1H3","WGPCZPLRVAWXPW-UHFFFAOYSA-N"
"CC(C1)OC(=O)CC1","InChI=1S/C6H10O2/c1-5-3-2-4-6(7)8-5/h5H,2-4H2,1H3","RZTOWFMDBDPERY-UHFFFAOYSA-N"
"CCCC(C1)OC(=O)CC1","InChI=1S/C8H14O2/c1-2-4-7-5-3-6-8(9)10-7/h7H,2-6H2,1H3","FYTRVXSHONWYNE-UHFFFAOYSA-N"
"CCCCC(C1)OC(=O)CC1","InChI=1S/C9H16O2/c1-2-3-5-8-6-4-7-9(10)11-8/h8H,2-7H2,1H3","PXRBWNLUQYZAAX-UHFFFAOYSA-N"
"CCCCCC(C1)OC(=O)CC1","InChI=1S/C10H18O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h9H,2-8H2,1H3","GHBSPIPJMLAMEP-UHFFFAOYSA-N"
"CCCCCCC(C1)OC(=O)CC1","InChI=1S/C11H20O2/c1-2-3-4-5-7-10-8-6-9-11(12)13-10/h10H,2-9H2,1H3","YZRXRLLRSPQHDK-UHFFFAOYSA-N"
"CCCCCCCC(C1)OC(=O)CC1","InChI=1S/C12H22O2/c1-2-3-4-5-6-8-11-9-7-10-12(13)14-11/h11H,2-10H2,1H3","QRPLZGZHJABGRS-UHFFFAOYSA-N"
"CCCCCCCCC(C1)OC(=O)CC1","InChI=1S/C13H24O2/c1-2-3-4-5-6-7-9-12-10-8-11-13(14)15-12/h12H,2-11H2,1H3","RZZLMGATMUAJPX-UHFFFAOYSA-N"
"CCCCCCCCCC(C1)OC(=O)CC1","InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-10-13-11-9-12-14(15)16-13/h13H,2-12H2,1H3","SKQYTJLYRIFFCO-UHFFFAOYSA-N"
"CCCCS","InChI=1S/C4H10S/c1-2-3-4-5/h5H,2-4H2,1H3","WQAQPCDUOCURKW-UHFFFAOYSA-N"
"CCC(C)CS","InChI=1S/C5H12S/c1-3-5(2)4-6/h5-6H,3-4H2,1-2H3","WGQKBCSACFQGQY-UHFFFAOYSA-N"
"CCCCCC(C)(C)S","InChI=1S/C8H18S/c1-4-5-6-7-8(2,3)9/h9H,4-7H2,1-3H3","KSTAKRCVPORMCA-UHFFFAOYSA-N"
"CCCCCCCCCCCCCS","InChI=1S/C13H28S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h14H,2-13H2,1H3","IPBROXKVGHZHJV-UHFFFAOYSA-N"
"OCCCSC","InChI=1S/C4H10OS/c1-6-4-2-3-5/h5H,2-4H2,1H3","CZUGFKJYCPYHHV-UHFFFAOYSA-N"
"CCCC(SC)CCO","InChI=1S/C7H16OS/c1-3-4-7(9-2)5-6-8/h7-8H,3-6H2,1-2H3","JSASXSHMJYRPCM-UHFFFAOYSA-N"
"OCc(c1)scc1","InChI=1S/C5H6OS/c6-4-5-2-1-3-7-5/h1-3,6H,4H2","ZPHGMBGIFODUMF-UHFFFAOYSA-N"
"CCSC","InChI=1S/C3H8S/c1-3-4-2/h3H2,1-2H3","WXEHBUMAEPOYKP-UHFFFAOYSA-N"
"CCCSC","InChI=1S/C4H10S/c1-3-4-5-2/h3-4H2,1-2H3","ZOASGOXWEHUTKZ-UHFFFAOYSA-N"
"CC(C)CSC","InChI=1S/C5H12S/c1-5(2)4-6-3/h5H,4H2,1-3H3","UYVGFIKOUAFDOZ-UHFFFAOYSA-N"
"CCCCN(C(=O)COC(C)=O)C(=O)c(c1)cccc1","InChI=1S/C15H19NO4/c1-3-4-10-16(14(18)11-20-12(2)17)15(19)13-8-6-5-7-9-13/h5-9H,3-4,10-11H2,1-2H3","SYAZCNUTZALLGP-UHFFFAOYSA-N"
"CCCCN(CC=CC)C(=O)COC(C1)OCCC1","InChI=1S/C15H27NO3/c1-3-5-10-16(11-6-4-2)14(17)13-19-15-9-7-8-12-18-15/h3,5,15H,4,6-13H2,1-2H3/b5-3+","AWBUGUYQGYOYJN-HWKANZROSA-N"
"CCCCNC(=O)C(O)C(C)C=C","InChI=1S/C10H19NO2/c1-4-6-7-11-10(13)9(12)8(3)5-2/h5,8-9,12H,2,4,6-7H2,1,3H3,(H,11,13)","PYKIEYOLXBNQDR-UHFFFAOYSA-N"
"CCCCN(C(=O)c(c1)cccc1)C(=O)C(C)(C)OC(C)=O","InChI=1S/C17H23NO4/c1-5-6-12-18(15(20)14-10-8-7-9-11-14)16(21)17(3,4)22-13(2)19/h7-11H,5-6,12H2,1-4H3","QSFHHPHMJZXYCC-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)S(N)=O","InChI=1S/C7H9NOS/c1-6-2-4-7(5-3-6)10(8)9/h2-5H,8H2,1H3","YNJDSRPIGAUCEE-UHFFFAOYSA-N"
"CCOC(=O)C(C)(C)COC(=O)NC(C)c(c1)cccc1","InChI=1S/C16H23NO4/c1-5-20-14(18)16(3,4)11-21-15(19)17-12(2)13-9-7-6-8-10-13/h6-10,12H,5,11H2,1-4H3,(H,17,19)","ZLDKFUYLNNFVFL-UHFFFAOYSA-N"
"C=CC([H])(C)C([H])(C)C(=O)NC([H])(C)c(c1)cccc1","InChI=1S/C15H21NO/c1-5-11(2)12(3)15(17)16-13(4)14-9-7-6-8-10-14/h5-13H,1H2,2-4H3,(H,16,17)/t11-,12-,13+/m0/s1","WBTKZEUGXDCOIT-RWMBFGLXSA-N"
"CCCCN(CC([2H])=CC)C(C)=O","InChI=1S/C10H19NO/c1-4-6-8-11(10(3)12)9-7-5-2/h4,6H,5,7-9H2,1-3H3/b6-4+/i6D","WJCKRGOUNCVHKN-DRXCQHCBSA-N"
"CCCCN(CC=CC)C(=O)CC(C)=O","InChI=1S/C12H21NO2/c1-4-6-8-13(9-7-5-2)12(15)10-11(3)14/h4,6H,5,7-10H2,1-3H3/b6-4+","ONPFXSVFNBDDME-GQCTYLIASA-N"
"CCC=CN(C(=O)CC)C(C)C(C)(C)C","InChI=1S/C13H25NO/c1-7-9-10-14(12(15)8-2)11(3)13(4,5)6/h9-11H,7-8H2,1-6H3/b10-9+","HVLRNHJPLZLMAS-MDZDMXLPSA-N"
"Fc(c(F)2)c(F)c(F)c(c(F)2)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C12F10/c13-3-1(4(14)8(18)11(21)7(3)17)2-5(15)9(19)12(22)10(20)6(2)16","ONUFSRWQCKNVSL-UHFFFAOYSA-N"
"Brc(c2)ccc(c2)c(c1)ccc(Br)c1","InChI=1S/C12H8Br2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H","HQJQYILBCQPYBI-UHFFFAOYSA-N"
"c(c3)cc(c(Br)1)c(c3)c(Br)c(c2)c(ccc2)1","InChI=1S/C14H8Br2/c15-13-9-5-1-2-6-10(9)14(16)12-8-4-3-7-11(12)13/h1-8H","BRUOAURMAFDGLP-UHFFFAOYSA-N"
"[2H]c(c([2H])1)c([2H])c([2H])c(O)c([2H])1","InChI=1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H/i1D,2D,3D,4D,5D","ISWSIDIOOBJBQZ-RALIUCGRSA-N"
"[2H]c(c([2H])1)c([2H])c(c([2H])2)c(c([2H])c([2H])c([2H])2)c([2H])1","InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H/i1D,2D,3D,4D,5D,6D,7D,8D","UFWIBTONFRDIAS-PGRXLJNUSA-N"
"Fc(c2)c(ccc2)c(c1)cccc1","InChI=1S/C12H9F/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H","KLECYOQFQXJYBC-UHFFFAOYSA-N"
"[2H]c(c([2H])3)c([2H])c(c([2H])1)c(c([2H])3)c([2H])c(c([2H])2)c(c([2H])c([2H])c([2H])2)1","InChI=1S/C14H10/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-10H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D","MWPLVEDNUUSJAV-LHNTUAQVSA-N"
"[2H]c(c([2H])3)c([2H])c(n1)c(c([2H])3)c([2H])c(c([2H])2)c(c([2H])c([2H])c([2H])2)1","InChI=1S/C13H9N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-9H/i1D,2D,3D,4D,5D,6D,7D,8D,9D","DZBUGLKDJFMEHC-LOIXRAQWSA-N"
"O=Cc(c(C)1)c(C)cc(C)c1","InChI=1S/C10H12O/c1-7-4-8(2)10(6-11)9(3)5-7/h4-6H,1-3H3","HIKRJHFHGKZKRI-UHFFFAOYSA-N"
"O=Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C11H8O/c12-8-10-6-3-5-9-4-1-2-7-11(9)10/h1-8H","SQAINHDHICKHLX-UHFFFAOYSA-N"
"ClC(Cl)=C(Cl)Cl","InChI=1S/C2Cl4/c3-1(4)2(5)6","CYTYCFOTNPOANT-UHFFFAOYSA-N"
"C=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C8H4F5NO/c1-14-15-2-3-4(9)6(11)8(13)7(12)5(3)10/h1-2H2","SRTQFRQWTUMMTC-UHFFFAOYSA-N"
"CC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C9H6F5NO/c1-2-15-16-3-4-5(10)7(12)9(14)8(13)6(4)11/h2H,3H2,1H3/b15-2+","AKDRYEADQPNLOH-RSSMCMFDSA-N"
"CCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C10H8F5NO/c1-2-3-16-17-4-5-6(11)8(13)10(15)9(14)7(5)12/h3H,2,4H2,1H3/b16-3+","BOPZGAUHLLBMFA-HQYXKAPLSA-N"
"CCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C11H10F5NO/c1-2-3-4-17-18-5-6-7(12)9(14)11(16)10(15)8(6)13/h4H,2-3,5H2,1H3/b17-4+","MDJOICYRBFIYJJ-HAVNEIBRSA-N"
"CCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C13H14F5NO/c1-2-3-4-5-6-19-20-7-8-9(14)11(16)13(18)12(17)10(8)15/h6H,2-5,7H2,1H3/b19-6-","GPAVMFOMYSGJDM-SWNXQHNESA-N"
"CCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C14H16F5NO/c1-2-3-4-5-6-7-20-21-8-9-10(15)12(17)14(19)13(18)11(9)16/h7H,2-6,8H2,1H3/b20-7-","OZZBQOMRSSEYJF-SCDVKCJHSA-N"
"CCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C15H18F5NO/c1-2-3-4-5-6-7-8-21-22-9-10-11(16)13(18)15(20)14(19)12(10)17/h8H,2-7,9H2,1H3/b21-8-","RLSQIXNUITTXKZ-WNFQYIGGSA-N"
"CCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C16H20F5NO/c1-2-3-4-5-6-7-8-9-22-23-10-11-12(17)14(19)16(21)15(20)13(11)18/h9H,2-8,10H2,1H3/b22-9-","DYTJHXNVXCBNHN-AFPJDJCSSA-N"
"CCCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C17H22F5NO/c1-2-3-4-5-6-7-8-9-10-23-24-11-12-13(18)15(20)17(22)16(21)14(12)19/h10H,2-9,11H2,1H3/b23-10+","NUGDFCWVLOJWOP-AUEPDCJTSA-N"
"CCCCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C18H24F5NO/c1-2-3-4-5-6-7-8-9-10-11-24-25-12-13-14(19)16(21)18(23)17(22)15(13)20/h11H,2-10,12H2,1H3/b24-11-","XJDXRHQPJGTNHN-MYKKPKGFSA-N"
"CCCCCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C19H26F5NO/c1-2-3-4-5-6-7-8-9-10-11-12-25-26-13-14-15(20)17(22)19(24)18(23)16(14)21/h12H,2-11,13H2,1H3/b25-12-","KVESFPFADCWDQR-ROTLSHHCSA-N"
"CCCCCCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C20H28F5NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-26-27-14-15-16(21)18(23)20(25)19(24)17(15)22/h13H,2-12,14H2,1H3/b26-13+","RBTHWMFPSLXCNJ-LGJNPRDNSA-N"
"CCCCCCCCCCCCCC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C21H30F5NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-27-28-15-16-17(22)19(24)21(26)20(25)18(16)23/h14H,2-13,15H2,1H3/b27-14+","XGPWCYWECONRBN-MZJWZYIUSA-N"
"CC(C)=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C10H8F5NO/c1-4(2)16-17-3-5-6(11)8(13)10(15)9(14)7(5)12/h3H2,1-2H3","DLIFNTQMBOCKTL-UHFFFAOYSA-N"
"CCC(C)=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C11H10F5NO/c1-3-5(2)17-18-4-6-7(12)9(14)11(16)10(15)8(6)13/h3-4H2,1-2H3/b17-5-","LNDQFOSWZJYEIC-ZWSORDCHSA-N"
"c(c2)ccc(c2)C=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C14H8F5NO/c15-10-9(11(16)13(18)14(19)12(10)17)7-21-20-6-8-4-2-1-3-5-8/h1-6H,7H2/b20-6+","UKSAZCDAGVHMRF-CGOBSMCZSA-N"
"C(C=NOCc(c(F)2)c(F)c(F)c(F)c(F)2)=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C16H6F10N2O2/c17-7-5(8(18)12(22)15(25)11(7)21)3-29-27-1-2-28-30-4-6-9(19)13(23)16(26)14(24)10(6)20/h1-2H,3-4H2/b27-1-,28-2-","VNVBOBJSRGZDCW-OFELNDECSA-N"
"CC(C=NOCc(c(F)2)c(F)c(F)c(F)c(F)2)=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C17H8F10N2O2/c1-5(29-31-4-7-10(20)14(24)17(27)15(25)11(7)21)2-28-30-3-6-8(18)12(22)16(26)13(23)9(6)19/h2H,3-4H2,1H3","ULNZDMZUVMUJSZ-UHFFFAOYSA-N"
"C=CC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C10H6F5NO/c1-2-3-16-17-4-5-6(11)8(13)10(15)9(14)7(5)12/h2-3H,1,4H2/b16-3+","ICDUEGOPUWNJNF-HQYXKAPLSA-N"
"CC=CC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C11H8F5NO/c1-2-3-4-17-18-5-6-7(12)9(14)11(16)10(15)8(6)13/h2-4H,5H2,1H3/b3-2+,17-4+","QNPFFCQTVXPCLD-GFJWLWTISA-N"
"CCCCC=CC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C14H14F5NO/c1-2-3-4-5-6-7-20-21-8-9-10(15)12(17)14(19)13(18)11(9)16/h5-7H,2-4,8H2,1H3/b6-5+,20-7+","PEYJSQOBEFLESI-RGQKVHTQSA-N"
"CCCC=CC=NOCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C13H12F5NO/c1-2-3-4-5-6-19-20-7-8-9(14)11(16)13(18)12(17)10(8)15/h4-6H,2-3,7H2,1H3/b5-4+,19-6+","UFLHMANGSVRSPF-QZRSKMOPSA-N"
"N#Cc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C7F5N/c8-3-2(1-13)4(9)6(11)7(12)5(3)10","YXWJGZQOGXGSSC-UHFFFAOYSA-N"
"O=Cc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C7HF5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h1H","QJXCFMJTJYCLFG-UHFFFAOYSA-N"
"OCc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C7H3F5O/c8-3-2(1-13)4(9)6(11)7(12)5(3)10/h13H,1H2","PGJYYCIOYBZTPU-UHFFFAOYSA-N"
"Fc(c(F)1)c(F)c(F)c(C=NOCc(c(F)2)c(F)c(F)c(F)c(F)2)c(F)1","InChI=1S/C14H3F10NO/c15-5-3(6(16)10(20)13(23)9(5)19)1-25-26-2-4-7(17)11(21)14(24)12(22)8(4)18/h1H,2H2/b25-1+","CBUMHWYKQJKMTE-WDOSQBGKSA-N"
"CCOC(=O)C(C)Sc(c1)cccc1","InChI=1S/C11H14O2S/c1-3-13-11(12)9(2)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3","AFQJVOVRMATZLA-UHFFFAOYSA-N"
"OCc(c1)ccc(c1)O[Si](C)(C)C(C)(C)C","InChI=1S/C13H22O2Si/c1-13(2,3)16(4,5)15-12-8-6-11(10-14)7-9-12/h6-9,14H,10H2,1-5H3","FQYWTODLVZFTLW-UHFFFAOYSA-N"
"c(O[Si](C(C)(C)C)(C)C)(c1)ccc(COCc(c2)ccc(O[Si](C(C)(C)C)(C)C)c2)c1","InChI=1S/C26H42O3Si2/c1-25(2,3)30(7,8)28-23-15-11-21(12-16-23)19-27-20-22-13-17-24(18-14-22)29-31(9,10)26(4,5)6/h11-18H,19-20H2,1-10H3","UPMJRTAREPBQGL-UHFFFAOYSA-N"
"COCOc(c1)ccc(COCc(c2)ccc(OCOC)c2)c1","InChI=1S/C18H22O5/c1-19-13-22-17-7-3-15(4-8-17)11-21-12-16-5-9-18(10-6-16)23-14-20-2/h3-10H,11-14H2,1-2H3","NWHIUNAHUVUFJR-UHFFFAOYSA-N"
"COc(c2)ccc(c2)COC(C)c(c1)ccc(OC)c1","InChI=1S/C17H20O3/c1-13(15-6-10-17(19-3)11-7-15)20-12-14-4-8-16(18-2)9-5-14/h4-11,13H,12H2,1-3H3","PIHQWXYOLCJTFL-UHFFFAOYSA-N"
"CN(C)c(c2)ccc(c2)Cc(c1)ccc(N(C)C)c1","InChI=1S/C17H22N2/c1-18(2)16-9-5-14(6-10-16)13-15-7-11-17(12-8-15)19(3)4/h5-12H,13H2,1-4H3","JNRLEMMIVRBKJE-UHFFFAOYSA-N"
"COc(c2)c(ccc2)COCc(c1)c(OC)ccc1","InChI=1S/C16H18O3/c1-17-15-9-5-3-7-13(15)11-19-12-14-8-4-6-10-16(14)18-2/h3-10H,11-12H2,1-2H3","UCXQVIZWEKJYRY-UHFFFAOYSA-N"
"COc(c2)cc(cc2)COCc(c1)cc(OC)cc1","InChI=1S/C16H18O3/c1-17-15-7-3-5-13(9-15)11-19-12-14-6-4-8-16(10-14)18-2/h3-10H,11-12H2,1-2H3","QBMDJGYKNWADIS-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(C)Cl","InChI=1S/C9H11ClO/c1-7(10)8-3-5-9(11-2)6-4-8/h3-7H,1-2H3","ZVBHVYBULNCPQB-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C(C)OC(C)c(c1)ccc(OC)c1","InChI=1S/C18H22O3/c1-13(15-5-9-17(19-3)10-6-15)21-14(2)16-7-11-18(20-4)12-8-16/h5-14H,1-4H3","ADAKWJDMGHHKIK-UHFFFAOYSA-N"
"c(c1)c(ccc(C(c(c4)ccc(c4)OC)OC(c(c3)ccc(c3)OC)c(c2)ccc(c2)OC)1)OC","InChI=1S/C30H30O5/c1-31-25-13-5-21(6-14-25)29(22-7-15-26(32-2)16-8-22)35-30(23-9-17-27(33-3)18-10-23)24-11-19-28(34-4)20-12-24/h5-20,29-30H,1-4H3","JDGODNFIWJDHSS-UHFFFAOYSA-N"
"COc(c1)ccc(COCc(c2)ccc(OC)c2)c1","InChI=1S/C16H18O3/c1-17-15-7-3-13(4-8-15)11-19-12-14-5-9-16(18-2)10-6-14/h3-10H,11-12H2,1-2H3","SDTORDSXCYSNTD-UHFFFAOYSA-N"
"CC(C)=CCOc(c1)cc(O2)c(C=CC(=O)2)c1","InChI=1S/C14H14O3/c1-10(2)7-8-16-12-5-3-11-4-6-14(15)17-13(11)9-12/h3-7,9H,8H2,1-2H3","SMHJTSOVVRGDEO-UHFFFAOYSA-N"
"O=CC(C2)=CC([H])(C(C=C)1)C([H])(C2)C(=C)CC1","InChI=1S/C14H18O/c1-3-12-6-4-10(2)13-7-5-11(9-15)8-14(12)13/h3,8-9,12-14H,1-2,4-7H2/t12-,13+,14+/m0/s1","CYPSKZONDWFFBC-BFHYXJOUSA-N"
"CC(C2)=CC([H])(C(C(C)=O)1)C([H])(C2)C(=C)CC1","InChI=1S/C14H20O/c1-9-4-6-12-10(2)5-7-13(11(3)15)14(12)8-9/h8,12-14H,2,4-7H2,1,3H3/t12-,13-,14+/m1/s1","YXIJNEOZFSAIAQ-MCIONIFRSA-N"
"CC(C3)CC(O)C(C3)C(C)(C)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C20H26O/c1-14-8-11-18(19(21)12-14)20(2,3)17-10-9-15-6-4-5-7-16(15)13-17/h4-7,9-10,13-14,18-19,21H,8,11-12H2,1-3H3","AKVNKXYVBBUSEZ-UHFFFAOYSA-N"
"C[SiH](C)O[SiH](C)C","InChI=1S/C4H14OSi2/c1-6(2)5-7(3)4/h6-7H,1-4H3","NVYQDQZEMGUESH-UHFFFAOYSA-N"
"C=C[Si](OC)(OC)OC","InChI=1S/C5H12O3Si/c1-5-9(6-2,7-3)8-4/h5H,1H2,2-4H3","NKSJNEHGWDZZQF-UHFFFAOYSA-N"
"OCCC(C)CCO","InChI=1S/C6H14O2/c1-6(2-4-7)3-5-8/h6-8H,2-5H2,1H3","SXFJDZNJHVPHPH-UHFFFAOYSA-N"
"C(O1)OCOC1","InChI=1S/C3H6O3/c1-4-2-6-3-5-1/h1-3H2","BGJSXRVXTHVRSN-UHFFFAOYSA-N"
"OCCC(C)=O","InChI=1S/C4H8O2/c1-4(6)2-3-5/h5H,2-3H2,1H3","LVSQXDHWDCMMRJ-UHFFFAOYSA-N"
"C(C1)OCO1","InChI=1S/C3H6O2/c1-2-5-3-4-1/h1-3H2","WNXJIVFYUVYPPR-UHFFFAOYSA-N"
"N#CCCOC","InChI=1S/C4H7NO/c1-6-4-2-3-5/h2,4H2,1H3","OOWFYDWAMOKVSF-UHFFFAOYSA-N"
"CCO[Si](C=C)(OCC)OCC","InChI=1S/C8H18O3Si/c1-5-9-12(8-4,10-6-2)11-7-3/h8H,4-7H2,1-3H3","FWDBOZPQNFPOLF-UHFFFAOYSA-N"
"C(C1)CCC=CC1","InChI=1S/C7H12/c1-2-4-6-7-5-3-1/h1-2H,3-7H2","ZXIJMRYMVAMXQP-UHFFFAOYSA-N"
"CCO[Si](C)(C)OCC","InChI=1S/C6H16O2Si/c1-5-7-9(3,4)8-6-2/h5-6H2,1-4H3","YYLGKUPAFFKGRQ-UHFFFAOYSA-N"
"CCOCCC(C)=O","InChI=1S/C6H12O2/c1-3-8-5-4-6(2)7/h3-5H2,1-2H3","YFBGSHHKHHCVDI-UHFFFAOYSA-N"
"O=C(Cl)Oc(c1)cccc1","InChI=1S/C7H5ClO2/c8-7(9)10-6-4-2-1-3-5-6/h1-5H","AHWALFGBDFAJAI-UHFFFAOYSA-N"
"COP(=O)OC","InChI=1S/C2H7O3P/c1-4-6(3)5-2/h6H,1-2H3","HZCDANOFLILNSA-UHFFFAOYSA-N"
"OCCCC(C)=O","InChI=1S/C5H10O2/c1-5(7)3-2-4-6/h6H,2-4H2,1H3","JSHPTIGHEWEXRW-UHFFFAOYSA-N"
"COCCOC(=O)Cl","InChI=1S/C4H7ClO3/c1-7-2-3-8-4(5)6/h2-3H2,1H3","NDYYWMXJZWHRLZ-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(=O)C([2H])([2H])[2H]","InChI=1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3","CSCPPACGZOOCGX-WFGJKAKNSA-N"
"[2H]C([2H])([2H])C([2H])(Cl)C([2H])([2H])[2H]","InChI=1S/C3H7Cl/c1-3(2)4/h3H,1-2H3/i1D3,2D3,3D","ULYZAYCEDJDHCC-YYWVXINBSA-N"
"C=CCBr","InChI=1S/C3H5Br/c1-2-3-4/h2H,1,3H2","BHELZAPQIKSEDF-UHFFFAOYSA-N"
"[SiH3]c(c1)cccc1","InChI=1S/C6H8Si/c7-6-4-2-1-3-5-6/h1-5H,7H3","PARWUHTVGZSQPD-UHFFFAOYSA-N"
"Nc(c1)c(S)ccc1","InChI=1S/C6H7NS/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2","VRVRGVPWCUEOGV-UHFFFAOYSA-N"
"CCOC(=O)CC(=O)CCl","InChI=1S/C6H9ClO3/c1-2-10-6(9)3-5(8)4-7/h2-4H2,1H3","OHLRLMWUFVDREV-UHFFFAOYSA-N"
"CO[Si](OC)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C14H16O2Si/c1-15-17(16-2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3-12H,1-2H3","AHUXYBVKTIBBJW-UHFFFAOYSA-N"
"c(c1)ccc(c1)[Si](Cl)(Cl)Cl","InChI=1S/C6H5Cl3Si/c7-10(8,9)6-4-2-1-3-5-6/h1-5H","ORVMIVQULIKXCP-UHFFFAOYSA-N"
"c(c1)ccc(c1)[Si](C)(C)C","InChI=1S/C9H14Si/c1-10(2,3)9-7-5-4-6-8-9/h4-8H,1-3H3","KXFSUVJPEQYUGN-UHFFFAOYSA-N"
"CCOP(=O)OCC","InChI=1S/C4H11O3P/c1-3-6-8(5)7-4-2/h8H,3-4H2,1-2H3","MJUJXFBTEFXVKU-UHFFFAOYSA-N"
"CO","InChI=1S/CH4O/c1-2/h2H,1H3","OKKJLVBELUTLKV-UHFFFAOYSA-N"
"C[Si](C)(C)C","InChI=1S/C4H12Si/c1-5(2,3)4/h1-4H3","CZDYPVPMEAXLPK-UHFFFAOYSA-N"
"CCOCCN","InChI=1S/C4H11NO/c1-2-6-4-3-5/h2-5H2,1H3","BPGIOCZAQDIBPI-UHFFFAOYSA-N"
"CCCCOP(=O)(CCCC)OCCCC","InChI=1S/C12H27O3P/c1-4-7-10-14-16(13,12-9-6-3)15-11-8-5-2/h4-12H2,1-3H3","JPGXOMADPRULAC-UHFFFAOYSA-N"
"c(c3)ccc(c3)OP(=O)(Oc(c2)cccc2)c(c1)cccc1","InChI=1S/C18H15O3P/c19-22(18-14-8-3-9-15-18,20-16-10-4-1-5-11-16)21-17-12-6-2-7-13-17/h1-15H","CDOMXXVCZQOOMT-UHFFFAOYSA-N"
"CC=CCO","InChI=1S/C4H8O/c1-2-3-4-5/h2-3,5H,4H2,1H3/b3-2+","WCASXYBKJHWFMY-NSCUHMNNSA-N"
"C(C1)CCOC1","InChI=1S/C5H10O/c1-2-4-6-5-3-1/h1-5H2","DHXVGJBLRPWPCS-UHFFFAOYSA-N"
"OCC(C1)OCCC1","InChI=1S/C6H12O2/c7-5-6-3-1-2-4-8-6/h6-7H,1-5H2","ROTONRWJLXYJBD-UHFFFAOYSA-N"
"CC(=O)OCC(C1)OCC1","InChI=1S/C7H12O3/c1-6(8)10-5-7-3-2-4-9-7/h7H,2-5H2,1H3","AAQDYYFAFXGBFZ-UHFFFAOYSA-N"
"Cc(c1)c(C)c(C)c(C)c1","InChI=1S/C10H14/c1-7-5-6-8(2)10(4)9(7)3/h5-6H,1-4H3","UOHMMEJUHBCKEE-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(C)c(C)1","InChI=1S/C10H14/c1-7-5-8(2)10(4)9(3)6-7/h5-6H,1-4H3","BFIMMTCNYPIMRN-UHFFFAOYSA-N"
"CCCCC(O)=O","InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)","NQPDZGIKBAWPEJ-UHFFFAOYSA-N"
"O=C(C1)c(c2)c(ccc2)CC1","InChI=1S/C10H10O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-2,4,6H,3,5,7H2","XHLHPRDBBAGVEG-UHFFFAOYSA-N"
"C=CCCCCCCCCC(O)=O","InChI=1S/C11H20O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2H,1,3-10H2,(H,12,13)","FRPZMMHWLSIFAZ-UHFFFAOYSA-N"
"CN(C)CCCN(C)C","InChI=1S/C7H18N2/c1-8(2)6-5-7-9(3)4/h5-7H2,1-4H3","DMQSHEKGGUOYJS-UHFFFAOYSA-N"
"CN(C)CCCCCCN(C)C","InChI=1S/C10H24N2/c1-11(2)9-7-5-6-8-10-12(3)4/h5-10H2,1-4H3","TXXWBTOATXBWDR-UHFFFAOYSA-N"
"CN(C)CCC(C)N(C)C","InChI=1S/C8H20N2/c1-8(10(4)5)6-7-9(2)3/h8H,6-7H2,1-5H3","AXFVIWBTKYFOCY-UHFFFAOYSA-N"
"CCC(C)Br","InChI=1S/C4H9Br/c1-3-4(2)5/h4H,3H2,1-2H3","UPSXAPQYNGXVBF-UHFFFAOYSA-N"
"CC(C1)CC(=O)C(C)1","InChI=1S/C7H12O/c1-5-3-6(2)7(8)4-5/h5-6H,3-4H2,1-2H3","UKJQTRVEZWBIRE-UHFFFAOYSA-N"
"CC(C1)CC(C)(C)C(=O)1","InChI=1S/C8H14O/c1-6-4-7(9)8(2,3)5-6/h6H,4-5H2,1-3H3","PJXIBUIXCXSNCM-UHFFFAOYSA-N"
"[2H]C([2H])(C1)C(=O)C([2H])([2H])C1","InChI=1S/C5H8O/c6-5-3-1-2-4-5/h1-4H2/i3D2,4D2","BGTOWKSIORTVQH-KHORGVISSA-N"
"[2H]C([2H])(C1)C(=O)C([2H])(C)C1","InChI=1S/C6H10O/c1-5-3-2-4-6(5)7/h5H,2-4H2,1H3/i4D2,5D","ZIXLDMFVRPABBX-AFBAWBIXSA-N"
"CC(C1)C([2H])([2H])C(=O)C([2H])([2H])1","InChI=1S/C6H10O/c1-5-2-3-6(7)4-5/h5H,2-4H2,1H3/i3D2,4D2","AOKRXIIIYJGNNU-KHORGVISSA-N"
"CC(C1)C([2H])([2H])C(=O)C([2H])(C)1","InChI=1S/C7H12O/c1-5-3-6(2)7(8)4-5/h5-6H,3-4H2,1-2H3/i4D2,6D","UKJQTRVEZWBIRE-HRMNUFNHSA-N"
"CC(C1)C([2H])([2H])C(=O)C(C)(C)1","InChI=1S/C8H14O/c1-6-4-7(9)8(2,3)5-6/h6H,4-5H2,1-3H3/i4D2","PJXIBUIXCXSNCM-APZFVMQVSA-N"
"CCC(C1)COC1","InChI=1S/C6H12O/c1-2-6-3-4-7-5-6/h6H,2-5H2,1H3","AIUUAKHKOQFCKF-UHFFFAOYSA-N"
"CCC(C1)OCC1","InChI=1S/C6H12O/c1-2-6-4-3-5-7-6/h6H,2-5H2,1H3","IHMXVSZXHFTOFN-UHFFFAOYSA-N"
"OC(C1)COC1","InChI=1S/C4H8O2/c5-4-1-2-6-3-4/h4-5H,1-3H2","XDPCNPCKDGQBAN-UHFFFAOYSA-N"
"CC(C1)COC1","InChI=1S/C5H10O/c1-5-2-3-6-4-5/h5H,2-4H2,1H3","LJPCNSSTRWGCMZ-UHFFFAOYSA-N"
"CCC([H])([2H])C","InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3/i3D","IJDNQMDRQITEOD-WFVSFCRTSA-N"
"[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]","InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3/i1D3,2D3,3D2,4D2","IJDNQMDRQITEOD-MWUKXHIBSA-N"
"CC(=O)OC(C1)C(C)CCC1","InChI=1S/C9H16O2/c1-7-5-3-4-6-9(7)11-8(2)10/h7,9H,3-6H2,1-2H3","AKIIJALHGMKJEJ-UHFFFAOYSA-N"
"CC(=O)OC(C1)CC(C)CC1","InChI=1S/C9H16O2/c1-7-4-3-5-9(6-7)11-8(2)10/h7,9H,3-6H2,1-2H3","POTQUGZZORQESZ-UHFFFAOYSA-N"
"CC(=O)OC(C1)CCC(C)C1","InChI=1S/C9H16O2/c1-7-3-5-9(6-4-7)11-8(2)10/h7,9H,3-6H2,1-2H3","VJBFCCCTSQEGMH-UHFFFAOYSA-N"
"CCC(C1)C(CCC1)OC(C)=O","InChI=1S/C10H18O2/c1-3-9-6-4-5-7-10(9)12-8(2)11/h9-10H,3-7H2,1-2H3","FTTKPCQDOGXTPC-UHFFFAOYSA-N"
"CCCC(C1)C(CCC1)OC(C)=O","InChI=1S/C11H20O2/c1-3-6-10-7-4-5-8-11(10)13-9(2)12/h10-11H,3-8H2,1-2H3","AZQJVKFEQQZYBC-UHFFFAOYSA-N"
"[H]C(C2)=C(CCC2)C(C)(O1)OCC1","InChI=1S/C10H16O2/c1-10(11-7-8-12-10)9-5-3-2-4-6-9/h5H,2-4,6-8H2,1H3","SKSVOXIMUGXIMZ-UHFFFAOYSA-N"
"COCCCCCCCCCC(C)CC","InChI=1S/C14H30O/c1-4-14(2)12-10-8-6-5-7-9-11-13-15-3/h14H,4-13H2,1-3H3","LDZDWAZXLUQRFM-UHFFFAOYSA-N"
"CNC(=C1)C(C)OC(=O)1","InChI=1S/C6H9NO2/c1-4-5(7-2)3-6(8)9-4/h3-4,7H,1-2H3","USTBRJZDDHHMQT-UHFFFAOYSA-N"
"CCOC(=O)C(C)(CCBr)Sc(c1)cccc1","InChI=1S/C13H17BrO2S/c1-3-16-12(15)13(2,9-10-14)17-11-7-5-4-6-8-11/h4-8H,3,9-10H2,1-2H3","ZFYZGJXPPJKWJM-UHFFFAOYSA-N"
"CCCC([2H])([H])[2H]","InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3/i1D2","IJDNQMDRQITEOD-DICFDUPASA-N"
"O=C(C=Cc(c2)cccc2)OC(C1)CCCC1","InChI=1S/C15H18O2/c16-15(17-14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1,3-4,7-8,11-12,14H,2,5-6,9-10H2/b12-11+","GCFAUZGWPDYAJN-VAWYXSNFSA-N"
"CCC=CCCOC(=O)c(c1)c(O)ccc1","InChI=1S/C13H16O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h3-6,8-9,14H,2,7,10H2,1H3/b4-3-","IEPWIPZLLIOZLU-ARJAWSKDSA-N"
"CCCCC(CC)COC(=O)c(c1)c(O)ccc1","InChI=1S/C15H22O3/c1-3-5-8-12(4-2)11-18-15(17)13-9-6-7-10-14(13)16/h6-7,9-10,12,16H,3-5,8,11H2,1-2H3","FMRHJJZUHUTGKE-UHFFFAOYSA-N"
"CC(C1)CC(OC(=O)c(c2)c(O)ccc2)C(C1)C(C)C","InChI=1S/C17H24O3/c1-11(2)13-9-8-12(3)10-16(13)20-17(19)14-6-4-5-7-15(14)18/h4-7,11-13,16,18H,8-10H2,1-3H3","SJOXEWUZWQYCGL-UHFFFAOYSA-N"
"Oc(c2)c(ccc2)C(=O)Oc(c1)cccc1","InChI=1S/C13H10O3/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h1-9,14H","ZQBAKBUEJOMQEX-UHFFFAOYSA-N"
"Oc(c2)c(ccc2)C(=O)OCCc(c1)cccc1","InChI=1S/C15H14O3/c16-14-9-5-4-8-13(14)15(17)18-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2","YNMSDIQQNIRGDP-UHFFFAOYSA-N"
"C=CCOC(=O)C=CC(=O)OCC=C","InChI=1S/C10H12O4/c1-3-7-13-9(11)5-6-10(12)14-8-4-2/h3-6H,1-2,7-8H2/b6-5+","ZPOLOEWJWXZUSP-AATRIKPKSA-N"
"CCCOC(=O)CC(=O)OCCC","InChI=1S/C9H16O4/c1-3-5-12-8(10)7-9(11)13-6-4-2/h3-7H2,1-2H3","LWIWFCDNJNZEKB-UHFFFAOYSA-N"
"CCCCOC(=O)CC(=O)OCCCC","InChI=1S/C11H20O4/c1-3-5-7-14-10(12)9-11(13)15-8-6-4-2/h3-9H2,1-2H3","NFKGQHYUYGYHIS-UHFFFAOYSA-N"
"O=C(CC(=O)OC(C)(C)C)OC(C)(C)C","InChI=1S/C11H20O4/c1-10(2,3)14-8(12)7-9(13)15-11(4,5)6/h7H2,1-6H3","CLPHAYNBNTVRDI-UHFFFAOYSA-N"
"CCOC(=O)C(CC)C(=O)OCC","InChI=1S/C9H16O4/c1-4-7(8(10)12-5-2)9(11)13-6-3/h7H,4-6H2,1-3H3","VQAZCUCWHIIFGE-UHFFFAOYSA-N"
"CCOC(=O)C(CC)(CC)C(=O)OCC","InChI=1S/C11H20O4/c1-5-11(6-2,9(12)14-7-3)10(13)15-8-4/h5-8H2,1-4H3","ZKBBUZRGPULIRN-UHFFFAOYSA-N"
"C=CCOC(=O)CCC(C)=O","InChI=1S/C8H12O3/c1-3-6-11-8(10)5-4-7(2)9/h3H,1,4-6H2,2H3","NETFSRNRGBJVMU-UHFFFAOYSA-N"
"CCCCOC(=O)CCC(C)=O","InChI=1S/C9H16O3/c1-3-4-7-12-9(11)6-5-8(2)10/h3-7H2,1-2H3","ISBWNEKJSSLXOD-UHFFFAOYSA-N"
"CC(C)COC(=O)CCC(C)=O","InChI=1S/C9H16O3/c1-7(2)6-12-9(11)5-4-8(3)10/h7H,4-6H2,1-3H3","WETOYPNHZMSVFZ-UHFFFAOYSA-N"
"CCCCCOC(=O)CCC(C)=O","InChI=1S/C10H18O3/c1-3-4-5-8-13-10(12)7-6-9(2)11/h3-8H2,1-2H3","NLDFWNCRMVSDMC-UHFFFAOYSA-N"
"CC(C)CCOC(=O)CCC(C)=O","InChI=1S/C10H18O3/c1-8(2)6-7-13-10(12)5-4-9(3)11/h8H,4-7H2,1-3H3","NYIALINCMIXBSP-UHFFFAOYSA-N"
"CCCCCCOC(=O)CCC(C)=O","InChI=1S/C11H20O3/c1-3-4-5-6-9-14-11(13)8-7-10(2)12/h3-9H2,1-2H3","HBBVKEXMLPMFQQ-UHFFFAOYSA-N"
"CCCCOC(=O)CC(C)=O","InChI=1S/C8H14O3/c1-3-4-5-11-8(10)6-7(2)9/h3-6H2,1-2H3","REIYHFWZISXFKU-UHFFFAOYSA-N"
"CC(C)CCOC(=O)CC(C)=O","InChI=1S/C9H16O3/c1-7(2)4-5-12-9(11)6-8(3)10/h7H,4-6H2,1-3H3","XHRGPLDMNNGHCX-UHFFFAOYSA-N"
"COc(c1)nccc1","InChI=1S/C6H7NO/c1-8-6-4-2-3-5-7-6/h2-5H,1H3","IWTFOFMTUOBLHG-UHFFFAOYSA-N"
"CCc(c1)nccn1","InChI=1S/C6H8N2/c1-2-6-5-7-3-4-8-6/h3-5H,2H2,1H3","KVFIJIWMDBAGDP-UHFFFAOYSA-N"
"CCCOC(=O)c(c1)occ1","InChI=1S/C8H10O3/c1-2-5-11-8(9)7-4-3-6-10-7/h3-4,6H,2,5H2,1H3","HSCVIIISAAEVQT-UHFFFAOYSA-N"
"CCCCCCOC(=O)c(c1)occ1","InChI=1S/C11H16O3/c1-2-3-4-5-8-14-11(12)10-7-6-9-13-10/h6-7,9H,2-5,8H2,1H3","KMLFVAGUWNPADU-UHFFFAOYSA-N"
"O=C(OCCc(c2)cccc2)c(c1)occ1","InChI=1S/C13H12O3/c14-13(12-7-4-9-15-12)16-10-8-11-5-2-1-3-6-11/h1-7,9H,8,10H2","QKPSYARWSBJEDY-UHFFFAOYSA-N"
"CCOC(=O)C=Cc(c1)occ1","InChI=1S/C9H10O3/c1-2-11-9(10)6-5-8-4-3-7-12-8/h3-7H,2H2,1H3/b6-5+","MWZBTMXISMOMAE-AATRIKPKSA-N"
"CCCOC(=O)C=Cc(c1)occ1","InChI=1S/C10H12O3/c1-2-7-13-10(11)6-5-9-4-3-8-12-9/h3-6,8H,2,7H2,1H3/b6-5+","RRFBKGHLBNBFGL-AATRIKPKSA-N"
"C=CCN=C=S","InChI=1S/C4H5NS/c1-2-3-5-4-6/h2H,1,3H2","ZOJBYZNEUISWFT-UHFFFAOYSA-N"
"CNC","InChI=1S/C2H7N/c1-3-2/h3H,1-2H3","ROSDSFDQCJNGOL-UHFFFAOYSA-N"
"CN(C)C","InChI=1S/C3H9N/c1-4(2)3/h1-3H3","GETQZCLCWQTVFV-UHFFFAOYSA-N"
"NCCC(C)C","InChI=1S/C5H13N/c1-5(2)3-4-6/h5H,3-4,6H2,1-2H3","BMFVGAAISNGQNM-UHFFFAOYSA-N"
"CC(C)C(C2)OC(OC2)C(C)c(c1)cccc1","InChI=1S/C15H22O2/c1-11(2)14-9-10-16-15(17-14)12(3)13-7-5-4-6-8-13/h4-8,11-12,14-15H,9-10H2,1-3H3","YWNRQAFPFQOIDO-UHFFFAOYSA-N"
"CCOC(OCC)CCc(c1)cccc1","InChI=1S/C13H20O2/c1-3-14-13(15-4-2)11-10-12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3","PUAHZQALAWRSNP-UHFFFAOYSA-N"
"CCCCCC(=O)OCC(C)CC","InChI=1S/C11H22O2/c1-4-6-7-8-11(12)13-9-10(3)5-2/h10H,4-9H2,1-3H3","ZWMQVDONBUJJLL-UHFFFAOYSA-N"
"CCC(C)COC(=O)CC","InChI=1S/C8H16O2/c1-4-7(3)6-10-8(9)5-2/h7H,4-6H2,1-3H3","MVJLYXCJBPXRCY-UHFFFAOYSA-N"
"CCC(C)COC(=O)C(C)C","InChI=1S/C9H18O2/c1-5-8(4)6-11-9(10)7(2)3/h7-8H,5-6H2,1-4H3","DUAXUBMIVRZGCO-UHFFFAOYSA-N"
"CCCCOCCOC(=O)CCC","InChI=1S/C10H20O3/c1-3-5-7-12-8-9-13-10(11)6-4-2/h3-9H2,1-2H3","JWIUNFHJMLAEPS-UHFFFAOYSA-N"
"CCCCCCC(=O)OCc(c1)cccc1","InChI=1S/C14H20O2/c1-2-3-4-8-11-14(15)16-12-13-9-6-5-7-10-13/h5-7,9-10H,2-4,8,11-12H2,1H3","UEDDAJQIHUEZCJ-UHFFFAOYSA-N"
"CCC(CC)C(=O)OCC(C)C","InChI=1S/C10H20O2/c1-5-9(6-2)10(11)12-7-8(3)4/h8-9H,5-7H2,1-4H3","SAWRJLRKAZYKPM-UHFFFAOYSA-N"
"CC(C)=CCOC(=O)c(c1)cccc1","InChI=1S/C12H14O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3","INVWRXWYYVMFQC-UHFFFAOYSA-N"
"CCCCCCCCCCC(=O)OCC=C","InChI=1S/C14H26O2/c1-3-5-6-7-8-9-10-11-12-14(15)16-13-4-2/h4H,2-3,5-13H2,1H3","PSGSIXPTLRADTD-UHFFFAOYSA-N"
"OCC(C1)=C([H])CC(C(C)=C)C1","InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3","NDTYTMIUWGWIMO-UHFFFAOYSA-N"
"C=CCOCCc(c1)cccc1","InChI=1S/C11H14O/c1-2-9-12-10-8-11-6-4-3-5-7-11/h2-7H,1,8-10H2","QNBZQCMSRGAZCR-UHFFFAOYSA-N"
"CC(C)OCCc(c1)cccc1","InChI=1S/C11H16O/c1-10(2)12-9-8-11-6-4-3-5-7-11/h3-7,10H,8-9H2,1-2H3","FMPXLXBVYDFXIC-UHFFFAOYSA-N"
"CCCCOC(=O)C(C)=O","InChI=1S/C7H12O3/c1-3-4-5-10-7(9)6(2)8/h3-5H2,1-2H3","ZAZUOXBHFXAWMD-UHFFFAOYSA-N"
"CCCCOCCc(c1)cccc1","InChI=1S/C12H18O/c1-2-3-10-13-11-9-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3","KLJOZKBZXLRMLU-UHFFFAOYSA-N"
"C=CCOc(c1)c(OCC=C)ccc1","InChI=1S/C12H14O2/c1-3-9-13-11-7-5-6-8-12(11)14-10-4-2/h3-8H,1-2,9-10H2","GZWLFCGQNCRLIN-UHFFFAOYSA-N"
"CCCOC(=O)C(C)=O","InChI=1S/C6H10O3/c1-3-4-9-6(8)5(2)7/h3-4H2,1-2H3","ILPVOWZUBFRIAX-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C)=O","InChI=1S/C6H10O3/c1-4(2)9-6(8)5(3)7/h4H,1-3H3","WUBJISGMPZWFKY-UHFFFAOYSA-N"
"CCCC=CCOC(C)OCC","InChI=1S/C10H20O2/c1-4-6-7-8-9-12-10(3)11-5-2/h7-8,10H,4-6,9H2,1-3H3/b8-7+","UMAFJFXCURZISP-BQYQJAHWSA-N"
"CCCCCOC(C)OCCCC","InChI=1S/C11H24O2/c1-4-6-8-10-13-11(3)12-9-7-5-2/h11H,4-10H2,1-3H3","PRLOXHKVPIRLDE-UHFFFAOYSA-N"
"CCCCOC(OCCCC)CC(C)C","InChI=1S/C13H28O2/c1-5-7-9-14-13(11-12(3)4)15-10-8-6-2/h12-13H,5-11H2,1-4H3","RLNQTYONQFCUOR-UHFFFAOYSA-N"
"CCCCCOC(OCC)CCCCC","InChI=1S/C13H28O2/c1-4-7-9-11-13(14-6-3)15-12-10-8-5-2/h13H,4-12H2,1-3H3","QPXFDYQXBUGQMT-UHFFFAOYSA-N"
"CCCCCCOC(CCCCC)OCCCCC","InChI=1S/C17H36O2/c1-4-7-10-13-16-19-17(14-11-8-5-2)18-15-12-9-6-3/h17H,4-16H2,1-3H3","GFNOERWAQBPPLQ-UHFFFAOYSA-N"
"CCCCCOC(CCCCC)OCCCCC","InChI=1S/C16H34O2/c1-4-7-10-13-16(17-14-11-8-5-2)18-15-12-9-6-3/h16H,4-15H2,1-3H3","MXIMWAJQWMYBAJ-UHFFFAOYSA-N"
"CCCC=CCOC(OCC)CCCCC","InChI=1S/C14H28O2/c1-4-7-9-11-13-16-14(15-6-3)12-10-8-5-2/h9,11,14H,4-8,10,12-13H2,1-3H3/b11-9+","WFWMTYHFABQEGD-PKNBQFBNSA-N"
"CCCCCCOC(CCCCC)OCCC=CCC","InChI=1S/C18H36O2/c1-4-7-10-13-16-19-18(15-12-9-6-3)20-17-14-11-8-5-2/h7,10,18H,4-6,8-9,11-17H2,1-3H3/b10-7-","ZSNIHKPCTYBURZ-YFHOEESVSA-N"
"CCCCCCOC(CCCCC)OCc(c1)cccc1","InChI=1S/C19H32O2/c1-3-5-7-12-16-20-19(15-9-6-4-2)21-17-18-13-10-8-11-14-18/h8,10-11,13-14,19H,3-7,9,12,15-17H2,1-2H3","VTDFABSNRXBZMU-UHFFFAOYSA-N"
"CCC=CCCOC(OCC)CCCCC","InChI=1S/C14H28O2/c1-4-7-9-11-13-16-14(15-6-3)12-10-8-5-2/h7,9,14H,4-6,8,10-13H2,1-3H3/b9-7-","PNXNUQGJDZBEHV-CLFYSBASSA-N"
"CCCCCOC(C)OCCCCC","InChI=1S/C12H26O2/c1-4-6-8-10-13-12(3)14-11-9-7-5-2/h12H,4-11H2,1-3H3","MIAGHUUTGZIIJW-UHFFFAOYSA-N"
"CCCCCC(OCC)OCc(c1)cccc1","InChI=1S/C15H24O2/c1-3-5-7-12-15(16-4-2)17-13-14-10-8-6-9-11-14/h6,8-11,15H,3-5,7,12-13H2,1-2H3","ZESDQEHIQRRQEU-UHFFFAOYSA-N"
"CCC=CCCOC(CCCCC)OCCCCC","InChI=1S/C17H34O2/c1-4-7-10-13-16-19-17(14-11-8-5-2)18-15-12-9-6-3/h7,10,17H,4-6,8-9,11-16H2,1-3H3/b10-7-","ZCGOMMOYYRGVQY-YFHOEESVSA-N"
"CCCC=CCOC(CCCCC)OCCCCC","InChI=1S/C17H34O2/c1-4-7-10-13-16-19-17(14-11-8-5-2)18-15-12-9-6-3/h10,13,17H,4-9,11-12,14-16H2,1-3H3/b13-10+","LZISIXHTZISKMZ-JLHYYAGUSA-N"
"CCCC=CCOC(CCCCC)OCCC=CCC","InChI=1S/C18H34O2/c1-4-7-10-13-16-19-18(15-12-9-6-3)20-17-14-11-8-5-2/h7,10-11,14,18H,4-6,8-9,12-13,15-17H2,1-3H3/b10-7-,14-11+","HNIIEWOWRPNMNR-BXHQFMRESA-N"
"CCCSC(=O)c(c1)cccc1","InChI=1S/C10H12OS/c1-2-8-12-10(11)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3","YPACPXJQEYROHD-UHFFFAOYSA-N"
"CCCC=CCOC(CCCCC)OCC=CCCC","InChI=1S/C18H34O2/c1-4-7-10-13-16-19-18(15-12-9-6-3)20-17-14-11-8-5-2/h10-11,13-14,18H,4-9,12,15-17H2,1-3H3/b13-10+,14-11+","CKGRYWOADIIZMT-IFQMDVHZSA-N"
"COC(=O)C(C)O","InChI=1S/C4H8O3/c1-3(5)4(6)7-2/h3,5H,1-2H3","LPEKGGXMPWTOCB-UHFFFAOYSA-N"
"CC(O)C(=O)OCc(c1)cccc1","InChI=1S/C10H12O3/c1-8(11)10(12)13-7-9-5-3-2-4-6-9/h2-6,8,11H,7H2,1H3","ZYTLPUIDJRKAAM-UHFFFAOYSA-N"
"C=Cc(c1)cc(OC)c(O)c1","InChI=1S/C9H10O2/c1-3-7-4-5-8(10)9(6-7)11-2/h3-6,10H,1H2,2H3","YOMSJEATGXXYPX-UHFFFAOYSA-N"
"O=COCc(c1)occ1","InChI=1S/C6H6O3/c7-5-8-4-6-2-1-3-9-6/h1-3,5H,4H2","FPRQARNPKWVCNI-UHFFFAOYSA-N"
"CC=CC(=O)OCc(c1)occ1","InChI=1S/C9H10O3/c1-2-4-9(10)12-7-8-5-3-6-11-8/h2-6H,7H2,1H3/b4-2+","RNOSZJQXPVHHLQ-DUXPYHPUSA-N"
"C=CCSC","InChI=1S/C4H8S/c1-3-4-5-2/h3H,1,4H2,2H3","NVLPQIPTCCLBEU-UHFFFAOYSA-N"
"CC(OCc(c2)cccc2)OCc(c1)cccc1","InChI=1S/C16H18O2/c1-14(17-12-15-8-4-2-5-9-15)18-13-16-10-6-3-7-11-16/h2-11,14H,12-13H2,1H3","RFRXYOZZAPXFFD-UHFFFAOYSA-N"
"CCCCCC(OCc(c2)cccc2)OCc(c1)cccc1","InChI=1S/C20H26O2/c1-2-3-6-15-20(21-16-18-11-7-4-8-12-18)22-17-19-13-9-5-10-14-19/h4-5,7-14,20H,2-3,6,15-17H2,1H3","KSUZGVFZLVNEAN-UHFFFAOYSA-N"
"CCCC=CCOC(CCCCC)OCc(c1)cccc1","InChI=1S/C19H30O2/c1-3-5-7-12-16-20-19(15-9-6-4-2)21-17-18-13-10-8-11-14-18/h7-8,10-14,19H,3-6,9,15-17H2,1-2H3/b12-7+","FQKZBNBSOLKMFF-KPKJPENVSA-N"
"CCC=CCCOC(CCCCC)OCc(c1)cccc1","InChI=1S/C19H30O2/c1-3-5-7-12-16-20-19(15-9-6-4-2)21-17-18-13-10-8-11-14-18/h5,7-8,10-11,13-14,19H,3-4,6,9,12,15-17H2,1-2H3/b7-5-","XKXIILVFTMECBU-ALCCZGGFSA-N"
"CCCCCOC(CCCCC)OCc(c1)cccc1","InChI=1S/C18H30O2/c1-3-5-8-14-18(19-15-11-6-4-2)20-16-17-12-9-7-10-13-17/h7,9-10,12-13,18H,3-6,8,11,14-16H2,1-2H3","YLHBFFYCNURKLU-UHFFFAOYSA-N"
"CCOC(C)OCc(c1)cccc1","InChI=1S/C11H16O2/c1-3-12-10(2)13-9-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3","QZLCHWYDADOBGM-UHFFFAOYSA-N"
"CCC=CCCOC(C)OCCCCC","InChI=1S/C13H26O2/c1-4-6-8-10-12-15-13(3)14-11-9-7-5-2/h6,8,13H,4-5,7,9-12H2,1-3H3/b8-6-","DTNQXBQAPPDECZ-VURMDHGXSA-N"
"CCCC=CCOC(C)OCCCCC","InChI=1S/C13H26O2/c1-4-6-8-10-12-15-13(3)14-11-9-7-5-2/h8,10,13H,4-7,9,11-12H2,1-3H3/b10-8+","ZCEQBTCRZDAWBC-CSKARUKUSA-N"
"CCCC=CCOC(C)OCC=CCCC","InChI=1S/C14H26O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h8-11,14H,4-7,12-13H2,1-3H3/b10-8+,11-9+","FVXJKQGRPGCDDF-GFULKKFKSA-N"
"CCCC=CCOC(C)OCc(c1)cccc1","InChI=1S/C15H22O2/c1-3-4-5-9-12-16-14(2)17-13-15-10-7-6-8-11-15/h5-11,14H,3-4,12-13H2,1-2H3/b9-5+","DUXYRRLZTBFRPL-WEVVVXLNSA-N"
"CCC=CCCOC(C)OCc(c1)cccc1","InChI=1S/C15H22O2/c1-3-4-5-9-12-16-14(2)17-13-15-10-7-6-8-11-15/h4-8,10-11,14H,3,9,12-13H2,1-2H3/b5-4-","LDEPYAQXQFOODV-PLNGDYQASA-N"
"CCCCCOC(C)OCc(c1)cccc1","InChI=1S/C14H22O2/c1-3-4-8-11-15-13(2)16-12-14-9-6-5-7-10-14/h5-7,9-10,13H,3-4,8,11-12H2,1-2H3","YQAXOOYRJPMFQS-UHFFFAOYSA-N"
"CCCC([H])=C([H])COC(C)OCCC([H])=C([H])CC","InChI=1S/C14H26O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h6,8-9,11,14H,4-5,7,10,12-13H2,1-3H3/b8-6-,11-9+","LNXYMQIPQAMVLK-ZOEDNYEGSA-N"
"CCCCCCCCCOC(=O)CCCCCCCC","InChI=1S/C18H36O2/c1-3-5-7-9-11-13-15-17-20-18(19)16-14-12-10-8-6-4-2/h3-17H2,1-2H3","WWDHABCVIVMHKP-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCC","InChI=1S/C21H44/c1-3-5-7-9-11-13-15-17-19-21-20-18-16-14-12-10-8-6-4-2/h3-21H2,1-2H3","FNAZRRHPUDJQCJ-UHFFFAOYSA-N"
"O=COC(C1)CCCCCCCCCC1","InChI=1S/C13H24O2/c14-12-15-13-10-8-6-4-2-1-3-5-7-9-11-13/h12-13H,1-11H2","WGFQFIYJBLNXIF-UHFFFAOYSA-N"
"C=CCSCC=C","InChI=1S/C6H10S/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H2","UBJVUCKUDDKUJF-UHFFFAOYSA-N"
"CCCSCC=C","InChI=1S/C6H12S/c1-3-5-7-6-4-2/h3H,1,4-6H2,2H3","JMLIYQJQKZYHDQ-UHFFFAOYSA-N"
"CC(C)SC(C)C","InChI=1S/C6H14S/c1-5(2)7-6(3)4/h5-6H,1-4H3","XYWDPYKBIRQXQS-UHFFFAOYSA-N"
"CCCCSCCCC","InChI=1S/C8H18S/c1-3-5-7-9-8-6-4-2/h3-8H2,1-2H3","HTIRHQRTDBPHNZ-UHFFFAOYSA-N"
"CC(C)(C)SC(C)(C)C","InChI=1S/C8H18S/c1-7(2,3)9-8(4,5)6/h1-6H3","LNMBCRKRCIMQLW-UHFFFAOYSA-N"
"CCCCCCCCSC","InChI=1S/C9H20S/c1-3-4-5-6-7-8-9-10-2/h3-9H2,1-2H3","AHCJTMBRROLNHV-UHFFFAOYSA-N"
"CCCCCCCCSCCCCCCCC","InChI=1S/C16H34S/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-16H2,1-2H3","LOXRGHGHQYWXJK-UHFFFAOYSA-N"
"CSc(c1)cccc1","InChI=1S/C7H8S/c1-8-7-5-3-2-4-6-7/h2-6H,1H3","HNKJADCVZUBCPG-UHFFFAOYSA-N"
"CSCc(c1)cccc1","InChI=1S/C8H10S/c1-9-7-8-5-3-2-4-6-8/h2-6H,7H2,1H3","OFQPKKGMNWASPN-UHFFFAOYSA-N"
"CC(C)SCc(c1)occ1","InChI=1S/C8H12OS/c1-7(2)10-6-8-4-3-5-9-8/h3-5,7H,6H2,1-2H3","WCHRNAKORAINOJ-UHFFFAOYSA-N"
"C=CCSSCC=C","InChI=1S/C6H10S2/c1-3-5-7-8-6-4-2/h3-4H,1-2,5-6H2","PFRGXCVKLLPLIP-UHFFFAOYSA-N"
"CCCSSCCC","InChI=1S/C6H14S2/c1-3-5-7-8-6-4-2/h3-6H2,1-2H3","ALVPFGSHPUPROW-UHFFFAOYSA-N"
"OCCC(C)O","InChI=1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3","PUPZLCDOIYMWBV-UHFFFAOYSA-N"
"CC(O)C(C)O","InChI=1S/C4H10O2/c1-3(5)4(2)6/h3-6H,1-2H3","OWBTYPJTUOEWEK-UHFFFAOYSA-N"
"CCC(CC)(CO)CO","InChI=1S/C7H16O2/c1-3-7(4-2,5-8)6-9/h8-9H,3-6H2,1-2H3","XRVCFZPJAHWYTB-UHFFFAOYSA-N"
"CC(C)(O)C#CC(C)(C)O","InChI=1S/C8H14O2/c1-7(2,9)5-6-8(3,4)10/h9-10H,1-4H3","IHJUECRFYCQBMW-UHFFFAOYSA-N"
"CC(O)C(C)=O","InChI=1S/C4H8O2/c1-3(5)4(2)6/h3,5H,1-2H3","ROWKJAVDOGWPAT-UHFFFAOYSA-N"
"CCOC(OCC)CC(C)CCCC(C)(C)O","InChI=1S/C14H30O3/c1-6-16-13(17-7-2)11-12(3)9-8-10-14(4,5)15/h12-13,15H,6-11H2,1-5H3","XOJDKWNFMFCXNE-UHFFFAOYSA-N"
"CC(C)C(C1)CCC(O)C1","InChI=1S/C9H18O/c1-7(2)8-3-5-9(10)6-4-8/h7-10H,3-6H2,1-2H3","DKKRDMLKVSKFMJ-UHFFFAOYSA-N"
"CC(C)(O)CCc(c1)cccc1","InChI=1S/C11H16O/c1-11(2,12)9-8-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3","YXVSKJDFNJFXAJ-UHFFFAOYSA-N"
"O=CCC(C)CC(C)(C)C","InChI=1S/C9H18O/c1-8(5-6-10)7-9(2,3)4/h6,8H,5,7H2,1-4H3","WTPYRCJDOZVZON-UHFFFAOYSA-N"
"O=CCCc(c1)ccc(c1)C(C)(C)C","InChI=1S/C13H18O/c1-13(2,3)12-8-6-11(7-9-12)5-4-10-14/h6-10H,4-5H2,1-3H3","FZJUFJKVIYFBSY-UHFFFAOYSA-N"
"CCCS","InChI=1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3","SUVIGLJNEAMWEG-UHFFFAOYSA-N"
"CC(C)(C)S","InChI=1S/C4H10S/c1-4(2,3)5/h5H,1-3H3","WMXCDAVJEZZYLT-UHFFFAOYSA-N"
"CCC(C)(C)S","InChI=1S/C5H12S/c1-4-5(2,3)6/h6H,4H2,1-3H3","IQIBYAHJXQVQGB-UHFFFAOYSA-N"
"CC(C)CCS","InChI=1S/C5H12S/c1-5(2)3-4-6/h5-6H,3-4H2,1-2H3","GIJGXNFNUUFEGH-UHFFFAOYSA-N"
"CCCCCS","InChI=1S/C5H12S/c1-2-3-4-5-6/h6H,2-5H2,1H3","ZRKMQKLGEQPLNS-UHFFFAOYSA-N"
"SC(C1)CCCC1","InChI=1S/C6H12S/c7-6-4-2-1-3-5-6/h6-7H,1-5H2","CMKBCTPCXZNQKX-UHFFFAOYSA-N"
"SCc(c1)occ1","InChI=1S/C5H6OS/c7-4-5-2-1-3-6-5/h1-3,7H,4H2","ZFFTZDQKIXPDAF-UHFFFAOYSA-N"
"SCc(c1)cccc1","InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2","UENWRTRMUIOCKN-UHFFFAOYSA-N"
"OCCSCC","InChI=1S/C4H10OS/c1-2-6-4-3-5/h5H,2-4H2,1H3","LNRIEBFNWGMXKP-UHFFFAOYSA-N"
"CCSC(C)=O","InChI=1S/C4H8OS/c1-3-6-4(2)5/h3H2,1-2H3","APTGPWJUOYMUCE-UHFFFAOYSA-N"
"CCCSC(C)=O","InChI=1S/C5H10OS/c1-3-4-7-5(2)6/h3-4H2,1-2H3","SBWFWBJCYMBZEY-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(C)(C)C","InChI=1S/C11H16O/c1-11(2,3)9-5-7-10(12-4)8-6-9/h5-8H,1-4H3","MCUPBIBNSTXCPQ-UHFFFAOYSA-N"
"O=Cc(c1)scc1","InChI=1S/C5H4OS/c6-4-5-2-1-3-7-5/h1-4H","CNUDBTRUORMMPA-UHFFFAOYSA-N"
"c(c2)cc(o2)CSCc(c1)occ1","InChI=1S/C10H10O2S/c1-3-9(11-5-1)7-13-8-10-4-2-6-12-10/h1-6H,7-8H2","UYLKDZXJEKFFHJ-UHFFFAOYSA-N"
"CC=Cc(c1)ccc(OC)c1","InChI=1S/C10H12O/c1-3-4-9-5-7-10(11-2)8-6-9/h3-8H,1-2H3/b4-3+","RUVINXPYWBROJD-ONEGZZNKSA-N"
"CC(O)=O","InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)","QTBSBXVTEAMEQO-UHFFFAOYSA-N"
"CC=CC(O)=O","InChI=1S/C4H6O2/c1-2-3-4(5)6/h2-3H,1H3,(H,5,6)/b3-2+","LDHQCZJRKDOVOX-NSCUHMNNSA-N"
"CCC(C)C(O)=O","InChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7)","WLAMNBDJUVNPJU-UHFFFAOYSA-N"
"CCCC=CC(O)=O","InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h4-5H,2-3H2,1H3,(H,7,8)/b5-4+","NIONDZDPPYHYKY-SNAWJCMRSA-N"
"CCC=CCC(O)=O","InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h3-4H,2,5H2,1H3,(H,7,8)/b4-3-","XXHDAWYDNSXJQM-ARJAWSKDSA-N"
"CCC=CCC(O)=O","InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h3-4H,2,5H2,1H3,(H,7,8)/b4-3+","XXHDAWYDNSXJQM-ONEGZZNKSA-N"
"CCCCCC(O)=O","InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)","FUZZWVXGSFPDMH-UHFFFAOYSA-N"
"CCCC(C)C(O)=O","InChI=1S/C6H12O2/c1-3-4-5(2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8)","OVBFMEVBMNZIBR-UHFFFAOYSA-N"
"CCC(C)CC(O)=O","InChI=1S/C6H12O2/c1-3-5(2)4-6(7)8/h5H,3-4H2,1-2H3,(H,7,8)","IGIDLTISMCAULB-UHFFFAOYSA-N"
"CCC(CC)C(O)=O","InChI=1S/C6H12O2/c1-3-5(4-2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8)","OXQGTIUCKGYOAA-UHFFFAOYSA-N"
"CCCCCCC(O)=O","InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)","MNWFXJYAOYHMED-UHFFFAOYSA-N"
"CCCCC(C)C(O)=O","InChI=1S/C7H14O2/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3,(H,8,9)","CVKMFSAVYPAZTQ-UHFFFAOYSA-N"
"CC(C)CCCC(O)=O","InChI=1S/C7H14O2/c1-6(2)4-3-5-7(8)9/h6H,3-5H2,1-2H3,(H,8,9)","MHPUGCYGQWGLJL-UHFFFAOYSA-N"
"CCCCCC=CC(O)=O","InChI=1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h6-7H,2-5H2,1H3,(H,9,10)/b7-6+","CWMPPVPFLSZGCY-VOTSOKGWSA-N"
"CCCCC=CCC(O)=O","InChI=1S/C8H14O2/c1-2-3-4-5-6-7-8(9)10/h5-6H,2-4,7H2,1H3,(H,9,10)/b6-5+","IWPOSDLLFZKGOW-AATRIKPKSA-N"
"CCCCCCCC(O)=O","InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)","WWZKQHOCKIZLMA-UHFFFAOYSA-N"
"CCCCCCC=CC(O)=O","InChI=1S/C9H16O2/c1-2-3-4-5-6-7-8-9(10)11/h7-8H,2-6H2,1H3,(H,10,11)/b8-7+","ADLXTJMPCFOTOO-BQYQJAHWSA-N"
"CCCCCCCC=CC(O)=O","InChI=1S/C10H18O2/c1-2-3-4-5-6-7-8-9-10(11)12/h8-9H,2-7H2,1H3,(H,11,12)/b9-8+","WXBXVVIUZANZAU-CMDGGOBGSA-N"
"CCCCCCC=CCC(O)=O","InChI=1S/C10H18O2/c1-2-3-4-5-6-7-8-9-10(11)12/h7-8H,2-6,9H2,1H3,(H,11,12)/b8-7+","CPVUNKGURQKKKX-BQYQJAHWSA-N"
"CCCCCCCCCC(O)=O","InChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)","GHVNFZFCNZKVNT-UHFFFAOYSA-N"
"CCCCCCCCCCC(O)=O","InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13)","ZDPHROOEEOARMN-UHFFFAOYSA-N"
"CCCCCCCCCCCC(O)=O","InChI=1S/C12H24O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h2-11H2,1H3,(H,13,14)","POULHZVOKOAJMA-UHFFFAOYSA-N"
"CCCCC(CC)C(O)=O","InChI=1S/C8H16O2/c1-3-5-6-7(4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)","OBETXYAYXDNJHR-UHFFFAOYSA-N"
"CC(=O)C(O)=O","InChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6)","LCTONWCANYUPML-UHFFFAOYSA-N"
"OC(=O)CC(C1)CCCC1","InChI=1S/C8H14O2/c9-8(10)6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)","LJOODBDWMQKMFB-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cccc1","InChI=1S/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)","WLJVXDMOQOGPHL-UHFFFAOYSA-N"
"O=C(C1)CCCCCCCCCCCCC1","InChI=1S/C15H28O/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-15/h1-14H2","OSOIQJGOYGSIMF-UHFFFAOYSA-N"
"C=CCc(c1)c(O)ccc1","InChI=1S/C9H10O/c1-2-5-8-6-3-4-7-9(8)10/h2-4,6-7,10H,1,5H2","QIRNGVVZBINFMX-UHFFFAOYSA-N"
"CCCc(c1)ccc(O)c1","InChI=1S/C9H12O/c1-2-3-8-4-6-9(10)7-5-8/h4-7,10H,2-3H2,1H3","KLSLBUSXWBJMEC-UHFFFAOYSA-N"
"CCc(c1)cc(O)cc(C)1","InChI=1S/C9H12O/c1-3-8-4-7(2)5-9(10)6-8/h4-6,10H,3H2,1-2H3","XTCHLXABLZQNNN-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCc(c1)cccc1","InChI=1S/C17H26O2/c1-2-3-4-5-6-7-11-14-17(18)19-15-16-12-9-8-10-13-16/h8-10,12-13H,2-7,11,14-15H2,1H3","ZSAYVPCIKVBDRI-UHFFFAOYSA-N"
"CCOC(=O)C(C)O","InChI=1S/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3","LZCLXQDLBQLTDK-UHFFFAOYSA-N"
"CCCOC(=O)C(C)O","InChI=1S/C6H12O3/c1-3-4-9-6(8)5(2)7/h5,7H,3-4H2,1-2H3","ILVGAIQLOCKNQA-UHFFFAOYSA-N"
"CCCCCOC(=O)C(C)O","InChI=1S/C8H16O3/c1-3-4-5-6-11-8(10)7(2)9/h7,9H,3-6H2,1-2H3","GXOHBWLPQHTYPF-UHFFFAOYSA-N"
"CCCCCCOC(=O)C(C)O","InChI=1S/C9H18O3/c1-3-4-5-6-7-12-9(11)8(2)10/h8,10H,3-7H2,1-2H3","KDPXOGYCOOUWOS-UHFFFAOYSA-N"
"CC(C)CCOC(=O)C(C)O","InChI=1S/C8H16O3/c1-6(2)4-5-11-8(10)7(3)9/h6-7,9H,4-5H2,1-3H3","CRORGGSWAKIXSA-UHFFFAOYSA-N"
"CCCC=CCOC(=O)C(C)O","InChI=1S/C9H16O3/c1-3-4-5-6-7-12-9(11)8(2)10/h5-6,8,10H,3-4,7H2,1-2H3/b6-5+","CLRYHPFNHRAPPN-AATRIKPKSA-N"
"CCC=CCCOC(=O)C(C)O","InChI=1S/C9H16O3/c1-3-4-5-6-7-12-9(11)8(2)10/h4-5,8,10H,3,6-7H2,1-2H3/b5-4-","NNLLMULULOBXBY-PLNGDYQASA-N"
"CCCCCCCCCOC(=O)C(C)O","InChI=1S/C12H24O3/c1-3-4-5-6-7-8-9-10-15-12(14)11(2)13/h11,13H,3-10H2,1-2H3","XYQKYLPARUIQOX-UHFFFAOYSA-N"
"CCOC(=O)CCC(C)=O","InChI=1S/C7H12O3/c1-3-10-7(9)5-4-6(2)8/h3-5H2,1-2H3","GMEONFUTDYJSNV-UHFFFAOYSA-N"
"CCCOC(=O)CCC(C)=O","InChI=1S/C8H14O3/c1-3-6-11-8(10)5-4-7(2)9/h3-6H2,1-2H3","QOSMNYMQXIVWKY-UHFFFAOYSA-N"
"CC(=O)CCC(=O)OC(C)C","InChI=1S/C8H14O3/c1-6(2)11-8(10)5-4-7(3)9/h6H,4-5H2,1-3H3","MGJRGGIHFUREHT-UHFFFAOYSA-N"
"CCC=CCCOC(=O)C(C)=O","InChI=1S/C9H14O3/c1-3-4-5-6-7-12-9(11)8(2)10/h4-5H,3,6-7H2,1-2H3/b5-4-","LKNXTZXOBHAYSR-PLNGDYQASA-N"
"CCCCC(CC)C(=O)OCCc(c1)cccc1","InChI=1S/C16H24O2/c1-3-5-11-15(4-2)16(17)18-13-12-14-9-7-6-8-10-14/h6-10,15H,3-5,11-13H2,1-2H3","DLUUSIFAGWCEES-UHFFFAOYSA-N"
"CC=CC=CC(=O)OCC","InChI=1S/C8H12O2/c1-3-5-6-7-8(9)10-4-2/h3,5-7H,4H2,1-2H3/b5-3+,7-6+","OZZYKXXGCOLLLO-TWTPFVCWSA-N"
"CC=CC=CC(=O)OCCC","InChI=1S/C9H14O2/c1-3-5-6-7-9(10)11-8-4-2/h3,5-7H,4,8H2,1-2H3/b5-3+,7-6+","JAVXBQKCKGHZHM-TWTPFVCWSA-N"
"CC=CC=CC(=O)OC(C)C","InChI=1S/C9H14O2/c1-4-5-6-7-9(10)11-8(2)3/h4-8H,1-3H3/b5-4+,7-6+","PERLTXCUPZSJTA-YTXTXJHMSA-N"
"CC=CC=CC(=O)OCCCC","InChI=1S/C10H16O2/c1-3-5-7-8-10(11)12-9-6-4-2/h3,5,7-8H,4,6,9H2,1-2H3/b5-3+,8-7+","SCVZKPKDMFXESQ-VSAQMIDASA-N"
"CC=CC=CC(=O)OCC=C","InChI=1S/C9H12O2/c1-3-5-6-7-9(10)11-8-4-2/h3-7H,2,8H2,1H3/b5-3+,7-6+","CVNZYQJBZIJLCL-TWTPFVCWSA-N"
"CC=CC=CC(=O)OCCC(C)C","InChI=1S/C11H18O2/c1-4-5-6-7-11(12)13-9-8-10(2)3/h4-7,10H,8-9H2,1-3H3/b5-4+,7-6+","QEBWFKHQSLXUSK-YTXTXJHMSA-N"
"CCC(C)CCOC(=O)c(c1)c(O)ccc1","InChI=1S/C13H18O3/c1-3-10(2)8-9-16-13(15)11-6-4-5-7-12(11)14/h4-7,10,14H,3,8-9H2,1-2H3","GWYVTSFBLKXAMY-UHFFFAOYSA-N"
"C(C2)CCC(C2)OC(=O)c(c1)c(O)ccc1","InChI=1S/C13H16O3/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h4-5,8-10,14H,1-3,6-7H2","NUQDJSMHGCTKNL-UHFFFAOYSA-N"
"CCCC=CCOC(=O)c(c1)c(O)ccc1","InChI=1S/C13H16O3/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h4-9,14H,2-3,10H2,1H3/b7-4+","DLWPCXLFHSLSMZ-QPJJXVBHSA-N"
"CC(O)C(=O)OCCc(c1)cccc1","InChI=1S/C11H14O3/c1-9(12)11(13)14-8-7-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3","IYXFDAOFSCZADY-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(O)=O","InChI=1S/C22H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h2-21H2,1H3,(H,23,24)","UKMSUNONTOPOIO-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(O)=O","InChI=1S/C24H48O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26/h2-23H2,1H3,(H,25,26)","QZZGJDVWLFXDLK-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C22H44O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-2/h3-21H2,1-2H3","AJRICDSAJQHDSD-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(=O)OC","InChI=1S/C24H48O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h3-23H2,1-2H3","VORKGRIRMPBCCZ-UHFFFAOYSA-N"
"CCCC=CC(=O)Oc(c1)ccc(C)c1","InChI=1S/C13H16O2/c1-3-4-5-6-13(14)15-12-9-7-11(2)8-10-12/h5-10H,3-4H2,1-2H3/b6-5+","ZSNJETLPYLDVIM-AATRIKPKSA-N"
"CC(C)CCOC(CC(C)C)OCc(c1)cccc1","InChI=1S/C17H28O2/c1-14(2)10-11-18-17(12-15(3)4)19-13-16-8-6-5-7-9-16/h5-9,14-15,17H,10-13H2,1-4H3","GLRXEEABVKURPO-UHFFFAOYSA-N"
"CC(C)CC(OCc(c2)cccc2)OCc(c1)cccc1","InChI=1S/C19H24O2/c1-16(2)13-19(20-14-17-9-5-3-6-10-17)21-15-18-11-7-4-8-12-18/h3-12,16,19H,13-15H2,1-2H3","JEWZPHLVMXOYOT-UHFFFAOYSA-N"
"CC(C)CCOC(OCC(C)C)CC(C)C","InChI=1S/C14H30O2/c1-11(2)7-8-15-14(9-12(3)4)16-10-13(5)6/h11-14H,7-10H2,1-6H3","HSBMJOHFCSICMS-UHFFFAOYSA-N"
"CC(C)COC(OCC(C)C)CC(C)C","InChI=1S/C13H28O2/c1-10(2)7-13(14-8-11(3)4)15-9-12(5)6/h10-13H,7-9H2,1-6H3","XQJQKXSIFKNEPF-UHFFFAOYSA-N"
"CCCOC(OCCC(C)C)CC(C)C","InChI=1S/C13H28O2/c1-6-8-14-13(10-12(4)5)15-9-7-11(2)3/h11-13H,6-10H2,1-5H3","NAMDZBPRKJYRCO-UHFFFAOYSA-N"
"CCCOC(OCCC)CC(C)C","InChI=1S/C11H24O2/c1-5-7-12-11(9-10(3)4)13-8-6-2/h10-11H,5-9H2,1-4H3","SALIHKDQCDUOSH-UHFFFAOYSA-N"
"CCCOC(OCC(C)C)CC(C)C","InChI=1S/C12H26O2/c1-6-7-13-12(8-10(2)3)14-9-11(4)5/h10-12H,6-9H2,1-5H3","IRROWXSGAWXJDE-UHFFFAOYSA-N"
"CCCCCCC(OCC)OCCC(C)C","InChI=1S/C14H30O2/c1-5-7-8-9-10-14(15-6-2)16-12-11-13(3)4/h13-14H,5-12H2,1-4H3","ZBRSUNZCGCABAB-UHFFFAOYSA-N"
"CCCCOC(CCC)OCCCC","InChI=1S/C12H26O2/c1-4-7-10-13-12(9-6-3)14-11-8-5-2/h12H,4-11H2,1-3H3","WQRBJFZKPWPIJD-UHFFFAOYSA-N"
"CCCC(OCCC(C)C)OCCC(C)C","InChI=1S/C14H30O2/c1-6-7-14(15-10-8-12(2)3)16-11-9-13(4)5/h12-14H,6-11H2,1-5H3","KWZAGPSMWWHQMR-UHFFFAOYSA-N"
"CCCCOC(CCC)OCCC(C)C","InChI=1S/C13H28O2/c1-5-7-10-14-13(8-6-2)15-11-9-12(3)4/h12-13H,5-11H2,1-4H3","BSNWVXDNGIOQGW-UHFFFAOYSA-N"
"CCCCCCC(OCCC(C)C)OCCC(C)C","InChI=1S/C17H36O2/c1-6-7-8-9-10-17(18-13-11-15(2)3)19-14-12-16(4)5/h15-17H,6-14H2,1-5H3","FCNZGZQLIKHVGP-UHFFFAOYSA-N"
"CCCC(OCCC(C)C)OC(C)C","InChI=1S/C12H26O2/c1-6-7-12(14-11(4)5)13-9-8-10(2)3/h10-12H,6-9H2,1-5H3","IYAICXDFPSVBGK-UHFFFAOYSA-N"
"CCCCOC(CCC)OC(C)C","InChI=1S/C11H24O2/c1-5-7-9-12-11(8-6-2)13-10(3)4/h10-11H,5-9H2,1-4H3","CNHSQHGCGGFGSB-UHFFFAOYSA-N"
"CCC(OCc(c2)cccc2)OCc(c1)cccc1","InChI=1S/C17H20O2/c1-2-17(18-13-15-9-5-3-6-10-15)19-14-16-11-7-4-8-12-16/h3-12,17H,2,13-14H2,1H3","ANNDAFXCWSPYIU-UHFFFAOYSA-N"
"CCOC(CC)OCc(c1)cccc1","InChI=1S/C12H18O2/c1-3-12(13-4-2)14-10-11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3","CJUFJTXKBQQYSD-UHFFFAOYSA-N"
"CC(C)CCOC(CC)OCc(c1)cccc1","InChI=1S/C15H24O2/c1-4-15(16-11-10-13(2)3)17-12-14-8-6-5-7-9-14/h5-9,13,15H,4,10-12H2,1-3H3","LCIWBVUWLVMMOZ-UHFFFAOYSA-N"
"CCC(OCCC(C)C)OCCC(C)C","InChI=1S/C13H28O2/c1-6-13(14-9-7-11(2)3)15-10-8-12(4)5/h11-13H,6-10H2,1-5H3","MQOHVHXEZYLDJW-UHFFFAOYSA-N"
"CCOC(CC)OCCC(C)C","InChI=1S/C10H22O2/c1-5-10(11-6-2)12-8-7-9(3)4/h9-10H,5-8H2,1-4H3","WMLCXIOXLJBRRH-UHFFFAOYSA-N"
"CC(C)CCOC(OCCC(C)C)c(c1)cccc1","InChI=1S/C17H28O2/c1-14(2)10-12-18-17(19-13-11-15(3)4)16-8-6-5-7-9-16/h5-9,14-15,17H,10-13H2,1-4H3","TVAMBUYNQKUINU-UHFFFAOYSA-N"
"CCOC(OCCC(C)C)c(c1)cccc1","InChI=1S/C14H22O2/c1-4-15-14(16-11-10-12(2)3)13-8-6-5-7-9-13/h5-9,12,14H,4,10-11H2,1-3H3","ZSTHUNZWLDCRMU-UHFFFAOYSA-N"
"CCCCOC(OCCCC)c(c1)cccc1","InChI=1S/C15H24O2/c1-3-5-12-16-15(17-13-6-4-2)14-10-8-7-9-11-14/h7-11,15H,3-6,12-13H2,1-2H3","WSVMGQQPLZDDQN-UHFFFAOYSA-N"
"CCCCOC(OCCC(C)C)c(c1)cccc1","InChI=1S/C16H26O2/c1-4-5-12-17-16(18-13-11-14(2)3)15-9-7-6-8-10-15/h6-10,14,16H,4-5,11-13H2,1-3H3","BRHOZUMENSVNBY-UHFFFAOYSA-N"
"CCCCOC(C)OCCC(C)C","InChI=1S/C11H24O2/c1-5-6-8-12-11(4)13-9-7-10(2)3/h10-11H,5-9H2,1-4H3","OOTKYVQGUQRYPB-UHFFFAOYSA-N"
"CCCOC(C)OCCC(C)C","InChI=1S/C10H22O2/c1-5-7-11-10(4)12-8-6-9(2)3/h9-10H,5-8H2,1-4H3","VPJHYSGCDYPNSB-UHFFFAOYSA-N"
"CCCC(OC(C)C)OC(C)C","InChI=1S/C10H22O2/c1-6-7-10(11-8(2)3)12-9(4)5/h8-10H,6-7H2,1-5H3","QOJSNHMWGGZTDQ-UHFFFAOYSA-N"
"CC(C)CCOC(OCc(c2)cccc2)c(c1)cccc1","InChI=1S/C19H24O2/c1-16(2)13-14-20-19(18-11-7-4-8-12-18)21-15-17-9-5-3-6-10-17/h3-12,16,19H,13-15H2,1-2H3","XFGJYOYWFTXAFO-UHFFFAOYSA-N"
"CCOC(OCc(c2)cccc2)c(c1)cccc1","InChI=1S/C16H18O2/c1-2-17-16(15-11-7-4-8-12-15)18-13-14-9-5-3-6-10-14/h3-12,16H,2,13H2,1H3","PNNHDYOYZSRBLH-UHFFFAOYSA-N"
"CCC(OC(C)C)OC(C)C","InChI=1S/C9H20O2/c1-6-9(10-7(2)3)11-8(4)5/h7-9H,6H2,1-5H3","OMKOEKNZLXINHM-UHFFFAOYSA-N"
"CCOC(CC)OC(C)C","InChI=1S/C8H18O2/c1-5-8(9-6-2)10-7(3)4/h7-8H,5-6H2,1-4H3","ITHBKLPXPKVPOR-UHFFFAOYSA-N"
"CCC(OC(C)C)OCc(c1)cccc1","InChI=1S/C13H20O2/c1-4-13(15-11(2)3)14-10-12-8-6-5-7-9-12/h5-9,11,13H,4,10H2,1-3H3","AMCIABLINRQKGJ-UHFFFAOYSA-N"
"CCC(OCCC(C)C)OC(C)C","InChI=1S/C11H24O2/c1-6-11(13-10(4)5)12-8-7-9(2)3/h9-11H,6-8H2,1-5H3","JWKHUAAWOAFUMW-UHFFFAOYSA-N"
"CC(C)COC(C)OCC(C)C","InChI=1S/C10H22O2/c1-8(2)6-11-10(5)12-7-9(3)4/h8-10H,6-7H2,1-5H3","KIELJSVPUISYCI-UHFFFAOYSA-N"
"CCCOC(C)OCC(C)C","InChI=1S/C9H20O2/c1-5-6-10-9(4)11-7-8(2)3/h8-9H,5-7H2,1-4H3","ZTFNAAOKRDLYDA-UHFFFAOYSA-N"
"CC(C)OC(C)OC(C)C","InChI=1S/C8H18O2/c1-6(2)9-8(5)10-7(3)4/h6-8H,1-5H3","TWWSMHPNERSWRN-UHFFFAOYSA-N"
"CCCCOC(C)OC(C)C","InChI=1S/C9H20O2/c1-5-6-7-10-9(4)11-8(2)3/h8-9H,5-7H2,1-4H3","MDDRKDNGWLHURG-UHFFFAOYSA-N"
"CC(C)CCOC(C)OC(C)C","InChI=1S/C10H22O2/c1-8(2)6-7-11-10(5)12-9(3)4/h8-10H,6-7H2,1-5H3","FUVLXJQGLJXAQI-UHFFFAOYSA-N"
"CCOCCOCCOCC","InChI=1S/C8H18O3/c1-3-9-5-7-11-8-6-10-4-2/h3-8H2,1-2H3","RRQYJINTUHWNHW-UHFFFAOYSA-N"
"CC=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2-6H,7H2,1H3/b3-2+","VHVOLFRBFDOUSH-NSCUHMNNSA-N"
"CC=Cc(c1)cc(OC)c(O)c1","InChI=1S/C10H12O2/c1-3-4-8-5-6-9(11)10(7-8)12-2/h3-7,11H,1-2H3/b4-3+","BJIOGJUNALELMI-ONEGZZNKSA-N"
"[2H]C(O)(C1)CC(C2)C(C)(CCC2)C1","InChI=1S/C11H20O/c1-11-6-3-2-4-9(11)8-10(12)5-7-11/h9-10,12H,2-8H2,1H3/i10D","ZGVYVWSAAMJYCN-MMIHMFRQSA-N"
"C(C2)CC([H])(C1)C(C)(C2)CCC1","InChI=1S/C11H20/c1-11-8-4-2-6-10(11)7-3-5-9-11/h10H,2-9H2,1H3/t10-,11+","RAFDCSMAXTUJKJ-PHIMTYICSA-N"
"C(C2)CC([H])(C1)C(C)(C2)CCC1","InChI=1S/C11H20/c1-11-8-4-2-6-10(11)7-3-5-9-11/h10H,2-9H2,1H3/t10-,11-","RAFDCSMAXTUJKJ-XYPYZODXSA-N"
"O=C(C1)C=C(C2)C(C)(CCC2)C1","InChI=1S/C11H16O/c1-11-6-3-2-4-9(11)8-10(12)5-7-11/h8H,2-7H2,1H3","OHERZLWVBJCXOF-UHFFFAOYSA-N"
"O=C(C1)CC(C2)C(C)(CCC2)C1","InChI=1S/C11H18O/c1-11-6-3-2-4-9(11)8-10(12)5-7-11/h9H,2-8H2,1H3","QAFCUHJMKAQBFU-UHFFFAOYSA-N"
"O=C(OCc(c21)c(c3)c(ccc3)c(C)c(cccc2)1)C(C)(C)C","InChI=1S/C21H22O2/c1-14-15-9-5-7-11-17(15)19(13-23-20(22)21(2,3)4)18-12-8-6-10-16(14)18/h5-12H,13H2,1-4H3","DJMFMJYBGUQQCQ-UHFFFAOYSA-N"
"C=Cc(c21)c(c3)c(ccc3)c(C)c(cccc2)1","InChI=1S/C17H14/c1-3-13-16-10-6-4-8-14(16)12(2)15-9-5-7-11-17(13)15/h3-11H,1H2,2H3","DRRJFUPMBLRKSQ-UHFFFAOYSA-N"
"CN(C)c(c3)ccc(c3)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C18H17N/c1-19(2)16-12-10-15(11-13-16)18-9-5-7-14-6-3-4-8-17(14)18/h3-13H,1-2H3","VEXNITXCNXSHHK-UHFFFAOYSA-N"
"CN(C)c(c4)ccc(c4)c(c1)c(c3)c(ccc3)c(c2)c(ccc(C(C)=O)2)1","InChI=1S/C24H21NO/c1-16(26)18-8-9-19-15-23(17-10-12-20(13-11-17)25(2)3)21-6-4-5-7-22(21)24(19)14-18/h4-15H,1-3H3","HXKAXPZIJRDBIK-UHFFFAOYSA-N"
"CCCCC","InChI=1S/C5H12/c1-3-5-4-2/h3-5H2,1-2H3","OFBQJSOFQDEBGM-UHFFFAOYSA-N"
"C(C3)CCC(C3)=CC(=N2)CC(O2)c(c1)cccc1","InChI=1S/C16H19NO/c1-3-7-13(8-4-1)11-15-12-16(18-17-15)14-9-5-2-6-10-14/h2,5-6,9-11,16H,1,3-4,7-8,12H2","YUINRBMISZKSNG-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=O)CC(O)CBr","InChI=1S/C9H18BrO5P/c1-3-14-16(13,15-4-2)7-9(12)5-8(11)6-10/h8,11H,3-7H2,1-2H3","ZLBKIXSDTIHKAT-UHFFFAOYSA-N"
"CCOP(=O)(CC1=CC=C(N1)C)OCC","InChI=1S/C10H18NO3P/c1-4-13-15(12,14-5-2)8-10-7-6-9(3)11-10/h6-7,11H,4-5,8H2,1-3H3","CJNXLSYPKGOXNM-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=N1)CC(C(C)=O)O1","InChI=1S/C10H18NO5P/c1-4-14-17(13,15-5-2)7-9-6-10(8(3)12)16-11-9/h10H,4-7H2,1-3H3","TXPQHUXZMQZVNC-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=O)CC(O)C(C)=O","InChI=1S/C10H19O6P/c1-4-15-17(14,16-5-2)7-9(12)6-10(13)8(3)11/h10,13H,4-7H2,1-3H3","HSDQBKZUQHXQHT-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=N1)CC(OC(C)=O)O1","InChI=1S/C10H18NO6P/c1-4-14-18(13,15-5-2)7-9-6-10(17-11-9)16-8(3)12/h10H,4-7H2,1-3H3","PUOIXLJREASCAX-UHFFFAOYSA-N"
"COC(=O)C(O1)CC(=N1)CP(=O)(OCC)OCC","InChI=1S/C10H18NO6P/c1-4-15-18(13,16-5-2)7-8-6-9(17-11-8)10(12)14-3/h9H,4-7H2,1-3H3","HLHGCXALTYCKCW-UHFFFAOYSA-N"
"COC(=O)C(O)CC(=O)CP(=O)(OCC)OCC","InChI=1S/C10H19O7P/c1-4-16-18(14,17-5-2)7-8(11)6-9(12)10(13)15-3/h9,12H,4-7H2,1-3H3","PUNMCCFNGLRFTH-UHFFFAOYSA-N"
"CC(=O)C(=N2)CC(O2)c(c1)cccc1","InChI=1S/C11H11NO2/c1-8(13)10-7-11(14-12-10)9-5-3-2-4-6-9/h2-6,11H,7H2,1H3","XILXRKZJQSENAD-UHFFFAOYSA-N"
"CCCCCC=CC(=O)CP(=O)(OCC)OCC","InChI=1S/C13H25O4P/c1-4-7-8-9-10-11-13(14)12-18(15,16-5-2)17-6-3/h10-11H,4-9,12H2,1-3H3/b11-10+","GOURVSOVGPBRIT-ZHACJKMWSA-N"
"CCOC(OCC)C(O1)CC(=N1)CP(=O)(OCC)OCC","InChI=1S/C13H26NO6P/c1-5-16-13(17-6-2)12-9-11(14-20-12)10-21(15,18-7-3)19-8-4/h12-13H,5-10H2,1-4H3","MEWHSFWACYOMPK-UHFFFAOYSA-N"
"CCCCCC(O)CC(=O)CP(=O)(OCC)OCC","InChI=1S/C13H27O5P/c1-4-7-8-9-12(14)10-13(15)11-19(16,17-5-2)18-6-3/h12,14H,4-11H2,1-3H3","GOWXDWHMDPJXEG-UHFFFAOYSA-N"
"CC=CC=CC(=N2)CC(O2)c(c1)cccc1","InChI=1S/C14H15NO/c1-2-3-5-10-13-11-14(16-15-13)12-8-6-4-7-9-12/h2-10,14H,11H2,1H3/b3-2+,10-5+","LDBCNEIPFQCAMB-XPQLPGEHSA-N"
"CCOP(=O)(OCC)CC(=N2)CC(O2)c(c1)cccc1","InChI=1S/C14H20NO4P/c1-3-17-20(16,18-4-2)11-13-10-14(19-15-13)12-8-6-5-7-9-12/h5-9,14H,3-4,10-11H2,1-2H3","NBWNSGRSVRMQDP-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=N2)CC(O2)S(=O)(=O)c(c1)cccc1","InChI=1S/C14H20NO6PS/c1-3-19-22(16,20-4-2)11-12-10-14(21-15-12)23(17,18)13-8-6-5-7-9-13/h5-9,14H,3-4,10-11H2,1-2H3","PXKGACKLAUJPNY-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=O)CC(O)c(c1)cccc1","InChI=1S/C14H21O5P/c1-3-18-20(17,19-4-2)11-13(15)10-14(16)12-8-6-5-7-9-12/h5-9,14,16H,3-4,10-11H2,1-2H3","PZGPHVQDUFPFNU-UHFFFAOYSA-N"
"CCCCCC(O2)CC(=N2)C(=O)Cc(c1)cccc1","InChI=1S/C16H21NO2/c1-2-3-5-10-14-12-15(17-19-14)16(18)11-13-8-6-4-7-9-13/h4,6-9,14H,2-3,5,10-12H2,1H3","YFVLMZMPHAZJIT-UHFFFAOYSA-N"
"c(c3)ccc(c3)C=CC(=N2)CC(O2)c(c1)cccc1","InChI=1S/C17H15NO/c1-3-7-14(8-4-1)11-12-16-13-17(19-18-16)15-9-5-2-6-10-15/h1-12,17H,13H2/b12-11+","OFNNLHMXDFWUTR-VAWYXSNFSA-N"
"CCCCCC(O1)CC(=N1)CP(=O)(OCC)OCC","InChI=1S/C13H26NO4P/c1-4-7-8-9-13-10-12(14-18-13)11-19(15,16-5-2)17-6-3/h13H,4-11H2,1-3H3","SJRNQODZDUDLQK-UHFFFAOYSA-N"
"CCOC(OCC)C(O)CC(=O)CP(=O)(OCC)OCC","InChI=1S/C13H27O7P/c1-5-17-13(18-6-2)12(15)9-11(14)10-21(16,19-7-3)20-8-4/h12-13,15H,5-10H2,1-4H3","MLYOGOHTSZHGEQ-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=O)C=Cc(c1)cccc1","InChI=1S/C14H19O4P/c1-3-17-19(16,18-4-2)12-14(15)11-10-13-8-6-5-7-9-13/h5-11H,3-4,12H2,1-2H3/b11-10+","MIBDHTHXMJVXEP-ZHACJKMWSA-N"
"CCCCCC(=O)C(=N2)CC(O2)c(c1)cccc1","InChI=1S/C15H19NO2/c1-2-3-5-10-14(17)13-11-15(18-16-13)12-8-6-4-7-9-12/h4,6-9,15H,2-3,5,10-11H2,1H3","GHVPDJOCSLYPED-UHFFFAOYSA-N"
"COC(=O)C(C1)C(=O)C(C(=O)OC)Cc(c2)c(ccc2)1","InChI=1S/C15H16O5/c1-19-14(17)11-7-9-5-3-4-6-10(9)8-12(13(11)16)15(18)20-2/h3-6,11-12H,7-8H2,1-2H3","AKTMCFLYKONPOD-UHFFFAOYSA-N"
"c(c5)cc(C1)c(c5)CC(C2)C(=O)C1Cc(c3)c(cc(c4)c(ccc4)3)2","InChI=1S/C23H20O/c24-23-21-11-17-7-3-4-8-18(17)12-22(23)14-20-10-16-6-2-1-5-15(16)9-19(20)13-21/h1-10,21-22H,11-14H2","MWOVBEVAEJDHFU-UHFFFAOYSA-N"
"CC(C)(C)Br","InChI=1S/C4H9Br/c1-4(2,3)5/h1-3H3","RKSOPLXZQNSWAS-UHFFFAOYSA-N"
"CC(C)I","InChI=1S/C3H7I/c1-3(2)4/h3H,1-2H3","FMKOJHQHASLBPH-UHFFFAOYSA-N"
"COC(=O)Cl","InChI=1S/C2H3ClO2/c1-5-2(3)4/h1H3","XMJHPCRAQCTCFT-UHFFFAOYSA-N"
"CCOC(=O)Cl","InChI=1S/C3H5ClO2/c1-2-6-3(4)5/h2H2,1H3","RIFGWPKJUGCATF-UHFFFAOYSA-N"
"O=C(Cl)COc(c1)cccc1","InChI=1S/C8H7ClO2/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2","PKUPAJQAJXVUEK-UHFFFAOYSA-N"
"[2H]C([2H])([2H])O[2H]","InChI=1S/CH4O/c1-2/h2H,1H3/i1D3,2D","OKKJLVBELUTLKV-MZCSYVLQSA-N"
"CCN(CC)CC","InChI=1S/C6H15N/c1-4-7(5-2)6-3/h4-6H2,1-3H3","ZMANZCXQSJIPKH-UHFFFAOYSA-N"
"OC(=O)C(F)(F)F","InChI=1S/C2HF3O2/c3-2(4,5)1(6)7/h(H,6,7)","DTQVDTLACAAQTR-UHFFFAOYSA-N"
"O=Cc(c1)ccc(F)c1","InChI=1S/C7H5FO/c8-7-3-1-6(5-9)2-4-7/h1-5H","UOQXIWFBQSVDPP-UHFFFAOYSA-N"
"CC(C)COC(=O)Cl","InChI=1S/C5H9ClO2/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3","YOETUEMZNOLGDB-UHFFFAOYSA-N"
"Cc(c1)cc(N)c(O)c1","InChI=1S/C7H9NO/c1-5-2-3-7(9)6(8)4-5/h2-4,9H,8H2,1H3","ZMXYNJXDULEQCK-UHFFFAOYSA-N"
"COC(=O)c(c1)c(ccc1)OC(C)=O","InChI=1S/C10H10O4/c1-7(11)14-9-6-4-3-5-8(9)10(12)13-2/h3-6H,1-2H3","ONWPLBKWMAUFGZ-UHFFFAOYSA-N"
"OC(=O)COc(c1)cccc1","InChI=1S/C8H8O3/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)","LCPDWSOZIOUXRV-UHFFFAOYSA-N"
"CCCOC(=O)Cl","InChI=1S/C4H7ClO2/c1-2-3-7-4(5)6/h2-3H2,1H3","QQKDTTWZXHEGAQ-UHFFFAOYSA-N"
"OC(=O)c(c1)c(ccc1)[N+1]([O-1])=O","InChI=1S/C7H5NO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)","SLAMLWHELXOEJZ-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C7H5NO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)","AFPHTEQTJZKQAQ-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)C(=O)c(c1)cccc1","InChI=1S/C13H10O2/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,14H","NPFYZDNDJHZQKY-UHFFFAOYSA-N"
"O=CCc(c1)cccc1","InChI=1S/C8H8O/c9-7-6-8-4-2-1-3-5-8/h1-5,7H,6H2","DTUQWGWMVIHBKE-UHFFFAOYSA-N"
"OC(=O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C7H5NO4/c9-7(10)5-1-3-6(4-2-5)8(11)12/h1-4H,(H,9,10)","OTLNPYWUJOZPPA-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(I)cc1","InChI=1S/C6H4INO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H","CBYAZOKPJYBCHE-UHFFFAOYSA-N"
"N#CCC(N)=O","InChI=1S/C3H4N2O/c4-2-1-3(5)6/h1H2,(H2,5,6)","DGJMPUGMZIKDRO-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(S1)=C(C)C(=O)c(c2)c(ccc2)1","InChI=1S/C11H10OS/c1-7-8(2)13-10-6-4-3-5-9(10)11(7)12/h3-6H,1-2H3/i2D3","MBMJRWSFDYUTRL-BMSJAHLVSA-N"
"CC=Cc(c1)cccc1","InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2+","QROGIFZRVHSFLM-QHHAFSJGSA-N"
"CC=Cc(c1)cc(OC)c(OC)c1","InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+","NNWHUJCUHAELCL-SNAWJCMRSA-N"
"CC=Cc(c1)cc(OC)c(OC([2H])([2H])[2H])c1","InChI=1S/C11H14O2/c1-4-5-9-6-7-10(12-2)11(8-9)13-3/h4-8H,1-3H3/b5-4+/i2D3","NNWHUJCUHAELCL-GZQATRPDSA-N"
"O=C(OCCc(c2)cccc2)C=Cc(c1)cccc1","InChI=1S/C17H16O2/c18-17(12-11-15-7-3-1-4-8-15)19-14-13-16-9-5-2-6-10-16/h1-12H,13-14H2/b12-11+","MJQVZIANGRDJBT-VAWYXSNFSA-N"
"c(c3)cc(n1)c(c3)nc(c2)c(ccc2)1","InChI=1S/C12H8N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8H","PCNDJXKNXGMECE-UHFFFAOYSA-N"
"c(c3)cc(c1)c(c3)c(n2)c(ccc2)c1","InChI=1S/C13H9N/c1-2-6-12-10(4-1)7-8-11-5-3-9-14-13(11)12/h1-9H","WZJYKHNJTSNBHV-UHFFFAOYSA-N"
"Oc(c3)cc(n1)c(c3)nc(c2)c(ccc2)1","InChI=1S/C12H8N2O/c15-8-5-6-11-12(7-8)14-10-4-2-1-3-9(10)13-11/h1-7,15H","RETSEGNZNUBJRB-UHFFFAOYSA-N"
"COc(c3)cc(n1)c(c3)nc(c2)c(ccc2)1","InChI=1S/C13H10N2O/c1-16-9-6-7-12-13(8-9)15-11-5-3-2-4-10(11)14-12/h2-8H,1H3","YGSXHEXJOFMTHZ-UHFFFAOYSA-N"
"N#Cc(c3)cc(n1)c(c3)nc(c2)c(ccc2)1","InChI=1S/C13H7N3/c14-8-9-5-6-12-13(7-9)16-11-4-2-1-3-10(11)15-12/h1-7H","IWDIQIINIKFOEB-UHFFFAOYSA-N"
"OC(=O)c(c3)c(n1)c(cc3)nc(c2)c(ccc2)1","InChI=1S/C13H8N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7H,(H,16,17)","JGCSKOVQDXEQHI-UHFFFAOYSA-N"
"c(c3)cc(N1)c(c3)Nc(c2)c(ccc2)1","InChI=1S/C12H10N2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8,13-14H","IVURTNNWJAPOML-UHFFFAOYSA-N"
"OC(=O)c(c3)c(N1)c(cc3)Nc(c2)c(ccc2)1","InChI=1S/C13H10N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7,14-15H,(H,16,17)","RWCXEOMFBZOODX-UHFFFAOYSA-N"
"OC(=O)c(c(O)3)c(n1)c(cc3)nc(c2)c(ccc2)1","InChI=1S/C13H8N2O3/c16-10-6-5-9-12(11(10)13(17)18)15-8-4-2-1-3-7(8)14-9/h1-6,16H,(H,17,18)","GXLWPTUCVZRTBQ-UHFFFAOYSA-N"
"NC(=O)c(c3)cc(n1)c(c3)nc(c2)c(ccc2)1","InChI=1S/C13H9N3O/c14-13(17)8-5-6-11-12(7-8)16-10-4-2-1-3-9(10)15-11/h1-7H,(H2,14,17)","HBUAKGFNHSQHSX-UHFFFAOYSA-N"
"NC(=O)c(c3)c(N1)c(cc3)Nc(c2)c(ccc2)1","InChI=1S/C13H11N3O/c14-13(17)8-4-3-7-11-12(8)16-10-6-2-1-5-9(10)15-11/h1-7,15-16H,(H2,14,17)","MGGYDPTZXGZDOD-UHFFFAOYSA-N"
"COC(=O)c(c3)c(n1)c(cc3)nc(c2)c(ccc2)1","InChI=1S/C14H10N2O2/c1-18-14(17)9-5-4-8-12-13(9)16-11-7-3-2-6-10(11)15-12/h2-8H,1H3","UEHCMQFOWIRZGQ-UHFFFAOYSA-N"
"COC(=O)c(c3)c(N1)c(cc3)Nc(c2)c(ccc2)1","InChI=1S/C14H12N2O2/c1-18-14(17)9-5-4-8-12-13(9)16-11-7-3-2-6-10(11)15-12/h2-8,15-16H,1H3","COHAWUIBTRRGHL-UHFFFAOYSA-N"
"COc(c1)cc(n2)c(nc(c3)c(ccc3)2)c(N)1","InChI=1S/C13H11N3O/c1-17-8-6-9(14)13-12(7-8)15-10-4-2-3-5-11(10)16-13/h2-7H,14H2,1H3","RYMYEMJNPWTUNT-UHFFFAOYSA-N"
"COc(c3)c(n1)c(c(N)c3)nc(c2)c(ccc2)1","InChI=1S/C13H11N3O/c1-17-11-7-6-8(14)12-13(11)16-10-5-3-2-4-9(10)15-12/h2-7H,14H2,1H3","VFEBRDAKZGPEHA-UHFFFAOYSA-N"
"[H]C(C14C)(C(CCC(C(C)C)CC)C)CCC1(C(C(CC4)2[H])=CCC(C3)(C2(CCC3([H])O)C)[H])[H]","InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h11,19-23,25-27,30H,7-10,12-18H2,1-6H3/t20?,21-,22-,23-,25+,26-,27-,28-,29+/m0/s1","YSKVBPGQYRAUQO-DYSDFPMNSA-N"
"[H]C(C14C)(C(CCC(C(C)=C)CC)C)CCC1(C(C(CC4)2[H])=CCC(C3)(C2(CCC3([H])O)C)[H])[H]","InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h11,20-23,25-27,30H,2,7-10,12-18H2,1,3-6H3/t20?,21-,22-,23-,25+,26-,27-,28-,29+/m0/s1","CMQUSRGUOMCHOZ-DYSDFPMNSA-N"
"C(C(C)12)CC(O)CC1(CC=C(C([H])43)C(CCC(C)3C(C(C)C=CC(C(C)C)CC)CC4)2[H])[H]","InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-9,11,19-23,25-27,30H,7,10,12-18H2,1-6H3/b9-8+/t20-,21+,22+,23+,25-,26+,27+,28+,29-/m1/s1","JZVFJDZBLUFKCA-INYURWPISA-N"
"CCN(CC)C=O","InChI=1S/C5H11NO/c1-3-6(4-2)5-7/h5H,3-4H2,1-2H3","SUAKHGWARZSWIH-UHFFFAOYSA-N"
"c(c2)ccc(c2)N(C)c(c1)cccc1","InChI=1S/C13H13N/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3","DYFFAVRFJWYYQO-UHFFFAOYSA-N"
"O=C(c21)c(c3)c(ccc3)Nc(cccc2)1","InChI=1S/C13H9NO/c15-13-9-5-1-3-7-11(9)14-12-8-4-2-6-10(12)13/h1-8H,(H,14,15)","FZEYVTFCMJSGMP-UHFFFAOYSA-N"
"C(O1)C1CBr","InChI=1S/C3H5BrO/c4-1-3-2-5-3/h3H,1-2H2","GKIPXFAANLTWBM-UHFFFAOYSA-N"
"c(c3)cc(C1)c(c3)Cc(c2)c(ccc2)C1","InChI=1S/C15H14/c1-3-7-14-11-15-8-4-2-6-13(15)10-9-12(14)5-1/h1-8H,9-11H2","PJQCANLCUDUPRF-UHFFFAOYSA-N"
"BrCCc(c1)cccc1","InChI=1S/C8H9Br/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7H2","WMPPDTMATNBGJN-UHFFFAOYSA-N"
"CCc(c1)cc(CC)cc1","InChI=1S/C10H14/c1-3-9-6-5-7-10(4-2)8-9/h5-8H,3-4H2,1-2H3","AFZZYIJIWUTJFO-UHFFFAOYSA-N"
"O=C(Cc(c2)cccc2)Cc(c1)cccc1","InChI=1S/C15H14O/c16-15(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2","YFKBXYGUSOXJGS-UHFFFAOYSA-N"
"SCCCS","InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2","ZJLMKPKYJBQJNH-UHFFFAOYSA-N"
"OC(=O)C([H])(C1)NCC1","InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1","ONIBWKKTOPOVIA-BYPYZUCNSA-N"
"ON=Cc(c1)c(O)ccc1","InChI=1S/C7H7NO2/c9-7-4-2-1-3-6(7)5-8-10/h1-5,9-10H/b8-5+","ORIHZIZPTZTNCU-VMPITWQZSA-N"
"NC(=O)c(c1)nccc1","InChI=1S/C6H6N2O/c7-6(9)5-3-1-2-4-8-5/h1-4H,(H2,7,9)","IBBMAWULFFBRKK-UHFFFAOYSA-N"
"C1=NNN=N1","InChI=1S/CH2N4/c1-2-4-5-3-1/h1H,(H,2,3,4,5)","KJUGUADJHNHALS-UHFFFAOYSA-N"
"C1=C(NC=N1)C=CC(=O)O","InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)/b2-1+","LOIYMIARKYCTBW-OWOJBTEDSA-N"
"CC(=C1)C(=O)NC(=O)N1","InChI=1S/C5H6N2O2/c1-3-2-6-5(9)7-4(3)8/h2H,1H3,(H2,6,7,8,9)","RWQNBRDOKXIBIV-UHFFFAOYSA-N"
"C1=NC2=C(N1)C(=O)N=CN2","InChI=1S/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)","FDGQSTZJBFJUBT-UHFFFAOYSA-N"
"CN(C)C(=S)S[Zn]SC(=S)N(C)C","InChI=1S/2C3H7NS2.Zn/c2*1-4(2)3(5)6;/h2*1-2H3,(H,5,6);/q;;+2/p-2","DUBNHZYBDBBJHD-UHFFFAOYSA-L"
"C(=CC([H])(C)C(C)C)C(C(C4)([H])C(C3(C4)[H])(CCC(C=23)(C(C1)(C)C(=CC2)CC(O)C1)[H])C)([H])C","InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+/t19-,20-,22-,24+,25-,26-,27-,28+/m0/s1","DNVPQKQSNYMLRS-PFQWWJQESA-N"
"CC(C4([H])C([H])(C)CCC(C(C)C)=C)(C([H])3CC4)CCC(C([H])23)([H])C(C)(C=1CC2)CCC(C1)=O","InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h17-18,20,23-26H,3,7-16H2,1-2,4-6H3/t20-,23+,24+,25-,26-,27-,28+/m0/s1","JRMPVNVOLQJLJX-AWYZUKNCSA-N"
"Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3/t14-,15-,16+,18+/m1/s1","DNXHEGUUPJUMQT-CBZIJGRNSA-N"
"CCC([H])(C)C(=O)OC(C3)C([H])(C1=CC(C)3)C(CCC(C2)OC(=O)CC(O)2)C(C)C=C1","InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3/t14-,15-,16-,18+,19+,20-,21-,23-/m0/s1","PCZOHLXUXFIOCF-BXMDZJJMSA-N"
"N#Cc(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C15H9N/c16-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)15/h1-9H","KEQZHLAEKAVZLY-UHFFFAOYSA-N"
"COC(=O)C(N)Cc(c1)cccc1","InChI=1S/C10H13NO2/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9H,7,11H2,1H3/t9-/m0/s1","VSDUZFOSJDMAFZ-VIFPVBQESA-N"
"ON=C(C)C(C)=NO","InChI=1S/C4H8N2O2/c1-3(5-7)4(2)6-8/h7-8H,1-2H3/b5-3+,6-4+","JGUQDUKBUKFFRO-GGWOSOGESA-N"
"OC(=O)C(C)c(c3)cc(n1)c(c3)oc1c(c2)ccc(Cl)c2","InChI=1S/C16H12ClNO3/c1-9(16(19)20)11-4-7-14-13(8-11)18-15(21-14)10-2-5-12(17)6-3-10/h2-9H,1H3,(H,19,20)","MITFXPHMIHQXPI-UHFFFAOYSA-N"
"OC(=O)c(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C15H10O2/c16-15(17)14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-9H,(H,16,17)","XGWFJBFNAQHLEF-UHFFFAOYSA-N"
"ClC(Cl)(Cl)Br","InChI=1S/CBrCl3/c2-1(3,4)5","XNNQFQFUQLJSQT-UHFFFAOYSA-N"
"CNC(C)=O","InChI=1S/C3H7NO/c1-3(5)4-2/h1-2H3,(H,4,5)","OHLUUHNLEMFGTQ-UHFFFAOYSA-N"
"OC(=O)c(c2)cc(O1)c(c2)OC([2H])([2H])1","InChI=1S/C8H6O4/c9-8(10)5-1-2-6-7(3-5)12-4-11-6/h1-3H,4H2,(H,9,10)/i4D2","VDVJGIYXDVPQLP-APZFVMQVSA-N"
"OC(C2)Oc(c(Cl)1)c(C(=O)2)c(Cl)cc1","InChI=1S/C9H6Cl2O3/c10-4-1-2-5(11)9-8(4)6(12)3-7(13)14-9/h1-2,7,13H,3H2","OBIVNYOBLULRFU-UHFFFAOYSA-N"
"COc(c2)cc(c(Cl)1)c(c2)nc(C)c1","InChI=1S/C11H10ClNO/c1-7-5-10(12)9-6-8(14-2)3-4-11(9)13-7/h3-6H,1-2H3","WABDZSKKLDCIRM-UHFFFAOYSA-N"
"Nc(n1)ncnc1","InChI=1S/C3H4N4/c4-3-6-1-5-2-7-3/h1-2H,(H2,4,5,6,7)","KCZIUKYAJJEIQG-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)C(=O)c(c1)cccc1","InChI=1S/C13H11NO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H,14H2","RBKHNGHPZZZJCI-UHFFFAOYSA-N"
"Nc(n1)nccc1","InChI=1S/C4H5N3/c5-4-6-2-1-3-7-4/h1-3H,(H2,5,6,7)","LJXQPZWIHJMPQQ-UHFFFAOYSA-N"
"N#CCc(c1)ccc(N)c1","InChI=1S/C8H8N2/c9-6-5-7-1-3-8(10)4-2-7/h1-4H,5,10H2","YCWRFIYBUQBHJI-UHFFFAOYSA-N"
"Nc(c1)c(F)ccc1","InChI=1S/C6H6FN/c7-5-3-1-2-4-6(5)8/h1-4H,8H2","FTZQXOJYPFINKJ-UHFFFAOYSA-N"
"CN(C)c(c1)cc(C)cc1","InChI=1S/C9H13N/c1-8-5-4-6-9(7-8)10(2)3/h4-7H,1-3H3","CWOMTHDOJCARBY-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCBr","InChI=1S/C10H17Br/c1-9(2)5-4-6-10(3)7-8-11/h5,7H,4,6,8H2,1-3H3/b10-7+","JSCUZAYKVZXKQE-JXMROGBWSA-N"
"O=CNc(c1)cccc1","InChI=1S/C7H7NO/c9-6-8-7-4-2-1-3-5-7/h1-6H,(H,8,9)","DYDNPESBYVVLBO-UHFFFAOYSA-N"
"c(c3)cc(C1)c(c3)Nc(c2)c(ccc2)1","InChI=1S/C13H11N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8,14H,9H2","HJCUTNIGJHJGCF-UHFFFAOYSA-N"
"Oc(c1)c(cc(c1)C(C)(C)C)C(C)(C)C","InChI=1S/C14H22O/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6/h7-9,15H,1-6H3","ICKWICRCANNIBI-UHFFFAOYSA-N"
"OC(=O)c(c1)c(O)ccn1","InChI=1S/C6H5NO3/c8-5-1-2-7-3-4(5)6(9)10/h1-3H,(H,7,8)(H,9,10)","CHCUBGPSZDGABM-UHFFFAOYSA-N"
"CC(O)Cc(c1)cccc1","InChI=1S/C9H12O/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3","WYTRYIUQUDTGSX-UHFFFAOYSA-N"
"NCc(s1)nc(C(O)=O)c1","InChI=1S/C5H6N2O2S/c6-1-4-7-3(2-10-4)5(8)9/h2H,1,6H2,(H,8,9)","DOIRUXCDSGNCMX-UHFFFAOYSA-N"
"","InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h7,9,19,21-25,28H,6,8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1","AVSXSVCZWQODGV-DPAQBDIFSA-N"
"CC(N)c(s1)nc(C(O)=O)c1","InChI=1S/C6H8N2O2S/c1-3(7)5-8-4(2-11-5)6(9)10/h2-3H,7H2,1H3,(H,9,10)","IZYPOVIPPSQRBI-UHFFFAOYSA-N"
"C(CC=C(C)C)C(C)=C(CCC(C)=C(CCC([H])=C(CCC([H])=C(CCC=C(C)C)C)C)[H])[H]","InChI=1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h15-18,23-24H,9-14,19-22H2,1-8H3/b27-17+,28-18+,29-23+,30-24+","YYGNTYWPHWGJRM-AAJYLUCBSA-N"
"C1=CC2=C(C=C1O)C(=CN2)CCN","InChI=1S/C10H12N2O/c11-4-3-7-6-12-10-2-1-8(13)5-9(7)10/h1-2,5-6,12-13H,3-4,11H2","QZAYGJVTTNCVMB-UHFFFAOYSA-N"
"CCOC(=O)CCCCCC(O)=O","InChI=1S/C9H16O4/c1-2-13-9(12)7-5-3-4-6-8(10)11/h2-7H2,1H3,(H,10,11)","NQYXFXWKKYGBNL-UHFFFAOYSA-N"
"CC(C)CC(N)C(=O)NC(CC(C)C)C(O)=O","InChI=1S/C12H24N2O3/c1-7(2)5-9(13)11(15)14-10(12(16)17)6-8(3)4/h7-10H,5-6,13H2,1-4H3,(H,14,15)(H,16,17)","LCPYQJIKPJDLLB-UHFFFAOYSA-N"
"O=c(c1)cc(C(C)(C)C)c(=O)c1C(C)(C)C","InChI=1S/C14H20O2/c1-13(2,3)10-7-9(15)8-11(12(10)16)14(4,5)6/h7-8H,1-6H3","RDQSIADLBQFVMY-UHFFFAOYSA-N"
"CC(C)CC(N)C(=O)NCC(=O)NCC(O)=O","InChI=1S/C10H19N3O4/c1-6(2)3-7(11)10(17)13-4-8(14)12-5-9(15)16/h6-7H,3-5,11H2,1-2H3,(H,12,14)(H,13,17)(H,15,16)","VWHGTYCRDRBSFI-UHFFFAOYSA-N"
"Oc(c5)cc(O1)c(c5)C(O3)(c(c4)c(ccc4)C(=O)3)c(c2)c(cc(O)c2)1","InChI=1S/C20H12O5/c21-11-5-7-15-17(9-11)24-18-10-12(22)6-8-16(18)20(15)14-4-2-1-3-13(14)19(23)25-20/h1-10,21-22H","GNBHRKFJIUUOQI-UHFFFAOYSA-N"
"OC(=O)C(C1)C(C)(C)C(C)(C(O)=O)C1","InChI=1S/C10H16O4/c1-9(2)6(7(11)12)4-5-10(9,3)8(13)14/h6H,4-5H2,1-3H3,(H,11,12)(H,13,14)","LSPHULWDVZXLIL-UHFFFAOYSA-N"
"NC(=S)N(c(c2)cccc2)c(c1)cccc1","InChI=1S/C13H12N2S/c14-13(16)15(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H2,14,16)","FPZXQVCYHDMIIA-UHFFFAOYSA-N"
"OC(=O)C(C1)C(CCC1)C(O)=O","InChI=1S/C8H12O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6-/m1/s1","QSAWQNUELGIYBC-PHDIDXHHSA-N"
"Clc(c1)c(O)c(c2)c(ccc2)c(Cl)1","InChI=1S/C10H6Cl2O/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,13H","HVLJEMXDXOTWLV-UHFFFAOYSA-N"
"OC(=O)c(c1)c(O)c(C)cc1","InChI=1S/C8H8O3/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4,9H,1H3,(H,10,11)","WHSXTWFYRGOBGO-UHFFFAOYSA-N"
"OC(=O)c(c1)c(I)ccc1","InChI=1S/C7H5IO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)","CJNZAXGUTKBIHP-UHFFFAOYSA-N"
"Oc(c4)c(C)cc(c4)C(O1)(c(c3)cc(C)c(O)c3)c(c2)c(ccc2)C(=O)1","InChI=1S/C22H18O4/c1-13-11-15(7-9-19(13)23)22(16-8-10-20(24)14(2)12-16)18-6-4-3-5-17(18)21(25)26-22/h3-12,23-24H,1-2H3","CPBJMKMKNCRKQB-UHFFFAOYSA-N"
"OC(=O)c(c1)ccc(c1)C(C)(C)C","InChI=1S/C11H14O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)","KDVYCTOWXSLNNI-UHFFFAOYSA-N"
"CC(=O)Nc(c1)ccc(C)c1","InChI=1S/C9H11NO/c1-7-3-5-9(6-4-7)10-8(2)11/h3-6H,1-2H3,(H,10,11)","YICAMJWHIUMFDI-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(O)=O","InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)","ZEYHEAKUIGZSGI-UHFFFAOYSA-N"
"OC(=O)c(c1)ccc(Br)c1","InChI=1S/C7H5BrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)","TUXYZHVUPGXXQG-UHFFFAOYSA-N"
"O=C(C2)NN(C2)c(c1)cccc1","InChI=1S/C9H10N2O/c12-9-6-7-11(10-9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,12)","CMCWWLVWPDLCRM-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(Cl)c(Cl)c1","InChI=1S/C7H4Cl2O2/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3H,(H,10,11)","VPHHJAOJUJHJKD-UHFFFAOYSA-N"
"Nc(c1)c(Cl)ccc(Cl)1","InChI=1S/C6H5Cl2N/c7-4-1-2-5(8)6(9)3-4/h1-3H,9H2","AVYGCQXNNJPXSS-UHFFFAOYSA-N"
"OC(=O)c(c1)ccc(c1)C(O)=O","InChI=1S/C8H6O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H,(H,9,10)(H,11,12)","KKEYFWRCBNTPAC-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(c1)C(C)(C)C","InChI=1S/C13H18O2/c1-5-15-12(14)10-6-8-11(9-7-10)13(2,3)4/h6-9H,5H2,1-4H3","LIQWHXBLFOERRD-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(N(C)C)c1","InChI=1S/C11H15NO2/c1-4-14-11(13)9-5-7-10(8-6-9)12(2)3/h5-8H,4H2,1-3H3","FZUGPQWGEGAKET-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(Br)cc1","InChI=1S/C9H9BrO2/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3","QAUASTLEZAPQTB-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(Cl)cc1","InChI=1S/C9H9ClO2/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3","LVFRSNCBCHABAM-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(Cl)c1","InChI=1S/C9H9ClO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2H2,1H3","RWBYCMPOFNRISR-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(cc1)S(C)(=O)=O","InChI=1S/C10H12O4S/c1-3-14-10(11)8-5-4-6-9(7-8)15(2,12)13/h4-7H,3H2,1-2H3","XCBPURUOABFDDU-UHFFFAOYSA-N"
"CC(=O)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C12H10O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-8H,1H3","XSAYZAUNJMRRIR-UHFFFAOYSA-N"
"CC(=O)c(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C16H12O/c1-11(17)16-14-8-4-2-6-12(14)10-13-7-3-5-9-15(13)16/h2-10H,1H3","NXXNVJDXUHMAHU-UHFFFAOYSA-N"
"CC(=O)c(c2)ccc(c2)c(c1)cccc1","InChI=1S/C14H12O/c1-11(15)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10H,1H3","QCZZSANNLWPGEA-UHFFFAOYSA-N"
"CC(C)c(c1)ccc(C(C)=O)c1","InChI=1S/C11H14O/c1-8(2)10-4-6-11(7-5-10)9(3)12/h4-8H,1-3H3","PDLCCNYKIIUWHA-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(C(C)=O)c(C)1","InChI=1S/C11H14O/c1-7-5-8(2)11(10(4)12)9(3)6-7/h5-6H,1-4H3","XWCIICLTKWRWCI-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(c(c3)1)c(c2)c(ccc2)cc1","InChI=1S/C16H12O/c1-11(17)14-9-8-13-7-6-12-4-2-3-5-15(12)16(13)10-14/h2-10H,1H3","JKVNPRNAHRHQDD-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C16H12O/c1-11(17)13-8-9-16-14(10-13)7-6-12-4-2-3-5-15(12)16/h2-10H,1H3","CWILMKDSVMROHT-UHFFFAOYSA-N"
"CC(=O)c(c3)c(c1)c(cc3)cc(c2)c(ccc2)1","InChI=1S/C16H12O/c1-11(17)15-8-4-7-14-9-12-5-2-3-6-13(12)10-16(14)15/h2-10H,1H3","MGRRZBKEFOXFRI-UHFFFAOYSA-N"
"CCc(c3)cc(C1)c(c3)c(c2)c(cc(C(C)=O)c2)1","InChI=1S/C17H16O/c1-3-12-4-6-16-14(8-12)10-15-9-13(11(2)18)5-7-17(15)16/h4-9H,3,10H2,1-2H3","JHMVPGWDPZHTSF-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(C1)c(c3)c(c2)c(ccc2)1","InChI=1S/C15H12O/c1-10(16)11-6-7-15-13(8-11)9-12-4-2-3-5-14(12)15/h2-8H,9H2,1H3","IBASEVZORZFIIH-UHFFFAOYSA-N"
"CC(=O)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H10O/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11/h2-8H,1H3","QQLIGMASAVJVON-UHFFFAOYSA-N"
"N#Cc(c1)cc(cc1)C(C)=O","InChI=1S/C9H7NO/c1-7(11)9-4-2-3-8(5-9)6-10/h2-5H,1H3","SBCFGFDAZCTSRH-UHFFFAOYSA-N"
"CC(=O)c(c1)cc(N)cc1","InChI=1S/C8H9NO/c1-6(10)7-3-2-4-8(9)5-7/h2-5H,9H2,1H3","CKQHAYFOPRIUOM-UHFFFAOYSA-N"
"CC(=O)c(c3)cc(C1)c(c3)c(c2)c(ccc2)C1","InChI=1S/C16H14O/c1-11(17)13-8-9-16-14(10-13)7-6-12-4-2-3-5-15(12)16/h2-5,8-10H,6-7H2,1H3","JLABAJAYOGFVQR-UHFFFAOYSA-N"
"Clc(c3)cc(cc3)C(=O)c(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C19H13ClO2/c20-16-6-4-5-15(13-16)19(21)14-9-11-18(12-10-14)22-17-7-2-1-3-8-17/h1-13H","CJLZBJCUUYTJOL-UHFFFAOYSA-N"
"Clc(c4)cc(cc4)C(=O)c(c3)cc(C1)c(c3)c(c2)c(ccc2)1","InChI=1S/C20H13ClO/c21-17-6-3-5-14(12-17)20(22)15-8-9-19-16(11-15)10-13-4-1-2-7-18(13)19/h1-9,11-12H,10H2","BYCULHXMOSCHIW-UHFFFAOYSA-N"
"Clc(c3)cc(cc3)C(=O)c(c2)ccc(c2)c(c1)cccc1","InChI=1S/C19H13ClO/c20-18-8-4-7-17(13-18)19(21)16-11-9-15(10-12-16)14-5-2-1-3-6-14/h1-13H","IIMHFJOYSGKNFB-UHFFFAOYSA-N"
"CC(O)c(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C14H14O2/c1-11(15)12-7-9-14(10-8-12)16-13-5-3-2-4-6-13/h2-11,15H,1H3","HCIFMENZOKGFEI-UHFFFAOYSA-N"
"CC(O)c(c1)ccc(I)c1","InChI=1S/C8H9IO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3","KWUDBZIJCVKUHM-UHFFFAOYSA-N"
"CC(O)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H12O/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11/h2-9,13H,1H3","CDRQOYRPWJULJN-UHFFFAOYSA-N"
"Clc(c2)cc(cc2)C(O)c(c1)cccc1","InChI=1S/C13H11ClO/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9,13,15H","DDCJHFYXAPQYLA-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(C)c(C)1","InChI=1S/C12H16O2/c1-5-14-12(13)11-6-8(2)10(4)9(3)7-11/h6-7H,5H2,1-4H3","KPJDFDDXGVPHRI-UHFFFAOYSA-N"
"CCOC(=O)c(c2)cc(C)c(c(C)2)C(=O)c(c1)cccc1","InChI=1S/C18H18O3/c1-4-21-18(20)15-10-12(2)16(13(3)11-15)17(19)14-8-6-5-7-9-14/h5-11H,4H2,1-3H3","HIUGILYOVQDTAN-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(C#N)c(C)1","InChI=1S/C12H13NO2/c1-4-15-12(14)10-5-8(2)11(7-13)9(3)6-10/h5-6H,4H2,1-3H3","PBIVJCCDRQYWSV-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(c1)S(C)(=O)=O","InChI=1S/C10H12O4S/c1-3-14-10(11)8-4-6-9(7-5-8)15(2,12)13/h4-7H,3H2,1-2H3","ADTIKXSMRDSYSK-UHFFFAOYSA-N"
"CCOC(=O)c(c2)cc(cc2)c(c1)cccc1","InChI=1S/C15H14O2/c1-2-17-15(16)14-10-6-9-13(11-14)12-7-4-3-5-8-12/h3-11H,2H2,1H3","UWJOIAKPUPVYPW-UHFFFAOYSA-N"
"CCOC(=O)c(c2)cc(cc2)Oc(c1)cccc1","InChI=1S/C15H14O3/c1-2-17-15(16)12-7-6-10-14(11-12)18-13-8-4-3-5-9-13/h3-11H,2H2,1H3","LBKYKBFMRILRCT-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)cc(C)1","InChI=1S/C11H14O2/c1-4-13-11(12)10-6-8(2)5-9(3)7-10/h5-7H,4H2,1-3H3","IHAAVLXHNOZMBC-UHFFFAOYSA-N"
"CCOC(=O)c(c(C)1)c(C)cc(C)c1","InChI=1S/C12H16O2/c1-5-14-12(13)11-9(3)6-8(2)7-10(11)4/h6-7H,5H2,1-4H3","ZXTXIZPSMQCYBN-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(SC)c(C)1","InChI=1S/C12H16O2S/c1-5-14-12(13)10-6-8(2)11(15-4)9(3)7-10/h6-7H,5H2,1-4H3","WEWKDUHBBQKMCR-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(C(=O)OCC)c(C)1","InChI=1S/C14H18O4/c1-5-17-13(15)11-7-9(3)12(10(4)8-11)14(16)18-6-2/h7-8H,5-6H2,1-4H3","SFIMTKVOVRYIGN-UHFFFAOYSA-N"
"CC(=O)c(c1)c(c3)c(ccc3)c(c2)c(ccc2)1","InChI=1S/C16H12O/c1-11(17)16-10-12-6-2-3-7-13(12)14-8-4-5-9-15(14)16/h2-10H,1H3","UIFAWZBYTTXSOG-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(OC)c(C)1","InChI=1S/C12H16O3/c1-5-15-12(13)10-6-8(2)11(14-4)9(3)7-10/h6-7H,5H2,1-4H3","VTPOFWHQBYJVTQ-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(Cl)c(C)1","InChI=1S/C11H13ClO2/c1-4-14-11(13)9-5-7(2)10(12)8(3)6-9/h5-6H,4H2,1-3H3","LNDNLCSHAZPLIV-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(C(C)=O)c(C)1","InChI=1S/C13H16O3/c1-5-16-13(15)11-6-8(2)12(10(4)14)9(3)7-11/h6-7H,5H2,1-4H3","CJMJIWJARUFVLF-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(c(C)1)S(C)(=O)=O","InChI=1S/C12H16O4S/c1-5-16-12(13)10-6-8(2)11(9(3)7-10)17(4,14)15/h6-7H,5H2,1-4H3","KZEWHBQUQSKYAE-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c([N+1]([O-1])=O)c(C)1","InChI=1S/C11H13NO4/c1-4-16-11(13)9-5-7(2)10(12(14)15)8(3)6-9/h5-6H,4H2,1-3H3","LXHYBLDIIOAWLA-UHFFFAOYSA-N"
"CCOC(=O)Cc(c1)ccc(C)c1","InChI=1S/C11H14O2/c1-3-13-11(12)8-10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3","BTRGZBIXPLFVNK-UHFFFAOYSA-N"
"CC(=O)c(c1)ccc(c1)C(C)(C)C","InChI=1S/C12H16O/c1-9(13)10-5-7-11(8-6-10)12(2,3)4/h5-8H,1-4H3","UYFJYGWNYQCHOB-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C13H12O2/c1-2-15-13(14)12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,2H2,1H3","HQKSINSCHCDMLS-UHFFFAOYSA-N"
"CCOC(=O)c(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C15H14O3/c1-2-17-15(16)12-8-10-14(11-9-12)18-13-6-4-3-5-7-13/h3-11H,2H2,1H3","GJDBBHASMUCGME-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(SC)c1","InChI=1S/C10H12O2S/c1-3-12-10(11)8-4-6-9(13-2)7-5-8/h4-7H,3H2,1-2H3","URNLGRVTEGNSHT-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(cc1)N(C)C","InChI=1S/C11H15NO2/c1-4-14-11(13)9-6-5-7-10(8-9)12(2)3/h5-8H,4H2,1-3H3","CQNOGTUXPYIVDM-UHFFFAOYSA-N"
"CCOC(=O)Cc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C16H16O3/c1-2-18-16(17)12-13-8-10-15(11-9-13)19-14-6-4-3-5-7-14/h3-11H,2,12H2,1H3","CPYLMUNOJSVCRZ-UHFFFAOYSA-N"
"CCOC(=O)Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C14H14O2/c1-2-16-14(15)10-12-8-5-7-11-6-3-4-9-13(11)12/h3-9H,2,10H2,1H3","XIDPSKQLXKCVQN-UHFFFAOYSA-N"
"CCOC(=O)c(c3)cc(c(c3)1)c(c2)c(ccc2)cc1","InChI=1S/C17H14O2/c1-2-19-17(18)14-10-9-13-8-7-12-5-3-4-6-15(12)16(13)11-14/h3-11H,2H2,1H3","XGGPWBCYWFCCES-UHFFFAOYSA-N"
"CCOC(=O)c(c2)ccc(c2)c(c1)cccc1","InChI=1S/C15H14O2/c1-2-17-15(16)14-10-8-13(9-11-14)12-6-4-3-5-7-12/h3-11H,2H2,1H3","FFQZMOHAQYZTNR-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(C#N)c1","InChI=1S/C10H9NO2/c1-2-13-10(12)9-5-3-8(7-11)4-6-9/h3-6H,2H2,1H3","JLSSWDFCYXSLQX-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C#N)cc1","InChI=1S/C10H9NO2/c1-2-13-10(12)9-5-3-4-8(6-9)7-11/h3-6H,2H2,1H3","ZKXMKMLGUYSGNS-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(C(C)=O)c1","InChI=1S/C11H12O3/c1-3-14-11(13)10-6-4-9(5-7-10)8(2)12/h4-7H,3H2,1-2H3","GLOAPLPTWAXAIG-UHFFFAOYSA-N"
"CCOC(=O)c(c3)cc(C1)c(c3)c(c2)c(ccc2)1","InChI=1S/C16H14O2/c1-2-18-16(17)12-7-8-15-13(10-12)9-11-5-3-4-6-14(11)15/h3-8,10H,2,9H2,1H3","SAFAPOUNUGQSNS-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(cc1)C(C)=O","InChI=1S/C11H12O3/c1-3-14-11(13)10-6-4-5-9(7-10)8(2)12/h4-7H,3H2,1-2H3","KHTGDCLCPJJWEY-UHFFFAOYSA-N"
"CCOC(=O)c(c1)ccc(c1)C(=O)OCC","InChI=1S/C12H14O4/c1-3-15-11(13)9-5-7-10(8-6-9)12(14)16-4-2/h5-8H,3-4H2,1-2H3","ONIHPYYWNBVMID-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C9H9NO4/c1-2-14-9(11)7-4-3-5-8(6-7)10(12)13/h3-6H,2H2,1H3","MKBIJCPQTPFQKQ-UHFFFAOYSA-N"
"CC(=O)c(c4)cc(C3)c(c14)c(c2C3)c(ccc2)CC1","InChI=1S/C18H16O/c1-11(19)16-9-14-7-5-12-3-2-4-13-6-8-15(10-16)18(14)17(12)13/h2-4,9-10H,5-8H2,1H3","INKIBYZEUXUPPA-UHFFFAOYSA-N"
"Cc(c1)c(O)c(C)cc(Br)1","InChI=1S/C8H9BrO/c1-5-3-7(9)4-6(2)8(5)10/h3-4,10H,1-2H3","ZLVFYUORUHNMBO-UHFFFAOYSA-N"
"N#Cc(c1)cc(C)c(C#N)c(C)1","InChI=1S/C10H8N2/c1-7-3-9(5-11)4-8(2)10(7)6-12/h3-4H,1-2H3","VODNMFZZKATZHT-UHFFFAOYSA-N"
"Cc(c1)c(N)c(C)cc(Br)1","InChI=1S/C8H10BrN/c1-5-3-7(9)4-6(2)8(5)10/h3-4H,10H2,1-2H3","QGLAYJCJLHNIGJ-UHFFFAOYSA-N"
"Cc(c2)c(ccc2)COC(=O)c(c1)cccc1","InChI=1S/C15H14O2/c1-12-7-5-6-10-14(12)11-17-15(16)13-8-3-2-4-9-13/h2-10H,11H2,1H3","NAIUTWJYNXOVNP-UHFFFAOYSA-N"
"CSc(c2)cc(cc2)COC(=O)c(c1)cccc1","InChI=1S/C15H14O2S/c1-18-14-9-5-6-12(10-14)11-17-15(16)13-7-3-2-4-8-13/h2-10H,11H2,1H3","TYFATSPQNVLDKD-UHFFFAOYSA-N"
"Cc(c2)cc(cc2)COC(=O)c(c1)cccc1","InChI=1S/C15H14O2/c1-12-6-5-7-13(10-12)11-17-15(16)14-8-3-2-4-9-14/h2-10H,11H2,1H3","PNDUDVIQWFVXIO-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)COC(=O)c(c1)cccc1","InChI=1S/C14H11FO2/c15-13-8-6-11(7-9-13)10-17-14(16)12-4-2-1-3-5-12/h1-9H,10H2","DVTATUAZGVHURR-UHFFFAOYSA-N"
"CSc(c1)ccc(COC(=O)c(c2)cccc2)c1","InChI=1S/C15H14O2S/c1-18-14-9-7-12(8-10-14)11-17-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3","PXRPPQZOKMHYRY-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)COC(=O)c(c1)cccc1","InChI=1S/C15H14O2/c1-12-7-9-13(10-8-12)11-17-15(16)14-5-3-2-4-6-14/h2-10H,11H2,1H3","VHSYVZKRJCCJMK-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(C)c(C(N)=O)c(C)1","InChI=1S/C12H15NO3/c1-4-16-12(15)9-5-7(2)10(11(13)14)8(3)6-9/h5-6H,4H2,1-3H3,(H2,13,14)","LURKQVNXGQMQEE-UHFFFAOYSA-N"
"COCC([H])(O1)C([H])(OC)C([H])(OC)C([H])(OC)1","InChI=1S/C9H18O5/c1-10-5-6-7(11-2)8(12-3)9(13-4)14-6/h6-9H,5H2,1-4H3","GGXQVNLZJSOZBN-UHFFFAOYSA-N"
"COCC([H])(O1)C([H])(OC)C([H])(OC)C([H])(OC)C([H])(OC)1","InChI=1S/C11H22O6/c1-12-6-7-8(13-2)9(14-3)10(15-4)11(16-5)17-7/h7-11H,6H2,1-5H3","ZYGZAHUNAGVTEC-UHFFFAOYSA-N"
"OCC(=O)C([H])(C4)C(C=O)(C3)C([H])(C4)C([H])(C1)C([H])(C([H])(O)3)C(C)(C2)C(=C([H])C(=O)C2)C1","InChI=1S/C21H28O5/c1-20-7-6-13(24)8-12(20)2-3-14-15-4-5-16(18(26)10-22)21(15,11-23)9-17(25)19(14)20/h8,11,14-17,19,22,25H,2-7,9-10H2,1H3/t14-,15-,16+,17-,19+,20-,21+/m0/s1","PQSUYGKTWSAVDQ-ZVIOFETBSA-N"
"OCC(=O)C([H])(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C([H])(O)3)C(C)(C2)C(=C([H])C(=O)C2)C1","InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1","OMFXVFTZEKFJBZ-HJTSIMOOSA-N"
"OCC(=O)C(O)(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C2)C([H])(CC([H])(O)C2)C1","InChI=1S/C21H34O4/c1-19-8-5-14(23)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,25)18(24)12-22/h13-17,22-23,25H,3-12H2,1-2H3/t13-,14-,15-,16+,17+,19+,20+,21+/m1/s1","UPTAPIKFKZGAGM-FAIYVORSSA-N"
"OCC(=O)C(O)(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(=O)3)C(C)(C2)C([H])(CC(O)C2)C1","InChI=1S/C21H32O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-15,18,22-23,26H,3-11H2,1-2H3/t12-,13-,14+,15+,18-,19+,20+,21+/m1/s1","SYGWGHVTLUBCEM-ZIZPXRJBSA-N"
"OCC(=O)C(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(O)3)C(C)(C2)C([H])(CC(O)C2)C1","InChI=1S/C21H34O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-17,19,22-24H,3-11H2,1-2H3/t12-,13-,14+,15+,16-,17+,19-,20+,21+/m1/s1","RHQQHZQUAMFINJ-DTDWNVJFSA-N"
"OC(C4)CC([H])(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(C(C)O)C1","InChI=1S/C21H36O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19,22-23H,4-12H2,1-3H3/t13?,14-,15-,16+,17-,18+,19+,20+,21-/m1/s1","YWYQTGBBEZQBGO-WDDCBOSHSA-N"
"[H]C(O)(C4)CC([H])(C3)C(C)(C4)C([H])(C(=O)1)C([H])(C3)C([H])(C2)C(C)(C(=O)C2)C1","InChI=1S/C19H28O3/c1-18-8-7-12(20)9-11(18)3-4-13-14-5-6-16(22)19(14,2)10-15(21)17(13)18/h11-14,17,20H,3-10H2,1-2H3/t11-,12-,13+,14+,17-,18+,19+/m1/s1","IUNYGQONJQTULL-UKZLPJRTSA-N"
"OC(C4)CC([H])(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14+,15+,16+,18+,19+/m1/s1","QGXBDMJGAMFCBF-BNSUEQOYSA-N"
"O=c(c(Cl)1)c(Cl)c(Cl)c(=O)c(Cl)1","InChI=1S/C6Cl4O2/c7-1-2(8)6(12)4(10)3(9)5(1)11","UGNWTBMOAKPKBL-UHFFFAOYSA-N"
"N#CC(C#N)=c(c1)ccc(c1)=C(C#N)C#N","InChI=1S/C12H4N4/c13-5-11(6-14)9-1-2-10(4-3-9)12(7-15)8-16/h1-4H","PCCVSPMFGIFTHU-UHFFFAOYSA-N"
"Cc(c1)c(C)c(C)c(C)c(C)1","InChI=1S/C11H16/c1-7-6-8(2)10(4)11(5)9(7)3/h6H,1-5H3","BEZDDPMMPIDMGJ-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)c(c1)ccc(C(O)=O)c1","InChI=1S/C13H10O3/c14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16/h1-8,14H,(H,15,16)","JTGCXYYDAVPSFD-UHFFFAOYSA-N"
"CCC(CO)(CO)CO","InChI=1S/C6H14O3/c1-2-6(3-7,4-8)5-9/h7-9H,2-5H2,1H3","ZJCCRDAZUWHFQH-UHFFFAOYSA-N"
"OCC(C)(CO)CO","InChI=1S/C5H12O3/c1-5(2-6,3-7)4-8/h6-8H,2-4H2,1H3","QXJQHYBHAIHNGG-UHFFFAOYSA-N"
"CCN(CC)C(=O)c(c1)cncc1","InChI=1S/C10H14N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h5-8H,3-4H2,1-2H3","NCYVXEGFNDZQCU-UHFFFAOYSA-N"
"CN(C2)C([H])(CC2)c(c1)cncc1","InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1","SNICXCGAKADSCV-JTQLQIEISA-N"
"O=c(c1)cc(Cl)c(=O)c(Cl)1","InChI=1S/C6H2Cl2O2/c7-4-1-3(9)2-5(8)6(4)10/h1-2H","JCARTGJGWCGSSU-UHFFFAOYSA-N"
"OCCCCCCO","InChI=1S/C6H14O2/c7-5-3-1-2-4-6-8/h7-8H,1-6H2","XXMIOPMDWAUFGU-UHFFFAOYSA-N"
"COCCOCCl","InChI=1S/C4H9ClO2/c1-6-2-3-7-4-5/h2-4H2,1H3","BIAAQBNMRITRDV-UHFFFAOYSA-N"
"NCCN(C1)CCNC1","InChI=1S/C6H15N3/c7-1-4-9-5-2-8-3-6-9/h8H,1-7H2","IMUDHTPIFIBORV-UHFFFAOYSA-N"
"O=C(C1)NC(=O)NC(=O)1","InChI=1S/C4H4N2O3/c7-2-1-3(8)6-4(9)5-2/h1H2,(H2,5,6,7,8,9)","HNYOPLTXPVRDBG-UHFFFAOYSA-N"
"OC(C1)CC(C2)C(C)(CCC2)C1","InChI=1S/C11H20O/c1-11-6-3-2-4-9(11)8-10(12)5-7-11/h9-10,12H,2-8H2,1H3","ZGVYVWSAAMJYCN-UHFFFAOYSA-N"
"CCOC(=O)C(C1)C(=O)CC(C(=O)OCC)C(=O)1","InChI=1S/C12H16O6/c1-3-17-11(15)7-5-10(14)8(6-9(7)13)12(16)18-4-2/h7-8H,3-6H2,1-2H3","KSKWGMNRWCYVAT-UHFFFAOYSA-N"
"C(C1)C1","InChI=1S/C3H6/c1-2-3-1/h1-3H2","LVZWSLJZHVFIQJ-UHFFFAOYSA-N"
"O=C(C=3)Oc(c1)c(C3)ccc(OCC=C(C)C(=C2)OC(C)(C)C(=O)2)1","InChI=1S/C19H18O5/c1-12(15-11-17(20)19(2,3)24-15)8-9-22-14-6-4-13-5-7-18(21)23-16(13)10-14/h4-8,10-11H,9H2,1-3H3/b12-8+","OUTLLBZGJYDUQE-XYOKQWHBSA-N"
"Oc(c1)c(Br)cc(O)c1CC([H])(C(=C)2)C(C)(C)C([H])(Br)CC2","InChI=1S/C16H20Br2O2/c1-9-4-5-15(18)16(2,3)11(9)6-10-7-14(20)12(17)8-13(10)19/h7-8,11,15,19-20H,1,4-6H2,2-3H3/t11-,15+/m0/s1","OVQUXMIHRFSOJM-XHDPSFHLSA-N"
"CCC(O)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C11H24OSi/c1-7-11(12)10(9(2)3)8-13(4,5)6/h10-12H,2,7-8H2,1,3-6H3","LTTVLXPPUDUYBC-UHFFFAOYSA-N"
"O=CC(C)=CCOc(c1)cc(O2)c(C=CC(=O)2)c1","InChI=1S/C14H12O4/c1-10(9-15)6-7-17-12-4-2-11-3-5-14(16)18-13(11)8-12/h2-6,8-9H,7H2,1H3/b10-6+","BOEYBMJEVSXRSZ-UXBLZVDNSA-N"
"CC(=CCOc(c1)cc(O2)c(C=CC(=O)2)c1)C(=O)C#CC(C)(C)O","InChI=1S/C19H18O5/c1-13(16(20)8-10-19(2,3)22)9-11-23-15-6-4-14-5-7-18(21)24-17(14)12-15/h4-7,9,12,22H,11H2,1-3H3/b13-9+","OYKRKWYDZSRLEV-UKTHLTGXSA-N"
"CC(C1)(O1)CCBr","InChI=1S/C5H9BrO/c1-5(2-3-6)4-7-5/h2-4H2,1H3","HUQIPXUHULWQTD-UHFFFAOYSA-N"
"COC(OC)C(Cl)C(C)=C","InChI=1S/C7H13ClO2/c1-5(2)6(8)7(9-3)10-4/h6-7H,1H2,2-4H3","ABPMBQRFVZPMID-UHFFFAOYSA-N"
"O=C(C(=O)1)C(C2)C(C)(C)C(C)(C2)1","InChI=1S/C10H14O2/c1-9(2)6-4-5-10(9,3)8(12)7(6)11/h6H,4-5H2,1-3H3","VNQXSTWCDUXYEZ-UHFFFAOYSA-N"
"CC(C)=CCC(=C(C)C)C(C)=O","InChI=1S/C11H18O/c1-8(2)6-7-11(9(3)4)10(5)12/h6H,7H2,1-5H3","XUOWQIBGRJIEDN-UHFFFAOYSA-N"
"OCC(O)COc(c1)cccc1","InChI=1S/C9H12O3/c10-6-8(11)7-12-9-4-2-1-3-5-9/h1-5,8,10-11H,6-7H2","FNQIYTUXOKTMDM-UHFFFAOYSA-N"
"O=C(C(O)1)C(C2)C(C)(C)C(C)(C2)1","InChI=1S/C10H16O2/c1-9(2)6-4-5-10(9,3)8(12)7(6)11/h6,8,12H,4-5H2,1-3H3","HJVHHNRJPMNKAK-UHFFFAOYSA-N"
"CCOC(C)OCC=C(C)C#C","InChI=1S/C10H16O2/c1-5-9(3)7-8-12-10(4)11-6-2/h1,7,10H,6,8H2,2-4H3/b9-7+","JTRZVLCJKKJLNN-VQHVLOKHSA-N"
"CC(C)=CCCC(C)=CC(O)=O","InChI=1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/b9-7-","ZHYZQXUYZJNEHD-CLFYSBASSA-N"
"CC(C)=CCCC(C)=CC(O)=O","InChI=1S/C10H16O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,7H,4,6H2,1-3H3,(H,11,12)/b9-7+","ZHYZQXUYZJNEHD-VQHVLOKHSA-N"
"CC(=O)C(C1)=C(C)OC(C)(C)C1","InChI=1S/C10H16O2/c1-7(11)9-5-6-10(3,4)12-8(9)2/h5-6H2,1-4H3","UMPFVLPDUDPOHN-UHFFFAOYSA-N"
"CC(C)=CC(C(C(O)=O)1)C(C)(C)1","InChI=1S/C10H16O2/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3,(H,11,12)","XLOPRKKSAJMMEW-UHFFFAOYSA-N"
"CC(C)=CCC(=C(C)C)C(C)O","InChI=1S/C11H20O/c1-8(2)6-7-11(9(3)4)10(5)12/h6,10,12H,7H2,1-5H3","VSBFLTQWMJCTBX-UHFFFAOYSA-N"
"C=CC(C)=CCC(Cl)C(C)=C","InChI=1S/C10H15Cl/c1-5-9(4)6-7-10(11)8(2)3/h5-6,10H,1-2,7H2,3-4H3/b9-6+","RHUJVDWXWYMVRC-RMKNXTFCSA-N"
"CCOC(C)OCC=C(C)C=C","InChI=1S/C10H18O2/c1-5-9(3)7-8-12-10(4)11-6-2/h5,7,10H,1,6,8H2,2-4H3/b9-7+","SXYHZQKHSJEQNM-VQHVLOKHSA-N"
"CCCCC(OC)C=C(C)C=O","InChI=1S/C10H18O2/c1-4-5-6-10(12-3)7-9(2)8-11/h7-8,10H,4-6H2,1-3H3/b9-7+","RTCHEAZARYSCOY-VQHVLOKHSA-N"
"CC(C)=CCCC(C)(O1)C(CO)1","InChI=1S/C10H18O2/c1-8(2)5-4-6-10(3)9(7-11)12-10/h5,9,11H,4,6-7H2,1-3H3","RZRBXGPSHVAUQO-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O)C(C1)O1","InChI=1S/C10H18O2/c1-8(2)5-4-6-10(3,11)9-7-12-9/h5,9,11H,4,6-7H2,1-3H3","BXOURKNXQXLKRK-UHFFFAOYSA-N"
"C=CC(C)(C1)OC(C1)C(C)(C)O","InChI=1S/C10H18O2/c1-5-10(4)7-6-8(12-10)9(2,3)11/h5,8,11H,1,6-7H2,2-4H3","BRHDDEIRQPDPMG-UHFFFAOYSA-N"
"C=CCC(C)(O)CCCC(C)C","InChI=1S/C11H22O/c1-5-8-11(4,12)9-6-7-10(2)3/h5,10,12H,1,6-9H2,2-4H3","LGYLSRRKPXWRAT-UHFFFAOYSA-N"
"CCOC(=O)CN(C1)C(=O)CC1","InChI=1S/C8H13NO3/c1-2-12-8(11)6-9-5-3-4-7(9)10/h2-6H2,1H3","AQZWKPDVWWJWRY-UHFFFAOYSA-N"
"CC(C)CCOC(C1)OCCC1","InChI=1S/C10H20O2/c1-9(2)6-8-12-10-5-3-4-7-11-10/h9-10H,3-8H2,1-2H3","DHDKLGMTNBVEIS-UHFFFAOYSA-N"
"CC(C)=CCOCCC(C)(C)O","InChI=1S/C10H20O2/c1-9(2)5-7-12-8-6-10(3,4)11/h5,11H,6-8H2,1-4H3","XWKFROPYJWBTBH-UHFFFAOYSA-N"
"OCCCC(C)CCCC(C)C","InChI=1S/C11H24O/c1-10(2)6-4-7-11(3)8-5-9-12/h10-12H,4-9H2,1-3H3","ASDSWUHLJCTXPE-UHFFFAOYSA-N"
"N#CC(C)C(CC)c(c1)cccc1","InChI=1S/C12H15N/c1-3-12(10(2)9-13)11-7-5-4-6-8-11/h4-8,10,12H,3H2,1-2H3","LPJQHUZTKUSKPA-UHFFFAOYSA-N"
"CCOC(=O)C(C)C(=O)OCC","InChI=1S/C8H14O4/c1-4-11-7(9)6(3)8(10)12-5-2/h6H,4-5H2,1-3H3","UPQZOUHVTJNGFK-UHFFFAOYSA-N"
"OCCOCCOC(=O)C(C)=C","InChI=1S/C8H14O4/c1-7(2)8(10)12-6-5-11-4-3-9/h9H,1,3-6H2,2H3","OLQFXOWPTQTLDP-UHFFFAOYSA-N"
"CC(=C)C=COCc(c1)cccc1","InChI=1S/C12H14O/c1-11(2)8-9-13-10-12-6-4-3-5-7-12/h3-9H,1,10H2,2H3/b9-8+","JICYZRMWDNTUNJ-CMDGGOBGSA-N"
"OC(C2)C(CCC2)c(c1)cccc1","InChI=1S/C12H16O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-13H,4-5,8-9H2","AAIBYZBZXNWTPP-UHFFFAOYSA-N"
"C#CC(=O)CC(C)CCC=C(C)C","InChI=1S/C12H18O/c1-5-12(13)9-11(4)8-6-7-10(2)3/h1,7,11H,6,8-9H2,2-4H3","YGQFGXUPZVFDTI-UHFFFAOYSA-N"
"C[Sn](C)(C)C","InChI=1S/4CH3.Sn/h4*1H3;","VXKWYPOMXBVZSJ-UHFFFAOYSA-N"
"CC(=O)OCCC(C)(O)CCl","InChI=1S/C7H13ClO3/c1-6(9)11-4-3-7(2,10)5-8/h10H,3-5H2,1-2H3","CXGRFFKXRMWAOS-UHFFFAOYSA-N"
"CC(=O)OCC(Cl)C(C)(C)O","InChI=1S/C7H13ClO3/c1-5(9)11-4-6(8)7(2,3)10/h6,10H,4H2,1-3H3","GVGGNYJJOUJXTK-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(O2)c(OC2)c1","InChI=1S/C9H8O4/c1-11-9(10)6-2-3-7-8(4-6)13-5-12-7/h2-4H,5H2,1H3","QCHGUEIECOASJU-UHFFFAOYSA-N"
"C=COC(C1)C(C)(C2)C(C)(C)C(C2)1","InChI=1S/C12H20O/c1-5-13-10-8-9-6-7-12(10,4)11(9,2)3/h5,9-10H,1,6-8H2,2-4H3","LQLLNKLOYCYFEB-UHFFFAOYSA-N"
"C=CCCCC=CCN(CC)CC","InChI=1S/C12H23N/c1-4-7-8-9-10-11-12-13(5-2)6-3/h4,10-11H,1,5-9,12H2,2-3H3/b11-10+","ZDIDSJWITLGYFN-ZHACJKMWSA-N"
"COC(=O)C(Cl)C(=C)CCl","InChI=1S/C6H8Cl2O2/c1-4(3-7)5(8)6(9)10-2/h5H,1,3H2,2H3","YRNAQLFSLJHQFK-UHFFFAOYSA-N"
"CCC(=O)C(C1)=C(C)OC(C)(C)C1","InChI=1S/C11H18O2/c1-5-10(12)9-6-7-11(3,4)13-8(9)2/h5-7H2,1-4H3","ZERLPEUSKXJNAS-UHFFFAOYSA-N"
"OC(C2)C(CCC2)C(C1)CCCC1","InChI=1S/C12H22O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h10-13H,1-9H2","YTWWBKKPWACPPB-UHFFFAOYSA-N"
"CC(C)=CCOC(O1)CC(C)=CC1","InChI=1S/C11H18O2/c1-9(2)4-6-12-11-8-10(3)5-7-13-11/h4-5,11H,6-8H2,1-3H3","MSJLAJXSUADVQP-UHFFFAOYSA-N"
"C=CC(O)(C1)CC(C)(C)NC(C)(C)1","InChI=1S/C11H21NO/c1-6-11(13)7-9(2,3)12-10(4,5)8-11/h6,12-13H,1,7-8H2,2-5H3","KSGXXSJRSQQSOW-UHFFFAOYSA-N"
"CCCCCCC(O)CC(C)C=C","InChI=1S/C12H24O/c1-4-6-7-8-9-12(13)10-11(3)5-2/h5,11-13H,2,4,6-10H2,1,3H3","ONXKCUDRJQBVFX-UHFFFAOYSA-N"
"O=CC=C(C)CCC(Cl)C(C)=C","InChI=1S/C10H15ClO/c1-8(2)10(11)5-4-9(3)6-7-12/h6-7,10H,1,4-5H2,2-3H3/b9-6+","AUSCHJGENLMKTA-RMKNXTFCSA-N"
"O=CCCCCCCCC(=O)OC","InChI=1S/C10H18O3/c1-13-10(12)8-6-4-2-3-5-7-9-11/h9H,2-8H2,1H3","JMLYDLZRFNYHHO-UHFFFAOYSA-N"
"OCC(N)C(C)(O)CCC=C(C)C","InChI=1S/C10H21NO2/c1-8(2)5-4-6-10(3,13)9(11)7-12/h5,9,12-13H,4,6-7,11H2,1-3H3","MYZAIZLYFVZBRQ-UHFFFAOYSA-N"
"CCOC(=O)C(C)(C)C(=O)OCC","InChI=1S/C9H16O4/c1-5-12-7(10)9(3,4)8(11)13-6-2/h5-6H2,1-4H3","UELKSYXXNGHTSE-UHFFFAOYSA-N"
"OC(=O)c(c2)cc(c1)c(c2)cc(O)c1","InChI=1S/C11H8O3/c12-10-4-3-7-5-9(11(13)14)2-1-8(7)6-10/h1-6,12H,(H,13,14)","KAUQJMHLAFIZDU-UHFFFAOYSA-N"
"CC=CCC(C)(C=O)c(c1)cccc1","InChI=1S/C13H16O/c1-3-4-10-13(2,11-14)12-8-6-5-7-9-12/h3-9,11H,10H2,1-2H3/b4-3+","RXBHCNJVNOKWOX-ONEGZZNKSA-N"
"c(c2)cc(c(c2)1)C(C)(C)C(C)C(C)(C)1","InChI=1S/C14H20/c1-10-13(2,3)11-8-6-7-9-12(11)14(10,4)5/h6-10H,1-5H3","ZCMKNGQFIXAHLP-UHFFFAOYSA-N"
"ClCS(=O)(=O)c(c1)cccc1","InChI=1S/C7H7ClO2S/c8-6-11(9,10)7-4-2-1-3-5-7/h1-5H,6H2","NXAIQSVCXQZNRY-UHFFFAOYSA-N"
"CCCCC(OC)C(Cl)C(C)=C","InChI=1S/C10H19ClO/c1-5-6-7-9(12-4)10(11)8(2)3/h9-10H,2,5-7H2,1,3-4H3","ZGVARBJHFUAWRR-UHFFFAOYSA-N"
"CC(C)CCCC(C)(O)C(O)CO","InChI=1S/C10H22O3/c1-8(2)5-4-6-10(3,13)9(12)7-11/h8-9,11-13H,4-7H2,1-3H3","AXSMBYNAYXIVCP-UHFFFAOYSA-N"
"OCCC(C)(C)OCCC(C)(C)O","InChI=1S/C10H22O3/c1-9(2,12)6-8-13-10(3,4)5-7-11/h11-12H,5-8H2,1-4H3","CASYYYJJAUURRZ-UHFFFAOYSA-N"
"COC(=O)C(=O)C=Cc(c1)cccc1","InChI=1S/C11H10O3/c1-14-11(13)10(12)8-7-9-5-3-2-4-6-9/h2-8H,1H3/b8-7+","ZWDYRZGSCHGREX-BQYQJAHWSA-N"
"CC(=C)C(=O)COCc(c1)cccc1","InChI=1S/C12H14O2/c1-10(2)12(13)9-14-8-11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3","MTTACSFQMRIJPO-UHFFFAOYSA-N"
"CC(=C)C(C2)OC(O2)c(c1)cccc1","InChI=1S/C12H14O2/c1-9(2)11-8-13-12(14-11)10-6-4-3-5-7-10/h3-7,11-12H,1,8H2,2H3","QIQZXVSZGSDFQR-UHFFFAOYSA-N"
"O=CC(C)=CCOCc(c1)cccc1","InChI=1S/C12H14O2/c1-11(9-13)7-8-14-10-12-5-3-2-4-6-12/h2-7,9H,8,10H2,1H3/b11-7+","DCVWTVWAMAMRST-YRNVUSSQSA-N"
"O=CC(C)c(c1)ccc(c1)C(C)(C)C","InChI=1S/C13H18O/c1-10(9-14)11-5-7-12(8-6-11)13(2,3)4/h5-10H,1-4H3","SNOVXNPIRUDJNG-UHFFFAOYSA-N"
"CCNc(n1)nc(Cl)nc(Cl)1","InChI=1S/C5H6Cl2N4/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H,8,9,10,11)","ACAHVXOSWOUZAB-UHFFFAOYSA-N"
"COC(=O)CC(=O)Cc(c1)cccc1","InChI=1S/C11H12O3/c1-14-11(13)8-10(12)7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3","DTMSEOVTDVSPDO-UHFFFAOYSA-N"
"COC(=O)C(O1)C(Cc(c2)cccc2)1","InChI=1S/C11H12O3/c1-13-11(12)10-9(14-10)7-8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3","IVHYJCFQLLHFHQ-UHFFFAOYSA-N"
"COC(=O)C(=O)CCc(c1)cccc1","InChI=1S/C11H12O3/c1-14-11(13)10(12)8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3","DMZGURNRYOUAGC-UHFFFAOYSA-N"
"O=C(OC(C)(C)C)Cc(c1)cccc1","InChI=1S/C12H16O2/c1-12(2,3)14-11(13)9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3","QROFQHQXTMKORN-UHFFFAOYSA-N"
"CC(=C)C(O)COCc(c1)cccc1","InChI=1S/C12H16O2/c1-10(2)12(13)9-14-8-11-6-4-3-5-7-11/h3-7,12-13H,1,8-9H2,2H3","HOEBLAPFNZPWIE-UHFFFAOYSA-N"
"CC(=C)C=CC=C(C)C=COC(C)=O","InChI=1S/C12H16O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h5-9H,1H2,2-4H3/b6-5+,9-8+,11-7+","RYVXRHRZBWBWBB-ZTCKEYQCSA-N"
"OCC(C)=CCOCc(c1)cccc1","InChI=1S/C12H16O2/c1-11(9-13)7-8-14-10-12-5-3-2-4-6-12/h2-7,13H,8-10H2,1H3/b11-7+","ZBNQXXPQZJJMIB-YRNVUSSQSA-N"
"CC(=O)c(c(C)1)c(O)c(C)c(C)c(O)1","InChI=1S/C11H14O3/c1-5-6(2)11(14)9(8(4)12)7(3)10(5)13/h13-14H,1-4H3","ADMGWHTWSYEIOQ-UHFFFAOYSA-N"
"CCCCCCc(c1)c(O)cc(O)c1","InChI=1S/C12H18O2/c1-2-3-4-5-6-10-7-8-11(13)9-12(10)14/h7-9,13-14H,2-6H2,1H3","WFJIVOKAWHGMBH-UHFFFAOYSA-N"
"CC(=O)OCC(Cl)C(=C)CCl","InChI=1S/C7H10Cl2O2/c1-5(3-8)7(9)4-11-6(2)10/h7H,1,3-4H2,2H3","FHCAXNJSBOWFBL-UHFFFAOYSA-N"
"COC(=O)C(Cl)=Cc(c1)cccc1","InChI=1S/C10H9ClO2/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-7H,1H3/b9-7-","OHXMZPBSQGEXEV-CLFYSBASSA-N"
"OC(=O)c(c(C)1)c(O)c(C)c(C)c(O)1","InChI=1S/C10H12O4/c1-4-5(2)9(12)7(10(13)14)6(3)8(4)11/h11-12H,1-3H3,(H,13,14)","KJUBUGFOUWAGTK-UHFFFAOYSA-N"
"CCOC(=O)C([H])=C(C)CCC=C(C)C","InChI=1S/C12H20O2/c1-5-14-12(13)9-11(4)8-6-7-10(2)3/h7,9H,5-6,8H2,1-4H3/b11-9-","ZPKNTCZTABQJPS-LUAWRHEFSA-N"
"CCOC(=O)C([H])=C(C)CCC=C(C)C","InChI=1S/C12H20O2/c1-5-14-12(13)9-11(4)8-6-7-10(2)3/h7,9H,5-6,8H2,1-4H3/b11-9+","ZPKNTCZTABQJPS-PKNBQFBNSA-N"
"COC(OC)C(Cl)C(=C)CCl","InChI=1S/C7H12Cl2O2/c1-5(4-8)6(9)7(10-2)11-3/h6-7H,1,4H2,2-3H3","XCKYPAWKCCJSFQ-UHFFFAOYSA-N"
"COC(=O)C(Cl)Cc(c1)cccc1","InChI=1S/C10H11ClO2/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9H,7H2,1H3","DWKOUAHXOPJAHG-UHFFFAOYSA-N"
"OC(Cc(c2)cccc2)c(c1)cccc1","InChI=1S/C14H14O/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14-15H,11H2","GBGXVCNOKWAMIP-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCCC(C)O","InChI=1S/C13H28O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h11-14H,5-10H2,1-4H3","GNJORAZPXCKMSY-UHFFFAOYSA-N"
"C=COCC=CCCCc(c1)cccc1","InChI=1S/C14H18O/c1-2-15-13-9-4-3-6-10-14-11-7-5-8-12-14/h2,4-5,7-9,11-12H,1,3,6,10,13H2/b9-4+","LQIXWNQKGOAZAI-RUDMXATFSA-N"
"NC(=O)Nc(c1)cc(Cl)c(Cl)c1","InChI=1S/C7H6Cl2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12)","CYESCLHCWJKRKM-UHFFFAOYSA-N"
"CCOC(C)OCC=C(C)C=CCl","InChI=1S/C10H17ClO2/c1-4-12-10(3)13-8-6-9(2)5-7-11/h5-7,10H,4,8H2,1-3H3/b7-5+,9-6+","XJDHKKWKOPKDMF-PDTNFJSOSA-N"
"CC(=O)c(c1)cc(C(C)=O)cc(C(C)=O)1","InChI=1S/C12H12O3/c1-7(13)10-4-11(8(2)14)6-12(5-10)9(3)15/h4-6H,1-3H3","HSOAIPRTHLEQFI-UHFFFAOYSA-N"
"CC(C)=CCC(C)(CO)c(c1)cccc1","InChI=1S/C14H20O/c1-12(2)9-10-14(3,11-15)13-7-5-4-6-8-13/h4-9,15H,10-11H2,1-3H3","ZIIUMKBETGSXRY-UHFFFAOYSA-N"
"OCC(O)C(C)(O)CCCC(C)(C)O","InChI=1S/C10H22O4/c1-9(2,13)5-4-6-10(3,14)8(12)7-11/h8,11-14H,4-7H2,1-3H3","UWRGONHVPULUGX-UHFFFAOYSA-N"
"OC(=O)C(C)=Cc(c2)c(O1)c(cc2)OC1","InChI=1S/C11H10O4/c1-7(11(12)13)5-8-3-2-4-9-10(8)15-6-14-9/h2-5H,6H2,1H3,(H,12,13)/b7-5-","GHPDISUPGNPJBE-ALCCZGGFSA-N"
"O=C(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C12H14O3/c1-6-7(2)12-9(8(3)11(6)14)4-5-10(13)15-12/h14H,4-5H2,1-3H3","IWIXYZQOIASOQM-UHFFFAOYSA-N"
"OCCC(C)(C1)Oc(c2)c(cc(C)c2)C1","InChI=1S/C13H18O2/c1-10-3-4-12-11(9-10)5-6-13(2,15-12)7-8-14/h3-4,9,14H,5-8H2,1-2H3","XYPZIMJRPNTDRA-UHFFFAOYSA-N"
"Cc(c1)c(O)c(C)c(C2)c1OC(C)(C)C2","InChI=1S/C13H18O2/c1-8-7-11-10(9(2)12(8)14)5-6-13(3,4)15-11/h7,14H,5-6H2,1-4H3","JCUAPADRRINJBH-UHFFFAOYSA-N"
"","InChI=1S/C13H22N2/c1-3-7-12(8-4-1)14-11-15-13-9-5-2-6-10-13/h12-13H,1-10H2","QOSSAOTZNIDXMA-UHFFFAOYSA-N"
"O=CC(C)=CCC(=C(C)1)C(C)(C)CCC1","InChI=1S/C14H22O/c1-11(10-15)7-8-13-12(2)6-5-9-14(13,3)4/h7,10H,5-6,8-9H2,1-4H3/b11-7+","FJCQUJKUMKZEMH-YRNVUSSQSA-N"
"CC(=O)OCC=C(C)C=C(Cl)Cl","InChI=1S/C8H10Cl2O2/c1-6(5-8(9)10)3-4-12-7(2)11/h3,5H,4H2,1-2H3/b6-3+","LSFBFKFSLCFMGT-ZZXKWVIFSA-N"
"CCC(=O)OCc(c1)cc(O2)c(OC2)c1","InChI=1S/C11H12O4/c1-2-11(12)13-6-8-3-4-9-10(5-8)15-7-14-9/h3-5H,2,6-7H2,1H3","FVRCUNZJSLRIKU-UHFFFAOYSA-N"
"OCCC(C)(C2)Oc(c1)c(C2)c(O)cc1","InChI=1S/C12H16O3/c1-12(7-8-13)6-5-9-10(14)3-2-4-11(9)15-12/h2-4,13-14H,5-8H2,1H3","WXVMCKFUHIGFAR-UHFFFAOYSA-N"
"OCCC(C)(C1)Oc(c2)c(cc(O)c2)C1","InChI=1S/C12H16O3/c1-12(6-7-13)5-4-9-8-10(14)2-3-11(9)15-12/h2-3,8,13-14H,4-7H2,1H3","IZVREMVRDLKBEU-UHFFFAOYSA-N"
"CC(=O)CC(=O)C(C1)C(C)=CC(C)(C)C1","InChI=1S/C13H20O2/c1-9-8-13(3,4)6-5-11(9)12(15)7-10(2)14/h8,11H,5-7H2,1-4H3","VYSSESUTYQNLPY-UHFFFAOYSA-N"
"C=CC(=C)CCCC(C)CCCC(C)C","InChI=1S/C15H28/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,13,15H,1,4,7-12H2,2-3,5H3","AEUDOPZBDNUKIV-UHFFFAOYSA-N"
"CC(C)=CCN(CC=C(C)C)C(C)(C)C","InChI=1S/C14H27N/c1-12(2)8-10-15(14(5,6)7)11-9-13(3)4/h8-9H,10-11H2,1-7H3","RAGXFGSULNYENY-UHFFFAOYSA-N"
"O=CC(C)=CCCC(C)=CCOC(C)=O","InChI=1S/C12H18O3/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6-7,9H,4-5,8H2,1-3H3/b10-7-,11-6+","YODDEHYDMMDDCV-IKVLVDHLSA-N"
"O=CC(C)=CCCC(C)=CCOC(C)=O","InChI=1S/C12H18O3/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6-7,9H,4-5,8H2,1-3H3/b10-7+,11-6+","YODDEHYDMMDDCV-NXAIOARDSA-N"
"COC(=O)CCC=C(C)CCC=C(C)C","InChI=1S/C13H22O2/c1-11(2)7-5-8-12(3)9-6-10-13(14)15-4/h7,9H,5-6,8,10H2,1-4H3/b12-9-","AVFLRLAFBQUJGG-XFXZXTDPSA-N"
"COC(=O)CCC=C(C)CCC=C(C)C","InChI=1S/C13H22O2/c1-11(2)7-5-8-12(3)9-6-10-13(14)15-4/h7,9H,5-6,8,10H2,1-4H3/b12-9+","AVFLRLAFBQUJGG-FMIVXFBMSA-N"
"C=CCC(O)C(C)(CCC)CC=C(C)C","InChI=1S/C14H26O/c1-6-8-13(15)14(5,10-7-2)11-9-12(3)4/h6,9,13,15H,1,7-8,10-11H2,2-5H3","QLDLPUYFCLNUQZ-UHFFFAOYSA-N"
"CCC(=O)CCC(=O)N(C1)CCN(C)C1","InChI=1S/C11H20N2O2/c1-3-10(14)4-5-11(15)13-8-6-12(2)7-9-13/h3-9H2,1-2H3","TYGIAYFULOQNDZ-UHFFFAOYSA-N"
"CC(=O)OCC=C(C)CCC(O)C(C)=C","InChI=1S/C12H20O3/c1-9(2)12(14)6-5-10(3)7-8-15-11(4)13/h7,12,14H,1,5-6,8H2,2-4H3/b10-7+","AJCBRFGINYAOCJ-JXMROGBWSA-N"
"OCC(C)=CCCC(C)=CCOC(C)=O","InChI=1S/C12H20O3/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6-7,13H,4-5,8-9H2,1-3H3/b10-7-,11-6+","HZIJXISIZGWHAY-IKVLVDHLSA-N"
"OCC(C)=CCCC(C)=CCOC(C)=O","InChI=1S/C12H20O3/c1-10(7-8-15-12(3)14)5-4-6-11(2)9-13/h6-7,13H,4-5,8-9H2,1-3H3/b10-7+,11-6+","HZIJXISIZGWHAY-NXAIOARDSA-N"
"CCC(=O)CCC(C)=CCCC(=O)OC","InChI=1S/C12H20O3/c1-4-11(13)9-8-10(2)6-5-7-12(14)15-3/h6H,4-5,7-9H2,1-3H3/b10-6+","KQXMJPIJJDMVKD-UXBLZVDNSA-N"
"BrCCCCBr","InChI=1S/C4H8Br2/c5-3-1-2-4-6/h1-4H2","ULTHEAFYOOPTTB-UHFFFAOYSA-N"
"COC(=O)CC(O)(C=C)CC(C)(O)C=C","InChI=1S/C11H18O4/c1-5-10(3,13)8-11(14,6-2)7-9(12)15-4/h5-6,13-14H,1-2,7-8H2,3-4H3","DBGDHNKKUGAQJO-UHFFFAOYSA-N"
"O=CCCCCCCCCCOC(C)=O","InChI=1S/C12H22O3/c1-12(14)15-11-9-7-5-3-2-4-6-8-10-13/h10H,2-9,11H2,1H3","JAPNOISVXDOAHT-UHFFFAOYSA-N"
"CCC(O)CCC(C)=CCCC(=O)OC","InChI=1S/C12H22O3/c1-4-11(13)9-8-10(2)6-5-7-12(14)15-3/h6,11,13H,4-5,7-9H2,1-3H3/b10-6+","PAFTXKVWUFSNKO-UXBLZVDNSA-N"
"O=CCC(C)CCOC(O1)CC(C)CC1","InChI=1S/C12H22O3/c1-10(3-6-13)4-7-14-12-9-11(2)5-8-15-12/h6,10-12H,3-5,7-9H2,1-2H3","NYNVUDUNNAUQKW-UHFFFAOYSA-N"
"CCCC(C)(CC=C(C)C)C(OC)OC","InChI=1S/C13H26O2/c1-7-9-13(4,10-8-11(2)3)12(14-5)15-6/h8,12H,7,9-10H2,1-6H3","CYKQWXWEZRIDJL-UHFFFAOYSA-N"
"CC(CCOC(C1)OCCC1)C(C)(C)O","InChI=1S/C12H24O3/c1-10(12(2,3)13)7-9-15-11-6-4-5-8-14-11/h10-11,13H,4-9H2,1-3H3","AHUOICUKGFHOHG-UHFFFAOYSA-N"
"OCCC(C)CCOC(O1)CC(C)CC1","InChI=1S/C12H24O3/c1-10(3-6-13)4-7-14-12-9-11(2)5-8-15-12/h10-13H,3-9H2,1-2H3","SKVDDTWHWFDGBM-UHFFFAOYSA-N"
"C=CC(O)(C2)CCN(C2)Cc(c1)cccc1","InChI=1S/C14H19NO/c1-2-14(16)8-10-15(11-9-14)12-13-6-4-3-5-7-13/h2-7,16H,1,8-12H2","KBCISEBKFUOCHX-UHFFFAOYSA-N"
"N#CC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C15H23N/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11H,5-6,8,10H2,1-4H3/b14-9+,15-11+","KNFDAUYLUSORSX-YFVJMOTDSA-N"
"CC(C)=CCCC(C)CCBr","InChI=1S/C10H19Br/c1-9(2)5-4-6-10(3)7-8-11/h5,10H,4,6-8H2,1-3H3","QPKCDMXLSDFCQD-UHFFFAOYSA-N"
"CC(C)=CCC(C)(C)C(O)c(c1)cccc1","InChI=1S/C15H22O/c1-12(2)10-11-15(3,4)14(16)13-8-6-5-7-9-13/h5-10,14,16H,11H2,1-4H3","LHBLOKIXWZKFJL-UHFFFAOYSA-N"
"CC(C)=CCC(CC)(CO)c(c1)cccc1","InChI=1S/C15H22O/c1-4-15(12-16,11-10-13(2)3)14-8-6-5-7-9-14/h5-10,16H,4,11-12H2,1-3H3","DHXIFOUGIOWUMY-UHFFFAOYSA-N"
"COC(=O)c(c1)c(Cl)c(N)cc(Cl)1","InChI=1S/C8H7Cl2NO2/c1-13-8(12)5-2-4(9)3-6(11)7(5)10/h2-3H,11H2,1H3","DTSSCQVCVYZGSI-UHFFFAOYSA-N"
"Cc(c1)cc(N=Nc(n2)scc2)c(O)c1","InChI=1S/C10H9N3OS/c1-7-2-3-9(14)8(6-7)12-13-10-11-4-5-15-10/h2-6,14H,1H3/b13-12+","MZRKINSTWYZJLV-OUKQBFOZSA-N"
"CC(=O)OCC(=C)CC(Cl)OC(C)=O","InChI=1S/C9H13ClO4/c1-6(5-13-7(2)11)4-9(10)14-8(3)12/h9H,1,4-5H2,2-3H3","VIJVCKDWQUPTRB-UHFFFAOYSA-N"
"COC(=O)C(C)=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C12H12O4/c1-8(12(13)14-2)5-9-3-4-10-11(6-9)16-7-15-10/h3-6H,7H2,1-2H3/b8-5+","ONRIBRPCDSNRTI-VMPITWQZSA-N"
"Oc(c(C)1)c(C)c(C2)c(OC(C)(C)C2)c(C)1","InChI=1S/C14H20O2/c1-8-9(2)13-11(10(3)12(8)15)6-7-14(4,5)16-13/h15H,6-7H2,1-5H3","SEBPXHSZHLFWRL-UHFFFAOYSA-N"
"O=CCC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C16H26O/c1-14(2)8-5-9-15(3)10-6-11-16(4)12-7-13-17/h8,10,12-13H,5-7,9,11H2,1-4H3/b15-10+,16-12+","HXNIVGFVIQFPHU-NCZFFCEISA-N"
"COC(=O)C(NC(C)=O)Cc(c1)cccc1","InChI=1S/C12H15NO3/c1-9(14)13-11(12(15)16-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3,(H,13,14)","IKGHIFGXPVLPFD-UHFFFAOYSA-N"
"CCCCCC=CC=CC(=O)N(C1)CCC1","InChI=1S/C14H23NO/c1-2-3-4-5-6-7-8-11-14(16)15-12-9-10-13-15/h6-8,11H,2-5,9-10,12-13H2,1H3/b7-6+,11-8+","BFZBGTMIBOQWBA-HRCSPUOPSA-N"
"COC(=O)C(C(C=C(Cl)Cl)1)C(C)(C)1","InChI=1S/C9H12Cl2O2/c1-9(2)5(4-6(10)11)7(9)8(12)13-3/h4-5,7H,1-3H3","QJOOIMSFFIUFKX-UHFFFAOYSA-N"
"Oc(c1)cc(N=CC=Cc(c2)cccc2)cc1","InChI=1S/C15H13NO/c17-15-10-4-9-14(12-15)16-11-5-8-13-6-2-1-3-7-13/h1-12,17H/b8-5?,16-11-","LAMWJTQGOKUQKO-HWMYPRNFSA-N"
"CC(N2)CN(CC2)C(=C)N(C1)CC(C)NC1","InChI=1S/C12H24N4/c1-10-8-15(6-4-13-10)12(3)16-7-5-14-11(2)9-16/h10-11,13-14H,3-9H2,1-2H3","OUPYNEDRGBWKKS-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=C([H])CCCOC(C)=O","InChI=1S/C14H24O2/c1-12(2)8-7-10-13(3)9-5-6-11-16-14(4)15/h8-9H,5-7,10-11H2,1-4H3/b13-9-","PLVUZLFGBFWHDU-LCYFTJDESA-N"
"CC(C)=CCCC(C)=C([H])CCCOC(C)=O","InChI=1S/C14H24O2/c1-12(2)8-7-10-13(3)9-5-6-11-16-14(4)15/h8-9H,5-7,10-11H2,1-4H3/b13-9+","PLVUZLFGBFWHDU-UKTHLTGXSA-N"
"CC(C)CCCC(C)CCC(CC)C(C)C","InChI=1S/C16H34/c1-7-16(14(4)5)12-11-15(6)10-8-9-13(2)3/h13-16H,7-12H2,1-6H3","OHXPAEQCBFOPSB-UHFFFAOYSA-N"
"COC(=O)c(c2)c(ccc2)NN=C(C)c(c1)cccc1","InChI=1S/C16H16N2O2/c1-12(13-8-4-3-5-9-13)17-18-15-11-7-6-10-14(15)16(19)20-2/h3-11,18H,1-2H3/b17-12-","GMSDKZMVKPYFOV-ATVHPVEESA-N"
"CCOC(=O)CC(C)CCCC(C)CCC=C(C)C","InChI=1S/C17H32O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h9,15-16H,6-8,10-13H2,1-5H3","RLJQAAPXMHYQJM-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCCC(C)CCCC(C)=O","InChI=1S/C18H36O/c1-15(2)9-6-10-16(3)11-7-12-17(4)13-8-14-18(5)19/h15-17H,6-14H2,1-5H3","WHWDWIHXSPCOKZ-UHFFFAOYSA-N"
"CC(=O)Oc(c2)cc(cc2)Oc(c1)ccc(C(O)=O)c1","InChI=1S/C15H12O5/c1-10(16)19-13-3-2-4-14(9-13)20-12-7-5-11(6-8-12)15(17)18/h2-9H,1H3,(H,17,18)","PYJZFSCAKHRLSC-UHFFFAOYSA-N"
"CC(=O)Oc(c2)ccc(c2)Oc(c1)ccc(C(O)=O)c1","InChI=1S/C15H12O5/c1-10(16)19-12-6-8-14(9-7-12)20-13-4-2-11(3-5-13)15(17)18/h2-9H,1H3,(H,17,18)","BALYRASTARBISG-UHFFFAOYSA-N"
"CCC(C)(C1)c(c2)c(cc(C(C)3)c(C(C)CO3)2)C(C)(C)1","InChI=1S/C19H28O/c1-7-19(6)11-18(4,5)16-9-15-13(3)20-10-12(2)14(15)8-17(16)19/h8-9,12-13H,7,10-11H2,1-6H3","CSEKCKNHEKPVHN-UHFFFAOYSA-N"
"C=CC(=C)CCC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C20H32/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,11,14-15H,1,4,8-10,12-13,16H2,2-3,5-6H3/b19-15+,20-14+","XSIVJVJUIXOEPW-YTOAGJIJSA-N"
"CC(C)CCCC(C)CCCC(C)(O)C(NC)CO","InChI=1S/C16H35NO2/c1-13(2)8-6-9-14(3)10-7-11-16(4,19)15(12-18)17-5/h13-15,17-19H,6-12H2,1-5H3","LCIWWMFNDBZAFP-UHFFFAOYSA-N"
"C#CCOc(c(Cl)1)c(Cl)c(O)c(C(=O)OC)c1","InChI=1S/C11H8Cl2O4/c1-3-4-17-10-7(12)5-6(11(15)16-2)9(14)8(10)13/h1,5,14H,4H2,2H3","HFDROIQVJXCSEP-UHFFFAOYSA-N"
"CCCCCCc(c1)c(O)cc(O2)c(CCC(C)(C=C)2)1","InChI=1S/C18H26O2/c1-4-6-7-8-9-14-12-15-10-11-18(3,5-2)20-17(15)13-16(14)19/h5,12-13,19H,2,4,6-11H2,1,3H3","JVEAWTAJDFFQKM-UHFFFAOYSA-N"
"O=C(Oc(c2)c(Cl)cc(Cl)c(O)2)N(C1)CCC1","InChI=1S/C11H11Cl2NO3/c12-7-5-8(13)10(6-9(7)15)17-11(16)14-3-1-2-4-14/h5-6,15H,1-4H2","NNKDVXRNTGSXFM-UHFFFAOYSA-N"
"CC(=O)OCC=C(C)CCC(=O)OCc(c1)cccc1","InChI=1S/C16H20O4/c1-13(10-11-19-14(2)17)8-9-16(18)20-12-15-6-4-3-5-7-15/h3-7,10H,8-9,11-12H2,1-2H3/b13-10+","GBALUYBVKIVYMM-JLHYYAGUSA-N"
"c(c3)ccc(c3)P(=O)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C18H15OP/c19-20(16-10-4-1-5-11-16,17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15H","FIQMHBFVRAXMOP-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCS(=O)(=O)c(c1)cccc1","InChI=1S/C16H22O2S/c1-14(2)8-7-9-15(3)12-13-19(17,18)16-10-5-4-6-11-16/h4-6,8,10-12H,7,9,13H2,1-3H3/b15-12+","IULKHBFGJTXXCU-NTCAYCPXSA-N"
"CC(C1)=C(CS(=O)(=O)c(c2)cccc2)C(C)(C)CC1","InChI=1S/C16H22O2S/c1-13-8-7-11-16(2,3)15(13)12-19(17,18)14-9-5-4-6-10-14/h4-6,9-10H,7-8,11-12H2,1-3H3","WQRHISGXRFLGKQ-UHFFFAOYSA-N"
"CC(=O)OCCC(C)=CCc(c(OC)1)c(OC)ccc1","InChI=1S/C16H22O4/c1-12(10-11-20-13(2)17)8-9-14-15(18-3)6-5-7-16(14)19-4/h5-8H,9-11H2,1-4H3/b12-8+","GLVUXJCZSHESLV-XYOKQWHBSA-N"
"CC(=O)OCCC(C)(C2)Oc(c1)c(C2)c(C)c(O)c(C)1","InChI=1S/C16H22O4/c1-10-9-14-13(11(2)15(10)18)5-6-16(4,20-14)7-8-19-12(3)17/h9,18H,5-8H2,1-4H3","FMRLOVBRAMDRIK-UHFFFAOYSA-N"
"CCOCCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C17H26O3/c1-6-19-10-9-17(5)8-7-14-13(4)15(18)11(2)12(3)16(14)20-17/h18H,6-10H2,1-5H3","CIVPYQYYCUJIJT-UHFFFAOYSA-N"
"C=CC(=C)CCCC(C)CCCC(C)CCCC(C)C","InChI=1S/C20H38/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3/h7,17,19-20H,1,4,8-16H2,2-3,5-6H3","NIDGCIPAMWNKOA-UHFFFAOYSA-N"
"O=C(C4)C=C(C=3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3-4,11,14-16H,5-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1","YEWSFUFGMDJFFG-QAGGRKNESA-N"
"CC(=O)Nc(c2)ccc(c2)Oc(c1)ccc(OC(C)=O)c1","InChI=1S/C16H15NO4/c1-11(18)17-13-3-5-15(6-4-13)21-16-9-7-14(8-10-16)20-12(2)19/h3-10H,1-2H3,(H,17,18)","HIZBNPMDDFRWMP-UHFFFAOYSA-N"
"CC(=C)C(=O)OCCOCCOCCOC(=O)C(C)=C","InChI=1S/C14H22O6/c1-11(2)13(15)19-9-7-17-5-6-18-8-10-20-14(16)12(3)4/h1,3,5-10H2,2,4H3","HWSSEYVMGDIFMH-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCCC(C)(O)C(O)CN(C)C","InChI=1S/C17H37NO2/c1-14(2)9-7-10-15(3)11-8-12-17(4,20)16(19)13-18(5)6/h14-16,19-20H,7-13H2,1-6H3","AYIZETHHCXDLGF-UHFFFAOYSA-N"
"CCOC(=O)C(C)CC(C)(C(=O)OCC)C(=O)OCC","InChI=1S/C14H24O6/c1-6-18-11(15)10(4)9-14(5,12(16)19-7-2)13(17)20-8-3/h10H,6-9H2,1-5H3","QCTIOLMTJPOZIA-UHFFFAOYSA-N"
"COC(=O)CCC=C(C)CCC(=O)OCc(c1)cccc1","InChI=1S/C17H22O4/c1-14(7-6-10-16(18)20-2)11-12-17(19)21-13-15-8-4-3-5-9-15/h3-5,7-9H,6,10-13H2,1-2H3/b14-7+","JLDIJNJHXGCWNE-VGOFMYFVSA-N"
"CCOC(=O)C=CC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C19H30O2/c1-6-21-19(20)15-9-14-18(5)13-8-12-17(4)11-7-10-16(2)3/h9-10,12,14-15H,6-8,11,13H2,1-5H3/b15-9+,17-12-,18-14+","WXCIIDBUNPXVPR-OBAPAJOLSA-N"
"CCOC(=O)C=CC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C19H30O2/c1-6-21-19(20)15-9-14-18(5)13-8-12-17(4)11-7-10-16(2)3/h9-10,12,14-15H,6-8,11,13H2,1-5H3/b15-9+,17-12+,18-14+","WXCIIDBUNPXVPR-GQHNWBNOSA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCCC(C)(O)C=C","InChI=1S/C20H34O/c1-7-20(6,21)16-10-15-19(5)14-9-13-18(4)12-8-11-17(2)3/h7,11,13,15,21H,1,8-10,12,14,16H2,2-6H3/b18-13+,19-15+","IQDXAJNQKSIPGB-HQSZAHFGSA-N"
"OCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C20H34O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,15,21H,6-8,10,12,14,16H2,1-5H3/b18-11+,19-13+,20-15+","OJISWRZIEWCUBN-QIRCYJPOSA-N"
"CCCCCCc(c1)c(O)cc(O2)c(CCC(C)(CCO)2)1","InChI=1S/C18H28O3/c1-3-4-5-6-7-14-12-15-8-9-18(2,10-11-19)21-17(15)13-16(14)20/h12-13,19-20H,3-11H2,1-2H3","GSSPKHFHVBRYGV-UHFFFAOYSA-N"
"CC(=C)C(=O)OCCCCCCCCCOC(=O)C(C)=C","InChI=1S/C17H28O4/c1-14(2)16(18)20-12-10-8-6-5-7-9-11-13-21-17(19)15(3)4/h1,3,5-13H2,2,4H3","YJVIKVWFGPLAFS-UHFFFAOYSA-N"
"O=C(OCc(c3)cc(O4)c(OC4)c3)c(c1)cc(O2)c(OC2)c1","InChI=1S/C16H12O6/c17-16(11-2-4-13-15(6-11)22-9-20-13)18-7-10-1-3-12-14(5-10)21-8-19-12/h1-6H,7-9H2","FFPTUNHKEQKODI-UHFFFAOYSA-N"
"CC(C)c(c3)cc(C2)c(c3)C(C)(C1)C(C2)C(C)(C(O)=O)CC1","InChI=1S/C20H28O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h6,8,12-13,17H,5,7,9-11H2,1-4H3,(H,21,22)","NFWKVWVWBFBAOV-UHFFFAOYSA-N"
"c(n3)cn(c3)CCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C18H24N2O2/c1-12-13(2)17-15(14(3)16(12)21)5-6-18(4,22-17)7-9-20-10-8-19-11-20/h8,10-11,21H,5-7,9H2,1-4H3","YRQDSILNLFORDF-UHFFFAOYSA-N"
"O=C(C4)C=C(C(O)3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H26O3/c1-18-7-5-11(20)9-15(18)16(21)10-12-13-3-4-17(22)19(13,2)8-6-14(12)18/h9,12-14,16,21H,3-8,10H2,1-2H3/t12-,13-,14-,16?,18+,19-/m0/s1","WVAMBAWFDOYFOD-WFJVDCJUSA-N"
"O=C(C4)C=C(C3)C(C)(C4)C([H])(C2)C([H])(C(O)3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H26O3/c1-18-7-5-12(20)9-11(18)10-15(21)17-13-3-4-16(22)19(13,2)8-6-14(17)18/h9,13-15,17,21H,3-8,10H2,1-2H3/t13-,14-,15?,17-,18-,19-/m0/s1","LFWLQMQUJQUZBD-UOEDLQKQSA-N"
"CCCCCC(C)(CC(C)OC(=O)C(C)=C)c(c1)cccc1","InChI=1S/C20H30O2/c1-6-7-11-14-20(5,18-12-9-8-10-13-18)15-17(4)22-19(21)16(2)3/h8-10,12-13,17H,2,6-7,11,14-15H2,1,3-5H3","GPKKCNPTXCVNEX-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCN(C1)C(=O)CCC1","InChI=1S/C20H33NO/c1-17(2)9-7-10-18(3)11-8-12-19(4)14-16-21-15-6-5-13-20(21)22/h9,11,14H,5-8,10,12-13,15-16H2,1-4H3/b18-11+,19-14+","NIYHCJHBUMZSLH-MMOYSQFZSA-N"
"CCCCn(c(C)1)c(c(C)2)c(c(C)c(O)c(C)2)c(C(=O)OC)1","InChI=1S/C18H25NO3/c1-7-8-9-19-13(5)15(18(21)22-6)14-12(4)17(20)11(3)10(2)16(14)19/h20H,7-9H2,1-6H3","HGABABVBQJLOLJ-UHFFFAOYSA-N"
"SCCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(OC(C)=O)c(C)1","InChI=1S/C17H24O3S/c1-10-11(2)16-14(12(3)15(10)19-13(4)18)6-7-17(5,20-16)8-9-21/h21H,6-9H2,1-5H3","BZMFPCPZSSVHGT-UHFFFAOYSA-N"
"CC(=O)C(C)CCCC(C)=C([H])CCC(=O)N(C1)CCN(C)C1","InChI=1S/C18H32N2O2/c1-15(7-5-9-16(2)17(3)21)8-6-10-18(22)20-13-11-19(4)12-14-20/h8,16H,5-7,9-14H2,1-4H3/b15-8+","QMADJUVVKFXMDJ-OVCLIPMQSA-N"
"OC(=O)C(C)=CCCC(C)=CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C17H28N2O3/c1-14(6-4-8-15(2)17(21)22)7-5-9-16(20)19-12-10-18(3)11-13-19/h7-8H,4-6,9-13H2,1-3H3,(H,21,22)/b14-7+,15-8-","UPJGDYBMMHGILS-GOBHWCIESA-N"
"CC(=C)C(=O)OCCCCCCCCCCOC(=O)C(C)=C","InChI=1S/C18H30O4/c1-15(2)17(19)21-13-11-9-7-5-6-8-10-12-14-22-18(20)16(3)4/h1,3,5-14H2,2,4H3","LRZPQLZONWIQOJ-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCCC(C)CCCC(C)(O)C(C1)O1","InChI=1S/C20H40O2/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-20(5,21)19-15-22-19/h16-19,21H,6-15H2,1-5H3","NOXQKQDMUVOWCE-UHFFFAOYSA-N"
"CN(C)C(=O)Nc(c1)ccc(OCSc(c2)cc(C)cc2)c1","InChI=1S/C17H20N2O2S/c1-13-5-4-6-16(11-13)22-12-21-15-9-7-14(8-10-15)18-17(20)19(2)3/h4-11H,12H2,1-3H3,(H,18,20)","UFVWOSHVXSRPKE-UHFFFAOYSA-N"
"ClCCN(CCCl)c(c1)ccc(c1)CC(N)C(=O)OC","InChI=1S/C14H20Cl2N2O2/c1-20-14(19)13(17)10-11-2-4-12(5-3-11)18(8-6-15)9-7-16/h2-5,13H,6-10,17H2,1H3","YHYUQHQOUXSXQE-UHFFFAOYSA-N"
"OCCOc(c1)c(Cl)cc(Cl)c(OC(=O)N(C2)CCC2)1","InChI=1S/C13H15Cl2NO4/c14-9-7-10(15)12(8-11(9)19-6-5-17)20-13(18)16-3-1-2-4-16/h7-8,17H,1-6H2","WYJXQWOKFHETOU-UHFFFAOYSA-N"
"CC(C)OC(=O)CCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C19H28O4/c1-11(2)22-16(20)8-10-19(6)9-7-15-14(5)17(21)12(3)13(4)18(15)23-19/h11,21H,7-10H2,1-6H3","PWRAYOPGCFLHSF-UHFFFAOYSA-N"
"COC(=O)C(C)=CCCC(C)=CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C18H30N2O3/c1-15(7-5-9-16(2)18(22)23-4)8-6-10-17(21)20-13-11-19(3)12-14-20/h8-9H,5-7,10-14H2,1-4H3/b15-8+,16-9+","UJSXGCPFSPWPNB-BVXMOGEKSA-N"
"CC(=O)SCc(c(C)1)c(OC(C)=O)c(C)c(C)c(OC(C)=O)1","InChI=1S/C16H20O5S/c1-8-9(2)16(21-12(5)18)14(7-22-13(6)19)10(3)15(8)20-11(4)17/h7H2,1-6H3","TWCQSTWNXKQUGO-UHFFFAOYSA-N"
"COC(=O)C(C)CCCC(C)=CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C18H32N2O3/c1-15(7-5-9-16(2)18(22)23-4)8-6-10-17(21)20-13-11-19(3)12-14-20/h8,16H,5-7,9-14H2,1-4H3/b15-8+","YOOYZUUMVILRGI-OVCLIPMQSA-N"
"CN(C)c(c1)cc(N=Nc(n2)sc(c3)c(ccc3)2)c(C(O)=O)c1","InChI=1S/C16H14N4O2S/c1-20(2)10-7-8-11(15(21)22)13(9-10)18-19-16-17-12-5-3-4-6-14(12)23-16/h3-9H,1-2H3,(H,21,22)/b19-18+","IUIWKULRUPRNEN-VHEBQXMUSA-N"
"CC#CCO","InChI=1S/C4H6O/c1-2-3-4-5/h5H,4H2,1H3","NEEDEQSZOUAJMU-UHFFFAOYSA-N"
"CC(=C)C(C1)O1","InChI=1S/C5H8O/c1-4(2)5-3-6-5/h5H,1,3H2,2H3","JZQHTTYHPIAPCZ-UHFFFAOYSA-N"
"CC(C1)=COC1","InChI=1S/C5H8O/c1-5-2-3-6-4-5/h4H,2-3H2,1H3","FWGYRFWKBWPRJD-UHFFFAOYSA-N"
"NNC(=O)NN","InChI=1S/CH6N4O/c2-4-1(6)5-3/h2-3H2,(H2,4,5,6)","XEVRDFDBXJMZFG-UHFFFAOYSA-N"
"C=CCCCl","InChI=1S/C4H7Cl/c1-2-3-4-5/h2H,1,3-4H2","WKEVRZCQFQDCIR-UHFFFAOYSA-N"
"OCC(C)CO","InChI=1S/C4H10O2/c1-4(2-5)3-6/h4-6H,2-3H2,1H3","QWGRWMMWNDWRQN-UHFFFAOYSA-N"
"C=CC(C)(O)C#C","InChI=1S/C6H8O/c1-4-6(3,7)5-2/h1,5,7H,2H2,3H3","VBATUBQIYXCZPA-UHFFFAOYSA-N"
"OCC=C(C)C#C","InChI=1S/C6H8O/c1-3-6(2)4-5-7/h1,4,7H,5H2,2H3/b6-4+","ZSJHASYJQIRSLE-GQCTYLIASA-N"
"CC(=C1)C=COC1","InChI=1S/C6H8O/c1-6-2-4-7-5-3-6/h2-4H,5H2,1H3","OOARNVHTYGBULA-UHFFFAOYSA-N"
"CC(C1)=CCOC1","InChI=1S/C6H10O/c1-6-2-4-7-5-3-6/h2H,3-5H2,1H3","PQGPYWUIWWYUGU-UHFFFAOYSA-N"
"OCC=C(C)C=C","InChI=1S/C6H10O/c1-3-6(2)4-5-7/h3-4,7H,1,5H2,2H3/b6-4+","MOBKGOLFIBXIOP-GQCTYLIASA-N"
"C=CC(=O)C(C)C","InChI=1S/C6H10O/c1-4-6(7)5(2)3/h4-5H,1H2,2-3H3","SNOYUTZWILESAI-UHFFFAOYSA-N"
"O=CCCCC=O","InChI=1S/C5H8O2/c6-4-2-1-3-5-7/h4-5H,1-3H2","SXRSQZLOMIGNAQ-UHFFFAOYSA-N"
"CN(C1)CCNC1","InChI=1S/C5H12N2/c1-7-4-2-6-3-5-7/h6H,2-5H2,1H3","PVOAHINGSUIXLS-UHFFFAOYSA-N"
"CC(C1)CCOC1","InChI=1S/C6H12O/c1-6-2-4-7-5-3-6/h6H,2-5H2,1H3","OVRKATYHWPCGPZ-UHFFFAOYSA-N"
"OCCC(C)C=C","InChI=1S/C6H12O/c1-3-6(2)4-5-7/h3,6-7H,1,4-5H2,2H3","VTCQTYOGWYLVES-UHFFFAOYSA-N"
"OCC(C)C(C)C","InChI=1S/C6H14O/c1-5(2)6(3)4-7/h5-7H,4H2,1-3H3","SXSWMAUXEHKFGX-UHFFFAOYSA-N"
"CC(=O)C=CCl","InChI=1S/C4H5ClO/c1-4(6)2-3-5/h2-3H,1H3/b3-2+","HTPABEPAZTWGPP-NSCUHMNNSA-N"
"OCC(C)C(C)O","InChI=1S/C5H12O2/c1-4(3-6)5(2)7/h4-7H,3H2,1-2H3","GNBPEYCZELNJMS-UHFFFAOYSA-N"
"OCC=C(C)Cl","InChI=1S/C4H7ClO/c1-4(5)2-3-6/h2,6H,3H2,1H3/b4-2-","SRQGZQPUPABHCN-RQOWECAXSA-N"
"C=CN(C1)C(=O)CC1","InChI=1S/C6H9NO/c1-2-7-5-3-4-6(7)8/h2H,1,3-5H2","WHNWPMSKXPGLAX-UHFFFAOYSA-N"
"CC(C1)=CC(=O)OC1","InChI=1S/C6H8O2/c1-5-2-3-8-6(7)4-5/h4H,2-3H2,1H3","RPEASMBMVIKUTH-UHFFFAOYSA-N"
"CC(C1)CC(=O)NC1","InChI=1S/C6H11NO/c1-5-2-3-7-6(8)4-5/h5H,2-4H2,1H3,(H,7,8)","PTSGHGGLRADEFP-UHFFFAOYSA-N"
"CC(C1)CC(=O)OC1","InChI=1S/C6H10O2/c1-5-2-3-8-6(7)4-5/h5H,2-4H2,1H3","YHTLGFCVBKENTE-UHFFFAOYSA-N"
"CCOCC=C(C)C","InChI=1S/C7H14O/c1-4-8-6-5-7(2)3/h5H,4,6H2,1-3H3","HPMSQLYFMOOLKS-UHFFFAOYSA-N"
"CCOC(C)(C)C=C","InChI=1S/C7H14O/c1-5-7(3,4)8-6-2/h5H,1,6H2,2-4H3","ZZKVKKJYPYTFHL-UHFFFAOYSA-N"
"CC(O)(C1)CCOC1","InChI=1S/C6H12O2/c1-6(7)2-4-8-5-3-6/h7H,2-5H2,1H3","DCUYGCJQVJXUHU-UHFFFAOYSA-N"
"NCCC(C)CCN","InChI=1S/C6H16N2/c1-6(2-4-7)3-5-8/h6H,2-5,7-8H2,1H3","FJSUFIIJYXMJQO-UHFFFAOYSA-N"
"OCC(CO)C(C)C","InChI=1S/C6H14O2/c1-5(2)6(3-7)4-8/h5-8H,3-4H2,1-2H3","VVOISBSEMFDYNE-UHFFFAOYSA-N"
"OCCN(C)CCO","InChI=1S/C5H13NO2/c1-6(2-4-7)3-5-8/h7-8H,2-5H2,1H3","CRVGTESFCCXCTH-UHFFFAOYSA-N"
"O=S(=O)(C1)CCC1","InChI=1S/C4H8O2S/c5-7(6)3-1-2-4-7/h1-4H2","HXJUTPCZVOIRIF-UHFFFAOYSA-N"
"C=CC(C)(C1)OC(=O)C1","InChI=1S/C7H10O2/c1-3-7(2)5-4-6(8)9-7/h3H,1,4-5H2,2H3","QESPSAHXYXIGBG-UHFFFAOYSA-N"
"CCOCC=C(C)C=C","InChI=1S/C8H14O/c1-4-8(3)6-7-9-5-2/h4,6H,1,5,7H2,2-3H3/b8-6+","KNRWANBXKZWMCQ-SOFGYWHQSA-N"
"C=CCCCC=CCO","InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h2,6-7,9H,1,3-5,8H2/b7-6+","YHYGSIBXYYKYFB-VOTSOKGWSA-N"
"CC(C1)CC(=O)N(C)C1","InChI=1S/C7H13NO/c1-6-3-4-8(2)7(9)5-6/h6H,3-5H2,1-2H3","JBCMUNOVVMEKMO-UHFFFAOYSA-N"
"CC(=C)CCOC(C)=O","InChI=1S/C7H12O2/c1-6(2)4-5-9-7(3)8/h1,4-5H2,2-3H3","OCUAPVNNQFAQSM-UHFFFAOYSA-N"
"CCOC(=O)C=C(C)C","InChI=1S/C7H12O2/c1-4-9-7(8)5-6(2)3/h5H,4H2,1-3H3","UTXVCHVLDOLVPC-UHFFFAOYSA-N"
"CC(Cl)(C1)CCOC1","InChI=1S/C6H11ClO/c1-6(7)2-4-8-5-3-6/h2-5H2,1H3","AJALOBPESIDPGW-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)CS1","InChI=1S/C8H8S/c1-2-4-8-6-9-5-7(8)3-1/h1-4H,5-6H2","KVRZARWOKBNZMM-UHFFFAOYSA-N"
"CC(C)=CCNC(C)(C)C","InChI=1S/C9H19N/c1-8(2)6-7-10-9(3,4)5/h6,10H,7H2,1-5H3","POFOHSVASPTSTC-UHFFFAOYSA-N"
"O=CC(C)=CCOC(C)=O","InChI=1S/C7H10O3/c1-6(5-8)3-4-10-7(2)9/h3,5H,4H2,1-2H3/b6-3-","LPDDKAJRWGPGSI-UTCJRWHESA-N"
"CN(C1)CCN(C1)C(C)=O","InChI=1S/C7H14N2O/c1-7(10)9-5-3-8(2)4-6-9/h3-6H2,1-2H3","YSDBJKNOEWSFGA-UHFFFAOYSA-N"
"CC(=C)C(C1)OC(C)(C)O1","InChI=1S/C8H14O2/c1-6(2)7-5-9-8(3,4)10-7/h7H,1,5H2,2-4H3","WACAKSJDGYQSKE-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(C)O","InChI=1S/C9H18O/c1-8(2)6-5-7-9(3,4)10/h6,10H,5,7H2,1-4H3","URIIVOSFQJXLPT-UHFFFAOYSA-N"
"COc(c1)nc(Cl)cc1","InChI=1S/C6H6ClNO/c1-9-6-4-2-3-5(7)8-6/h2-4H,1H3","VAVGOGHLNAJECD-UHFFFAOYSA-N"
"O=CC(C)=CC(OC)OC","InChI=1S/C7H12O3/c1-6(5-8)4-7(9-2)10-3/h4-5,7H,1-3H3/b6-4+","UKYNGIDUKUFOQS-GQCTYLIASA-N"
"CC(=O)CCCC(C)(C)O","InChI=1S/C8H16O2/c1-7(9)5-4-6-8(2,3)10/h10H,4-6H2,1-3H3","BDKJAPPUGXLAHC-UHFFFAOYSA-N"
"OCCC(C)CC(=O)NC","InChI=1S/C7H15NO2/c1-6(3-4-9)5-7(10)8-2/h6,9H,3-5H2,1-2H3,(H,8,10)","XZEGKLNXAIQEJU-UHFFFAOYSA-N"
"ClCc(c(C)1)c(C)on1","InChI=1S/C6H8ClNO/c1-4-6(3-7)5(2)9-8-4/h3H2,1-2H3","NIFAUKBQIAURIM-UHFFFAOYSA-N"
"OCC(C1)C(C)(O)CCO1","InChI=1S/C7H14O3/c1-7(9)2-3-10-5-6(7)4-8/h6,8-9H,2-5H2,1H3","BAMBQJPPLYXMBB-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCCC(C)CCCC(C)(O)C(O)CO","InChI=1S/C20H42O3/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-20(5,23)19(22)15-21/h16-19,21-23H,6-15H2,1-5H3","CGIHFIDULQUVJG-UHFFFAOYSA-N"
"CCOC(=O)C=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C22H36O2/c1-7-24-22(23)17-21(6)16-10-15-20(5)14-9-13-19(4)12-8-11-18(2)3/h11,13,15,17H,7-10,12,14,16H2,1-6H3/b19-13+,20-15+,21-17+","BFYVSGCRUDETNO-JYQWTDEISA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(O)=O","InChI=1S/C22H36O2/c1-18(2)10-6-11-19(3)12-7-13-20(4)14-8-15-21(5)16-9-17-22(23)24/h10,12,14,16H,6-9,11,13,15,17H2,1-5H3,(H,23,24)/b19-12+,20-14+,21-16+","PIJHYAQKPAXLRO-RFRQLJORSA-N"
"CCCCCCc(c1)c(O)cc(O2)c(CCC(C)(CCOC(C)=O)2)1","InChI=1S/C20H30O4/c1-4-5-6-7-8-16-13-17-9-10-20(3,11-12-23-15(2)21)24-19(17)14-18(16)22/h13-14,22H,4-12H2,1-3H3","CZDAYPXTPJELBJ-UHFFFAOYSA-N"
"O=CCCCCCCCCCc(c(C)1)c(=O)c(OC)c(OC)c(=O)1","InChI=1S/C19H28O5/c1-14-15(12-10-8-6-4-5-7-9-11-13-20)17(22)19(24-3)18(23-2)16(14)21/h13H,4-12H2,1-3H3","NWTCBWDIPOKYAO-UHFFFAOYSA-N"
"O=C(OCc(c3)cc(O4)c(OC4)c3)C(C)=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C19H16O6/c1-12(6-13-2-4-15-17(7-13)24-10-22-15)19(20)21-9-14-3-5-16-18(8-14)25-11-23-16/h2-8H,9-11H2,1H3/b12-6+","UQGWIRIJKQMRHI-WUXMJOGZSA-N"
"CC(C)=CCCC(C)(O)CC(O)C(=O)CC(C)(O)CCC=C(C)C","InChI=1S/C20H36O4/c1-15(2)9-7-11-19(5,23)13-17(21)18(22)14-20(6,24)12-8-10-16(3)4/h9-10,17,21,23-24H,7-8,11-14H2,1-6H3","NMPBMQZZQNDZKJ-UHFFFAOYSA-N"
"c(c3)ccc(c3)COC(=O)C(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C21H24O4/c1-13-14(2)19-17(15(3)18(13)22)10-11-21(4,25-19)20(23)24-12-16-8-6-5-7-9-16/h5-9,22H,10-12H2,1-4H3","BKLVARSCGRWNBA-UHFFFAOYSA-N"
"COC(=O)c(c1)c(Cl)cc(NCP(=O)(OC)OC)c(Cl)1","InChI=1S/C11H14Cl2NO5P/c1-17-11(15)7-4-9(13)10(5-8(7)12)14-6-20(16,18-2)19-3/h4-5,14H,6H2,1-3H3","LWQMIQAGQGFXHX-UHFFFAOYSA-N"
"CC(CCOC(C2)OCCC2)CCC(C)CCOC(C1)OCCC1","InChI=1S/C20H38O4/c1-17(11-15-23-19-7-3-5-13-21-19)9-10-18(2)12-16-24-20-8-4-6-14-22-20/h17-20H,3-16H2,1-2H3","CMMVTFNLFCVCPP-UHFFFAOYSA-N"
"O=CC(C)C([H])(C4)C(C)(C3)C([H])(C4)C([H])(C(O)1)C([H])(C3)C(C)(C=2)C(=CC(=O)C2)C1","InChI=1S/C22H30O3/c1-13(12-23)16-4-5-17-20-18(7-9-22(16,17)3)21(2)8-6-15(24)10-14(21)11-19(20)25/h6,8,10,12-13,16-20,25H,4-5,7,9,11H2,1-3H3/t13?,16-,17+,18+,19?,20+,21+,22-/m1/s1","XKNAFGDXOSIMKT-PZSYZHRISA-N"
"O=CC(C)C([H])(C4)C(C)(C3)C([H])(C4)C([H])(C(O)1)C([H])(C3)C(C)(C2)C(=CC(=O)C2)C1","InChI=1S/C22H32O3/c1-13(12-23)16-4-5-17-20-18(7-9-22(16,17)3)21(2)8-6-15(24)10-14(21)11-19(20)25/h10,12-13,16-20,25H,4-9,11H2,1-3H3/t13?,16-,17+,18+,19?,20+,21+,22-/m1/s1","ALHATGQVHVESGQ-PZSYZHRISA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCS(=O)(=O)c(c1)cccc1","InChI=1S/C21H30O2S/c1-18(2)10-8-11-19(3)12-9-13-20(4)16-17-24(22,23)21-14-6-5-7-15-21/h5-7,10,12,14-16H,8-9,11,13,17H2,1-4H3/b19-12+,20-16+","MLMQYHDLGZNPKC-YEFHWUCQSA-N"
"COC(=O)CCC(C)=CCCC(C)=CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C20H34N2O3/c1-17(7-5-8-18(2)11-12-20(24)25-4)9-6-10-19(23)22-15-13-21(3)14-16-22/h8-9H,5-7,10-16H2,1-4H3/b17-9-,18-8-","NCVBXHMUXQRVJI-DWFXYBKLSA-N"
"C=CC(=O)OCC(COC(=O)C=C)(COC(=O)C=C)COC(=O)C=C","InChI=1S/C17H20O8/c1-5-13(18)22-9-17(10-23-14(19)6-2,11-24-15(20)7-3)12-25-16(21)8-4/h5-8H,1-4,9-12H2","KNSXNCFKSZZHEA-UHFFFAOYSA-N"
"COC(=O)CCC(C)=CCCC(C)=CCCC(=O)N(C1)CCN(C1)C([2H])([2H])[2H]","InChI=1S/C20H34N2O3/c1-17(7-5-8-18(2)11-12-20(24)25-4)9-6-10-19(23)22-15-13-21(3)14-16-22/h8-9H,5-7,10-16H2,1-4H3/b17-9+,18-8-/i3D3","NCVBXHMUXQRVJI-MNWKKPFGSA-N"
"c(c3)ccc(c3)SCC(Sc(c2)cccc2)Sc(c1)cccc1","InChI=1S/C20H18S3/c1-4-10-17(11-5-1)21-16-20(22-18-12-6-2-7-13-18)23-19-14-8-3-9-15-19/h1-15,20H,16H2","PQXFZZRYLUCAQH-UHFFFAOYSA-N"
"c(c4)ccc(c4)CC(N)(c(c3)cncc3)Cn(c(=O)1)c(=O)c(c2)c(ccc2)1","InChI=1S/C22H19N3O2/c23-22(17-9-6-12-24-14-17,13-16-7-2-1-3-8-16)15-25-20(26)18-10-4-5-11-19(18)21(25)27/h1-12,14H,13,15,23H2","KFOGGLFEAPXODO-UHFFFAOYSA-N"
"CCOC(=O)C=CCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(OC(C)=O)c(C)1","InChI=1S/C21H28O5/c1-7-24-18(23)9-8-11-21(6)12-10-17-15(4)19(25-16(5)22)13(2)14(3)20(17)26-21/h8-9H,7,10-12H2,1-6H3/b9-8+","BZVNJQIUTBPNGK-CMDGGOBGSA-N"
"OCC(=O)C(O)(C4)C(C)(C3)C([H])(C4)C([H])(C2)C([H])(C([H])(O)3)C(C)(C([H])=1)C(C2)=C([H])C(=O)C([H])1","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1","OIGNJSKKLXVSLS-VWUMJDOOSA-N"
"c(c3)ccc(c3)C(=O)Oc(c1)c(C)c(C)c(OC(=O)c(c2)cccc2)c(C)1","InChI=1S/C23H20O4/c1-15-14-20(26-22(24)18-10-6-4-7-11-18)16(2)17(3)21(15)27-23(25)19-12-8-5-9-13-19/h4-14H,1-3H3","WQYMVLAZGLEXEI-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC=CC=CC(=O)N(C1)CCC1","InChI=1S/C24H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-24(26)25-22-19-20-23-25/h16-18,21H,2-15,19-20,22-23H2,1H3/b17-16+,21-18+","RIDFJCCEYZWOSP-RAISGICESA-N"
"OC(=O)C(C)C(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(O)3)C(C)(C2)C(CC(=O)C2)C1","InChI=1S/C22H34O4/c1-12(20(25)26)16-6-7-17-15-5-4-13-10-14(23)8-9-21(13,2)19(15)18(24)11-22(16,17)3/h12-13,15-19,24H,4-11H2,1-3H3,(H,25,26)/t12?,13?,15-,16+,17-,18?,19+,21-,22+/m0/s1","NCZFUIRADBGZAC-RCXLZMTBSA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCO[Si](C)(C)C","InChI=1S/C23H42OSi/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-17-23(5)18-19-24-25(6,7)8/h12,14,16,18H,9-11,13,15,17,19H2,1-8H3/b21-14+,22-16+,23-18+","OGLCJQCKGRHUOG-INVBOZNNSA-N"
"CC(C)NCC(O)COCCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C21H35NO4/c1-13(2)22-11-17(23)12-25-10-9-21(6)8-7-18-16(5)19(24)14(3)15(4)20(18)26-21/h13,17,22-24H,7-12H2,1-6H3","APMGJFMVYQXFIP-UHFFFAOYSA-N"
"CCCCC(CC)C(=O)OC(C)C(CCC(C)CCCC(C)C)C(C)C","InChI=1S/C24H48O2/c1-9-11-15-22(10-2)24(25)26-21(8)23(19(5)6)17-16-20(7)14-12-13-18(3)4/h18-23H,9-17H2,1-8H3","SYALHZYVHKJYEJ-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCN(C1)C(=O)CCC1","InChI=1S/C25H41NO/c1-21(2)11-8-12-22(3)13-9-14-23(4)15-10-16-24(5)18-20-26-19-7-6-17-25(26)27/h11,13,15,18H,6-10,12,14,16-17,19-20H2,1-5H3/b22-13+,23-15-,24-18+","AZXQGUBARWMYAD-RTEFFSRBSA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCN(C1)CCN(C)C1","InChI=1S/C25H44N2/c1-22(2)10-7-11-23(3)12-8-13-24(4)14-9-15-25(5)16-17-27-20-18-26(6)19-21-27/h10,12,14,16H,7-9,11,13,15,17-21H2,1-6H3/b23-12+,24-14-,25-16+","RNYWGZFGJLZKNY-ZASDBRTLSA-N"
"OC(=O)C(C)C([H])(C4)C(C)(C(O)3)C([H])(C4)C([H])(C(O)1)C([H])(C3)C(C)(C=2)C(=CC(=O)C2)C1","InChI=1S/C22H30O5/c1-11(20(26)27)14-4-5-15-19-16(10-18(25)22(14,15)3)21(2)7-6-13(23)8-12(21)9-17(19)24/h6-8,11,14-19,24-25H,4-5,9-10H2,1-3H3,(H,26,27)/t11?,14-,15+,16+,17?,18?,19+,21+,22-/m1/s1","RIPUUOOMDLZCBV-IRZBZXEOSA-N"
"CC(C)CCCC(C)CCCC(C)CCCC(C)(O)C(O)CO[N+1]([O-1])=O","InChI=1S/C20H41NO5/c1-16(2)9-6-10-17(3)11-7-12-18(4)13-8-14-20(5,23)19(22)15-26-21(24)25/h16-19,22-23H,6-15H2,1-5H3","JTBGMTKEKZFXJG-UHFFFAOYSA-N"
"CCCCCCc(c1)c(OC(C)=O)cc(O2)c(CCC(C)(CCOC(C)=O)2)1","InChI=1S/C22H32O5/c1-5-6-7-8-9-18-14-19-10-11-22(4,12-13-25-16(2)23)27-21(19)15-20(18)26-17(3)24/h14-15H,5-13H2,1-4H3","UIXUWDLVIIMRCQ-UHFFFAOYSA-N"
"CC(CCC=C(C)C(C)O[Si](C)(C)C)=CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C21H40N2O2Si/c1-18(10-8-12-19(2)20(3)25-26(5,6)7)11-9-13-21(24)23-16-14-22(4)15-17-23/h11-12,20H,8-10,13-17H2,1-7H3/b18-11+,19-12+","ROQLKSKDJZZPGV-GDAWTGGTSA-N"
"CC1=C(C(=C2CCC(OC2=C1C)(C)CCSC3=NC4=CC=CC=C4N3)C)O","InChI=1S/C22H26N2O2S/c1-13-14(2)20-16(15(3)19(13)25)9-10-22(4,26-20)11-12-27-21-23-17-7-5-6-8-18(17)24-21/h5-8,25H,9-12H2,1-4H3,(H,23,24)","QWRCLQDGIAHWMP-UHFFFAOYSA-N"
"CCOCCC(C)(C3)Oc(c(C)1)c(C3)c(C)c(OC(=O)c(c2)cccc2)c(C)1","InChI=1S/C24H30O4/c1-6-26-15-14-24(5)13-12-20-18(4)21(16(2)17(3)22(20)28-24)27-23(25)19-10-8-7-9-11-19/h7-11H,6,12-15H2,1-5H3","NXLFZDMUKZIROL-UHFFFAOYSA-N"
"CC(=O)Oc(c(C)1)c(C)c(C2)c(OC(C)(CCSc(c3)cccc3)C2)c(C)1","InChI=1S/C23H28O3S/c1-15-16(2)22-20(17(3)21(15)25-18(4)24)11-12-23(5,26-22)13-14-27-19-9-7-6-8-10-19/h6-10H,11-14H2,1-5H3","XZRSZKHNRBOICQ-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCN(C1)C(=O)CCCC1","InChI=1S/C26H43NO/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)19-21-27-20-8-6-7-18-26(27)28/h12,14,16,19H,6-11,13,15,17-18,20-21H2,1-5H3/b23-14+,24-16+,25-19+","CEMMKPPUZSMGFQ-PHPAXXOYSA-N"
"","InChI=1S/C24H36O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h12,14,16-19,21,26H,4-11,13H2,1-3H3,(H,27,28)/t14-,16+,17?,18+,19+,21?,23-,24-/m1/s1","VNVAJHCQVWXNTN-YUZXQEEUSA-N"
"c(c34)cc(cc3C(C)(C)C(C)C4(C)C)Cc(c2)ccc(c21)C(C)(C)C(C)C1(C)C","InChI=1S/C29H40/c1-18-26(3,4)22-13-11-20(16-24(22)28(18,7)8)15-21-12-14-23-25(17-21)29(9,10)19(2)27(23,5)6/h11-14,16-19H,15H2,1-10H3","ONWXJPHQWJMWHT-UHFFFAOYSA-N"
"CC(CCC=C(C)CCC(=O)OC(C)(C)C)=CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C23H40N2O3/c1-19(11-8-12-21(26)25-17-15-24(6)16-18-25)9-7-10-20(2)13-14-22(27)28-23(3,4)5/h10-11H,7-9,12-18H2,1-6H3/b19-11-,20-10-","SWODQJWXQSPCDE-GDHXLXJCSA-N"
"COc(c(C)1)c(C)c(C2)c(OC(C)(CC(=O)Nc(c3)c(ccc3)C(O)=O)C2)c(C)1","InChI=1S/C23H27NO5/c1-13-14(2)21-16(15(3)20(13)28-5)10-11-23(4,29-21)12-19(25)24-18-9-7-6-8-17(18)22(26)27/h6-9H,10-12H2,1-5H3,(H,24,25)(H,26,27)","MLTDEXJIUPNCJM-UHFFFAOYSA-N"
"C(C3)C(Oc(c4C)c3c(c(c4C)O)C)(C)CCN(C2)CCN(C2)Cc(c1)cccc1","InChI=1S/C26H36N2O2/c1-19-20(2)25-23(21(3)24(19)29)10-11-26(4,30-25)12-13-27-14-16-28(17-15-27)18-22-8-6-5-7-9-22/h5-9,29H,10-18H2,1-4H3","BXQIFMPEGGKVBU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)OC(C)C(CCC(C)C)CCC(C)C","InChI=1S/C27H54O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-27(28)29-25(6)26(21-19-23(2)3)22-20-24(4)5/h23-26H,7-22H2,1-6H3","JHAGSLRTFDBCLA-UHFFFAOYSA-N"
"C(C(C)CCCC(C)C)CCC(C)(O)C=CC(C)(O)CCCC(C)CCCC(C)C","InChI=1S/C28H56O2/c1-23(2)13-9-15-25(5)17-11-19-27(7,29)21-22-28(8,30)20-12-18-26(6)16-10-14-24(3)4/h21-26,29-30H,9-20H2,1-8H3/b22-21+","GMSBGIXDRWRUNO-QURGRASLSA-N"
"O=C(N(C3)CCC3)Oc(c1)c(Cl)cc(Cl)c(OCS(=O)(=O)c(c2)cccc2)1","InChI=1S/C18H17Cl2NO5S/c19-14-10-15(20)17(26-18(22)21-8-4-5-9-21)11-16(14)25-12-27(23,24)13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9,12H2","GGJJHFOGACSQDE-UHFFFAOYSA-N"
"C(C3)C(Oc(c31)c(C2)c(OC(C2)(C)CCO)c(c1)CCCCCC)(C)CCOC(C)=O","InChI=1S/C26H40O5/c1-5-6-7-8-9-20-18-21-10-12-26(4,15-17-29-19(2)28)31-24(21)22-11-13-25(3,14-16-27)30-23(20)22/h18,27H,5-17H2,1-4H3","IYYCMEMGCSSERE-UHFFFAOYSA-N"
"OCC(C)CCC(CC=C(C)CCC=C(C)C)C(C)=CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C27H48N2O2/c1-22(2)9-7-10-23(3)13-15-26(16-14-24(4)21-30)25(5)11-8-12-27(31)29-19-17-28(6)18-20-29/h9,11,13,24,26,30H,7-8,10,12,14-21H2,1-6H3/b23-13+,25-11-","GTWPATCKPNRMQH-LDKJWMHBSA-N"
"OCC(C)CCC(CC=C(C)CCC=C(C)C)C(C)=CCCC(=O)N(C1)CCN(C1)C([2H])([2H])[2H]","InChI=1S/C27H48N2O2/c1-22(2)9-7-10-23(3)13-15-26(16-14-24(4)21-30)25(5)11-8-12-27(31)29-19-17-28(6)18-20-29/h9,11,13,24,26,30H,7-8,10,12,14-21H2,1-6H3/b23-13-,25-11-/i6D3","GTWPATCKPNRMQH-PUXXHZLSSA-N"
"C(C)(O)(CCC=C(C)CCC=C(C)C)CCCCC(C)(O)CCC=C(C)CCC=C(C)C","InChI=1S/C30H54O2/c1-25(2)15-11-17-27(5)19-13-23-29(7,31)21-9-10-22-30(8,32)24-14-20-28(6)18-12-16-26(3)4/h15-16,19-20,31-32H,9-14,17-18,21-24H2,1-8H3/b27-19-,28-20+","UJLSKUQXMLFRSK-RIRMOVKSSA-N"
"C(C(C)(CCCC(C)CCCC(C)CCCC(C)C)OC(C)=O)(COC(C)=O)OC(C)=O","InChI=1S/C26H48O6/c1-19(2)12-9-13-20(3)14-10-15-21(4)16-11-17-26(8,32-24(7)29)25(31-23(6)28)18-30-22(5)27/h19-21,25H,9-18H2,1-8H3","CAXLGZQZIAMUFU-UHFFFAOYSA-N"
"C(C1)C(Oc(c2C)c1c(c(C(=O)Oc(c3)cncc3)c2C)C)(C)CCOCC(O)CNC(C)C","InChI=1S/C27H38N2O5/c1-17(2)29-14-21(30)16-32-13-11-27(6)10-9-23-20(5)24(18(3)19(4)25(23)34-27)26(31)33-22-8-7-12-28-15-22/h7-8,12,15,17,21,29-30H,9-11,13-14,16H2,1-6H3","PSRVQJBDDHENFU-UHFFFAOYSA-N"
"c(c21)(c(C)c(c(C)c1CCC(C)(O2)CCCC(C)CCCC(C)CCCC(C)C)OC(C)=O)C","InChI=1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3","ZAKOWWREFLAJOT-UHFFFAOYSA-N"
"C(COC(C)=O)C(O1)(CCc(c3)c1c(c2c(CCCCCC)3)CCC(CCOC(C)=O)(O2)C)C","InChI=1S/C28H42O6/c1-6-7-8-9-10-22-19-23-11-13-27(4,15-17-31-20(2)29)34-26(23)24-12-14-28(5,33-25(22)24)16-18-32-21(3)30/h19H,6-18H2,1-5H3","GILZWGRFJQKHAM-UHFFFAOYSA-N"
"CC(C)(O1)C1CCC(O2)(C)C2CCC(C(CCC(C(CCC(O5)C5(C)CCC(O6)C(C)(C)6)(C)4)O4)3)(C)O3","InChI=1S/C30H50O6/c1-25(2)19(31-25)11-15-29(7)23(35-29)13-17-27(5)21(33-27)9-10-22-28(6,34-22)18-14-24-30(8,36-24)16-12-20-26(3,4)32-20/h19-24H,9-18H2,1-8H3","PSNNHFRISFMCAD-UHFFFAOYSA-N"
"C(C)(CO[Si](C)(C)C)CCC(CC=C(C)CCC=C(C)C)C(=CCCC(=O)N(C1)CCN(C([2H])([2H])[2H])C1)C","InChI=1S/C30H56N2O2Si/c1-25(2)12-10-13-26(3)16-18-29(19-17-27(4)24-34-35(7,8)9)28(5)14-11-15-30(33)32-22-20-31(6)21-23-32/h12,14,16,27,29H,10-11,13,15,17-24H2,1-9H3/b26-16-,28-14-/i6D3","QBLBWOSQGPWRPG-CBGKHWDGSA-N"
"CC(C)(c(c2)ccc(c2)OCC(COC(=O)C(C)=C)O)c(c1)ccc(c1)OCC(COC(C(C)=C)=O)OC(C(C)=C)=O","InChI=1S/C33H40O9/c1-21(2)30(35)40-18-26(34)17-38-27-13-9-24(10-14-27)33(7,8)25-11-15-28(16-12-25)39-19-29(42-32(37)23(5)6)20-41-31(36)22(3)4/h9-16,26,29,34H,1,3,5,17-20H2,2,4,6-8H3","QONAMQVPGGEUCA-UHFFFAOYSA-N"
"CC(C1)CCOC(=O)CCCC(=O)COC1","InChI=1S/C12H20O4/c1-10-5-7-15-9-11(13)3-2-4-12(14)16-8-6-10/h10H,2-9H2,1H3","KGPVQKJWSBHFFC-UHFFFAOYSA-N"
"O=CCC(C1)C(C)(C)C(CBr)=C([H])1","InChI=1S/C10H15BrO/c1-10(2)8(5-6-12)3-4-9(10)7-11/h4,6,8H,3,5,7H2,1-2H3","XCQDWMJNYQLKSC-UHFFFAOYSA-N"
"CC(=O)OCC=C(C)CCC(Cl)C(C)=C","InChI=1S/C12H19ClO2/c1-9(2)12(13)6-5-10(3)7-8-15-11(4)14/h7,12H,1,5-6,8H2,2-4H3/b10-7+","WPMFOBQJRQAIKY-JXMROGBWSA-N"
"C=CC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C15H20O2/c1-6-15(5)8-7-12-11(4)13(16)9(2)10(3)14(12)17-15/h6,16H,1,7-8H2,2-5H3","PPNVGJUSMNMFCL-UHFFFAOYSA-N"
"CCCC(CO)(CC=C(C)C)c(c1)cccc1","InChI=1S/C16H24O/c1-4-11-16(13-17,12-10-14(2)3)15-8-6-5-7-9-15/h5-10,17H,4,11-13H2,1-3H3","BEDUQJQVSNUTQR-UHFFFAOYSA-N"
"CNCC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C16H29N/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-17-5/h8,10,12,17H,6-7,9,11,13H2,1-5H3/b15-10+,16-12+","ZPEMKPFPWVTBPX-NCZFFCEISA-N"
"ClCc(c2)cc(c(c2)1)C(C)(C)C(C)C(C)(C)1","InChI=1S/C15H21Cl/c1-10-14(2,3)12-7-6-11(9-16)8-13(12)15(10,4)5/h6-8,10H,9H2,1-5H3","WTNAJFTWCDMYBG-UHFFFAOYSA-N"
"OCCN(C2)Cc(c(C)1)c(O2)c(C)c(C)c(O)1","InChI=1S/C13H19NO3/c1-8-9(2)13-11(10(3)12(8)16)6-14(4-5-15)7-17-13/h15-16H,4-7H2,1-3H3","FVVBBMBYRNGVBY-UHFFFAOYSA-N"
"COC(=O)CP(=O)(OC(C)C)OC(C)C","InChI=1S/C9H19O5P/c1-7(2)13-15(11,14-8(3)4)6-9(10)12-5/h7-8H,6H2,1-5H3","GQQNLIOQXHGIII-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=C([H])CCC(C)(O)C(O1)C1","InChI=1S/C15H26O2/c1-12(2)7-5-8-13(3)9-6-10-15(4,16)14-11-17-14/h7,9,14,16H,5-6,8,10-11H2,1-4H3/b13-9-","CLIDOAFOSTWHAW-LCYFTJDESA-N"
"CC(C)=CCCC(C)=C([H])CCC(C)(O)C(O1)C1","InChI=1S/C15H26O2/c1-12(2)7-5-8-13(3)9-6-10-15(4,16)14-11-17-14/h7,9,14,16H,5-6,8,10-11H2,1-4H3/b13-9+","CLIDOAFOSTWHAW-UKTHLTGXSA-N"
"CCCCCCCC=C(C=O)CCCCCC","InChI=1S/C16H30O/c1-3-5-7-9-10-12-14-16(15-17)13-11-8-6-4-2/h14-15H,3-13H2,1-2H3/b16-14-","RSBRHLFCWKXUSQ-PEZBUJJGSA-N"
"OC(=O)CC(C)(C2)Oc(c1)c(C2)cc(Cl)c1","InChI=1S/C12H13ClO3/c1-12(7-11(14)15)5-4-8-6-9(13)2-3-10(8)16-12/h2-3,6H,4-5,7H2,1H3,(H,14,15)","QFDFXSNSTAWKAN-UHFFFAOYSA-N"
"CC(=C)CCOC(=O)CC(=O)OCCC(C)=C","InChI=1S/C13H20O4/c1-10(2)5-7-16-12(14)9-13(15)17-8-6-11(3)4/h1,3,5-9H2,2,4H3","GGLFCLVHOQEERG-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O)CCCC(C)(O)C=C","InChI=1S/C15H28O2/c1-6-14(4,16)11-8-12-15(5,17)10-7-9-13(2)3/h6,9,16-17H,1,7-8,10-12H2,2-5H3","WNMPAKAQHSXIKK-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCC(C(C)C)C(C)=O","InChI=1S/C16H32O/c1-12(2)8-7-9-14(5)10-11-16(13(3)4)15(6)17/h12-14,16H,7-11H2,1-6H3","XCMBADWJWNQIAY-UHFFFAOYSA-N"
"CC(=C)C(=O)OCCOCCOC(=O)C(C)=C","InChI=1S/C12H18O5/c1-9(2)11(13)16-7-5-15-6-8-17-12(14)10(3)4/h1,3,5-8H2,2,4H3","XFCMNSHQOZQILR-UHFFFAOYSA-N"
"OCCCCCCCCCCOC(=O)C(C)=C","InChI=1S/C14H26O3/c1-13(2)14(16)17-12-10-8-6-4-3-5-7-9-11-15/h15H,1,3-12H2,2H3","ZUQABTLQDXJZFK-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCCC(C)(O)C(O1)C1","InChI=1S/C15H30O2/c1-12(2)7-5-8-13(3)9-6-10-15(4,16)14-11-17-14/h12-14,16H,5-11H2,1-4H3","NHBSCDIASIETLN-UHFFFAOYSA-N"
"CC(C)CCCC(C)CCC(C(C)C)C(C)O","InChI=1S/C16H34O/c1-12(2)8-7-9-14(5)10-11-16(13(3)4)15(6)17/h12-17H,7-11H2,1-6H3","BVNWBGCXCHDPNH-UHFFFAOYSA-N"
"CC#COc(c1)c(C#N)cc(Cl)c(OC#CC)1","InChI=1S/C13H8ClNO2/c1-3-5-16-12-8-13(17-6-4-2)11(14)7-10(12)9-15/h7-8H,1-2H3","YWRHZTAJZBSLDN-UHFFFAOYSA-N"
"OCC(C)c(c2)cc(c(c2)1)C(C)(C)C(C)C(C)(C)1","InChI=1S/C17H26O/c1-11(10-18)13-7-8-14-15(9-13)17(5,6)12(2)16(14,3)4/h7-9,11-12,18H,10H2,1-6H3","FADUOCSCUWPALK-UHFFFAOYSA-N"
"CC(C)=CCC(C)(C(OC)OC)c(c1)cccc1","InChI=1S/C16H24O2/c1-13(2)11-12-16(3,15(17-4)18-5)14-9-7-6-8-10-14/h6-11,15H,12H2,1-5H3","HQFQZISESHHIGV-UHFFFAOYSA-N"
"CC(=O)Oc(c1)cc(C)c(c1)N(C(C)=O)C(C)=O","InChI=1S/C13H15NO4/c1-8-7-12(18-11(4)17)5-6-13(8)14(9(2)15)10(3)16/h5-7H,1-4H3","CNTDZEFLPRSVDQ-UHFFFAOYSA-N"
"CC(C)=CCCC(C)=CCN(C1)C(=O)CCCC1","InChI=1S/C16H27NO/c1-14(2)8-7-9-15(3)11-13-17-12-6-4-5-10-16(17)18/h8,11H,4-7,9-10,12-13H2,1-3H3/b15-11+","IZUPQLMOLYRSQK-RVDMUPIBSA-N"
"OC(=O)C=CC(=O)c(c(C)1)c(O)c(C)c(C)c(O)1","InChI=1S/C13H14O5/c1-6-7(2)13(18)11(8(3)12(6)17)9(14)4-5-10(15)16/h4-5,17-18H,1-3H3,(H,15,16)/b5-4-","HAWOBRSXOITBKM-PLNGDYQASA-N"
"C=CC(C)C(O)c(c1)cc(OC)c(OC)c(OC)1","InChI=1S/C14H20O4/c1-6-9(2)13(15)10-7-11(16-3)14(18-5)12(8-10)17-4/h6-9,13,15H,1H2,2-5H3","LXSUFJZTCALJSS-UHFFFAOYSA-N"
"CC(C)=CC(=O)OC(C(C)=1)CC(CC1)C(C)(C)O","InChI=1S/C15H24O3/c1-10(2)8-14(16)18-13-9-12(15(4,5)17)7-6-11(13)3/h6,8,12-13,17H,7,9H2,1-5H3","PYDAVHFDKJZDEH-UHFFFAOYSA-N"
"CCCCC(C)(O)CCC([H])=C(C)CCC=C(C)C","InChI=1S/C17H32O/c1-6-7-13-17(5,18)14-9-12-16(4)11-8-10-15(2)3/h10,12,18H,6-9,11,13-14H2,1-5H3/b16-12+","SKBMBPGXVLGRGO-FOWTUZBSSA-N"
"CCCCC(C)(O)CCC([H])=C(C)CCC=C(C)C","InChI=1S/C17H32O/c1-6-7-13-17(5,18)14-9-12-16(4)11-8-10-15(2)3/h10,12,18H,6-9,11,13-14H2,1-5H3/b16-12-","SKBMBPGXVLGRGO-VBKFSLOCSA-N"
"C=Cn(c(=O)1)c(=O)c(c2)c(ccc2)1","InChI=1S/C10H7NO2/c1-2-11-9(12)7-5-3-4-6-8(7)10(11)13/h2-6H,1H2","IGDLZDCWMRPMGL-UHFFFAOYSA-N"
"COC(=O)CC(C(=O)OC)Sc(c1)cccc1","InChI=1S/C12H14O4S/c1-15-11(13)8-10(12(14)16-2)17-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3","DUXDHXOTAWOLFK-UHFFFAOYSA-N"
"COC(=O)C(C)CCCC(=O)N(C1)CCN(C)C1","InChI=1S/C13H24N2O3/c1-11(13(17)18-3)5-4-6-12(16)15-9-7-14(2)8-10-15/h11H,4-10H2,1-3H3","CMYWFMWDBNLMFJ-UHFFFAOYSA-N"
"COC(OC)(c(c2)cccc2)C(=O)c(c1)cccc1","InChI=1S/C16H16O3/c1-18-16(19-2,14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h3-12H,1-2H3","KWVGIHKZDCUPEU-UHFFFAOYSA-N"
"SCCCCCCCCCCOC(=O)C(C)=C","InChI=1S/C14H26O2S/c1-13(2)14(15)16-11-9-7-5-3-4-6-8-10-12-17/h17H,1,3-12H2,2H3","GPEZMHDRNRAYHT-UHFFFAOYSA-N"
"c(c2)ccc(c2)COc(c(C)1)c(C)c(C)c(S)c1","InChI=1S/C16H18OS/c1-11-9-15(18)12(2)13(3)16(11)17-10-14-7-5-4-6-8-14/h4-9,18H,10H2,1-3H3","ULHSFEMRDABVHU-UHFFFAOYSA-N"
"O=CCC(C)c(c2)cc(C(C)(C)1)c(c2)C(C)(CC)C1","InChI=1S/C18H26O/c1-6-18(5)12-17(3,4)16-11-14(7-8-15(16)18)13(2)9-10-19/h7-8,10-11,13H,6,9,12H2,1-5H3","ODUMZLYKVWGWHS-UHFFFAOYSA-N"
"CCC(C)(C1)c(c2)c(cc(C(C)3)c(COC3)2)C(C)(C)1","InChI=1S/C18H26O/c1-6-18(5)11-17(3,4)15-8-14-12(2)9-19-10-13(14)7-16(15)18/h7-8,12H,6,9-11H2,1-5H3","BYAUGQHXQRQQPB-UHFFFAOYSA-N"
"COC(=O)C(C)CCCC(=O)N(C1)CCN(C1)C([2H])([2H])[2H]","InChI=1S/C13H24N2O3/c1-11(13(17)18-3)5-4-6-12(16)15-9-7-14(2)8-10-15/h11H,4-10H2,1-3H3/i2D3","CMYWFMWDBNLMFJ-BMSJAHLVSA-N"
"N#CCCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(O)c(C)1","InChI=1S/C16H21NO2/c1-10-11(2)15-13(12(3)14(10)18)6-8-16(4,19-15)7-5-9-17/h18H,5-8H2,1-4H3","YBRKMFFHXSYDJP-UHFFFAOYSA-N"
"Clc(c1)cc(cc1)SC(Cl)(Cl)Cl","InChI=1S/C7H4Cl4S/c8-5-2-1-3-6(4-5)12-7(9,10)11/h1-4H","IDIYVHNEJVLEBV-UHFFFAOYSA-N"
"CC(=O)Nc(c1)c(Cl)cc(Cl)c(OC(C)=O)1","InChI=1S/C10H9Cl2NO3/c1-5(14)13-9-4-10(16-6(2)15)8(12)3-7(9)11/h3-4H,1-2H3,(H,13,14)","PJSPXYNFWNCCNO-UHFFFAOYSA-N"
"CCCCCCc(c1)c(O)cc(O2)c(CCC(C)(C)2)1","InChI=1S/C17H26O2/c1-4-5-6-7-8-13-11-14-9-10-17(2,3)19-16(14)12-15(13)18/h11-12,18H,4-10H2,1-3H3","BTRMVFVWPYRKRX-UHFFFAOYSA-N"
"CC(=O)OCC=C(C)C=CC(=C(C)1)C(C)(C)CCC1","InChI=1S/C17H26O2/c1-13(10-12-19-15(3)18)8-9-16-14(2)7-6-11-17(16,4)5/h8-10H,6-7,11-12H2,1-5H3/b9-8+,13-10+","HSKLNRJFWBXQNW-PEGOPYGQSA-N"
"OCCC(C)(C2)Oc(c(C)1)c(C2)c(C)c(OC)c(C)1","InChI=1S/C16H24O3/c1-10-11(2)15-13(12(3)14(10)18-5)6-7-16(4,19-15)8-9-17/h17H,6-9H2,1-5H3","VNYSURHHUVEARS-UHFFFAOYSA-N"
"CCOC(=O)C=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C17H28O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h9,11,13H,6-8,10,12H2,1-5H3/b15-11-,16-13+","RAVLTUCAFRTDRY-GYPBQELOSA-N"
"CCOC(=O)C=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C17H28O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h9,11,13H,6-8,10,12H2,1-5H3/b15-11+,16-13+","RAVLTUCAFRTDRY-NWFDBUFXSA-N"
"Oc(c1)cc(OCSc(c2)cccc2)c(Cl)c1","InChI=1S/C13H11ClO2S/c14-12-7-6-10(15)8-13(12)16-9-17-11-4-2-1-3-5-11/h1-8,15H,9H2","QKTJORZNGHGNDS-UHFFFAOYSA-N"
"CCOC(=O)CC(C)CCC=C(C)CCC=C(C)C","InChI=1S/C17H30O2/c1-6-19-17(18)13-16(5)12-8-11-15(4)10-7-9-14(2)3/h9,11,16H,6-8,10,12-13H2,1-5H3/b15-11+","AVNMXCJYOADGLH-RVDMUPIBSA-N"
"CCCCOC(=O)C(C1)CN(C)C1","InChI=1S/C10H19NO2/c1-3-4-7-13-10(12)9-5-6-11(2)8-9/h9H,3-8H2,1-2H3","BXNLFEWJERMLFZ-UHFFFAOYSA-N"
"CN(C2)CC(C2)S(=O)(=O)c(c1)cccc1","InChI=1S/C11H15NO2S/c1-12-8-7-11(9-12)15(13,14)10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3","UOSZETBWCRGLCU-UHFFFAOYSA-N"
"COC(=O)C(C2)(C1)C(CN(C)2)(CN(C)1)C(=O)OC","InChI=1S/C12H20N2O4/c1-13-5-11(9(15)17-3)7-14(2)8-12(11,6-13)10(16)18-4/h5-8H2,1-4H3","PXMWCPHTPVACCP-UHFFFAOYSA-N"
"N#CC(C#N)(C2)C(CN(C)2)c(c1)cccc1","InChI=1S/C13H13N3/c1-16-7-12(11-5-3-2-4-6-11)13(8-14,9-15)10-16/h2-6,12H,7,10H2,1H3","QMVUZDKUOLUWBB-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)N(C(=O)1)C(=O)C(C2)C(CN2)1","InChI=1S/C13H14N2O2/c1-8-2-4-9(5-3-8)15-12(16)10-6-14-7-11(10)13(15)17/h2-5,10-11,14H,6-7H2,1H3","FXVANCKDLNHCJC-UHFFFAOYSA-N"
"CC(=O)C([H])(O2)C([H])(C(C)=O)N(C2)c(c1)cccc1","InChI=1S/C13H15NO3/c1-9(15)12-13(10(2)16)17-8-14(12)11-6-4-3-5-7-11/h3-7,12-13H,8H2,1-2H3/t12-,13-/m1/s1","ZPLOACWSVMAWQV-CHWSQXEVSA-N"
"Cc(c3)ccc(c3)N(C(=O)1)C(=O)C(C2)C(CN(C)2)1","InChI=1S/C14H16N2O2/c1-9-3-5-10(6-4-9)16-13(17)11-7-15(2)8-12(11)14(16)18/h3-6,11-12H,7-8H2,1-2H3","CDGMLTCYXXHIDE-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c3)ccc(c3)C(O2)CN(C2)c(c1)cccc1","InChI=1S/C15H14N2O3/c18-17(19)14-8-6-12(7-9-14)15-10-16(11-20-15)13-4-2-1-3-5-13/h1-9,15H,10-11H2","IWUFAXQNIIZKHP-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)N(C(=O)1)C(=O)C(C(C)(C)2)C(CN2)1","InChI=1S/C15H18N2O2/c1-9-4-6-10(7-5-9)17-13(18)11-8-16-15(2,3)12(11)14(17)19/h4-7,11-12,16H,8H2,1-3H3","JGPQGJKAHSKRKG-UHFFFAOYSA-N"
"Cc(c4)ccc(c4)N(C(=O)3)C(=O)C(C13)C(C2)(CCCC2)NC1","InChI=1S/C18H22N2O2/c1-12-5-7-13(8-6-12)20-16(21)14-11-19-18(15(14)17(20)22)9-3-2-4-10-18/h5-8,14-15,19H,2-4,9-11H2,1H3","UZYOMVNADBCKTA-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)C(O2)CN(C2)c(c1)cccc1","InChI=1S/C16H15NO2/c18-16(13-7-3-1-4-8-13)15-11-17(12-19-15)14-9-5-2-6-10-14/h1-10,15H,11-12H2","FELZSBWQVLITIO-UHFFFAOYSA-N"
"C(N(C4)CC(C5=O)C4C(N(c(c6)ccc(C)c6)5)=O)N(C1)CC(C2=O)C1C(N(c(c3)ccc(C)c3)2)=O","InChI=1S/C27H28N4O4/c1-16-3-7-18(8-4-16)30-24(32)20-11-28(12-21(20)25(30)33)15-29-13-22-23(14-29)27(35)31(26(22)34)19-9-5-17(2)6-10-19/h3-10,20-23H,11-15H2,1-2H3","JJHLVDNCHWSTEB-UHFFFAOYSA-N"
"O=C(O4)CN(C4)C(c(c3)cccc3)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C22H19NO2/c24-21-16-23(17-25-21)22(18-10-4-1-5-11-18,19-12-6-2-7-13-19)20-14-8-3-9-15-20/h1-15H,16-17H2","MLOBYZUIPXPCOL-UHFFFAOYSA-N"
"COC(=O)C(C1)C(C(=O)OC)CN(CN(C2)CC(C(=O)OC)C(C(=O)OC)2)1","InChI=1S/C17H26N2O8/c1-24-14(20)10-5-18(6-11(10)15(21)25-2)9-19-7-12(16(22)26-3)13(8-19)17(23)27-4/h10-13H,5-9H2,1-4H3","AAYGIPRMYLQNFU-UHFFFAOYSA-N"
"Cc(c4)ccc(c4)N(C(=O)3)C(=O)C(C23)C(C1)(NC2)C(C)CC1","InChI=1S/C18H22N2O2/c1-11-5-7-13(8-6-11)20-16(21)14-10-19-18(15(14)17(20)22)9-3-4-12(18)2/h5-8,12,14-15,19H,3-4,9-10H2,1-2H3","SJLJUSUBOGDIFX-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)C(C2)=C(CN(C)2)C(=O)c(c1)cccc1","InChI=1S/C19H17NO2/c1-20-12-16(18(21)14-8-4-2-5-9-14)17(13-20)19(22)15-10-6-3-7-11-15/h2-11H,12-13H2,1H3","ZCPUFQNBOLDSDB-UHFFFAOYSA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C(C2)C(CN(c(c3)cccc3)2)1","InChI=1S/C19H18N2O2/c1-13-7-9-15(10-8-13)21-18(22)16-11-20(12-17(16)19(21)23)14-5-3-2-4-6-14/h2-10,16-17H,11-12H2,1H3","KFDVATXTXXLVRY-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)C(=O)C([H])(C2)C([H])(CN(C)2)c(c1)cccc1","InChI=1S/C19H21NO/c1-14-8-10-16(11-9-14)19(21)18-13-20(2)12-17(18)15-6-4-3-5-7-15/h3-11,17-18H,12-13H2,1-2H3/t17-,18+/m1/s1","CBXXNMSANPCLIY-MSOLQXFVSA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C(C2)C(CN(Cc(c3)cccc3)2)1","InChI=1S/C20H20N2O2/c1-14-7-9-16(10-8-14)22-19(23)17-12-21(13-18(17)20(22)24)11-15-5-3-2-4-6-15/h2-10,17-18H,11-13H2,1H3","VAYXRPHMCAOOCA-UHFFFAOYSA-N"
"Cc(c4)ccc(c4)N(C(=O)3)C(=O)C(C13)C(C2)(CCCC2)N(C)C1","InChI=1S/C19H24N2O2/c1-13-6-8-14(9-7-13)21-17(22)15-12-20(2)19(16(15)18(21)23)10-4-3-5-11-19/h6-9,15-16H,3-5,10-12H2,1-2H3","WBWHLFPGZUBCLQ-UHFFFAOYSA-N"
"COC(=O)C(O)CC(=O)C=Cc(c1)cccc1","InChI=1S/C13H14O4/c1-17-13(16)12(15)9-11(14)8-7-10-5-3-2-4-6-10/h2-8,12,15H,9H2,1H3/b8-7+","LJWUPYNWZLDBFB-BQYQJAHWSA-N"
"CCCCCCCC(=O)C=CC(O)CC","InChI=1S/C13H24O2/c1-3-5-6-7-8-9-13(15)11-10-12(14)4-2/h10-12,14H,3-9H2,1-2H3/b11-10-","RWNNWUUGCZFEHL-KHPPLWFESA-N"
"CCCCCC(O)CC(=O)C=CC(C)C","InChI=1S/C13H24O2/c1-4-5-6-7-12(14)10-13(15)9-8-11(2)3/h8-9,11-12,14H,4-7,10H2,1-3H3/b9-8+","TVXUVXZFXYEFMI-CMDGGOBGSA-N"
"CCCCCC=CC(=O)C=Cc(c1)cccc1","InChI=1S/C16H20O/c1-2-3-4-5-9-12-16(17)14-13-15-10-7-6-8-11-15/h6-14H,2-5H2,1H3/b12-9+,14-13+","GJCLYAMIBTXTMM-KAQIVPQOSA-N"
"CCOC(OCC)C(O)CC(=O)C=Cc(c1)cccc1","InChI=1S/C16H22O4/c1-3-19-16(20-4-2)15(18)12-14(17)11-10-13-8-6-5-7-9-13/h5-11,15-16,18H,3-4,12H2,1-2H3/b11-10+","XRVSYOZKHXIBPW-ZHACJKMWSA-N"
"CCOP(=O)(OCC)CC(=N1)CC(CCc(c2)cccc2)O1","InChI=1S/C16H24NO4P/c1-3-19-22(18,20-4-2)13-15-12-16(21-17-15)11-10-14-8-6-5-7-9-14/h5-9,16H,3-4,10-13H2,1-2H3","PBSWHVPMOPBXLP-UHFFFAOYSA-N"
"CCOP(=O)(OCC)CC(=O)CC(O)CCc(c1)cccc1","InChI=1S/C16H25O5P/c1-3-20-22(19,21-4-2)13-16(18)12-15(17)11-10-14-8-6-5-7-9-14/h5-9,15,17H,3-4,10-13H2,1-2H3","IKOGQZHIYYAIQP-UHFFFAOYSA-N"
"O=C(C=Cc(c2)cccc2)CC(O)c(c1)cccc1","InChI=1S/C17H16O2/c18-16(12-11-14-7-3-1-4-8-14)13-17(19)15-9-5-2-6-10-15/h1-12,17,19H,13H2/b12-11+","VEDSJBNQWQAJJE-VAWYXSNFSA-N"
"c(c3)ccc(c3)CCC(O1)CC(C=Cc(c2)cccc2)=N1","InChI=1S/C19H19NO/c1-3-7-16(8-4-1)11-13-18-15-19(21-20-18)14-12-17-9-5-2-6-10-17/h1-11,13,19H,12,14-15H2/b13-11+","SNDAIAGNNKHSOS-ACCUITESSA-N"
"CCCCCC(O3)CC(=N3)C=Cc(c1)cc(OC)c(OCc(c2)cccc2)c1","InChI=1S/C24H29NO3/c1-3-4-6-11-22-17-21(25-28-22)14-12-19-13-15-23(24(16-19)26-2)27-18-20-9-7-5-8-10-20/h5,7-10,12-16,22H,3-4,6,11,17-18H2,1-2H3/b14-12+","ASTZGWAWISXKOA-WYMLVPIESA-N"
"CCCCCC(O)CC(=O)CCc(c1)cc(OC)c(OCc(c2)cccc2)c1","InChI=1S/C24H32O4/c1-3-4-6-11-21(25)17-22(26)14-12-19-13-15-23(24(16-19)27-2)28-18-20-9-7-5-8-10-20/h5,7-10,13,15-16,21,25H,3-4,6,11-12,14,17-18H2,1-2H3","PTWSCGSMXVXGRT-UHFFFAOYSA-N"
"","InChI=1S/C27H24N2O4/c1-17-13-15-20(16-14-17)29-25(30)21-22(26(29)31)24(27(32)33-2)28(19-11-7-4-8-12-19)23(21)18-9-5-3-6-10-18/h3-16,21-24H,1-2H3/t21-,22+,23-,24-/m1/s1","UNNLIGTYNIBHQK-UEQSERJNSA-N"
"","InChI=1S/C27H24N2O4/c1-17-13-15-20(16-14-17)29-25(30)21-22(26(29)31)24(27(32)33-2)28(19-11-7-4-8-12-19)23(21)18-9-5-3-6-10-18/h3-16,21-24H,1-2H3/t21-,22+,23+,24-/m1/s1","UNNLIGTYNIBHQK-NAVOZUGXSA-N"
"Cc(c3)ccc(c3)N(C(=O)1)C(=O)C(=C([H])2)C(CC([H])=C([H])2)1","InChI=1S/C15H13NO2/c1-10-6-8-11(9-7-10)16-14(17)12-4-2-3-5-13(12)15(16)18/h2-4,6-9,13H,5H2,1H3","HUFOTEUMQBTPCV-UHFFFAOYSA-N"
"CCOC(=O)C([H])(C1)N(C)C([H])(c(c2)cccc2)C([H])(C(=O)OC)1","InChI=1S/C16H21NO4/c1-4-21-16(19)13-10-12(15(18)20-3)14(17(13)2)11-8-6-5-7-9-11/h5-9,12-14H,4,10H2,1-3H3/t12-,13+,14-/m0/s1","COEWARZJRMXCQB-MJBXVCDLSA-N"
"CCOC(=O)C([H])(N(C)1)C([H])(C(=O)OC)C([H])(C(=O)OC)C([H])(c(c2)cccc2)1","InChI=1S/C18H23NO6/c1-5-25-18(22)15-13(17(21)24-4)12(16(20)23-3)14(19(15)2)11-9-7-6-8-10-11/h6-10,12-15H,5H2,1-4H3/t12-,13+,14-,15+/m0/s1","XZCVHTYLCXMOOX-LJISPDSOSA-N"
"CCOC(=O)C([H])(N(C)1)C([H])(C(=O)OC)C([H])(C(=O)OC)C([H])(c(c2)cccc2)1","InChI=1S/C18H23NO6/c1-5-25-18(22)15-13(17(21)24-4)12(16(20)23-3)14(19(15)2)11-9-7-6-8-10-11/h6-10,12-15H,5H2,1-4H3/t12-,13+,14-,15-/m0/s1","XZCVHTYLCXMOOX-XGUBFFRZSA-N"
"CCOC(=O)C([H])(N(C)1)C([H])(C(=O)2)C([H])(C(=O)N(c(c3)ccc(C)c3)2)C([H])(CC)1","InChI=1S/C19H24N2O4/c1-5-13-14-15(16(20(13)4)19(24)25-6-2)18(23)21(17(14)22)12-9-7-11(3)8-10-12/h7-10,13-16H,5-6H2,1-4H3/t13-,14-,15-,16+/m0/s1","HOLUPEUXIPLRIG-YHUYYLMFSA-N"
"CCOC(=O)C([H])(N(C)1)C([H])(C(=O)2)C([H])(C(=O)N(c(c3)ccc(C)c3)2)C([H])(CC)1","InChI=1S/C19H24N2O4/c1-5-13-14-15(16(20(13)4)19(24)25-6-2)18(23)21(17(14)22)12-9-7-11(3)8-10-12/h7-10,13-16H,5-6H2,1-4H3/t13-,14+,15+,16+/m1/s1","HOLUPEUXIPLRIG-UGUYLWEFSA-N"
"CCOC(=O)C([H])(N(C)1)C([H])(C(=O)2)C([H])(C(=O)N(c(c3)ccc(C)c3)2)C([H])(C=CC)1","InChI=1S/C20H24N2O4/c1-5-7-14-15-16(17(21(14)4)20(25)26-6-2)19(24)22(18(15)23)13-10-8-12(3)9-11-13/h5,7-11,14-17H,6H2,1-4H3/b7-5+/t14-,15-,16-,17+/m0/s1","HCPRLJQOXMIOCW-NUJXTKSFSA-N"
"CCOC(=O)C([H])(N(C)1)C(C(=O)2)C(C(=O)N(c(c3)ccc(C)c3)2)C([H])(C=CC)1","InChI=1S/C20H24N2O4/c1-5-7-14-15-16(17(21(14)4)20(25)26-6-2)19(24)22(18(15)23)13-10-8-12(3)9-11-13/h5,7-11,14-17H,6H2,1-4H3/b7-5+/t14-,15?,16?,17+/m1/s1","HCPRLJQOXMIOCW-LTNSZIOFSA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])(C(=O)OC)2)C([H])1C([H])(CC)N(c(c3)cccc3)2","InChI=1S/C23H24N2O4/c1-4-17-18-19(20(23(28)29-3)24(17)15-8-6-5-7-9-15)22(27)25(21(18)26)16-12-10-14(2)11-13-16/h5-13,17-20H,4H2,1-3H3/t17-,18+,19+,20+/m1/s1","PRNQTPHKTQAPAG-FYQPLNBISA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])(c(c3)cccc3)2)C([H])1C([H])(C#N)N(C)2","InChI=1S/C21H19N3O2/c1-13-8-10-15(11-9-13)24-20(25)17-16(12-22)23(2)19(18(17)21(24)26)14-6-4-3-5-7-14/h3-11,16-19H,1-2H3/t16-,17+,18+,19-/m0/s1","JCGYPVYGWLSUNO-MANSERQUSA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])(c(c3)cccc3)2)C([H])1C([H])(C#N)N(C)2","InChI=1S/C21H19N3O2/c1-13-8-10-15(11-9-13)24-20(25)17-16(12-22)23(2)19(18(17)21(24)26)14-6-4-3-5-7-14/h3-11,16-19H,1-2H3/t16-,17-,18-,19-/m1/s1","JCGYPVYGWLSUNO-NCXUSEDFSA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])(c(c3)cccc3)2)C([H])1C([H])(C#N)N(C)2","InChI=1S/C21H19N3O2/c1-13-8-10-15(11-9-13)24-20(25)17-16(12-22)23(2)19(18(17)21(24)26)14-6-4-3-5-7-14/h3-11,16-19H,1-2H3/t16-,17-,18-,19+/m1/s1","JCGYPVYGWLSUNO-MKXGPGLRSA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])(c(c3)cccc3)2)C([H])1C([H])(C#N)N(C)2","InChI=1S/C21H19N3O2/c1-13-8-10-15(11-9-13)24-20(25)17-16(12-22)23(2)19(18(17)21(24)26)14-6-4-3-5-7-14/h3-11,16-19H,1-2H3/t16-,17+,18+,19+/m0/s1","JCGYPVYGWLSUNO-WJFTUGDTSA-N"
"Cc(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])(C(=O)OC)2)C([H])(CN(c(c3)cccc3)2)1","InChI=1S/C21H20N2O4/c1-13-8-10-15(11-9-13)23-19(24)16-12-22(14-6-4-3-5-7-14)18(21(26)27-2)17(16)20(23)25/h3-11,16-18H,12H2,1-2H3/t16-,17-,18-/m0/s1","KTXSTUFUZXOMIO-BZSNNMDCSA-N"
"CCOC(=O)C([H])(N(C)1)C([H])(C(=O)3)C([H])(C(=O)N(c(c4)ccc(C)c4)3)C([H])(c(c2)cccc2)1","InChI=1S/C23H24N2O4/c1-4-29-23(28)20-18-17(19(24(20)3)15-8-6-5-7-9-15)21(26)25(22(18)27)16-12-10-14(2)11-13-16/h5-13,17-20H,4H2,1-3H3/t17-,18+,19+,20-/m1/s1","VGSBKCSOMUUVGJ-FUMNGEBKSA-N"
"COC(=O)C([H])(C1)C([H])(C(=O)OC)CC(C(=O)2)=C(CC2)1","InChI=1S/C13H16O5/c1-17-12(15)9-5-7-3-4-11(14)8(7)6-10(9)13(16)18-2/h9-10H,3-6H2,1-2H3/t9-,10-/m1/s1","RPLFDITWLLPMSI-NXEZZACHSA-N"
"C=CC(=O)C(=C1)CC([H])(C(=O)OC)C([H])(C1)C(=O)OC","InChI=1S/C13H16O5/c1-4-11(14)8-5-6-9(12(15)17-2)10(7-8)13(16)18-3/h4-5,9-10H,1,6-7H2,2-3H3/t9-,10+/m1/s1","MFKLHWNYBKUURK-ZJUUUORDSA-N"
"COC(=O)C([H])(C1)C([H])(C(=O)OC)CC(C(=O)2)=C(CC2)1","InChI=1S/C13H16O5/c1-17-12(15)9-5-7-3-4-11(14)8(7)6-10(9)13(16)18-2/h9-10H,3-6H2,1-2H3/t9-,10+/m1/s1","RPLFDITWLLPMSI-ZJUUUORDSA-N"
"C=CC(=O)C(=C1)CC([H])(C(=O)OC)C([H])(C1)C(=O)OC","InChI=1S/C13H16O5/c1-4-11(14)8-5-6-9(12(15)17-2)10(7-8)13(16)18-3/h4-5,9-10H,1,6-7H2,2-3H3/t9-,10-/m0/s1","MFKLHWNYBKUURK-UWVGGRQHSA-N"
"CC=CC(=O)C(=C1)CC([H])(C(=O)OC)C([H])(C1)C(=O)OC","InChI=1S/C14H18O5/c1-4-5-12(15)9-6-7-10(13(16)18-2)11(8-9)14(17)19-3/h4-6,10-11H,7-8H2,1-3H3/b5-4+/t10-,11+/m0/s1","IXNYYJARHNGRSX-BXXZLRJFSA-N"
"CC=CC(=O)C(=C1)CC([H])(C(=O)OC)C([H])(C1)C(=O)OC","InChI=1S/C14H18O5/c1-4-5-12(15)9-6-7-10(13(16)18-2)11(8-9)14(17)19-3/h4-6,10-11H,7-8H2,1-3H3/b5-4+/t10-,11-/m0/s1","IXNYYJARHNGRSX-NNOMMRTBSA-N"
"COC(=O)C(C1)C(C(=O)OC)CC(C(=O)2)=C(C(C)C2)1","InChI=1S/C14H18O5/c1-7-4-12(15)9-6-11(14(17)19-3)10(5-8(7)9)13(16)18-2/h7,10-11H,4-6H2,1-3H3/t7-,10+,11-/m1/s1","AMUQJUSLJOGVMP-PPKCKEKNSA-N"
"COC(=O)C(C=1)C(C(=O)OC)CC([H])(C(C)2)C(C(=O)C2)1","InChI=1S/C14H18O5/c1-7-4-12(15)9-6-11(14(17)19-3)10(5-8(7)9)13(16)18-2/h6-8,10-11H,4-5H2,1-3H3/t7-,8+,10+,11+/m1/s1","MTNVPZYSZWWXDP-IFFSRLJSSA-N"
"CC(C)=CC(=O)C(=C1)CC([H])(C(=O)OC)C([H])(C1)C(=O)OC","InChI=1S/C15H20O5/c1-9(2)7-13(16)10-5-6-11(14(17)19-3)12(8-10)15(18)20-4/h5,7,11-12H,6,8H2,1-4H3/t11-,12+/m1/s1","DBKXMNLULSAGKE-NEPJUHHUSA-N"
"COC(=O)[C@@]([H])(C1)[C@]([H])(C(=O)OC)CC(C(C)(C)2)=C(C(=O)C2)1","InChI=1S/C15H20O5/c1-15(2)7-12(16)10-5-8(13(17)19-3)9(6-11(10)15)14(18)20-4/h8-9H,5-7H2,1-4H3/t8-,9+/m0/s1","PZZYXESBDRVCNH-DTWKUNHWSA-N"
"COC(=O)C(C=1)C(C(=O)OC)CC([H])(C(C)(C)2)C1C(=O)C2","InChI=1S/C15H20O5/c1-15(2)7-12(16)10-5-8(13(17)19-3)9(6-11(10)15)14(18)20-4/h5,8-9,11H,6-7H2,1-4H3/t8-,9-,11+/m1/s1","PINCIHVNNWHGGQ-KKZNHRDASA-N"
"COC(=O)C([H])(C1)C([H])(C(=O)OC)CC(C(=O)C=Cc(c2)cccc2)=C1","InChI=1S/C19H20O5/c1-23-18(21)15-10-9-14(12-16(15)19(22)24-2)17(20)11-8-13-6-4-3-5-7-13/h3-9,11,15-16H,10,12H2,1-2H3/b11-8+/t15-,16+/m0/s1","OTYBPIKOUDCLHE-UGTRGGQESA-N"
"COC(=O)C([H])(C1)C([H])(C(=O)OC)CC(C(=O)C=Cc(c2)cccc2)=C1","InChI=1S/C19H20O5/c1-23-18(21)15-10-9-14(12-16(15)19(22)24-2)17(20)11-8-13-6-4-3-5-7-13/h3-9,11,15-16H,10,12H2,1-2H3/b11-8+/t15-,16-/m0/s1","OTYBPIKOUDCLHE-RYRVOACTSA-N"
"COC(=O)C(C1)C(C(=O)OC)CC(C2c(c3)cccc3)=C1C(=O)C2","InChI=1S/C19H20O5/c1-23-18(21)15-8-13-12(11-6-4-3-5-7-11)10-17(20)14(13)9-16(15)19(22)24-2/h3-7,12,15-16H,8-10H2,1-2H3/t12-,15+,16-/m1/s1","ILKGAHQRSGVBBZ-UHOFOFEASA-N"
"COC(=O)C(C1)C(C(=O)OC)CC(C2c(c3)cccc3)=C1C(=O)C2","InChI=1S/C19H20O5/c1-23-18(21)15-8-13-12(11-6-4-3-5-7-11)10-17(20)14(13)9-16(15)19(22)24-2/h3-7,12,15-16H,8-10H2,1-2H3/t12-,15+,16+/m1/s1","ILKGAHQRSGVBBZ-KCXAZCMYSA-N"
"c(c3)ccc(c3)C(=N2)OC(C)(C2)c(c1)cccc1","InChI=1S/C16H15NO/c1-16(14-10-6-3-7-11-14)12-17-15(18-16)13-8-4-2-5-9-13/h2-11H,12H2,1H3","OQRWPZSNESWCRT-UHFFFAOYSA-N"
"CSC(SC)=NC[Si](C)(C)C","InChI=1S/C7H17NS2Si/c1-9-7(10-2)8-6-11(3,4)5/h6H2,1-5H3","UDLCMVXUWLNAJC-UHFFFAOYSA-N"
"CC(C)C(=N2)C(C(=O)1)C(C2)C(=O)N(C)1","InChI=1S/C10H14N2O2/c1-5(2)8-7-6(4-11-8)9(13)12(3)10(7)14/h5-7H,4H2,1-3H3","MNZPKNDSKJRXPD-UHFFFAOYSA-N"
"COC(=O)CC(CN=C(SC)SC)C(=O)OC","InChI=1S/C10H17NO4S2/c1-14-8(12)5-7(9(13)15-2)6-11-10(16-3)17-4/h7H,5-6H2,1-4H3","HHMRUUQKFGMVBD-UHFFFAOYSA-N"
"N#CC(C2)CC(=N2)c(c1)cccc1","InChI=1S/C11H10N2/c12-7-9-6-11(13-8-9)10-4-2-1-3-5-10/h1-5,9H,6,8H2","VELGLBWQTZMVOR-UHFFFAOYSA-N"
"CC(=O)C(C2)CC(=N2)c(c1)cccc1","InChI=1S/C12H13NO/c1-9(14)11-7-12(13-8-11)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3","FSDMHIHOCPMXSL-UHFFFAOYSA-N"
"COC(=O)C(C=2)CN(C2)c(c1)cccc1","InChI=1S/C12H13NO2/c1-15-12(14)10-7-8-13(9-10)11-5-3-2-4-6-11/h2-8,10H,9H2,1H3","XNZMRAHKWAPVFU-UHFFFAOYSA-N"
"COC(=O)C(C)(C2)C(=NC2)c(c1)cccc1","InChI=1S/C13H15NO2/c1-13(12(15)16-2)8-9-14-11(13)10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3/t13-/m1/s1","LNCMMHSBJKHPRZ-CYBMUJFWSA-N"
"COC(=O)C(C2c(c3)cccc3)C(=NC2)c(c1)cccc1","InChI=1S/C18H17NO2/c1-21-18(20)16-15(13-8-4-2-5-9-13)12-19-17(16)14-10-6-3-7-11-14/h2-11,15-16H,12H2,1H3/t15-,16-/m0/s1","RCDUXJYLTXEGNP-HOTGVXAUSA-N"
"COC(=O)C(C2)C(c(c3)cccc3)C(=N2)c(c1)cccc1","InChI=1S/C18H17NO2/c1-21-18(20)15-12-19-17(14-10-6-3-7-11-14)16(15)13-8-4-2-5-9-13/h2-11,15-16H,12H2,1H3","OCMNRGUEENYBHL-UHFFFAOYSA-N"
"CC(C)(C)OC(=O)C([H])(C2)C([H])(C(=O)OC(C)(C)C)C(=N2)c(c1)cccc1","InChI=1S/C20H27NO4/c1-19(2,3)24-17(22)14-12-21-16(13-10-8-7-9-11-13)15(14)18(23)25-20(4,5)6/h7-11,14-15H,12H2,1-6H3/t14-,15-/m0/s1","SVKDBPLUPBTIRO-GJZGRUSLSA-N"
"O=CCCCCCCC(S1)SCCC1","InChI=1S/C11H20OS2/c12-8-5-3-1-2-4-7-11-13-9-6-10-14-11/h8,11H,1-7,9-10H2","VPTCGEKIEYXIEX-UHFFFAOYSA-N"
"O=CCCCCCCC(O1)OCCC1","InChI=1S/C11H20O3/c12-8-5-3-1-2-4-7-11-13-9-6-10-14-11/h8,11H,1-7,9-10H2","SYAIQNFWXPQVMV-UHFFFAOYSA-N"
"c(c1C(N(c(c4)cccc4)2)([H])C(C([H])(CCCCCCC(S3)SCCC3)O2)([H])C=O)cccc1","InChI=1S/C26H33NO2S2/c28-20-23-24(16-9-1-2-10-17-25-30-18-11-19-31-25)29-27(22-14-7-4-8-15-22)26(23)21-12-5-3-6-13-21/h3-8,12-15,20,23-26H,1-2,9-11,16-19H2/t23-,24-,26-/m1/s1","XOMYPXJYUMGVJZ-DGWZTRNLSA-N"
"c(c1C(N(c(c4)cccc4)2)([H])C(C([H])(CCCCCCC(O3)OCCC3)O2)([H])C=O)cccc1","InChI=1S/C26H33NO4/c28-20-23-24(16-9-1-2-10-17-25-29-18-11-19-30-25)31-27(22-14-7-4-8-15-22)26(23)21-12-5-3-6-13-21/h3-8,12-15,20,23-26H,1-2,9-11,16-19H2/t23-,24-,26-/m1/s1","QJYJDNOFGWYKEM-DGWZTRNLSA-N"
"C(CCC([H])(C(C([H])=C([H])CCCCCC)([H])1)ON(c(c3)cccc3)C([H])(c(c2)cccc2)1)CCCC=O","InChI=1S/C30H41NO2/c1-2-3-4-5-7-16-23-28-29(24-17-8-6-9-18-25-32)33-31(27-21-14-11-15-22-27)30(28)26-19-12-10-13-20-26/h10-16,19-23,25,28-30H,2-9,17-18,24H2,1H3/b23-16+/t28-,29-,30-/m1/s1","UTKMFHRKXSADTA-DTFXIWBQSA-N"
"[H]C(=C([H])C(C(CCCCCCC(O)=O)([H])1)([H])C([H])(c(c3)cccc3)N(c(c2)cccc2)O1)CCCCCC","InChI=1S/C30H41NO3/c1-2-3-4-5-6-15-22-27-28(23-16-7-8-17-24-29(32)33)34-31(26-20-13-10-14-21-26)30(27)25-18-11-9-12-19-25/h9-15,18-22,27-28,30H,2-8,16-17,23-24H2,1H3,(H,32,33)/b22-15+/t27-,28-,30-/m1/s1","CKZNDROPOMCHCT-ZFSJSHRRSA-N"
"C(CCCCCC(O2)([H])C(C(=C([H])C(CCCCC)O)[H])(C(N2c(c3)cccc3)([H])c(c1)cccc1)[H])C=O","InChI=1S/C30H41NO3/c1-2-3-9-20-27(33)22-23-28-29(21-14-5-4-6-15-24-32)34-31(26-18-12-8-13-19-26)30(28)25-16-10-7-11-17-25/h7-8,10-13,16-19,22-24,27-30,33H,2-6,9,14-15,20-21H2,1H3/b23-22+/t27?,28-,29-,30-/m1/s1","KSJMGYIRHBDFIQ-DZIKBGJZSA-N"
"C(CCC)CC(C(=C([H])C(C1([H])c(c3)cccc3)(C(ON(c(c2)cccc2)1)(CCCCCCC(O)=O)[H])[H])[H])O","InChI=1S/C30H41NO4/c1-2-3-8-19-26(32)22-23-27-28(20-13-4-5-14-21-29(33)34)35-31(25-17-11-7-12-18-25)30(27)24-15-9-6-10-16-24/h6-7,9-12,15-18,22-23,26-28,30,32H,2-5,8,13-14,19-21H2,1H3,(H,33,34)/b23-22+/t26?,27-,28-,30-/m1/s1","XFDWCDZIURWMEN-DUIXEDJQSA-N"
"C(C(C([H])=C(C([H])(C([H])2c(c4)cccc4)C([H])(ON2c(c3)cccc3)CCCCCCC(S1)SCCC1)[H])=O)CCCC","InChI=1S/C33H45NO2S2/c1-2-3-8-20-29(35)23-24-30-31(21-13-4-5-14-22-32-37-25-15-26-38-32)36-34(28-18-11-7-12-19-28)33(30)27-16-9-6-10-17-27/h6-7,9-12,16-19,23-24,30-33H,2-5,8,13-15,20-22,25-26H2,1H3/b24-23+/t30-,31-,33-/m1/s1","FVKVVZZFEJOXKD-KAPGZKBJSA-N"
"CCCCCCC([H])=C(C(C(CCCCCCC(O4)OCCC4)([H])1)([H])C(c(c3)cccc3)(N(c(c2)cccc2)O1)[H])[H]","InChI=1S/C33H47NO3/c1-2-3-4-5-6-15-23-30-31(24-16-7-8-17-25-32-35-26-18-27-36-32)37-34(29-21-13-10-14-22-29)33(30)28-19-11-9-12-20-28/h9-15,19-23,30-33H,2-8,16-18,24-27H2,1H3/b23-15-/t30-,31-,33-/m1/s1","FCZBKAKLHSGZKG-DLHQYOMKSA-N"
"COC(=O)C(C(C)2)C(N=C2)c(c1)cccc1","InChI=1S/C13H15NO2/c1-9-8-14-12(11(9)13(15)16-2)10-6-4-3-5-7-10/h3-9,11-12H,1-2H3/t9-,11+,12+/m0/s1","ZBBUBJJCYIOTSS-MVWJERBFSA-N"
"COC(=O)C(C2)C(N=C(C)2)c(c1)cccc1","InChI=1S/C13H15NO2/c1-9-8-11(13(15)16-2)12(14-9)10-6-4-3-5-7-10/h3-7,11-12H,8H2,1-2H3/t11-,12-/m0/s1","GAQRALKIYFFKIF-RYUDHWBXSA-N"
"COC(=O)C(C(C)2)C(NC(C#N)2)c(c1)cccc1","InChI=1S/C14H16N2O2/c1-9-11(8-15)16-13(12(9)14(17)18-2)10-6-4-3-5-7-10/h3-7,9,11-13,16H,1-2H3/t9-,11+,12+,13+/m0/s1","VPTFVHPYMABDRZ-WKSBVSIWSA-N"
"COC(=O)C(C(C)2)C(N=C(C)2)c(c1)cccc1","InChI=1S/C14H17NO2/c1-9-10(2)15-13(12(9)14(16)17-3)11-7-5-4-6-8-11/h4-9,12-13H,1-3H3/t9-,12+,13+/m0/s1","SMAVUOBZOAUWCW-ZWKOPEQDSA-N"
"COC(=O)C(C1)C(CC)N=C1c(c2)cccc2","InChI=1S/C14H17NO2/c1-3-12-11(14(16)17-2)9-13(15-12)10-7-5-4-6-8-10/h4-8,11-12H,3,9H2,1-2H3/t11-,12-/m1/s1","DUSYLALIIZPQHE-VXGBXAGGSA-N"
"COC(=O)C(C)(C2)C(N=C(C)2)c(c1)cccc1","InChI=1S/C14H17NO2/c1-10-9-14(2,13(16)17-3)12(15-10)11-7-5-4-6-8-11/h4-8,12H,9H2,1-3H3/t12-,14-/m1/s1","JOVMMKRYJXRYLZ-TZMCWYRMSA-N"
"COC(=O)C(C)(C1)C(CC)N=C(c(c2)cccc2)1","InChI=1S/C15H19NO2/c1-4-13-15(2,14(17)18-3)10-12(16-13)11-8-6-5-7-9-11/h5-9,13H,4,10H2,1-3H3/t13-,15-/m1/s1","VYNPDGQQISDIGY-UKRRQHHQSA-N"
"COC(=O)C(C(CC)2)C(C)C(=N2)c(c1)cccc1","InChI=1S/C15H19NO2/c1-4-12-13(15(17)18-3)10(2)14(16-12)11-8-6-5-7-9-11/h5-10,12-13H,4H2,1-3H3/t10-,12-,13-/m1/s1","XWJJRAGNCUIQPA-RAIGVLPGSA-N"
"COC(=O)C(C(C)2)C(N=C(C(C)C)2)c(c1)cccc1","InChI=1S/C16H21NO2/c1-10(2)14-11(3)13(16(18)19-4)15(17-14)12-8-6-5-7-9-12/h5-11,13,15H,1-4H3/t11-,13-,15-/m1/s1","LPEWXAVTRVVJSD-UXIGCNINSA-N"
"COC(=O)C(C2c(c3)cccc3)C(N=C2)c(c1)cccc1","InChI=1S/C18H17NO2/c1-21-18(20)16-15(13-8-4-2-5-9-13)12-19-17(16)14-10-6-3-7-11-14/h2-12,15-17H,1H3/t15-,16-,17-/m1/s1","ASARVIYRSZDLHI-BRWVUGGUSA-N"
"O=C(C1)N(C)C(=O)C1=C([H])C(=O)c(c2)cccc2","InChI=1S/C13H11NO3/c1-14-12(16)8-10(13(14)17)7-11(15)9-5-3-2-4-6-9/h2-7H,8H2,1H3/b10-7+","OBCSOFNPRNSGHS-JXMROGBWSA-N"
"c(c3)ccc(c3)C(=O)C([H])=C(C1)C(=O)N(c(c2)cccc2)C(=O)1","InChI=1S/C18H13NO3/c20-16(13-7-3-1-4-8-13)11-14-12-17(21)19(18(14)22)15-9-5-2-6-10-15/h1-11H,12H2/b14-11+","MXDOBCYVGIUBPN-SDNWHVSQSA-N"
"Cc(c3)ccc(c3)N(C(=O)2)C(=O)C(C2)=C([H])C(=O)c(o1)c([H])c([H])c([H])1","InChI=1S/C17H13NO4/c1-11-4-6-13(7-5-11)18-16(20)10-12(17(18)21)9-14(19)15-3-2-8-22-15/h2-9H,10H2,1H3/b12-9+","UJGYLEYSXYBNPL-FMIVXFBMSA-N"
"CC(=O)C([H])=C(C2)C(=O)N(C(=O)2)c(c1)ccc(C)c1","InChI=1S/C14H13NO3/c1-9-3-5-12(6-4-9)15-13(17)8-11(14(15)18)7-10(2)16/h3-7H,8H2,1-2H3/b11-7+","RCXQOHURHKFFFZ-YRNVUSSQSA-N"
"CCOC(=O)C([H])=C(C2)C(=O)N(C(=O)2)c(c1)ccc(C)c1","InChI=1S/C15H15NO4/c1-3-20-14(18)9-11-8-13(17)16(15(11)19)12-6-4-10(2)5-7-12/h4-7,9H,3,8H2,1-2H3/b11-9+","DEMLAUGQGJJHLG-PKNBQFBNSA-N"
"N#CC([H])=C(C2)C(=O)N(C(=O)2)c(c1)ccc(C)c1","InChI=1S/C13H10N2O2/c1-9-2-4-11(5-3-9)15-12(16)8-10(6-7-14)13(15)17/h2-6H,8H2,1H3/b10-6+","POSKQLATMWPYAJ-UXBLZVDNSA-N"
"c(c4)ccc(c4)C(=O)c(c1)cc(c(c3)cccc3)nc(c(c2)cccc2)1","InChI=1S/C24H17NO/c26-24(20-14-8-3-9-15-20)21-16-22(18-10-4-1-5-11-18)25-23(17-21)19-12-6-2-7-13-19/h1-17H","UDJAGNZJXMRIJL-UHFFFAOYSA-N"
"c(C(C(C=3)=CC(OC(C)=O)(OC(c(c4)cccc4)3)c(c2)cccc2)=O)(c1)cccc1","InChI=1S/C26H20O4/c1-19(27)29-26(23-15-9-4-10-16-23)18-22(25(28)21-13-7-3-8-14-21)17-24(30-26)20-11-5-2-6-12-20/h2-18H,1H3","ZKWZECOQRQWHFG-UHFFFAOYSA-N"
"N#CCc(c(C)1)c(=O)n(c(c2)ccc(C)c2)c(=O)1","InChI=1S/C14H12N2O2/c1-9-3-5-11(6-4-9)16-13(17)10(2)12(7-8-15)14(16)18/h3-6H,7H2,1-2H3","SHRYKSGYFMHYMM-UHFFFAOYSA-N"
"CC(=O)Cc(c(C)1)c(=O)n(c(c2)ccc(C)c2)c(=O)1","InChI=1S/C15H15NO3/c1-9-4-6-12(7-5-9)16-14(18)11(3)13(15(16)19)8-10(2)17/h4-7H,8H2,1-3H3","HUJBLJFHNVWYDA-UHFFFAOYSA-N"
"O=C(O2)C=C(C=C2c(c3)cccc3)C(=O)c(c1)cccc1","InChI=1S/C18H12O3/c19-17-12-15(18(20)14-9-5-2-6-10-14)11-16(21-17)13-7-3-1-4-8-13/h1-12H","NGYDIWXIDVGCOE-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)n(c(=O)1)c(=O)c(CC(=O)c(c2)cccc2)c(C)1","InChI=1S/C20H17NO3/c1-13-8-10-16(11-9-13)21-19(23)14(2)17(20(21)24)12-18(22)15-6-4-3-5-7-15/h3-11H,12H2,1-2H3","FYIZOMRXOHULSH-UHFFFAOYSA-N"
"CCOC(=O)Cc(c(C)1)c(=O)n(c(c2)ccc(C)c2)c(=O)1","InChI=1S/C16H17NO4/c1-4-21-14(18)9-13-11(3)15(19)17(16(13)20)12-7-5-10(2)6-8-12/h5-8H,4,9H2,1-3H3","DUVVEQVVACATLH-UHFFFAOYSA-N"
"CC(C)CCOC(=O)c(c1)ccc(O)c1","InChI=1S/C12H16O3/c1-9(2)7-8-15-12(14)10-3-5-11(13)6-4-10/h3-6,9,13H,7-8H2,1-2H3","KSHVDKDQYBNSAN-UHFFFAOYSA-N"
"N#Cc(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C7H4N2O2/c8-5-6-2-1-3-7(4-6)9(10)11/h1-4H","RUSAWEHOGCWOPG-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=O)NC2=O","InChI=1S/C8H5NO2/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-4H,(H,9,10,11)","XKJCHHZQLQNZHY-UHFFFAOYSA-N"
"Nc(c1)cc(cc1)C(O)=O","InChI=1S/C7H7NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H,9,10)","XFDUHJPVQKIXHO-UHFFFAOYSA-N"
"CC(N)C(O)=O","InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)","QNAYBMKLOCPYGJ-UHFFFAOYSA-N"
"c(c1)ccc(c1)P(O)(O)=O","InChI=1S/C6H7O3P/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)","QLZHNIAADXEJJP-UHFFFAOYSA-N"
"COc(c1)c(ccc1)C(O)=O","InChI=1S/C8H8O3/c1-11-7-5-3-2-4-6(7)8(9)10/h2-5H,1H3,(H,9,10)","ILUJQPXNXACGAN-UHFFFAOYSA-N"
"C=CC(C)O","InChI=1S/C4H8O/c1-3-4(2)5/h3-5H,1H2,2H3","MKUWVMRNQOOSAT-UHFFFAOYSA-N"
"C=CCCO","InChI=1S/C4H8O/c1-2-3-4-5/h2,5H,1,3-4H2","ZSPTYLOMNJNZNG-UHFFFAOYSA-N"
"OC(=O)C([H])(C1)C([H])(CCC1)C(O)=O","InChI=1S/C8H12O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h5-6H,1-4H2,(H,9,10)(H,11,12)/t5-,6+","QSAWQNUELGIYBC-OLQVQODUSA-N"
"C[SiH](C)N[SiH](C)C","InChI=1S/C4H15NSi2/c1-6(2)5-7(3)4/h5-7H,1-4H3","NQCZAYQXPJEPDS-UHFFFAOYSA-N"
"OCC(C1)C1","InChI=1S/C4H8O/c5-3-4-1-2-4/h4-5H,1-3H2","GUDMZGLFZNLYEY-UHFFFAOYSA-N"
"NCCCOCC","InChI=1S/C5H13NO/c1-2-7-5-3-4-6/h2-6H2,1H3","SOYBEXQHNURCGE-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(Cl)Cl","InChI=1S/C7H6Cl2/c8-7(9)6-4-2-1-3-5-6/h1-5,7H","CAHQGWAXKLQREW-UHFFFAOYSA-N"
"COC(=O)C(C1)C(CCC1)C(=O)OC","InChI=1S/C10H16O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s1","AIACXWOETVLBIA-HTQZYQBOSA-N"
"OC(=O)C(C1)CCCC1","InChI=1S/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9)","NZNMSOFKMUBTKW-UHFFFAOYSA-N"
"ICI","InChI=1S/CH2I2/c2-1-3/h1H2","NZZFYRREKKOMAT-UHFFFAOYSA-N"
"Nc(c1)ccc(c1)C(O)=O","InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)","ALYNCZNDIQEVRV-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(O)cc1","InChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10)","IJFXRHURBJZNAO-UHFFFAOYSA-N"
"NCCCCO","InChI=1S/C4H11NO/c5-3-1-2-4-6/h6H,1-5H2","BLFRQYKZFKYQLO-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(Br)cc1","InChI=1S/C7H5BrO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)","VOIZNVUXCQLQHS-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(I)cc1","InChI=1S/C7H5IO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)","KVBWBCRPWVKFQT-UHFFFAOYSA-N"
"OC(=O)c(c1)c(Br)ccc1","InChI=1S/C7H5BrO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,(H,9,10)","XRXMNWGCKISMOH-UHFFFAOYSA-N"
"COc(c1)cc(cc1)C(O)=O","InChI=1S/C8H8O3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5H,1H3,(H,9,10)","XHQZJYCNDZAGLW-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C(=O)c(c1)cccc1","InChI=1S/C14H12O2/c1-16-13-9-7-12(8-10-13)14(15)11-5-3-2-4-6-11/h2-10H,1H3","SWFHGTMLYIBPPA-UHFFFAOYSA-N"
"COc(c2)ccc(c2)NC(=O)c(c1)cccc1","InChI=1S/C14H13NO2/c1-17-13-9-7-12(8-10-13)15-14(16)11-5-3-2-4-6-11/h2-10H,1H3,(H,15,16)","KEEBHMMBUBEEOV-UHFFFAOYSA-N"
"CCO[Si](OCC)(OCC)OCC","InChI=1S/C8H20O4Si/c1-5-9-13(10-6-2,11-7-3)12-8-4/h5-8H2,1-4H3","BOTDANWDWHJENH-UHFFFAOYSA-N"
"CCO[Si](C)(OCC)OCC","InChI=1S/C7H18O3Si/c1-5-8-11(4,9-6-2)10-7-3/h5-7H2,1-4H3","CPUDPFPXCZDNGI-UHFFFAOYSA-N"
"Oc(c1)cc(c2)c(ccc2)c1","InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H","JWAZRIHNYRIHIV-UHFFFAOYSA-N"
"O=C(NNc(c2)cccc2)NNc(c1)cccc1","InChI=1S/C13H14N4O/c18-13(16-14-11-7-3-1-4-8-11)17-15-12-9-5-2-6-10-12/h1-10,14-15H,(H2,16,17,18)","KSPIHGBHKVISFI-UHFFFAOYSA-N"
"CCOC(=O)C=CCCCC(C1)C(C(=O)OCC)C(C2)C(CCC(O3)(OCC3)2)C(=O)1","InChI=1S/C23H34O7/c1-3-27-20(25)9-7-5-6-8-16-14-19(24)17-10-11-23(29-12-13-30-23)15-18(17)21(16)22(26)28-4-2/h7,9,16-18,21H,3-6,8,10-15H2,1-2H3/b9-7+","OUIQUNJXRQNGLD-VQHVLOKHSA-N"
"CCOC(=O)C=CCCCC=CC(=O)OCC","InChI=1S/C13H20O4/c1-3-16-12(14)10-8-6-5-7-9-11-13(15)17-4-2/h8-11H,3-7H2,1-2H3/b10-8+,11-9+","DGDKCADOPSQFGL-GFULKKFKSA-N"
"COC(=O)C(C1)([Si](C)(C)C)C(C2)C(CCC2)C(=O)C1","InChI=1S/C15H26O3Si/c1-18-14(17)15(19(2,3)4)10-9-13(16)11-7-5-6-8-12(11)15/h11-12H,5-10H2,1-4H3","COQGSBQFSUFWIR-UHFFFAOYSA-N"
"CC(=O)CCCC(=O)C(C1)=CCC(O2)(OCC2)C1","InChI=1S/C14H20O4/c1-11(15)3-2-4-13(16)12-5-7-14(8-6-12)17-9-10-18-14/h5H,2-4,6-10H2,1H3","WVSAPRNKVNYSSY-UHFFFAOYSA-N"
"COC(=O)C(C(C)2)(C31)C(CC3)C(C(=O)C2)C1","InChI=1S/C13H18O3/c1-7-5-11(14)9-6-8-3-4-10(9)13(7,8)12(15)16-2/h7-10H,3-6H2,1-2H3","JSOADSOCTCJGRD-UHFFFAOYSA-N"
"CCOC(C)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C12H26OSi/c1-8-13-11(4)12(10(2)3)9-14(5,6)7/h11-12H,2,8-9H2,1,3-7H3","NDKXMSYUHKEGHT-UHFFFAOYSA-N"
"COC(C)(C)CC(C)=C([H])C[Si](C)(C)C","InChI=1S/C12H26OSi/c1-11(8-9-14(5,6)7)10-12(2,3)13-4/h8H,9-10H2,1-7H3/b11-8-","PQFNAFJLRXIJPE-FLIBITNWSA-N"
"CCCCCCCC(O)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C16H34OSi/c1-7-8-9-10-11-12-16(17)15(14(2)3)13-18(4,5)6/h15-17H,2,7-13H2,1,3-6H3","LHGICPWDLVAOSU-UHFFFAOYSA-N"
"CC(CC(=O)c(c1)cccc1)=C([H])C[Si](C)(C)C","InChI=1S/C15H22OSi/c1-13(10-11-17(2,3)4)12-15(16)14-8-6-5-7-9-14/h5-10H,11-12H2,1-4H3/b13-10-","OISQXWPBMRUWCV-RAXLEYEMSA-N"
"CCC(=O)CC(=C)C(C(=O)CC)C[Si](C)(C)C","InChI=1S/C14H26O2Si/c1-7-12(15)9-11(3)13(14(16)8-2)10-17(4,5)6/h13H,3,7-10H2,1-2,4-6H3","USAZPJUUKKCIBZ-UHFFFAOYSA-N"
"CC(=C)CC[Si](C)(C)C","InChI=1S/C8H18Si/c1-8(2)6-7-9(3,4)5/h1,6-7H2,2-5H3","IBBBOJLWSCGXAH-UHFFFAOYSA-N"
"[H]C(C1)=C(CCC1)CC(C)=C([H])C[Si](C)(C)C","InChI=1S/C14H26Si/c1-13(10-11-15(2,3)4)12-14-8-6-5-7-9-14/h8,10H,5-7,9,11-12H2,1-4H3/b13-10-","HJNBOBDRSLDSEF-RAXLEYEMSA-N"
"C=CC(C)CC(C1)=CCCC1","InChI=1S/C11H18/c1-3-10(2)9-11-7-5-4-6-8-11/h3,7,10H,1,4-6,8-9H2,2H3","QCKZPSCCDVQVIX-UHFFFAOYSA-N"
"CC(=C)C(C[Si](C)(C)C)C(C1)=CCCC1","InChI=1S/C14H26Si/c1-12(2)14(11-15(3,4)5)13-9-7-6-8-10-13/h9,14H,1,6-8,10-11H2,2-5H3","CNSGVONQPNRERJ-UHFFFAOYSA-N"
"CCOC(C)CC(C)(C=C)C(C)OCC","InChI=1S/C13H26O2/c1-7-13(6,12(5)15-9-3)10-11(4)14-8-2/h7,11-12H,1,8-10H2,2-6H3","HSXIKBZFYMJFEI-UHFFFAOYSA-N"
"CC(=C)C(C[Si](C)(C)C)C(O)c(c1)cccc1","InChI=1S/C15H24OSi/c1-12(2)14(11-17(3,4)5)15(16)13-9-7-6-8-10-13/h6-10,14-16H,1,11H2,2-5H3","BHBGGKYGAFELRK-UHFFFAOYSA-N"
"[H]C(C([H])(O)1)=C(C5)C([H])(N(C5)2)C([H])(c(c3)c(cc(O4)c(OC4)3)C2)C([H])(O)1","InChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1","XGVJWXAYKUHDOO-DANNLKNASA-N"
"CC(=O)OC(C=5)C(OC(C)=O)C([H])(c21)C([H])(C45)N(CC4)Cc(cc(O3)c(OC3)c2)1","InChI=1S/C20H21NO6/c1-10(22)26-17-5-12-3-4-21-8-13-6-15-16(25-9-24-15)7-14(13)18(19(12)21)20(17)27-11(2)23/h5-7,17-20H,3-4,8-9H2,1-2H3/t17-,18-,19+,20+/m0/s1","LMZHAKUXAHOCST-VNTMZGSJSA-N"
"OC(CCc(c2)cccc2)CC(=O)C=Cc(c1)cccc1","InChI=1S/C19H20O2/c20-18(13-11-16-7-3-1-4-8-16)15-19(21)14-12-17-9-5-2-6-10-17/h1-11,13,19,21H,12,14-15H2/b13-11+","OUAINJWTDRNZIJ-ACCUITESSA-N"
"COC(C1)(CCCC1)CC(C)=C([H])C[Si](C)(C)C","InChI=1S/C15H30OSi/c1-14(9-12-17(3,4)5)13-15(16-2)10-7-6-8-11-15/h9H,6-8,10-13H2,1-5H3/b14-9-","SLMOZOJRBQRILI-ZROIWOOFSA-N"
"OC(=O)Cc(c1)c(ccc1)C(F)(F)F","InChI=1S/C9H7F3O2/c10-9(11,12)7-4-2-1-3-6(7)5-8(13)14/h1-4H,5H2,(H,13,14)","TYOCDHCKTWANIR-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(cc1)C(F)(F)F","InChI=1S/C9H7F3O2/c10-9(11,12)7-3-1-2-6(4-7)5-8(13)14/h1-4H,5H2,(H,13,14)","BLXXCCIBGGBDHI-UHFFFAOYSA-N"
"OC(=O)Cc(c1)ccc(c1)C(F)(F)F","InChI=1S/C9H7F3O2/c10-9(11,12)7-3-1-6(2-4-7)5-8(13)14/h1-4H,5H2,(H,13,14)","HNORVZDAANCHAY-UHFFFAOYSA-N"
"OC(=O)Cc(c1)c(C)ccc1","InChI=1S/C9H10O2/c1-7-4-2-3-5-8(7)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)","RZWGTXHSYZGXKF-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(C)cc1","InChI=1S/C9H10O2/c1-7-3-2-4-8(5-7)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)","GJMPSRSMBJLKKB-UHFFFAOYSA-N"
"COc(c1)ccc(c1)CC(O)=O","InChI=1S/C9H10O3/c1-12-8-4-2-7(3-5-8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)","NRPFNQUDKRYCNX-UHFFFAOYSA-N"
"OC(=O)CCc(c1)ccc(Cl)c1","InChI=1S/C9H9ClO2/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5H,3,6H2,(H,11,12)","BBSLOKZINKEUCR-UHFFFAOYSA-N"
"COc(c1)ccc(CCC(O)=O)c1","InChI=1S/C10H12O3/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-3,5-6H,4,7H2,1H3,(H,11,12)","FIUFLISGGHNPSM-UHFFFAOYSA-N"
"OCC(C(O)=O)c(c1)cccc1","InChI=1S/C9H10O3/c10-6-8(9(11)12)7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)","JACRWUWPXAESPB-UHFFFAOYSA-N"
"OC(=O)C([H])(O)Cc(c1)cccc1","InChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m0/s1","VOXXWSYKYCBWHO-QMMMGPOBSA-N"
"OC(=O)C(=Cc(c2)cccc2)c(c1)cccc1","InChI=1S/C15H12O2/c16-15(17)14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-11H,(H,16,17)/b14-11+","BIDDLDNGQCUOJQ-SDNWHVSQSA-N"
"OC(=O)CCCc(c1)cccc1","InChI=1S/C10H12O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,11,12)","OBKXEAXTFZPCHS-UHFFFAOYSA-N"
"COc(c1)ccc(CCCC(O)=O)c1","InChI=1S/C11H14O3/c1-14-10-7-5-9(6-8-10)3-2-4-11(12)13/h5-8H,2-4H2,1H3,(H,12,13)","LZHMNCJMXQKSBY-UHFFFAOYSA-N"
"OC(=O)CC(C)c(c1)cccc1","InChI=1S/C10H12O2/c1-8(7-10(11)12)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H,11,12)","ZZEWMYILWXCRHZ-UHFFFAOYSA-N"
"OC(=O)CCCCc(c1)cccc1","InChI=1S/C11H14O2/c12-11(13)9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2,(H,12,13)","BYHDDXPKOZIZRV-UHFFFAOYSA-N"
"OC(=O)C(Cc(c2)cccc2)c(c1)cccc1","InChI=1S/C15H14O2/c16-15(17)14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H,16,17)","PCRICPYPVZKEBZ-UHFFFAOYSA-N"
"OC(=O)CC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H14O2/c16-15(17)11-14(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,14H,11H2,(H,16,17)","BZQGAPWJKAYCHR-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C)(C(O)=O)c(c1)cccc1","InChI=1S/C15H14O2/c1-15(14(16)17,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11H,1H3,(H,16,17)","ODELFXJUOVNEFZ-UHFFFAOYSA-N"
"OC(=O)CC(c21)c(c3)c(ccc3)c(cccc2)1","InChI=1S/C15H12O2/c16-15(17)9-14-12-7-3-1-5-10(12)11-6-2-4-8-13(11)14/h1-8,14H,9H2,(H,16,17)","WFSMJMTYIMFHPV-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(CCC(O)=O)c1","InChI=1S/C11H14O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3,5,7H,4,6H2,1-2H3,(H,12,13)","LHHKQWQTBCTDQM-UHFFFAOYSA-N"
"O=C(C1)Nc(c2)c(ccc2)1","InChI=1S/C8H7NO/c10-8-5-6-3-1-2-4-7(6)9-8/h1-4H,5H2,(H,9,10)","JYGFTBXVXVMTGB-UHFFFAOYSA-N"
"O=C(C=1)NC=NC1","InChI=1S/C4H4N2O/c7-4-1-2-5-3-6-4/h1-3H,(H,5,6,7)","DNCYBUMDUBHIJZ-UHFFFAOYSA-N"
"O=C(C1)NCC1","InChI=1S/C4H7NO/c6-4-2-1-3-5-4/h1-3H2,(H,5,6)","HNJBEVLQSNELDL-UHFFFAOYSA-N"
"C1=CC(=O)NC1=O","InChI=1S/C4H3NO2/c6-3-1-2-4(7)5-3/h1-2H,(H,5,6,7)","PEEHTFAAVSWFBL-UHFFFAOYSA-N"
"O=C(N1)OCC1","InChI=1S/C3H5NO2/c5-3-4-1-2-6-3/h1-2H2,(H,4,5)","IZXIZTKNFFYFOF-UHFFFAOYSA-N"
"O=C(C1)NC(=O)N(C)1","InChI=1S/C4H6N2O2/c1-6-2-3(7)5-4(6)8/h2H2,1H3,(H,5,7,8)","RHYBFKMFHLPQPH-UHFFFAOYSA-N"
"O=C(C1)NC(=O)S1","InChI=1S/C3H3NO2S/c5-2-1-7-3(6)4-2/h1H2,(H,4,5,6)","ZOBPZXTWZATXDG-UHFFFAOYSA-N"
"O=C(C1)NCCCCC1","InChI=1S/C7H13NO/c9-7-5-3-1-2-4-6-8-7/h1-6H2,(H,8,9)","CJYXCQLOZNIMFP-UHFFFAOYSA-N"
"O=C(C1)NCCCCCC1","InChI=1S/C8H15NO/c10-8-6-4-2-1-3-5-7-9-8/h1-7H2,(H,9,10)","YDLSUFFXJYEVHW-UHFFFAOYSA-N"
"COc(c1)c(Cl)cc(OC)c(Cl)1","InChI=1S/C8H8Cl2O2/c1-11-7-3-6(10)8(12-2)4-5(7)9/h3-4H,1-2H3","PFIADAMVCJPXSF-UHFFFAOYSA-N"
"CNC(=O)Oc(c1)c(ccc1)OC(C)C","InChI=1S/C11H15NO3/c1-8(2)14-9-6-4-5-7-10(9)15-11(13)12-3/h4-8H,1-3H3,(H,12,13)","ISRUGXGCCGIOQO-UHFFFAOYSA-N"
"CCCCN(CC)c(c([N+1]([O-1])=O)1)c([N+1]([O-1])=O)cc(c1)C(F)(F)F","InChI=1S/C13H16F3N3O4/c1-3-5-6-17(4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3","SMDHCQAYESWHAE-UHFFFAOYSA-N"
"CCNc(n1)nc(NC(C)C)nc(Cl)1","InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)","MXWJVTOOROXGIU-UHFFFAOYSA-N"
"N#Cc(c(Cl)1)c(Cl)c(Cl)c(Cl)c(C#N)1","InChI=1S/C8Cl4N2/c9-5-3(1-13)6(10)8(12)7(11)4(5)2-14","CRQQGFGUEAVUIL-UHFFFAOYSA-N"
"Cc(c1)cc(Cl)c(c(Cl)1)OP(=S)(OC)OC","InChI=1S/C9H11Cl2O3PS/c1-6-4-7(10)9(8(11)5-6)14-15(16,12-2)13-3/h4-5H,1-3H3","OBZIQQJJIKNWNO-UHFFFAOYSA-N"
"CC(=O)c(c(C)1)c(C)c([N+1]([O-1])=O)c(C(C)(C)C)c([N+1]([O-1])=O)1","InChI=1S/C14H18N2O5/c1-7-10(9(3)17)8(2)13(16(20)21)11(14(4,5)6)12(7)15(18)19/h1-6H3","WXCMHFPAUCOJIG-UHFFFAOYSA-N"
"CCOc(s1)nc(n1)C(Cl)(Cl)Cl","InChI=1S/C5H5Cl3N2OS/c1-2-11-4-9-3(10-12-4)5(6,7)8/h2H2,1H3","KQTVWCSONPJJPE-UHFFFAOYSA-N"
"CNC(=O)C([H])=C(C)OP(=O)(OC)OC","InChI=1S/C7H14NO5P/c1-6(5-7(9)8-2)13-14(10,11-3)12-4/h5H,1-4H3,(H,8,9)/b6-5+","KRTSDMXIXPKRQR-AATRIKPKSA-N"
"CCNc(n1)nc(Cl)nc(NCC)1","InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)","ODCWYMIRDDJXKW-UHFFFAOYSA-N"
"C#CC(C)(C)NC(=O)c(c1)cc(Cl)cc(Cl)1","InChI=1S/C12H11Cl2NO/c1-4-12(2,3)15-11(16)8-5-9(13)7-10(14)6-8/h1,5-7H,2-3H3,(H,15,16)","PHNUZKMIPFFYSO-UHFFFAOYSA-N"
"CCOP(=S)(OCC)Oc(c1)nc(C(C)C)nc(C)1","InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3","FHIVAFMUCKRCQO-UHFFFAOYSA-N"
"CCSCCSP(=S)(OCC)OCC","InChI=1S/C8H19O2PS3/c1-4-9-11(12,10-5-2)14-8-7-13-6-3/h4-8H2,1-3H3","DOFZAZXDOSGAJZ-UHFFFAOYSA-N"
"CCOP(=S)(OCC)Oc(n1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3","SBPBAQFWLVIOKP-UHFFFAOYSA-N"
"CCC(CC)Nc(c([N+1]([O-1])=O)1)c([N+1]([O-1])=O)c(C)c(C)c1","InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3","CHIFOSRWCNZCFN-UHFFFAOYSA-N"
"CCOC(=O)C(c(c1)cccc1)SP(=S)(OC)OC","InChI=1S/C12H17O4PS2/c1-4-16-12(13)11(10-8-6-5-7-9-10)19-17(18,14-2)15-3/h5-9,11H,4H2,1-3H3","XAMUDJHXFNRLCY-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C(=O)OC(C)C)=C(S1)SCC1","InChI=1S/C12H18O4S2/c1-7(2)15-10(13)9(11(14)16-8(3)4)12-17-5-6-18-12/h7-8H,5-6H2,1-4H3","UFHLMYOGRXOCSL-UHFFFAOYSA-N"
"CCOP(=S)(OCC)Oc(n2)cc(o2)c(c1)cccc1","InChI=1S/C13H16NO4PS/c1-3-15-19(20,16-4-2)18-13-10-12(17-14-13)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3","SDMSCIWHRZJSRN-UHFFFAOYSA-N"
"[O-1][S+1](O3)OCC(C(C3)1)C(Cl)(C(Cl)=2)C(Cl)(Cl)C(Cl)(C(Cl)2)1","InChI=1S/C9H6Cl6O3S/c10-5-6(11)8(13)4-2-18-19(16)17-1-3(4)7(5,12)9(8,14)15/h3-4H,1-2H2","RDYMFSUJUZBWLH-UHFFFAOYSA-N"
"O=CC(Cl)(Cl)Cl","InChI=1S/C2HCl3O/c3-2(4,5)1-6/h1H","HFFLGKNGCAIQMO-UHFFFAOYSA-N"
"COC(=O)C(Cl)Cl","InChI=1S/C3H4Cl2O2/c1-7-3(6)2(4)5/h2H,1H3","HKMLRUAPIDAGIE-UHFFFAOYSA-N"
"COC(=O)C(Cl)(Cl)Cl","InChI=1S/C3H3Cl3O2/c1-8-2(7)3(4,5)6/h1H3","VHFUHRXYRYWELT-UHFFFAOYSA-N"
"COC(=O)CI","InChI=1S/C3H5IO2/c1-6-3(5)2-4/h2H2,1H3","YDGMIJCIBXSCQR-UHFFFAOYSA-N"
"NNc(c1)c([N+1]([O-1])=O)cc(c1)[N+1]([O-1])=O","InChI=1S/C6H6N4O4/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14/h1-3,8H,7H2","HORQAOAYAYGIBM-UHFFFAOYSA-N"
"O=CC([H])=C([H])c(c1)ccc(N(C)C)c1","InChI=1S/C11H13NO/c1-12(2)11-7-5-10(6-8-11)4-3-9-13/h3-9H,1-2H3/b4-3+","RUKJCCIJLIMGEP-ONEGZZNKSA-N"
"COc(c1)c(ccc1)C=CC(O)=O","InChI=1S/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-6+","FEGVSPGUHMGGBO-VOTSOKGWSA-N"
"COc(c1)c(ccc1)C=CC(O)=O","InChI=1S/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)/b7-6-","FEGVSPGUHMGGBO-SREVYHEPSA-N"
"O=C(C1)N(Br)C(=O)C1","InChI=1S/C4H4BrNO2/c5-6-3(7)1-2-4(6)8/h1-2H2","PCLIMKBDDGJMGD-UHFFFAOYSA-N"
"OC(=O)c(c2)ccc(c2)c(c1)cccc1","InChI=1S/C13H10O2/c14-13(15)12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H,(H,14,15)","NNJMFJSKMRYHSR-UHFFFAOYSA-N"
"O=Cc(c1)ccc(c1)C(O)=O","InChI=1S/C8H6O3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-5H,(H,10,11)","GOUHYARYYWKXHS-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(=O)Cl","InChI=1S/C8H7ClO2/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3","MXMOTZIXVICDSD-UHFFFAOYSA-N"
"COc(c1)c(F)ccc1","InChI=1S/C7H7FO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3","JIXDOBAQOWOUPA-UHFFFAOYSA-N"
"COc(c1)cc(F)cc1","InChI=1S/C7H7FO/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3","MFJNOXOAIFNSBX-UHFFFAOYSA-N"
"COc(c1)ccc(F)c1","InChI=1S/C7H7FO/c1-9-7-4-2-6(8)3-5-7/h2-5H,1H3","VIPWUFMFHBIKQI-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(=O)F","InChI=1S/C8H7FO2/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3","YVFLMEGQPCRTTO-UHFFFAOYSA-N"
"OC(=O)c(c1)c(ccc1)C(O)=O","InChI=1S/C8H6O4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)(H,11,12)","XNGIFLGASWRNHJ-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(cc1)C(O)=O","InChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)","QQVIHTHCMHWDBS-UHFFFAOYSA-N"
"Nc(c1)c(O)ccc1","InChI=1S/C6H7NO/c7-5-3-1-2-4-6(5)8/h1-4,8H,7H2","CDAWCLOXVUBKRW-UHFFFAOYSA-N"
"O=C(c21)c(c3)c(ccc3)Cc(cccc2)1","InChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-8H,9H2","RJGDLRCDCYRQOQ-UHFFFAOYSA-N"
"COC(OC)(OC)OC","InChI=1S/C5H12O4/c1-6-5(7-2,8-3)9-4/h1-4H3","AHJWSRRHTXRLAQ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(cc([N+1]([O-1])=O)1)C(=O)Cl","InChI=1S/C7H3ClN2O5/c8-7(11)4-1-5(9(12)13)3-6(2-4)10(14)15/h1-3H","NNOHXABAQAGKRZ-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c2)c(ccc2)c(c1)cccc1","InChI=1S/C18H14/c1-3-9-15(10-4-1)17-13-7-8-14-18(17)16-11-5-2-6-12-16/h1-14H","OIAQMFOKAXHPNH-UHFFFAOYSA-N"
"CCCOC(=O)CC(C)=O","InChI=1S/C7H12O3/c1-3-4-10-7(9)5-6(2)8/h3-5H2,1-2H3","DHGFMVMDBNLMKT-UHFFFAOYSA-N"
"CCOC(C)(OCC)OCC","InChI=1S/C8H18O3/c1-5-9-8(4,10-6-2)11-7-3/h5-7H2,1-4H3","NDQXKKFRNOPRDW-UHFFFAOYSA-N"
"CCN(C)C","InChI=1S/C4H11N/c1-4-5(2)3/h4H2,1-3H3","DAZXVJBJRMWXJP-UHFFFAOYSA-N"
"COc(c1)c(ccc1)C(C)O","InChI=1S/C9H12O2/c1-7(10)8-5-3-4-6-9(8)11-2/h3-7,10H,1-2H3","DHHGVIOVURMJEA-UHFFFAOYSA-N"
"CC=CCN(C(=O)CC)C(C1)c(c2)c(ccc2)C1","InChI=1S/C16H21NO/c1-3-5-12-17(16(18)4-2)15-11-10-13-8-6-7-9-14(13)15/h3,5-9,15H,4,10-12H2,1-2H3/b5-3+","CVWJSMCYKDJAJB-HWKANZROSA-N"
"CCC(=O)NC(C1)c(c2)c(ccc2)C1","InChI=1S/C12H15NO/c1-2-12(14)13-11-8-7-9-5-3-4-6-10(9)11/h3-6,11H,2,7-8H2,1H3,(H,13,14)","RZBLQFKQMMGHSQ-UHFFFAOYSA-N"
"CC=CCN(C(=O)CC)C(C(C)C)c(c1)cccc1","InChI=1S/C17H25NO/c1-5-7-13-18(16(19)6-2)17(14(3)4)15-11-9-8-10-12-15/h5,7-12,14,17H,6,13H2,1-4H3/b7-5+","ROGCCZKTCDZFOA-FNORWQNLSA-N"
"CCC(=O)NC(C(C)C)c(c1)cccc1","InChI=1S/C13H19NO/c1-4-12(15)14-13(10(2)3)11-8-6-5-7-9-11/h5-10,13H,4H2,1-3H3,(H,14,15)","YKBKVAVBYPIHRS-UHFFFAOYSA-N"
"CC(C)C(O)c(c1)cccc1","InChI=1S/C10H14O/c1-8(2)10(11)9-6-4-3-5-7-9/h3-8,10-11H,1-2H3","GMDYDZMQHRTHJA-UHFFFAOYSA-N"
"CC=CCN(C(=O)CC)C(CC)c(c1)cccc1","InChI=1S/C16H23NO/c1-4-7-13-17(16(18)6-3)15(5-2)14-11-9-8-10-12-14/h4,7-12,15H,5-6,13H2,1-3H3/b7-4+","KIROBTRQJHPXKH-QPJJXVBHSA-N"
"CCC(=O)NC(CC)c(c1)cccc1","InChI=1S/C12H17NO/c1-3-11(13-12(14)4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3,(H,13,14)","WOJZOOBUQTUMCT-UHFFFAOYSA-N"
"CCCCN(C(=O)C(C)C(C)C=C)C(=O)C(C)(C)COC(C)=O","InChI=1S/C18H31NO4/c1-8-10-11-19(16(21)14(4)13(3)9-2)17(22)18(6,7)12-23-15(5)20/h9,13-14H,2,8,10-12H2,1,3-7H3","QYDLGJPYMBVRDX-UHFFFAOYSA-N"
"OCC(C)(C)C(=O)NC([H])(C)c(c1)cccc1","InChI=1S/C13H19NO2/c1-10(11-7-5-4-6-8-11)14-12(16)13(2,3)9-15/h4-8,10,15H,9H2,1-3H3,(H,14,16)/t10-/m0/s1","AAQLUNZDLHDEQI-JTQLQIEISA-N"
"CC(=O)OCC(C)(C)C(=O)NC([H])(C)c(c1)cccc1","InChI=1S/C15H21NO3/c1-11(13-8-6-5-7-9-13)16-14(18)15(3,4)10-19-12(2)17/h5-9,11H,10H2,1-4H3,(H,16,18)/t11-/m0/s1","IIBGRZRPCJEHAI-NSHDSACASA-N"
"c(c2)ccc(c2)CNC(=O)C(C)(C)COC(=O)C(C1)CCCC1","InChI=1S/C19H27NO3/c1-19(2,14-23-17(21)16-11-7-4-8-12-16)18(22)20-13-15-9-5-3-6-10-15/h3,5-6,9-10,16H,4,7-8,11-14H2,1-2H3,(H,20,22)","AVZVCRIZNLQGRH-UHFFFAOYSA-N"
"CCCCN(CC=CC)C(=O)CO","InChI=1S/C10H19NO2/c1-3-5-7-11(8-6-4-2)10(13)9-12/h3,5,12H,4,6-9H2,1-2H3/b5-3+","YFPSYPMBCRPWDE-HWKANZROSA-N"
"CCC(=O)NC([H])(CO)c(c1)cccc1","InChI=1S/C11H15NO2/c1-2-11(14)12-10(8-13)9-6-4-3-5-7-9/h3-7,10,13H,2,8H2,1H3,(H,12,14)/t10-/m0/s1","BJDIBEQXCYQUMH-JTQLQIEISA-N"
"C=CC(C)C(C)C(=O)NC(C)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C19H23NO/c1-5-13(2)14(3)19(21)20-15(4)17-12-8-10-16-9-6-7-11-18(16)17/h5-15H,1H2,2-4H3,(H,20,21)","ISOGBRSHGNBMFT-UHFFFAOYSA-N"
"C=CC(C)c(c1)c(O)ccc1","InChI=1S/C10H12O/c1-3-8(2)9-6-4-5-7-10(9)11/h3-8,11H,1H2,2H3","KXVJXEPOPKSHOJ-UHFFFAOYSA-N"
"OCC(O)C(O)C(O)C(O)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5-,6-/m1/s1","FBPFZTCFMRRESA-KVTDHHQDSA-N"
"[O-1][N+1](=Nc(c2)cccc2)c(c1)cccc1","InChI=1S/C12H10N2O/c15-14(12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10H/b14-13+","GAUZCKBSTZFWCT-BUHFOSPRSA-N"
"COc(c2)ccc(c2)N=[N+1]([O-1])c(c1)ccc(OC)c1","InChI=1S/C14H14N2O3/c1-18-13-7-3-11(4-8-13)15-16(17)12-5-9-14(19-2)10-6-12/h3-10H,1-2H3/b16-15+","KAEZRSFWWCTVNP-FOCLMDBBSA-N"
"[O-1][n+1](o1)c(c2)c(ccc2)n1","InChI=1S/C6H4N2O2/c9-8-6-4-2-1-3-5(6)7-10-8/h1-4H","OKEAMBAZBICIFP-UHFFFAOYSA-N"
"CCCC(C)Br","InChI=1S/C5H11Br/c1-3-4-5(2)6/h5H,3-4H2,1-2H3","LGAJYTCRJPCZRJ-UHFFFAOYSA-N"
"c(c3)cc(C1)c(c3)Oc(c2)c(ccc2)1","InChI=1S/C13H10O/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8H,9H2","GJCOSYZMQJWQCA-UHFFFAOYSA-N"
"COC(=O)c(c(C)1)c(OC)c(C)c(O)c(C)1","InChI=1S/C12H16O4/c1-6-7(2)10(13)8(3)11(15-4)9(6)12(14)16-5/h13H,1-5H3","UCGSEFPFVKCJLI-UHFFFAOYSA-N"
"CN(C)C(=O)Nc(n1)cc(o1)C(C)(C)C","InChI=1S/C10H17N3O2/c1-10(2,3)7-6-8(12-15-7)11-9(14)13(4)5/h6H,1-5H3,(H,11,12,14)","JLLJHQLUZAKJFH-UHFFFAOYSA-N"
"ClCCBr","InChI=1S/C2H4BrCl/c3-1-2-4/h1-2H2","IBYHHJPAARCAIE-UHFFFAOYSA-N"
"CC(=O)Nc(c1)cccc1","InChI=1S/C8H9NO/c1-7(10)9-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10)","FZERHIULMFGESH-UHFFFAOYSA-N"
"Oc(c3)cc(c(=O)1)c(c3)c(=O)c(c2)c(ccc(O)2)1","InChI=1S/C14H8O4/c15-7-1-3-9-11(5-7)14(18)10-4-2-8(16)6-12(10)13(9)17/h1-6,15-16H","APAJFZPFBHMFQR-UHFFFAOYSA-N"
"c(c2)cnc(c2)SSc(c1)nccc1","InChI=1S/C10H8N2S2/c1-3-7-11-9(5-1)13-14-10-6-2-4-8-12-10/h1-8H","HAXFWIACAGNFHA-UHFFFAOYSA-N"
"N#Cc(c1)ccc(c1)C(C)=O","InChI=1S/C9H7NO/c1-7(11)9-4-2-8(6-10)3-5-9/h2-5H,1H3","NLPHXWGWBKZSJC-UHFFFAOYSA-N"
"OC(=O)c(c2)ccc(c2)N=[N+1]([O-1])c(c1)ccc(C(O)=O)c1","InChI=1S/C14H10N2O5/c17-13(18)9-1-5-11(6-2-9)15-16(21)12-7-3-10(4-8-12)14(19)20/h1-8H,(H,17,18)(H,19,20)/b16-15+","ZYVHVGJGLOEEKD-FOCLMDBBSA-N"
"CCOc(c2)ccc(c2)N=[N+1]([O-1])c(c1)ccc(OCC)c1","InChI=1S/C16H18N2O3/c1-3-20-15-9-5-13(6-10-15)17-18(19)14-7-11-16(12-8-14)21-4-2/h5-12H,3-4H2,1-2H3/b18-17+","QUICZVHSJNKDBL-ISLYRVAYSA-N"
"[O-1][N+1](=O)c(c1)cc(c2)c(ncc2)c1","InChI=1S/C9H6N2O2/c12-11(13)8-3-4-9-7(6-8)2-1-5-10-9/h1-6H","SMHPLBXIVNQFBA-UHFFFAOYSA-N"
"Cc(c1)cc(O)c(c1)C(C)(C)C","InChI=1S/C11H16O/c1-8-5-6-9(10(12)7-8)11(2,3)4/h5-7,12H,1-4H3","XOUQAVYLRNOXDO-UHFFFAOYSA-N"
"[H]c(c([H])1)c(C)n(C)c(C)1","InChI=1S/C7H11N/c1-6-4-5-7(2)8(6)3/h4-5H,1-3H3","YRABRACUKBOTKB-UHFFFAOYSA-N"
"Cc(n1)oc(c2)c(ccc2)1","InChI=1S/C8H7NO/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,1H3","DQSHFKPKFISSNM-UHFFFAOYSA-N"
"NNC(=O)c(c1)c(O)ccc(O)1","InChI=1S/C7H8N2O3/c8-9-7(12)5-3-4(10)1-2-6(5)11/h1-3,10-11H,8H2,(H,9,12)","BLXGSJAZCDGAEF-UHFFFAOYSA-N"
"c(c2)ccc(c2)CCc(c1)cccc1","InChI=1S/C14H14/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-10H,11-12H2","QWUWMCYKGHVNAV-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(c1)[N+1]([O-1])=O","InChI=1S/C8H9NO4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3","YFWBUVZWCBFSQN-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(c1)[N+1]([O-1])=O","InChI=1S/C8H9NO4/c1-12-6-3-4-7(9(10)11)8(5-6)13-2/h3-5H,1-2H3","XXWIYOBCHKCWNT-UHFFFAOYSA-N"
"COC(=O)c(c(C)1)c(O)c(C)c(O)c(C)1","InChI=1S/C11H14O4/c1-5-6(2)9(12)7(3)10(13)8(5)11(14)15-4/h12-13H,1-4H3","DMSHNIHYQFQGGG-UHFFFAOYSA-N"
"CC1=CC2=C(N1)C=CC(=C2)OC","InChI=1S/C10H11NO/c1-7-5-8-6-9(12-2)3-4-10(8)11-7/h3-6,11H,1-2H3","VSWGLJOQFUMFOQ-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(C(C)=O)c1","InChI=1S/C10H12O3/c1-7(11)9-5-4-8(12-2)6-10(9)13-3/h4-6H,1-3H3","VQTDPCRSXHFMOL-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)CC","InChI=1S/C18H36O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)4-2/h3-17H2,1-2H3","LMCGARAPKXJPNG-UHFFFAOYSA-N"
"C=C(C1)CCCC1","InChI=1S/C7H12/c1-7-5-3-2-4-6-7/h1-6H2","YULMNMJFAZWLLN-UHFFFAOYSA-N"
"O=C(Nc(c2)cccc2)Nc(c1)cccc1","InChI=1S/C13H12N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)","GWEHVDNNLFDJLR-UHFFFAOYSA-N"
"Oc(n2)c(ncc2)c(c1)cccc1","InChI=1S/C10H8N2O/c13-10-9(11-6-7-12-10)8-4-2-1-3-5-8/h1-7H,(H,12,13)","SYPKOIOSVWYKHO-UHFFFAOYSA-N"
"NC(=O)Nc(n1)cc(o1)C(C)(C)C","InChI=1S/C8H13N3O2/c1-8(2,3)5-4-6(11-13-5)10-7(9)12/h4H,1-3H3,(H3,9,10,11,12)","PMXLTKAKSSLLDX-UHFFFAOYSA-N"
"COC(=O)C(=O)C(Br)Br","InChI=1S/C4H4Br2O3/c1-9-4(8)2(7)3(5)6/h3H,1H3","BBEUKZFDZWGLQL-UHFFFAOYSA-N"
"O=C(N1)SC=C1","InChI=1S/C3H3NOS/c5-3-4-1-2-6-3/h1-2H,(H,4,5)","CZWWCTHQXBMHDA-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)cc(Cc(c2)c(N)nc(N)n2)1","InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)","IEDVJHCEMCRBQM-UHFFFAOYSA-N"
"COC(=O)C(=O)C(Cl)Cl","InChI=1S/C4H4Cl2O3/c1-9-4(8)2(7)3(5)6/h3H,1H3","UKGAJIPDOCPNDX-UHFFFAOYSA-N"
"CCOP(=S)(OCC)SCN(C(=O)1)c(c2)c(cc(Cl)c2)O1","InChI=1S/C12H15ClNO4PS2/c1-3-16-19(20,17-4-2)21-8-14-10-6-5-9(13)7-11(10)18-12(14)15/h5-7H,3-4,8H2,1-2H3","IOUNQDKNJZEDEP-UHFFFAOYSA-N"
"CCNC(N1)=NC(NCC)=NC(=O)1","InChI=1S/C7H13N5O/c1-3-8-5-10-6(9-4-2)12-7(13)11-5/h3-4H2,1-2H3,(H3,8,9,10,11,12,13)","YQIXRXMOJFQVBV-UHFFFAOYSA-N"
"O=Cc(c1)cc(C(C)(C)C)c(O)c1C(C)(C)C","InChI=1S/C15H22O2/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-9,17H,1-6H3","DOZRDZLFLOODMB-UHFFFAOYSA-N"
"N#Cc(c1)cc(C(C)(C)C)c(O)c1C(C)(C)C","InChI=1S/C15H21NO/c1-14(2,3)11-7-10(9-16)8-12(13(11)17)15(4,5)6/h7-8,17H,1-6H3","AKXIIOLURNATOC-UHFFFAOYSA-N"
"COC(=O)c(c(C)1)c(O)c(C)c(O)c1","InChI=1S/C10H12O4/c1-5-4-7(11)6(2)9(12)8(5)10(13)14-3/h4,11-12H,1-3H3","UUQHKWMIDYRWHH-UHFFFAOYSA-N"
"COc(c1)cc(N)c(N)c1","InChI=1S/C7H10N2O/c1-10-5-2-3-6(8)7(9)4-5/h2-4H,8-9H2,1H3","AGAHETWGCFCMDK-UHFFFAOYSA-N"
"CCOC(=O)c(c1)c(O)c(C)cc1","InChI=1S/C10H12O3/c1-3-13-10(12)8-6-4-5-7(2)9(8)11/h4-6,11H,3H2,1-2H3","NSRLIMVWJNHWJW-UHFFFAOYSA-N"
"Cc(c1)cc(C)c(n1)[N+1]([O-1])=O","InChI=1S/C7H8N2O2/c1-5-3-6(2)7(8-4-5)9(10)11/h3-4H,1-2H3","AVLLRPYTPHITGW-UHFFFAOYSA-N"
"CN(C)c(c1)cc(cc1)C(O)=O","InChI=1S/C9H11NO2/c1-10(2)8-5-3-4-7(6-8)9(11)12/h3-6H,1-2H3,(H,11,12)","NEGFNJRAUMCZMY-UHFFFAOYSA-N"
"CN(C)c(c1)ccc(c1)C(O)=O","InChI=1S/C9H11NO2/c1-10(2)8-5-3-7(4-6-8)9(11)12/h3-6H,1-2H3,(H,11,12)","YDIYEOMDOWUDTJ-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(C=CC(O)=O)c1","InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)10(7-9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+","YIKHDPHTFYWYJV-GQCTYLIASA-N"
"Cc(n1)oc(c2)c1cc(C)c(C)2","InChI=1S/C10H11NO/c1-6-4-9-10(5-7(6)2)12-8(3)11-9/h4-5H,1-3H3","PDVDINPEWGXOHX-UHFFFAOYSA-N"
"Cc(c1)c(C)c(N)c(C)c(C)1","InChI=1S/C10H15N/c1-6-5-7(2)9(4)10(11)8(6)3/h5H,11H2,1-4H3","ZCZPJZYQBNOPLT-UHFFFAOYSA-N"
"Cc(c1)c(C)c(C)c(C)c(N)1","InChI=1S/C10H15N/c1-6-5-10(11)9(4)8(3)7(6)2/h5H,11H2,1-4H3","JUNBHJRQUYYYBX-UHFFFAOYSA-N"
"COCC(C2)(C([H])71)C(CC(OC)C(C([H])63)(C(C([H])(C7OC)C(C64[H])(OC(C)=O)C(O)C(C(O)(C(OC(=O)c(c5)cccc5)4)C3)OC)N(C)2)1)O","InChI=1S/C33H45NO11/c1-16(35)45-33-21-18(13-31(39,28(43-6)26(33)37)27(21)44-29(38)17-10-8-7-9-11-17)32-20(41-4)12-19(36)30(15-40-3)14-34(2)25(32)22(33)23(42-5)24(30)32/h7-11,18-28,36-37,39H,12-15H2,1-6H3/t18-,19-,20+,21-,22+,23+,24-,25-,26+,27-,28+,30+,31-,32+,33-/m1/s1","XUHJBXVYNBQQBD-GQPWXMLZSA-N"
"N#CCC(O)c(c1)ccc(C)c1","InChI=1S/C10H11NO/c1-8-2-4-9(5-3-8)10(12)6-7-11/h2-5,10,12H,6H2,1H3","HTMRHSQTWGSYKW-UHFFFAOYSA-N"
"N#CCC(O)c(c1)ccc(OC)c1","InChI=1S/C10H11NO2/c1-13-9-4-2-8(3-5-9)10(12)6-7-11/h2-5,10,12H,6H2,1H3","HQMWYPRJRGJPJV-UHFFFAOYSA-N"
"N#CCC(O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C9H8N2O3/c10-6-5-9(12)7-1-3-8(4-2-7)11(13)14/h1-4,9,12H,5H2","HJMGPNYFZRPELU-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(Cl)no1","InChI=1S/C3HClN2O3/c4-3-2(6(7)8)1-9-5-3/h1H","NQLCWYZQXQDQGZ-UHFFFAOYSA-N"
"CSC1=C(NC2=CC=CC=C21)CO","InChI=1S/C10H11NOS/c1-13-10-7-4-2-3-5-8(7)11-9(10)6-12/h2-5,11-12H,6H2,1H3","JRAOFUGUXXJWOW-UHFFFAOYSA-N"
"OCc(c1)c(O)ccc(Cl)1","InChI=1S/C7H7ClO2/c8-6-1-2-7(10)5(3-6)4-9/h1-3,9-10H,4H2","AFPSETMCMFRVPG-UHFFFAOYSA-N"
"CCCCCc(n1)cc(N)o1","InChI=1S/C8H14N2O/c1-2-3-4-5-7-6-8(9)11-10-7/h6H,2-5,9H2,1H3","SWUFZCKNJXQAAH-UHFFFAOYSA-N"
"CCCCCc(o1)cc(N)n1","InChI=1S/C8H14N2O/c1-2-3-4-5-7-6-8(9)10-11-7/h6H,2-5H2,1H3,(H2,9,10)","OUYAUCZSSFLZIX-UHFFFAOYSA-N"
"Nc(n1)cc(o1)C(C)(C)C","InChI=1S/C7H12N2O/c1-7(2,3)5-4-6(8)9-10-5/h4H,1-3H3,(H2,8,9)","GGXGVZJHUKEJHO-UHFFFAOYSA-N"
"CC(=O)Nc(c(C)1)c(C)c(C)cc(C)1","InChI=1S/C12H17NO/c1-7-6-8(2)10(4)12(9(7)3)13-11(5)14/h6H,1-5H3,(H,13,14)","KXMBEFKNGACUMW-UHFFFAOYSA-N"
"CC(=O)Nc(c1)c(C)c(C)c(C)c(C)1","InChI=1S/C12H17NO/c1-7-6-12(13-11(5)14)10(4)9(3)8(7)2/h6H,1-5H3,(H,13,14)","XVFQGGMVGUEXOX-UHFFFAOYSA-N"
"C=CCOC(=O)C=CC(=O)OCC=C","InChI=1S/C10H12O4/c1-3-7-13-9(11)5-6-10(12)14-8-4-2/h3-6H,1-2,7-8H2/b6-5-","ZPOLOEWJWXZUSP-WAYWQWQTSA-N"
"CCCCC[SiH2]C","InChI=1S/C6H16Si/c1-3-4-5-6-7-2/h3-7H2,1-2H3","SCTSYHSKWVXLNV-UHFFFAOYSA-N"
"[2H]C([2H])([2H])CCCC[Si]([H])([H])C","InChI=1S/C6H16Si/c1-3-4-5-6-7-2/h3-7H2,1-2H3/i1D3","SCTSYHSKWVXLNV-FIBGUPNXSA-N"
"CCCC([2H])([2H])C[SiH2]C","InChI=1S/C6H16Si/c1-3-4-5-6-7-2/h3-7H2,1-2H3/i5D2","SCTSYHSKWVXLNV-BFWBPSQCSA-N"
"CCC[SiH](C)C","InChI=1S/C5H14Si/c1-4-5-6(2)3/h6H,4-5H2,1-3H3","AOJUJJFLGKIMAZ-UHFFFAOYSA-N"
"[2H]CCC[SiH](C)C","InChI=1S/C5H14Si/c1-4-5-6(2)3/h6H,4-5H2,1-3H3/i1D","AOJUJJFLGKIMAZ-MICDWDOJSA-N"
"CCC[Si](C)(C)C","InChI=1S/C6H16Si/c1-5-6-7(2,3)4/h5-6H2,1-4H3","WNWMJFBAIXMNOF-UHFFFAOYSA-N"
"CC(C1)=C([H])CCC(C)=C([H])C([H])(O)C([H])(CCC(C)=C([H])C1)C(C)=C","InChI=1S/C20H32O/c1-15(2)19-13-12-17(4)10-6-8-16(3)9-7-11-18(5)14-20(19)21/h9-10,14,19-21H,1,6-8,11-13H2,2-5H3/b16-9+,17-10+,18-14+/t19-,20-/m1/s1","AZUVBPVDRHGGEP-CHHSKAHISA-N"
"CC(=O)OC(C([H])=1)C(CCC(C)=C([H])CCC(C)=C([H])CCC(C)1)C(C)=C","InChI=1S/C22H34O2/c1-16(2)21-14-13-18(4)11-7-9-17(3)10-8-12-19(5)15-22(21)24-20(6)23/h10-11,15,21-22H,1,7-9,12-14H2,2-6H3/b17-10+,18-11+,19-15+","UQRKPAHSYAVOHS-BBCCYVLPSA-N"
"CC(C1)=C([H])CCC(C)(O)C([H])=C([H])C([H])(CCC(C)=C([H])C1)C(C)C","InChI=1S/C20H34O/c1-16(2)19-12-11-18(4)9-6-8-17(3)10-7-14-20(5,21)15-13-19/h9-10,13,15-16,19,21H,6-8,11-12,14H2,1-5H3/b15-13+,17-10+,18-9+/t19-,20-/m1/s1","YAPXSYXFLHDPCK-NANKYBSHSA-N"
"CC(C1)=C([H])CCC(C)=C([H])C([H])(O)C([H])(CCC(C)=C([H])C1)C(C)C","InChI=1S/C20H34O/c1-15(2)19-13-12-17(4)10-6-8-16(3)9-7-11-18(5)14-20(19)21/h9-10,14-15,19-21H,6-8,11-13H2,1-5H3/b16-9+,17-10+,18-14+/t19-,20+/m0/s1","HVZNIISBCURSMR-ALFIBICVSA-N"
"CC(C1)=C([H])CCC(C)=C([H])CC([H])(CCC(C)=C([H])C1)C(C)=C","InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,20H,1,6-7,9-10,13-15H2,2-5H3/b17-8+,18-12+,19-11+/t20-/m0/s1","VWSPQDDPRITBAM-KPGNMOGWSA-N"
"CC(C1)=C([H])CCC(C)=C([H])CC([H])(CCC(C)=C([H])C1)C(C)C","InChI=1S/C20H34/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,11-12,16,20H,6-7,9-10,13-15H2,1-5H3/b17-8+,18-12+,19-11+/t20-/m1/s1","OKMQTAYLLFRHKE-UYSOGGTPSA-N"
"[H]C(C1)=C(C)CCC([H])(C(C)C)C([H])=C([H])C(C)=C([H])CC([H])=C(C)C1","InChI=1S/C20H32/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,10-12,14,16,20H,6-7,9,13,15H2,1-5H3/b14-12+,17-8+,18-10-,19-11+/t20-/m1/s1","DMHADBQKVWXPPM-JJDAXJIHSA-N"
"[H]C(C1)=C(C)CCC([H])(C(C)=C)C([H])=C([H])C(C)=C([H])CC([H])=C(C)C1","InChI=1S/C20H30/c1-16(2)20-14-12-18(4)10-6-8-17(3)9-7-11-19(5)13-15-20/h8,10-12,14,20H,1,6-7,9,13,15H2,2-5H3/b14-12+,17-8+,18-10-,19-11+/t20-/m1/s1","RLAFZRBJBUMWGN-JJDAXJIHSA-N"
"[H]C(C1)=C(C)CCC([H])=C(C)CC(O)C([H])(C(C)=C)CC([H])=C(C)C1","InChI=1S/C20H32O/c1-15(2)19-13-12-17(4)10-6-8-16(3)9-7-11-18(5)14-20(19)21/h8,11-12,19-21H,1,6-7,9-10,13-14H2,2-5H3/b16-8+,17-12+,18-11+/t19-,20?/m1/s1","HTWXQGABXITTNW-QZNKQHNXSA-N"
"OC(=O)C(C2)=CCCC(C)=CC([H])(O1)C([H])(CCC(C)=CC2)C(=C)C(=O)1","InChI=1S/C20H26O4/c1-13-6-4-8-16(19(21)22)9-5-7-14(2)12-18-17(11-10-13)15(3)20(23)24-18/h6,9,12,17-18H,3-5,7-8,10-11H2,1-2H3,(H,21,22)/b13-6+,14-12+,16-9+/t17-,18-/m0/s1","SORYERHBQFTRIK-AQJYKDKHSA-N"
"OCC(C1)=C([H])CCC(C)=C([H])C([H])(O)C([H])(CCC(C)=C([H])C1)C(C)=CO","InChI=1S/C20H32O3/c1-15-6-4-8-18(14-22)9-5-7-16(2)12-20(23)19(11-10-15)17(3)13-21/h6,9,12-13,19-23H,4-5,7-8,10-11,14H2,1-3H3/b15-6+,16-12+,17-13+,18-9+/t19-,20+/m0/s1","NOLQVIDYFVOCMG-BAOFUKJUSA-N"
"OC(=O)C(C2)=C([H])CCC(C)=C([H])C([H])(O1)C([H])(CCC(C)=C([H])C2)C(=C)C(=O)1","InChI=1S/C20H26O4/c1-13-6-4-8-16(19(21)22)9-5-7-14(2)12-18-17(11-10-13)15(3)20(23)24-18/h6,9,12,17-18H,3-5,7-8,10-11H2,1-2H3,(H,21,22)/b13-6-,14-12+,16-9+/t17-,18-/m0/s1","SORYERHBQFTRIK-JAQFIYPLSA-N"
"COC(=O)C(C3)=CCCC(C)=CC([H])(O1)C([H])(CCC(C)=CC3)C(C2)(N=NC2)C(=O)1","InChI=1S/C22H30N2O4/c1-15-6-4-8-17(20(25)27-3)9-5-7-16(2)14-19-18(11-10-15)22(21(26)28-19)12-13-23-24-22/h6,9,14,18-19H,4-5,7-8,10-13H2,1-3H3/b15-6+,16-14+,17-9+/t18-,19+,22?/m1/s1","JLXRCOCRQNIQSO-AZZZFUBASA-N"
"OCC(=C)C([H])(C1)C([H])(O)C([H])=C(C)CCC([H])=C(C)CCC([H])=C(C)C1","InChI=1S/C20H32O2/c1-15-7-5-9-16(2)11-12-19(18(4)14-21)20(22)13-17(3)10-6-8-15/h8-9,13,19-22H,4-7,10-12,14H2,1-3H3/b15-8+,16-9+,17-13+/t19-,20+/m0/s1","VUIHPHBVTNHHIN-IDCFYYSISA-N"
"OCC(=C)C([H])(C1)C([H])(O)C([H])=C(C)CCC([H])=C(C)CCC([H])=C(C)C1","InChI=1S/C20H32O2/c1-15-7-5-9-16(2)11-12-19(18(4)14-21)20(22)13-17(3)10-6-8-15/h8-9,13,19-22H,4-7,10-12,14H2,1-3H3/b15-8+,16-9-,17-13+/t19-,20-/m0/s1","VUIHPHBVTNHHIN-WUTWRXGKSA-N"
"CC(=O)OCC(=C)C([H])(C1)C([H])(OC(C)=O)C([H])=C(C)CCC([H])=C(C)CCC([H])=C(C)C1","InChI=1S/C24H36O4/c1-17-9-7-11-18(2)13-14-23(20(4)16-27-21(5)25)24(28-22(6)26)15-19(3)12-8-10-17/h10-11,15,23-24H,4,7-9,12-14,16H2,1-3,5-6H3/b17-10+,18-11+,19-15+/t23-,24+/m0/s1","YBPOQSGQBJVMKO-JKQBEOCRSA-N"
"CC(=O)OCC(=C)C([H])(C1)C([H])(OC(C)=O)C([H])=C(C)CCC([H])=C(C)CCC([H])=C(C)C1","InChI=1S/C24H36O4/c1-17-9-7-11-18(2)13-14-23(20(4)16-27-21(5)25)24(28-22(6)26)15-19(3)12-8-10-17/h10-11,15,23-24H,4,7-9,12-14,16H2,1-3,5-6H3/b17-10+,18-11+,19-15+/t23-,24-/m0/s1","YBPOQSGQBJVMKO-QWTXQITRSA-N"
"[H]C(C1)=C(C)CC([H])(O)C([H])=C(C)CCC([H])(C(C)C)C([H])=C([H])C(C)=C([H])1","InChI=1S/C20H32O/c1-15(2)19-11-9-16(3)7-6-8-17(4)13-20(21)14-18(5)10-12-19/h7-9,11,14-15,19-21H,6,10,12-13H2,1-5H3/b11-9+,16-7+,17-8+,18-14+/t19-,20+/m0/s1","UISPGBUXWMMCCP-HLWKUWEHSA-N"
"COC([H])(C1)C([H])=C(C)CCC([H])(C(C)C)C([H])=C([H])C(C)=C([H])CC([H])=C(C)1","InChI=1S/C21H34O/c1-16(2)20-12-10-17(3)8-7-9-18(4)14-21(22-6)15-19(5)11-13-20/h8-10,12,15-16,20-21H,7,11,13-14H2,1-6H3/b12-10+,17-8-,18-9+,19-15+/t20-,21+/m0/s1","SBUSWOSYOAFPAG-LVRFIZCKSA-N"
"CC(C)C(C2)=C([H])C([H])=C(C)CCC(=O)C(C)(C1)OC(=O)C(C2)=C([H])C1","InChI=1S/C20H28O3/c1-14(2)16-9-7-15(3)8-12-18(21)20(4)13-5-6-17(11-10-16)19(22)23-20/h6-7,9,14H,5,8,10-13H2,1-4H3/b15-7-,16-9+","PSZUHEPXMXTNIL-CZCKSJKESA-N"
"CC(=O)OC([H])(C2)C(C)(C1)OC(=O)C(CCC(C(C)C)=C([H])C([H])=C(C)C2)=C([H])C1","InChI=1S/C22H32O4/c1-15(2)18-10-8-16(3)9-13-20(25-17(4)23)22(5)14-6-7-19(12-11-18)21(24)26-22/h7-8,10,15,20H,6,9,11-14H2,1-5H3/b16-8+,18-10+/t20-,22?/m1/s1","PSJHYYPVPGHZAJ-FPJKZIJLSA-N"
"[H]C(C1)=C(C)CCC(C(C)=O)=C([H])CC(C(=C)2)C(OC(=O)2)C([H])=C(C)C1","InChI=1S/C20H26O3/c1-13-6-5-7-14(2)12-19-18(15(3)20(22)23-19)11-10-17(9-8-13)16(4)21/h6,10,12,18-19H,3,5,7-9,11H2,1-2,4H3/b13-6+,14-12+,17-10+","JDQTWBYKDQDUAX-UXXKIGRPSA-N"
"[H]C(C1)=C(C)CCC(C(C)=O)C(O)CC(C(=C)2)C(OC(=O)2)C([H])=C(C)C1","InChI=1S/C20H28O4/c1-12-6-5-7-13(2)10-19-17(14(3)20(23)24-19)11-18(22)16(9-8-12)15(4)21/h6,10,16-19,22H,3,5,7-9,11H2,1-2,4H3/b12-6+,13-10+","ZKOWAHHRXXUZGA-WAAHFECUSA-N"
"[H]C(C2)=C(C)CCC(O1)C(C)(C(=O)CC(C(=C)3)C(OC(=O)3)C([H])=C(C)C2)1","InChI=1S/C20H26O4/c1-12-6-5-7-13(2)10-16-15(14(3)19(22)23-16)11-17(21)20(4)18(24-20)9-8-12/h6,10,15-16,18H,3,5,7-9,11H2,1-2,4H3/b12-6-,13-10-","JIXLTZWMNACINB-HVZNDUSUSA-N"
"CC(=O)OC(C2)C(C)(O1)C(CCC(C)=C([H])CCC(C)=C([H])C(O3)C(C(=C)C(=O)3)2)1","InChI=1S/C22H30O5/c1-13-7-6-8-14(2)11-18-17(15(3)21(24)26-18)12-20(25-16(4)23)22(5)19(27-22)10-9-13/h7,11,17-20H,3,6,8-10,12H2,1-2,4-5H3/b13-7-,14-11-","VAIRPKPEPRJXML-NHBSDZJZSA-N"
"CC(C2)=C([H])CCC(C)=C([H])C([H])(O1)C([H])(CC([H])(OC(C)=O)C(C)=C([H])C2)C(=C)C(=O)1","InChI=1S/C22H30O4/c1-14-8-6-10-15(2)12-21-19(17(4)22(24)26-21)13-20(25-18(5)23)16(3)11-7-9-14/h8,11-12,19-21H,4,6-7,9-10,13H2,1-3,5H3/b14-8+,15-12+,16-11+/t19-,20-,21-/m0/s1","XCKMFLVWQFOPHR-BDSHZVJHSA-N"
"CC(=O)OC([H])(C1)C(C)(O)CCC([H])(O)C(C)=C([H])CC([H])(C(=C)2)C([H])(OC(=O)2)C([H])=C(C)C1","InChI=1S/C22H32O6/c1-13-6-9-20(27-16(4)23)22(5,26)11-10-18(24)14(2)7-8-17-15(3)21(25)28-19(17)12-13/h7,12,17-20,24,26H,3,6,8-11H2,1-2,4-5H3/b13-12+,14-7-/t17-,18-,19-,20-,22+/m0/s1","XRJDKHSLEVYNJE-SNTVFBAHSA-N"
"CC(=O)OC([H])(C2)C(C)(C1)OC(C(C)=C([H])CC([H])(C(=C)3)C([H])(OC(=O)3)C([H])=C(C)C2)=C([H])1","InChI=1S/C22H28O5/c1-13-6-9-20(25-16(4)23)22(5)11-10-18(27-22)14(2)7-8-17-15(3)21(24)26-19(17)12-13/h7,10,12,17,19-20H,3,6,8-9,11H2,1-2,4-5H3/b13-12+,14-7-/t17-,19-,20-,22?/m0/s1","XVOSSVQHIXQCPL-AHLZJXBASA-N"
"OCC(=C)C([H])(C1)C([H])(O)C([H])=C(C)CCC([H])(OC(C)=O)C(C)(C2)OOC([H])(C2)C(C)=C([H])1","InChI=1S/C22H34O6/c1-14-6-9-21(26-17(4)24)22(5)11-10-20(27-28-22)15(2)7-8-18(16(3)13-23)19(25)12-14/h7,12,18-21,23,25H,3,6,8-11,13H2,1-2,4-5H3/b14-12+,15-7-/t18-,19-,20?,21-,22+/m0/s1","PAOCQIUKPAMWJR-GPLAYYROSA-N"
"CC(=C2)CCC([H])(O1)C(C)(CCC([H])(C(=C)3)CC([H])(OC(=O)3)C(C)(O)CC2)1","InChI=1S/C20H30O4/c1-13-6-5-10-19(3,22)17-12-15(14(2)18(21)23-17)9-11-20(4)16(24-20)8-7-13/h6,15-17,22H,2,5,7-12H2,1,3-4H3/b13-6+/t15-,16+,17-,19+,20+/m1/s1","YKKJETNBRNDYKN-JZZWRREUSA-N"
"CC(=C2)CCC([H])(O1)C(C)(CCC([H])(C(C)3)CC([H])(OC(=O)3)C(C)(O)CC2)1","InChI=1S/C20H32O4/c1-13-6-5-10-19(3,22)17-12-15(14(2)18(21)23-17)9-11-20(4)16(24-20)8-7-13/h6,14-17,22H,5,7-12H2,1-4H3/b13-6+/t14-,15+,16-,17+,19-,20-/m0/s1","WDEIQHZSEQJHHX-DLJWBEQKSA-N"
"CC(C2)=C([H])CCC(C)(O1)C([H])(CC([H])(C3)C(=C)C(=O)OC(C)(C3)C([H])(O)C2)1","InChI=1S/C20H30O4/c1-13-6-5-10-20(4)17(23-20)12-15-9-11-19(3,16(21)8-7-13)24-18(22)14(15)2/h6,15-17,21H,2,5,7-12H2,1,3-4H3/b13-6+/t15-,16+,17+,19-,20+/m1/s1","FONRUOAYELOHDC-ZOOQSLMQSA-N"
"CC(C2)=C([H])CCC(C)(O1)C([H])(CC([H])(C3)C(=C)C(=O)OC(C)(C3)C([H])(O)C2)1","InChI=1S/C20H30O4/c1-13-6-5-10-20(4)17(23-20)12-15-9-11-19(3,16(21)8-7-13)24-18(22)14(15)2/h6,15-17,21H,2,5,7-12H2,1,3-4H3/b13-6-/t15-,16+,17-,19-,20+/m1/s1","FONRUOAYELOHDC-PVYSAULZSA-N"
"CC(C2)=C([H])CCC(C)(O1)C([H])(CC([H])(C3)C(=C)C(=O)OC(C)(C3)C(=O)C2)1","InChI=1S/C20H28O4/c1-13-6-5-10-20(4)17(23-20)12-15-9-11-19(3,16(21)8-7-13)24-18(22)14(15)2/h6,15,17H,2,5,7-12H2,1,3-4H3/b13-6+/t15-,17+,19-,20+/m1/s1","BCEKDLJRXSZZRB-RWQKAGTCSA-N"
"CC(C)C([H])(C3)C([H])(C([H])21)C([H])(C(C)=C([H])3)C([H])(CC(C)(O)C([H])(O)CCC(C)(O)2)O1","InChI=1S/C20H34O4/c1-11(2)13-7-6-12(3)16-14-10-20(5,23)15(21)8-9-19(4,22)18(24-14)17(13)16/h6,11,13-18,21-23H,7-10H2,1-5H3/t13-,14-,15+,16+,17-,18-,19-,20+/m1/s1","DTXAQQMHPCOLBL-IIYNAOSSSA-N"
"CC(=O)OC([H])(C2)C(C)(O)CC([H])(O1)C([H])(C(C)=3)C([H])(C([H])(C(C)C)CC([H])3)C([H])(C(C)(O)C2)1","InChI=1S/C22H36O5/c1-12(2)15-8-7-13(3)18-16-11-22(6,25)17(26-14(4)23)9-10-21(5,24)20(27-16)19(15)18/h7,12,15-20,24-25H,8-11H2,1-6H3/t15-,16-,17+,18+,19-,20-,21-,22+/m1/s1","QTCWWOOKJDGITI-ZHPQPJTISA-N"
"C=CC(C)(OC)CCC([H])(C(C)=2)C(C)(C1)C([H])(CC([H])2)C(C)(C)CC1","InChI=1S/C21H36O/c1-8-20(5,22-7)15-12-17-16(2)10-11-18-19(3,4)13-9-14-21(17,18)6/h8,10,17-18H,1,9,11-15H2,2-7H3/t17-,18+,20-,21-/m1/s1","ZWCHJTGMHXJGEA-KOUHRCEDSA-N"
"CC(=C)C([H])(C1)CC([H])(C(C)=2)C(C)(CCC([H])2)C1","InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14+,15-/m1/s1","OZQAPQSEYFAMCY-QLFBSQMISA-N"
"CC(=C)C([H])(C1)CC([H])(C(C)(O)2)C(C)(CCC2)C1","InChI=1S/C15H26O/c1-11(2)12-6-9-14(3)7-5-8-15(4,16)13(14)10-12/h12-13,16H,1,5-10H2,2-4H3/t12-,13-,14-,15-/m1/s1","DPQYOKVMVCQHMY-KBUPBQIOSA-N"
"CC(=C1)CCC(CC=C(C)CC1)=C(C)C","InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h6,9H,5,7-8,10-11H2,1-4H3/b13-6+,14-9-","GXEGJTGWYVZSNR-JEKCHIPQSA-N"
"CC(=C1)CCC(C=CC(=C)CC1)C(C)C","InChI=1S/C15H24/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h7-8,10,12,15H,3,5-6,9,11H2,1-2,4H3/b10-8-,14-7-/t15-/m0/s1","GAIBLDCXCZKKJE-ACWLMNNXSA-N"
"CC(C1)=CCC(=C(C)C)C(=O)CC(C)=CC1","InChI=1S/C15H22O/c1-11(2)14-9-8-12(3)6-5-7-13(4)10-15(14)16/h7-8H,5-6,9-10H2,1-4H3/b12-8-,13-7-","CAULGCQHVOVVRN-SVGXSMIJSA-N"
"CC(=C2)CC(=O)C(=C(C)C)CC([H])(O1)C(C)(CC2)1","InChI=1S/C15H22O2/c1-10(2)12-9-14-15(4,17-14)7-5-6-11(3)8-13(12)16/h6,14H,5,7-9H2,1-4H3/b11-6-/t14-,15-/m1/s1","DWGVRYKQVZGSIB-JDBPXVJJSA-N"
"CC(C2)=CC([H])(C([H])(C(C)C)1)C([H])(C2)C(C)(O)CC1","InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13-,14-,15-/m0/s1","LHYHMMRYTDARSZ-AJNGGQMLSA-N"
"C=C(C2)C([H])(O)CCC(=C)C([H])(C1)C([H])(C2)C(C)(C)1","InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h12-14,16H,1-2,5-9H2,3-4H3/t12-,13+,14+/m1/s1","CIIYOYPOMGIECX-RDBSUJKOSA-N"
"CC(C2)C([H])(C3)C(C(C)C3)(C1)OC(C)(C)C(C2)1","InChI=1S/C15H26O/c1-10-5-7-12-9-15(16-14(12,3)4)11(2)6-8-13(10)15/h10-13H,5-9H2,1-4H3/t10-,11+,12+,13+,15-/m0/s1","GXMJXGUEPXEOGR-BGPZULBFSA-N"
"Cc(c2)cc(c(c2)1)C([H])(C(C)C)CCC([H])(C)1","InChI=1S/C15H22/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,12-13H,6,8H2,1-4H3/t12-,13-/m0/s1","PGTJIOWQJWHTJJ-STQMWFEESA-N"
"CC(=C)C([H])(C1)CC(=C(C)2)C(C)(CCC(=O)2)C1","InChI=1S/C15H22O/c1-10(2)12-5-7-15(4)8-6-14(16)11(3)13(15)9-12/h12H,1,5-9H2,2-4H3/t12-,15?/m1/s1","KUFXJZXMWHNCEH-KEKZHRQWSA-N"
"CC(C2)=C([H])C([H])(C([H])(C(C)C)1)C([H])(C2)C(C)=C([H])C1","InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h6,9-10,13-15H,5,7-8H2,1-4H3/t13-,14+,15-/m1/s1","QMAYBMKBYCGXDH-QLFBSQMISA-N"
"ClC(C1)C(C2)C(=C)C(C)(C)C12","InChI=1S/C10H15Cl/c1-6-8-4-7(5-9(8)11)10(6,2)3/h7-9H,1,4-5H2,2-3H3/t7-,8-,9+/m0/s1","RYBMATYKJPKXJO-XHNCKOQMSA-N"
"C=CC(C)(C1)OC(C)(C)C([H])(O)C1","InChI=1S/C10H18O2/c1-5-10(4)7-6-8(11)9(2,3)12-10/h5,8,11H,1,6-7H2,2-4H3/t8-,10+/m1/s1","BCTBAGTXFYWYMW-SCZZXKLOSA-N"
"C=CC(C)(C1)OC(C)(C)C([H])(OC(C)=O)C1","InChI=1S/C12H20O3/c1-6-12(5)8-7-10(14-9(2)13)11(3,4)15-12/h6,10H,1,7-8H2,2-5H3/t10-,12+/m1/s1","IRWLDXUJBJPFNV-PWSUYJOCSA-N"
"C=CC(C)(C1)OC(C)(C)C(=O)C1","InChI=1S/C10H16O2/c1-5-10(4)7-6-8(11)9(2,3)12-10/h5H,1,6-7H2,2-4H3/t10-/m0/s1","ATQPZCOAQSYTPR-JTQLQIEISA-N"
"CC(=O)OC([H])(C([H])(C)1)C([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(OC)O1","InChI=1S/C13H20O8/c1-6-10(19-7(2)14)11(20-8(3)15)12(21-9(4)16)13(17-5)18-6/h6,10-13H,1-5H3/t6-,10?,11-,12-,13?/m1/s1","RTVWBDNQHISFHI-JEWVQHRJSA-N"
"CC(=O)OC([H])(C([H])(C)1)C([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(OC)O1","InChI=1S/C13H20O8/c1-6-10(19-7(2)14)11(20-8(3)15)12(21-9(4)16)13(17-5)18-6/h6,10-13H,1-5H3/t6-,10?,11+,12+,13?/m0/s1","RTVWBDNQHISFHI-ZEDCYTHJSA-N"
"CC(=O)OC([H])(C([H])(C)1)C([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(OC)O1","InChI=1S/C13H20O8/c1-6-10(19-7(2)14)11(20-8(3)15)12(21-9(4)16)13(17-5)18-6/h6,10-13H,1-5H3/t6-,10?,11-,12+,13?/m0/s1","RTVWBDNQHISFHI-WBLBWYBMSA-N"
"CC#CC#CC([H])=C(O1)C([H])=C([H])C(C2)(OCCC2)1","InChI=1S/C14H14O2/c1-2-3-4-5-8-13-9-11-14(16-13)10-6-7-12-15-14/h8-9,11H,6-7,10,12H2,1H3/b13-8-","RNEORCMLRJNFGE-JYRVWZFOSA-N"
"CC#CC#CC([H])=C(O1)C([H])=C([H])C(C2)(OCC2)1","InChI=1S/C13H12O2/c1-2-3-4-5-7-12-8-10-13(15-12)9-6-11-14-13/h7-8,10H,6,9,11H2,1H3/b12-7-","WTRXKCNFPMTAJV-GHXNOFRVSA-N"
"CC#CC#CC([H])=C(O1)C([H])=C([H])C(C2)(OCC2)1","InChI=1S/C13H12O2/c1-2-3-4-5-7-12-8-10-13(15-12)9-6-11-14-13/h7-8,10H,6,9,11H2,1H3/b12-7+","WTRXKCNFPMTAJV-KPKJPENVSA-N"
"CC#CC#CC([H])=C(O1)C(OC(C)=O)C(OC(C)=O)C(C2)(OCCC2)1","InChI=1S/C18H20O6/c1-4-5-6-7-10-15-16(22-13(2)19)17(23-14(3)20)18(24-15)11-8-9-12-21-18/h10,16-17H,8-9,11-12H2,1-3H3/b15-10-","ZUVKMJVHYBUAHI-GDNBJRDFSA-N"
"CC#CC#CC([H])=C(O1)C(OC(=O)CC(C)C)C(O)C(C2)(OCCC2)1","InChI=1S/C19H24O5/c1-4-5-6-7-10-15-17(23-16(20)13-14(2)3)18(21)19(24-15)11-8-9-12-22-19/h10,14,17-18,21H,8-9,11-13H2,1-3H3/b15-10-","LEOZNWWIPMVKHH-GDNBJRDFSA-N"
"CC#CC#CC([H])=C(O1)C(OC(C)=O)C(O)C(C2)(OCCC2)1","InChI=1S/C16H18O5/c1-3-4-5-6-9-13-14(20-12(2)17)15(18)16(21-13)10-7-8-11-19-16/h9,14-15,18H,7-8,10-11H2,1-2H3/b13-9-","GSEJYTXIPBKHKH-LCYFTJDESA-N"
"CCCCCCC(O1)C(OC(C)=O)C(OC(C)=O)C(C2)(OCCC2)1","InChI=1S/C18H30O6/c1-4-5-6-7-10-15-16(22-13(2)19)17(23-14(3)20)18(24-15)11-8-9-12-21-18/h15-17H,4-12H2,1-3H3","CCGIUVLTJQXRSI-UHFFFAOYSA-N"
"CC#CC#CC([H])=C(O1)C(O)C(O)C(C2)(OCCC2)1","InChI=1S/C14H16O4/c1-2-3-4-5-8-11-12(15)13(16)14(18-11)9-6-7-10-17-14/h8,12-13,15-16H,6-7,9-10H2,1H3/b11-8-","YCXFYWBMQJMDBX-FLIBITNWSA-N"
"COc(c1)c(OC)c(OC)cc1","InChI=1S/C9H12O3/c1-10-7-5-4-6-8(11-2)9(7)12-3/h4-6H,1-3H3","CRUILBNAQILVHZ-UHFFFAOYSA-N"
"CC(=O)c(c(O)1)c(O)ccc1","InChI=1S/C8H8O3/c1-5(9)8-6(10)3-2-4-7(8)11/h2-4,10-11H,1H3","YPTJKHVBDCRKNF-UHFFFAOYSA-N"
"COc(c1)cc(O)c(c1)C(C)=O","InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3","UILPJVPSNHJFIK-UHFFFAOYSA-N"
"COc(c1)c(OC)c(cc1)C(C)=O","InChI=1S/C10H12O3/c1-7(11)8-5-4-6-9(12-2)10(8)13-3/h4-6H,1-3H3","FODUVZQSLRHUMC-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)c(C(C)=O)c1","InChI=1S/C11H14O4/c1-7(12)8-5-6-9(13-2)11(15-4)10(8)14-3/h5-6H,1-4H3","PKNAATJMQOUREZ-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(C(C)=O)c(OC)1","InChI=1S/C11H14O4/c1-7(12)8-5-10(14-3)11(15-4)6-9(8)13-2/h5-6H,1-4H3","GUTMBHHLVSFJIP-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(C(C)=O)c(OC)1","InChI=1S/C11H14O4/c1-7(12)11-9(14-3)5-8(13-2)6-10(11)15-4/h5-6H,1-4H3","KPZWHZSIXZXDMW-UHFFFAOYSA-N"
"O=Cc(c1)c(OC)c(OC)c(OC)c1","InChI=1S/C10H12O4/c1-12-8-5-4-7(6-11)9(13-2)10(8)14-3/h4-6H,1-3H3","UCTUXUGXIFRVGX-UHFFFAOYSA-N"
"COc(c1)c(OC)c(cc1)C(C)O","InChI=1S/C10H14O3/c1-7(11)8-5-4-6-9(12-2)10(8)13-3/h4-7,11H,1-3H3","CFTDWZSHQBCEMC-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)c(C(C)O)c1","InChI=1S/C11H16O4/c1-7(12)8-5-6-9(13-2)11(15-4)10(8)14-3/h5-7,12H,1-4H3","KBCIPNISEQNFCY-UHFFFAOYSA-N"
"COc(c1)c(OC)c(O)c(C(C)=O)c1","InChI=1S/C10H12O4/c1-6(11)7-4-5-8(13-2)10(14-3)9(7)12/h4-5,12H,1-3H3","BCEPNLMYVYJIHU-UHFFFAOYSA-N"
"COc(c1)c(O)c(OC)c(C(C)=O)c1","InChI=1S/C10H12O4/c1-6(11)7-4-5-8(13-2)9(12)10(7)14-3/h4-5,12H,1-3H3","RXUBOGMCVKRPOH-UHFFFAOYSA-N"
"CC(C)OP(=S)(OC(C)C)SCCNS(=O)(=O)c(c1)cccc1","InChI=1S/C14H24NO4PS3/c1-12(2)18-20(21,19-13(3)4)22-11-10-15-23(16,17)14-8-6-5-7-9-14/h5-9,12-13,15H,10-11H2,1-4H3","RRNIZKPFKNDSRS-UHFFFAOYSA-N"
"CCN(CC)C(=O)C(C)Oc(c1)c(c2)c(ccc2)cc1","InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3","WXZVAROIGSFCFJ-UHFFFAOYSA-N"
"CC(C)Oc(c2)cc(cc2)NC(=O)c(c1)c(ccc1)C(F)(F)F","InChI=1S/C17H16F3NO2/c1-11(2)23-13-7-5-6-12(10-13)21-16(22)14-8-3-4-9-15(14)17(18,19)20/h3-11H,1-2H3,(H,21,22)","PTCGDEVVHUXTMP-UHFFFAOYSA-N"
"O=C(C21)N(C(=O)C(CC=CC2)1)SC(Cl)(Cl)Cl","InChI=1S/C9H8Cl3NO2S/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15/h1-2,5-6H,3-4H2","LDVVMCZRFWMZSG-UHFFFAOYSA-N"
"COP(=O)(OC)C(O)C(Cl)(Cl)Cl","InChI=1S/C4H8Cl3O4P/c1-10-12(9,11-2)3(8)4(5,6)7/h3,8H,1-2H3","NFACJZMKEDPNKN-UHFFFAOYSA-N"
"CCC(C)NP(=S)(OCC)Oc(c1)c(ccc(C)1)[N+1]([O-1])=O","InChI=1S/C13H21N2O4PS/c1-5-11(4)14-20(21,18-6-2)19-13-9-10(3)7-8-12(13)15(16)17/h7-9,11H,5-6H2,1-4H3,(H,14,21)","OEYOMNZEMCPTKN-UHFFFAOYSA-N"
"CC(C)Oc(c2)cc(cc2)NC(=O)c(c1)c(C)ccc1","InChI=1S/C17H19NO2/c1-12(2)20-15-9-6-8-14(11-15)18-17(19)16-10-5-4-7-13(16)3/h4-12H,1-3H3,(H,18,19)","BCTQJXQXJVLSIG-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)N(C)C","InChI=1S/C9H13N/c1-8-4-6-9(7-5-8)10(2)3/h4-7H,1-3H3","GYVGXEWAOAAJEU-UHFFFAOYSA-N"
"CCOC(=O)C(O)c(c1)cccc1","InChI=1S/C10H12O3/c1-2-13-10(12)9(11)8-6-4-3-5-7-8/h3-7,9,11H,2H2,1H3","SAXHIDRUJXPDOD-UHFFFAOYSA-N"
"OC(C1)C(C(=O)2)C(C)(CC2)C(=O)C1","InChI=1S/C10H14O3/c1-10-5-4-7(12)9(10)6(11)2-3-8(10)13/h6,9,11H,2-5H2,1H3","GKIBMSXDKANYOB-UHFFFAOYSA-N"
"CN(C)c(c3)ccc(c3)c(c(C)1)c(c2)c(ccc2)cc1","InChI=1S/C19H19N/c1-14-8-9-15-6-4-5-7-18(15)19(14)16-10-12-17(13-11-16)20(2)3/h4-13H,1-3H3","CRFQMFFPQGYKHR-UHFFFAOYSA-N"
"CN(C)c(c1)ccc(CCCc(c2)cc(c3)c(ccc3)c2)c1","InChI=1S/C21H23N/c1-22(2)21-14-11-17(12-15-21)6-5-7-18-10-13-19-8-3-4-9-20(19)16-18/h3-4,8-16H,5-7H2,1-2H3","CYZHCTJNNRPWQW-UHFFFAOYSA-N"
"O=C(O1)c(c2)c(ccc2)C1","InChI=1S/C8H6O2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4H,5H2","WNZQDUSMALZDQF-UHFFFAOYSA-N"
"Oc(c1)cc(C(O)=O)c(O)c1","InChI=1S/C7H6O4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,8-9H,(H,10,11)","WXTMDXOMEHJXQO-UHFFFAOYSA-N"
"CCC(N)=O","InChI=1S/C3H7NO/c1-2-3(4)5/h2H2,1H3,(H2,4,5)","QLNJFJADRCOGBJ-UHFFFAOYSA-N"
"Cc(c1)c(ccc1)S(N)(=O)=O","InChI=1S/C7H9NO2S/c1-6-4-2-3-5-7(6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)","YCMLQMDWSXFTIF-UHFFFAOYSA-N"
"CC(N)=S","InChI=1S/C2H5NS/c1-2(3)4/h1H3,(H2,3,4)","YUKQRDCYNOVPGJ-UHFFFAOYSA-N"
"OC(=O)c(c1)c(S)ccc1","InChI=1S/C7H6O2S/c8-7(9)5-3-1-2-4-6(5)10/h1-4,10H,(H,8,9)","NBOMNTLFRHMDEZ-UHFFFAOYSA-N"
"c(c3)ccc(c3)Nc(c1)c(c2)c(ccc2)cc1","InChI=1S/C16H13N/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12,17H","XQVWYOYUZDUNRW-UHFFFAOYSA-N"
"Cc(c1)c(O)c(C)c(C)c(O)1","InChI=1S/C9H12O2/c1-5-4-8(10)6(2)7(3)9(5)11/h4,10-11H,1-3H3","AUFZRCJENRSRLY-UHFFFAOYSA-N"
"Oc(c2)ccc(c2)C(C)(C)c(c1)ccc(O)c1","InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3","IISBACLAFKSPIT-UHFFFAOYSA-N"
"Nc(c1)ccc(O)c1","InChI=1S/C6H7NO/c7-5-1-3-6(8)4-2-5/h1-4,8H,7H2","PLIKAWJENQZMHA-UHFFFAOYSA-N"
"CC(=O)NNc(c1)cccc1","InChI=1S/C8H10N2O/c1-7(11)9-10-8-5-3-2-4-6-8/h2-6,10H,1H3,(H,9,11)","UICBCXONCUFSOI-UHFFFAOYSA-N"
"CC(=O)CC(=O)Nc(c1)cccc1","InChI=1S/C10H11NO2/c1-8(12)7-10(13)11-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,11,13)","DYRDKSSFIWVSNM-UHFFFAOYSA-N"
"Nc(c1)cc(O)cc1","InChI=1S/C6H7NO/c7-5-2-1-3-6(8)4-5/h1-4,8H,7H2","CWLKGDAVCFYWJK-UHFFFAOYSA-N"
"CC(=O)NC(N)=S","InChI=1S/C3H6N2OS/c1-2(6)5-3(4)7/h1H3,(H3,4,5,6,7)","IPCRBOOJBPETMF-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(c2)c(ccc2)c1","InChI=1S/C12H10O2/c13-12(14)8-9-5-6-10-3-1-2-4-11(10)7-9/h1-7H,8H2,(H,13,14)","VIBOGIYPPWLDTI-UHFFFAOYSA-N"
"CC(=O)Nc(c1)cc(C)cc1","InChI=1S/C9H11NO/c1-7-4-3-5-9(6-7)10-8(2)11/h3-6H,1-2H3,(H,10,11)","ALMHSXDYCFOZQD-UHFFFAOYSA-N"
"COc(c1)c(ccc1)NC(C)=O","InChI=1S/C9H11NO2/c1-7(11)10-8-5-3-4-6-9(8)12-2/h3-6H,1-2H3,(H,10,11)","FGOFNVXHDGQVBG-UHFFFAOYSA-N"
"Oc(c(Br)1)c(Br)cc(Br)c1","InChI=1S/C6H3Br3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H","BSWWXRFVMJHFBN-UHFFFAOYSA-N"
"CN(C2)C([H])(CCC2)c(c1)cncc1","InChI=1S/C11H16N2/c1-13-8-3-2-6-11(13)10-5-4-7-12-9-10/h4-5,7,9,11H,2-3,6,8H2,1H3/t11-/m0/s1","WHAIHNKQZOMXJJ-NSHDSACASA-N"
"Nc(c1)c(c2)c(ncc2)cc1","InChI=1S/C9H8N2/c10-8-4-1-5-9-7(8)3-2-6-11-9/h1-6H,10H2","XMIAFAKRAAMSGX-UHFFFAOYSA-N"
"COc(c1)cc(CBr)c(OC)c(CBr)1","InChI=1S/C10H12Br2O2/c1-13-9-3-7(5-11)10(14-2)8(4-9)6-12/h3-4H,5-6H2,1-2H3","NMKXDEJEXSASNP-UHFFFAOYSA-N"
"CCC(=O)NC([H])(COC(C2)OCCC2)c(c1)cccc1","InChI=1S/C16H23NO3/c1-2-15(18)17-14(13-8-4-3-5-9-13)12-20-16-10-6-7-11-19-16/h3-5,8-9,14,16H,2,6-7,10-12H2,1H3,(H,17,18)/t14-,16?/m0/s1","FVMZMHCLDKHCNA-LBAUFKAWSA-N"
"CC(C)OC(=O)CC(=O)OC(C)C","InChI=1S/C9H16O4/c1-6(2)12-8(10)5-9(11)13-7(3)4/h6-7H,5H2,1-4H3","QRVSDVDFJFKYKA-UHFFFAOYSA-N"
"[H]C(C1)=C(C)CCC([H])=C(C)CC(=O)C([H])(C(C)=C)CC([H])=C(C)C1","InChI=1S/C20H30O/c1-15(2)19-13-12-17(4)10-6-8-16(3)9-7-11-18(5)14-20(19)21/h8,11-12,19H,1,6-7,9-10,13-14H2,2-5H3/b16-8+,17-12+,18-11+/t19-/m1/s1","FHFFESCITRPPTG-ZSAANFQCSA-N"
"[H]C(C1)=C(C)CC(=O)C([H])=C(C)CCC([H])(C(C)C)C([H])=C([H])C(C)=C([H])1","InChI=1S/C20H30O/c1-15(2)19-11-9-16(3)7-6-8-17(4)13-20(21)14-18(5)10-12-19/h7-9,11,14-15,19H,6,10,12-13H2,1-5H3/b11-9+,16-7+,17-8+,18-14+/t19-/m0/s1","MZTPSSNCTBEIEA-PHZHXBCNSA-N"
"CC(=O)OC([H])(C1)C([H])=C(C)CCC([H])(C(C)C)C([H])=C([H])C(C)=C([H])CC([H])=C(C)1","InChI=1S/C22H34O2/c1-16(2)21-12-10-17(3)8-7-9-18(4)14-22(24-20(6)23)15-19(5)11-13-21/h8-10,12,15-16,21-22H,7,11,13-14H2,1-6H3/b12-10+,17-8+,18-9+,19-15+/t21-,22+/m0/s1","AVHLQLZONYQCES-VWRYFPDESA-N"
"COC(=O)C(=C2)CCC(=O)C(C)(C1)OC(=O)C(CCC(C(C)C)=C2)=CC1","InChI=1S/C21H28O5/c1-14(2)15-7-9-16-6-5-13-21(3,26-20(16)24)18(22)12-11-17(10-8-15)19(23)25-4/h6,8,10,14H,5,7,9,11-13H2,1-4H3/b15-8-,17-10+","SSRWHVBVQPAITB-DLGMIZISSA-N"
"CC(C)C(C2)=C([H])C([H])=C(C)CCC([H])(O)C(C)(C1)OC(=O)C(C2)=C([H])C1","InChI=1S/C20H30O3/c1-14(2)16-9-7-15(3)8-12-18(21)20(4)13-5-6-17(11-10-16)19(22)23-20/h6-7,9,14,18,21H,5,8,10-13H2,1-4H3/b15-7+,16-9+/t18-,20+/m1/s1","UPVZGDDJVFXWOG-MKSSYNOGSA-N"
"CC(C2)=C([H])CCC(C)=C([H])C([H])(O1)C([H])(CC(=O)C(C)=C([H])C2)C(=C)C(=O)1","InChI=1S/C20H26O3/c1-13-7-5-9-14(2)11-19-17(16(4)20(22)23-19)12-18(21)15(3)10-6-8-13/h7,10-11,17,19H,4-6,8-9,12H2,1-3H3/b13-7+,14-11+,15-10+/t17-,19-/m0/s1","ROQQHOAGXJBFJT-FYGDRCKBSA-N"
"CC(C1)=CCCC(C)=CCC(C)(C)C=CCC(C)=CC1","InChI=1S/C20H32/c1-17-9-6-11-18(2)13-8-15-20(4,5)16-14-19(3)12-7-10-17/h8,10-11,14-15H,6-7,9,12-13,16H2,1-5H3/b15-8-,17-10+,18-11+,19-14-","SPMBDLTUBLYRCT-PWOPFSNCSA-N"
"c(c4)cc(c3)c(n4)c(cc3)O[Cu]Oc(c1)c(n2)c(ccc2)cc1","InChI=1S/2C9H7NO.Cu/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;/h2*1-6,11H;/q;;+2/p-2","YXLXNENXOJSQEI-UHFFFAOYSA-L"
"O=CCC(C)c(c1)cccc1","InChI=1S/C10H12O/c1-9(7-8-11)10-5-3-2-4-6-10/h2-6,8-9H,7H2,1H3","MYHGOWDLVRDUFA-UHFFFAOYSA-N"
"CCC(C)C(C1)C(=O)CCC1","InChI=1S/C10H18O/c1-3-8(2)9-6-4-5-7-10(9)11/h8-9H,3-7H2,1-2H3","RQXTZKGDMNIWJF-UHFFFAOYSA-N"
"O=C(C1)CC(=O)CC1","InChI=1S/C6H8O2/c7-5-2-1-3-6(8)4-5/h1-4H2","HJSLFCCWAKVHIW-UHFFFAOYSA-N"
"CCCCC(C1)C(=O)CCC1","InChI=1S/C10H18O/c1-2-3-6-9-7-4-5-8-10(9)11/h9H,2-8H2,1H3","POYYYXPQBFPUKS-UHFFFAOYSA-N"
"CCCCCCCCCC(C1)C(=O)CC1","InChI=1S/C14H26O/c1-2-3-4-5-6-7-8-10-13-11-9-12-14(13)15/h13H,2-12H2,1H3","XEOVFHLZQOKWSG-UHFFFAOYSA-N"
"CCCCCCC(C1)C(=O)CC1","InChI=1S/C11H20O/c1-2-3-4-5-7-10-8-6-9-11(10)12/h10H,2-9H2,1H3","JTHVYOIHZNYRCC-UHFFFAOYSA-N"
"CCCCC(C1)C(=O)CC1","InChI=1S/C9H16O/c1-2-3-5-8-6-4-7-9(8)10/h8H,2-7H2,1H3","ZAQYRXDJFINJJE-UHFFFAOYSA-N"
"CCCCC(=O)OCCc(c1)cccc1","InChI=1S/C13H18O2/c1-2-3-9-13(14)15-11-10-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3","PDGPIBIURNPBSE-UHFFFAOYSA-N"
"CCCCC(CC)C(=O)N(CC)CC","InChI=1S/C12H25NO/c1-5-9-10-11(6-2)12(14)13(7-3)8-4/h11H,5-10H2,1-4H3","LYGCLXFQIQORSE-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCC(O)=O","InChI=1S/C20H40O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-19H2,1H3,(H,21,22)","VKOBVWXKNCXXDE-UHFFFAOYSA-N"
"CCCCCCC(=O)CCc(c1)cccc1","InChI=1S/C15H22O/c1-2-3-4-8-11-15(16)13-12-14-9-6-5-7-10-14/h5-7,9-10H,2-4,8,11-13H2,1H3","QQSUQZXKESWTCP-UHFFFAOYSA-N"
"CCOC(=O)CC(O)C(=O)OCC","InChI=1S/C8H14O5/c1-3-12-7(10)5-6(9)8(11)13-4-2/h6,9H,3-5H2,1-2H3","VKNUORWMCINMRB-UHFFFAOYSA-N"
"CC(O)COC(=O)Cc(c1)cccc1","InChI=1S/C11H14O3/c1-9(12)8-14-11(13)7-10-5-3-2-4-6-10/h2-6,9,12H,7-8H2,1H3","DMVWKGDEFQXZJS-UHFFFAOYSA-N"
"CCCOC(=O)CC(C)CC(C)(C)C","InChI=1S/C12H24O2/c1-6-7-14-11(13)8-10(2)9-12(3,4)5/h10H,6-9H2,1-5H3","TXDNNEFZLUFLRT-UHFFFAOYSA-N"
"CCC(C)COC(=O)c(c1)c(O)ccc1","InChI=1S/C12H16O3/c1-3-9(2)8-15-12(14)10-6-4-5-7-11(10)13/h4-7,9,13H,3,8H2,1-2H3","LCMNCRZMVCRJNZ-UHFFFAOYSA-N"
"C=CCCCCCCCCC(=O)OCCCCCC","InChI=1S/C17H32O2/c1-3-5-7-9-10-11-12-13-15-17(18)19-16-14-8-6-4-2/h3H,1,4-16H2,2H3","LIZMMPXSSWQZSY-UHFFFAOYSA-N"
"CCCCCC(=O)Oc(c1)ccc(C)c1","InChI=1S/C13H18O2/c1-3-4-5-6-13(14)15-12-9-7-11(2)8-10-12/h7-10H,3-6H2,1-2H3","CUKVJQWRXQTFRF-UHFFFAOYSA-N"
"CCCCCCCC(=O)OCCc(c1)cccc1","InChI=1S/C16H24O2/c1-2-3-4-5-9-12-16(17)18-14-13-15-10-7-6-8-11-15/h6-8,10-11H,2-5,9,12-14H2,1H3","ASETYIALRXDVDF-UHFFFAOYSA-N"
"CCOC(=O)C(C)(C)C","InChI=1S/C7H14O2/c1-5-9-6(8)7(2,3)4/h5H2,1-4H3","HHEIMYAXCOIQCJ-UHFFFAOYSA-N"
"CCCCCCCC(CCCCCC)C(=O)OCC","InChI=1S/C17H34O2/c1-4-7-9-11-13-15-16(17(18)19-6-3)14-12-10-8-5-2/h16H,4-15H2,1-3H3","OOCDGNOKAHNFJG-UHFFFAOYSA-N"
"CCCCCC(CC)OC(=O)CCCCC","InChI=1S/C14H28O2/c1-4-7-9-11-13(6-3)16-14(15)12-10-8-5-2/h13H,4-12H2,1-3H3","IMKAZTAYLVONBX-UHFFFAOYSA-N"
"O=C(OCCCc(c2)cccc2)c(c1)cccc1","InChI=1S/C16H16O2/c17-16(15-11-5-2-6-12-15)18-13-7-10-14-8-3-1-4-9-14/h1-6,8-9,11-12H,7,10,13H2","ONPVMQLRVWKFFL-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)COC(=O)c(c1)c(O)ccc1","InChI=1S/C15H14O3/c1-11-6-8-12(9-7-11)10-18-15(17)13-4-2-3-5-14(13)16/h2-9,16H,10H2,1H3","CAKKYSSTIPDPQG-UHFFFAOYSA-N"
"c(c2)ccc(c2)CCCOC(=O)c(c1)c(O)ccc1","InChI=1S/C16H16O3/c17-15-11-5-4-10-14(15)16(18)19-12-6-9-13-7-2-1-3-8-13/h1-5,7-8,10-11,17H,6,9,12H2","GMHNYYKDPGWAJR-UHFFFAOYSA-N"
"CCCCCCC(O)CC=CCCCCCCCC(=O)OC","InChI=1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10-/t18-/m1/s1","XKGDWZQXVZSXAO-ADYSOMBNSA-N"
"CCCCCCC(O)CC=CCCCCCCCC(=O)OCC","InChI=1S/C20H38O3/c1-3-5-6-13-16-19(21)17-14-11-9-7-8-10-12-15-18-20(22)23-4-2/h11,14,19,21H,3-10,12-13,15-18H2,1-2H3/b14-11-/t19-/m1/s1","AZXVZUBIFYQWJK-KWRJMZDGSA-N"
"O=C(C1)OCCOC(=O)CCCCCCC1","InChI=1S/C12H20O4/c13-11-7-5-3-1-2-4-6-8-12(14)16-10-9-15-11/h1-10H2","XFQHIELVPOKJIM-UHFFFAOYSA-N"
"CCCCCCOC(=O)C(C)(C)C","InChI=1S/C11H22O2/c1-5-6-7-8-9-13-10(12)11(2,3)4/h5-9H2,1-4H3","RQSINLZXJXXKOH-UHFFFAOYSA-N"
"CCCCC(CC)OC(=O)CC(C)C","InChI=1S/C12H24O2/c1-5-7-8-11(6-2)14-12(13)9-10(3)4/h10-11H,5-9H2,1-4H3","XYLAGPURFZASEK-UHFFFAOYSA-N"
"CCC(C)CC(=O)OCCC(C)C","InChI=1S/C11H22O2/c1-5-10(4)8-11(12)13-7-6-9(2)3/h9-10H,5-8H2,1-4H3","JLJJAUHWSQZOJP-UHFFFAOYSA-N"
"CCCCCC(=O)OC(CC)CCCC","InChI=1S/C13H26O2/c1-4-7-9-11-13(14)15-12(6-3)10-8-5-2/h12H,4-11H2,1-3H3","KDHWURFMXQEFPK-UHFFFAOYSA-N"
"CCCCCCC(=O)OCC=CCCC","InChI=1S/C13H24O2/c1-3-5-7-9-11-13(14)15-12-10-8-6-4-2/h8,10H,3-7,9,11-12H2,1-2H3/b10-8+","QZZLOJKCWGHIFS-CSKARUKUSA-N"
"CCCCCCCCCCOC(=O)CC(C)C","InChI=1S/C15H30O2/c1-4-5-6-7-8-9-10-11-12-17-15(16)13-14(2)3/h14H,4-13H2,1-3H3","VKGHOXUAAAZEBE-UHFFFAOYSA-N"
"CC(C)CCCOC(=O)CCC(C)C","InChI=1S/C12H24O2/c1-10(2)6-5-9-14-12(13)8-7-11(3)4/h10-11H,5-9H2,1-4H3","BQOKYGYERMXUDU-UHFFFAOYSA-N"
"CCCCCCCCCOC(=O)CCCCCCC","InChI=1S/C17H34O2/c1-3-5-7-9-10-12-14-16-19-17(18)15-13-11-8-6-4-2/h3-16H2,1-2H3","HSGQXSBXGSRINJ-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OCC=CCCC","InChI=1S/C16H30O2/c1-3-5-7-9-10-11-12-14-16(17)18-15-13-8-6-4-2/h8,13H,3-7,9-12,14-15H2,1-2H3/b13-8+","IRAVWWBOSKWULT-MDWZMJQESA-N"
"CCCC=CCOC(=O)C(C)CC","InChI=1S/C11H20O2/c1-4-6-7-8-9-13-11(12)10(3)5-2/h7-8,10H,4-6,9H2,1-3H3/b8-7+","SXJKRFLZGRFPBD-BQYQJAHWSA-N"
"CCCCCC(CC)OC(=O)C(C)CC","InChI=1S/C13H26O2/c1-5-8-9-10-12(7-3)15-13(14)11(4)6-2/h11-12H,5-10H2,1-4H3","STGKDMMHQYQHRE-UHFFFAOYSA-N"
"CCCCCC(CC)OC(=O)CC(C)C","InChI=1S/C13H26O2/c1-5-7-8-9-12(6-2)15-13(14)10-11(3)4/h11-12H,5-10H2,1-4H3","NRBJSRMBRQHOPL-UHFFFAOYSA-N"
"C=CCOC(=O)C(C)CC","InChI=1S/C8H14O2/c1-4-6-10-8(9)7(3)5-2/h4,7H,1,5-6H2,2-3H3","ZSPLJXGRHFJQKO-UHFFFAOYSA-N"
"CCC(CC)C(=O)OC","InChI=1S/C7H14O2/c1-4-6(5-2)7(8)9-3/h6H,4-5H2,1-3H3","UNEAEGWIVFZPFI-UHFFFAOYSA-N"
"CCCC=CCOC(=O)C(CC)CC","InChI=1S/C12H22O2/c1-4-7-8-9-10-14-12(13)11(5-2)6-3/h8-9,11H,4-7,10H2,1-3H3/b9-8+","GWLMOEWFTARWTG-CMDGGOBGSA-N"
"CCCCCCCOC(=O)C(CC)CC","InChI=1S/C13H26O2/c1-4-7-8-9-10-11-15-13(14)12(5-2)6-3/h12H,4-11H2,1-3H3","ZAQPYAQFZYEMDO-UHFFFAOYSA-N"
"CCCCOC(=O)C(CC)CC","InChI=1S/C10H20O2/c1-4-7-8-12-10(11)9(5-2)6-3/h9H,4-8H2,1-3H3","YARHPYLJZOUSGU-UHFFFAOYSA-N"
"CCC=CCCOC(=O)C(CC)CC","InChI=1S/C12H22O2/c1-4-7-8-9-10-14-12(13)11(5-2)6-3/h7-8,11H,4-6,9-10H2,1-3H3/b8-7-","LFDWLVXNYKQQBT-FPLPWBNLSA-N"
"O=C(OCCc(c2)cccc2)CCC(=O)OCCc(c1)cccc1","InChI=1S/C20H22O4/c21-19(23-15-13-17-7-3-1-4-8-17)11-12-20(22)24-16-14-18-9-5-2-6-10-18/h1-10H,11-16H2","SIOVMRDTCNJTPS-UHFFFAOYSA-N"
"CC(=O)Oc(c2)c(ccc2)c(c1)cccc1","InChI=1S/C14H12O2/c1-11(15)16-14-10-6-5-9-13(14)12-7-3-2-4-8-12/h2-10H,1H3","UZUGIHHGLRFGMJ-UHFFFAOYSA-N"
"CCCCCCCOC(=O)C(C)CC","InChI=1S/C12H24O2/c1-4-6-7-8-9-10-14-12(13)11(3)5-2/h11H,4-10H2,1-3H3","CSFWIAGTSVOEOD-UHFFFAOYSA-N"
"COc(c1)ccc(COC(=O)CC(C)C)c1","InChI=1S/C13H18O3/c1-10(2)8-13(14)16-9-11-4-6-12(15-3)7-5-11/h4-7,10H,8-9H2,1-3H3","LOGIKTHBNCEEST-UHFFFAOYSA-N"
"CC(C)CCOC(=O)CC(C)CC(C)(C)C","InChI=1S/C14H28O2/c1-11(2)7-8-16-13(15)9-12(3)10-14(4,5)6/h11-12H,7-10H2,1-6H3","IXHGVSKMQLKBKI-UHFFFAOYSA-N"
"[H]C(C)=C([H])C(=O)OC(C)(C)Cc(c1)cccc1","InChI=1S/C14H18O2/c1-4-8-13(15)16-14(2,3)11-12-9-6-5-7-10-12/h4-10H,11H2,1-3H3/b8-4+","OKLPIYCKVVLHCP-XBXARRHUSA-N"
"CC(C)CCCOC(=O)c(c1)cccc1","InChI=1S/C13H18O2/c1-11(2)7-6-10-15-13(14)12-8-4-3-5-9-12/h3-5,8-9,11H,6-7,10H2,1-2H3","UUNAMHRNRUJYDO-UHFFFAOYSA-N"
"CCCCCCCCCCC(=O)OCC","InChI=1S/C13H26O2/c1-3-5-6-7-8-9-10-11-12-13(14)15-4-2/h3-12H2,1-2H3","IAFQYUQIAOWKSB-UHFFFAOYSA-N"
"CCCC=CCOC(=O)Cc(c1)cccc1","InChI=1S/C14H18O2/c1-2-3-4-8-11-16-14(15)12-13-9-6-5-7-10-13/h4-10H,2-3,11-12H2,1H3/b8-4+","BYGAPGDXGHDYGP-XBXARRHUSA-N"
"CC(=C)CCBr","InChI=1S/C5H9Br/c1-5(2)3-4-6/h1,3-4H2,2H3","IZMWJUPSQXIVDN-UHFFFAOYSA-N"
"COC(=O)C(Cl)C(C)=C","InChI=1S/C6H9ClO2/c1-4(2)5(7)6(8)9-3/h5H,1H2,2-3H3","FZUVHZZZCYKCFI-UHFFFAOYSA-N"
"COC(=O)C(C)(OC)OC","InChI=1S/C6H12O4/c1-6(9-3,10-4)5(7)8-2/h1-4H3","KHQQDBIXHUJARJ-UHFFFAOYSA-N"
"N#CCCS(=O)(=O)OC","InChI=1S/C4H7NO3S/c1-8-9(6,7)4-2-3-5/h2,4H2,1H3","VYWNBUBFYLAECR-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)NC(=S)N2","InChI=1S/C7H6N2S/c10-7-8-5-3-1-2-4-6(5)9-7/h1-4H,(H2,8,9,10)","YHMYGUUIMTVXNW-UHFFFAOYSA-N"
"OC(C1)C(C2)C(=C)C(C)(C)C12","InChI=1S/C10H16O/c1-6-8-4-7(5-9(8)11)10(6,2)3/h7-9,11H,1,4-5H2,2-3H3","CFXJOMGPUADAJE-UHFFFAOYSA-N"
"O=CCC(C1)C(C)(C)C(C)=C1","InChI=1S/C10H16O/c1-8-4-5-9(6-7-11)10(8,2)3/h4,7,9H,5-6H2,1-3H3","OGCGGWYLHSJRFY-UHFFFAOYSA-N"
"OCC(C1)=CCC(C(C)=C)C1","InChI=1S/C10H16O/c1-8(2)10-5-3-9(7-11)4-6-10/h3,10-11H,1,4-7H2,2H3","NDTYTMIUWGWIMO-UHFFFAOYSA-N"
"CCCCC(OC)=CC(C)=C","InChI=1S/C10H18O/c1-5-6-7-10(11-4)8-9(2)3/h8H,2,5-7H2,1,3-4H3/b10-8-","LRUTXLRHMKGBCN-NTMALXAHSA-N"
"O=CC=CCC(C)CC(C)C","InChI=1S/C10H18O/c1-9(2)8-10(3)6-4-5-7-11/h4-5,7,9-10H,6,8H2,1-3H3/b5-4+","LALGZGJSCVIMDQ-SNAWJCMRSA-N"
"CC(C)=CCC(C)(CC)C=O","InChI=1S/C10H18O/c1-5-10(4,8-11)7-6-9(2)3/h6,8H,5,7H2,1-4H3","LOQNRQKPDZGEBZ-UHFFFAOYSA-N"
"CC(C)=CCOCC=C(C)C","InChI=1S/C10H18O/c1-9(2)5-7-11-8-6-10(3)4/h5-6H,7-8H2,1-4H3","UATRONWBYDQKSQ-UHFFFAOYSA-N"
"O=C(C1)CC(C)(C)NC(C)(C)1","InChI=1S/C9H17NO/c1-8(2)5-7(11)6-9(3,4)10-8/h10H,5-6H2,1-4H3","JWUXJYZVKZKLTJ-UHFFFAOYSA-N"
"OCC(C(C)=C)C(C)(O)C=C","InChI=1S/C9H16O2/c1-5-9(4,11)8(6-10)7(2)3/h5,8,10-11H,1-2,6H2,3-4H3","VELVMAHUONHCSK-UHFFFAOYSA-N"
"OCC=CCCCCCC=O","InChI=1S/C9H16O2/c10-8-6-4-2-1-3-5-7-9-11/h4,6,9-10H,1-3,5,7-8H2/b6-4+","FWMKRIYREKTLSC-GQCTYLIASA-N"
"CCN(CC)CCOC(C)=O","InChI=1S/C8H17NO2/c1-4-9(5-2)6-7-11-8(3)10/h4-7H2,1-3H3","IDIFJUBLWASPDU-UHFFFAOYSA-N"
"CCOCC=C(C)C=CCl","InChI=1S/C8H13ClO/c1-3-10-7-5-8(2)4-6-9/h4-6H,3,7H2,1-2H3/b6-4+,8-5+","DFOBSVPZOINBQL-HLQBBKRNSA-N"
"OCCCCCCCCCO","InChI=1S/C9H20O2/c10-8-6-4-2-1-3-5-7-9-11/h10-11H,1-9H2","ALVZNPYWJMLXKV-UHFFFAOYSA-N"
"OCCCCCCC(C)CO","InChI=1S/C9H20O2/c1-9(8-11)6-4-2-3-5-7-10/h9-11H,2-8H2,1H3","SDQROPCSKIYYAV-UHFFFAOYSA-N"
"C=Cc(c1)ccc(c1)C(C)(C)C","InChI=1S/C12H16/c1-5-10-6-8-11(9-7-10)12(2,3)4/h5-9H,1H2,2-4H3","QEDJMOONZLUIMC-UHFFFAOYSA-N"
"CC(=O)OCC(Cl)C(C)=C","InChI=1S/C7H11ClO2/c1-5(2)7(8)4-10-6(3)9/h7H,1,4H2,2-3H3","XBHOPQWQWYJXRY-UHFFFAOYSA-N"
"ClCC(C)=CCOC(C)=O","InChI=1S/C7H11ClO2/c1-6(5-8)3-4-10-7(2)9/h3H,4-5H2,1-2H3/b6-3+","URVYVINLDPIJEH-ZZXKWVIFSA-N"
"O=CC(C)CCBr","InChI=1S/C5H9BrO/c1-5(4-7)2-3-6/h4-5H,2-3H2,1H3","HUEISMLONAXRSB-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(O)=O","InChI=1S/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)","QIQXTHQIDYTFRH-UHFFFAOYSA-N"
"CC(C4([H])C(CCC([H])(CC)C(C)C)([H])C)(C([H])3CC4)CCC(C([H])23)([H])C(C)(C1=CC2)CCC(C1)O","InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20-,21-,23+,24+,25-,26+,27+,28+,29-/m1/s1","KZJWDPNRJALLNS-VJSFXXLFSA-N"
"CC(C)=CCCC(C[Si](C)(C)C)=C([H])C[Si](C)(C)C","InChI=1S/C16H34Si2/c1-15(2)10-9-11-16(14-18(6,7)8)12-13-17(3,4)5/h10,12H,9,11,13-14H2,1-8H3/b16-12+","OCLVQVMSRGFTAZ-FOWTUZBSSA-N"
"[H]C(C[Si](C)(C)C)=C([H])C[Si](C)(C)C","InChI=1S/C10H24Si2/c1-11(2,3)9-7-8-10-12(4,5)6/h7-8H,9-10H2,1-6H3/b8-7-","DHTZZPHEAHKIBY-FPLPWBNLSA-N"
"CC(C)=CCCC(C[Si](C)(C)C)=C([H])CCC([H])=C(CCC=C(C)C)C[Si](C)(C)C","InChI=1S/C26H50Si2/c1-23(2)15-13-19-25(21-27(5,6)7)17-11-12-18-26(22-28(8,9)10)20-14-16-24(3)4/h15-18H,11-14,19-22H2,1-10H3/b25-17-,26-18+","BWUTUMBXRSCEQW-WTHRLWDASA-N"
"CCCCC(OC)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C14H30OSi/c1-8-9-10-14(15-4)13(12(2)3)11-16(5,6)7/h13-14H,2,8-11H2,1,3-7H3","YKJNQDLGBOSJKB-UHFFFAOYSA-N"
"COCC(C(C)=C)(C[Si](C)(C)C)c(c1)cccc1","InChI=1S/C16H26OSi/c1-14(2)16(12-17-3,13-18(4,5)6)15-10-8-7-9-11-15/h7-11H,1,12-13H2,2-6H3","HREYNLWFBUBNSR-UHFFFAOYSA-N"
"CCCCCCCC(OC)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C17H36OSi/c1-8-9-10-11-12-13-17(18-4)16(15(2)3)14-19(5,6)7/h16-17H,2,8-14H2,1,3-7H3","PPIZSCBITAXNHZ-UHFFFAOYSA-N"
"CC(C)CC(OC)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C14H30OSi/c1-11(2)9-14(15-5)13(12(3)4)10-16(6,7)8/h11,13-14H,3,9-10H2,1-2,4-8H3","DJNCIINENXRGIP-UHFFFAOYSA-N"
"COC(OC)(C(=O)2)C=C(C(=O)C=C2)CC(C(=O)1)=CC(OC)(OC)C(=O)C=C1","InChI=1S/C19H20O8/c1-24-18(25-2)10-12(14(20)5-7-16(18)22)9-13-11-19(26-3,27-4)17(23)8-6-15(13)21/h5-8,10-11H,9H2,1-4H3","VSNHPYQXHAUERB-UHFFFAOYSA-N"
"OCCOC(C(=O)2)=CC(=C(O)C=C2)CC(C=1)=C(O)C=CC(=O)C(OCCO)1","InChI=1S/C19H20O8/c20-5-7-26-18-10-12(14(22)1-3-16(18)24)9-13-11-19(27-8-6-21)17(25)4-2-15(13)23/h1-4,10-11,20-23H,5-9H2","TZCRLTYDWPSNKX-UHFFFAOYSA-N"
"COC(OC)(C(=O)2)C=C(C(=O)C=C2)CC(=C1)C(=O)C=CC(=O)C(=O)1","InChI=1S/C17H14O7/c1-23-17(24-2)9-11(13(19)5-6-16(17)22)7-10-8-15(21)14(20)4-3-12(10)18/h3-6,8-9H,7H2,1-2H3","SZQPLJNEWANUEH-UHFFFAOYSA-N"
"O=C(C=3)C(O)=CC(C1)=C(C3)OC(C=2)=C(C=C(O)C(=O)C2)1","InChI=1S/C15H10O5/c16-10-1-3-14-8(6-12(10)18)5-9-7-13(19)11(17)2-4-15(9)20-14/h1-4,6-7H,5H2,(H,16,18)(H,17,19)","XGPFDHDAGDKCBT-UHFFFAOYSA-N"
"COC(=C1)C(=O)C=C(C=O)C(OC)=C(C=O)1","InChI=1S/C11H10O5/c1-15-10-4-8(6-13)11(16-2)7(5-12)3-9(10)14/h3-6H,1-2H3","RFORALHKZGJPIC-UHFFFAOYSA-N"
"COC(=C1)C(=O)C=C(CO)C(OC)=C(CO)1","InChI=1S/C11H14O5/c1-15-10-4-8(6-13)11(16-2)7(5-12)3-9(10)14/h3-4,12-13H,5-6H2,1-2H3","CWVNHNFQLQMOEB-UHFFFAOYSA-N"
"O=COCC(=C1)C(OC)=C(COC=O)C=C(OC)C(=O)1","InChI=1S/C13H14O7/c1-17-12-4-10(6-20-8-15)13(18-2)9(3-11(12)16)5-19-7-14/h3-4,7-8H,5-6H2,1-2H3","PDDCWOQORITSKB-UHFFFAOYSA-N"
"COC(C(=O)1)=CC(C(Cl)Br)=C(OC)C(=C1)C(Cl)Br","InChI=1S/C11H10Br2Cl2O3/c1-17-8-4-6(11(13)15)9(18-2)5(10(12)14)3-7(8)16/h3-4,10-11H,1-2H3","YIDHYXSDJRXXGL-UHFFFAOYSA-N"
"N#CC(C=1)=CC=C(OC)C(=O)C1","InChI=1S/C9H7NO2/c1-12-9-5-3-7(6-10)2-4-8(9)11/h2-5H,1H3","DIFRASFURGHFIU-UHFFFAOYSA-N"
"COC(C=1)=CC=C(C#N)C(=O)C1","InChI=1S/C9H7NO2/c1-12-8-3-2-7(6-10)9(11)5-4-8/h2-5H,1H3","UFEQADNIIRQZNR-UHFFFAOYSA-N"
"COC(C=1)=C(O)C=C(Br)C(=N2)C1N=C(c(c3)cccc3)2","InChI=1S/C15H11BrN2O2/c1-20-13-8-11-14(10(16)7-12(13)19)18-15(17-11)9-5-3-2-4-6-9/h2-8,19H,1H3","USXRZCNGLLLIBT-UHFFFAOYSA-N"
"COC(=C1)C(Cl)=CC(Cl)=C(N=2)C(=NC(N)2)1","InChI=1S/C9H7Cl2N3O/c1-15-7-3-6-8(14-9(12)13-6)5(11)2-4(7)10/h2-3H,1H3,(H2,12,13,14)","KHAWCNUASHPRCZ-UHFFFAOYSA-N"
"COC(=C1)C(Cl)=CC(Cl)=C(OC)C(=O)1","InChI=1S/C9H8Cl2O3/c1-13-8-4-7(12)9(14-2)6(11)3-5(8)10/h3-4H,1-2H3","AUSJLBOWVUKOBM-UHFFFAOYSA-N"
"COC(=C1)C(=O)C(Br)=CC(OC)=C(Br)1","InChI=1S/C9H8Br2O3/c1-13-7-4-6(11)9(12)8(14-2)3-5(7)10/h3-4H,1-2H3","NZBMOJDPQJZJSM-UHFFFAOYSA-N"
"COC(O4)(C([H])=3)C(OC)(OCC4)C([H])=C([H])C(O1)(C([H])3)C([H])(C2)C([H])(CCCC2)1","InChI=1S/C18H26O5/c1-19-17-10-8-16(14-6-4-3-5-7-15(14)23-16)9-11-18(17,20-2)22-13-12-21-17/h8-11,14-15H,3-7,12-13H2,1-2H3/t14-,15+,17+,18+/m0/s1","RAJOABBIYPQRAC-BURFUSLBSA-N"
"COC(O4)(C=3)C(OC)(OCC4)C=CC(C3)(O1)C([H])(C2)C([H])(CCCC2)1","InChI=1S/C18H26O5/c1-19-17-10-8-16(14-6-4-3-5-7-15(14)23-16)9-11-18(17,20-2)22-13-12-21-17/h8-11,14-15H,3-7,12-13H2,1-2H3/t14-,15+,17-,18-/m0/s1","RAJOABBIYPQRAC-MVJTYMMSSA-N"
"COC(C2)C(OC)(OC)C(=O)C(C(C(=O)2)1)C(C)(C)C(C)(C)1","InChI=1S/C16H26O5/c1-14(2)11-9(17)8-10(19-5)16(20-6,21-7)13(18)12(11)15(14,3)4/h10-12H,8H2,1-7H3","UIMMCMGWKYSAKB-UHFFFAOYSA-N"
"COC(C1)C(OC)(OC)C(=O)CC(C(=O)1)C(C)(C)C(C)=C","InChI=1S/C16H26O5/c1-10(2)15(3,4)11-8-13(18)16(20-6,21-7)14(19-5)9-12(11)17/h11,14H,1,8-9H2,2-7H3","SUHFJSXLSLQLEM-UHFFFAOYSA-N"
"COC(C1)C(OC)(O2)C(=O)C(C(C)(C)3)C(C(C)(C)3)C(O)12","InChI=1S/C15H24O5/c1-12(2)9-10(13(12,3)4)14(17)7-8(18-5)15(19-6,20-14)11(9)16/h8-10,17H,7H2,1-6H3","WGOYWHAARDGZFT-UHFFFAOYSA-N"
"O=C(C=2)C(=CC=CC2)C(O)C(=O)c(c1)cccc1","InChI=1S/C15H12O3/c16-13-10-6-2-5-9-12(13)15(18)14(17)11-7-3-1-4-8-11/h1-10,15,18H","OLNQOXJVJAIPDC-UHFFFAOYSA-N"
"O=C(C=2)C(=CC=CC2)OCC(=O)c(c1)cccc1","InChI=1S/C15H12O3/c16-13-9-5-2-6-10-15(13)18-11-14(17)12-7-3-1-4-8-12/h1-10H,11H2","UJDSFPNTKNDAMY-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)C(O)C(=C1)C(=O)C=CC=C1","InChI=1S/C14H11NO4/c16-13-5-3-1-2-4-12(13)14(17)10-6-8-11(9-7-10)15(18)19/h1-9,14,17H","HQAWDVIRRDZIJT-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(COC(=C2)C(=O)C=CC=C2)c1","InChI=1S/C14H11NO4/c16-13-4-2-1-3-5-14(13)19-10-11-6-8-12(9-7-11)15(17)18/h1-9H,10H2","YQDITWJHEDBVFV-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)CC(C=1)=C(O)C(=O)C=CC1","InChI=1S/C14H11NO4/c16-13-4-2-1-3-11(14(13)17)9-10-5-7-12(8-6-10)15(18)19/h1-8H,9H2,(H,16,17)","QEWMKMWSHRWWCF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)C(=O)C(=C1)C(=O)C=CC=C1","InChI=1S/C14H9NO4/c16-13-5-3-1-2-4-12(13)14(17)10-6-8-11(9-7-10)15(18)19/h1-9H","DPDUPPFWOQSVOI-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(ccc2)COC(=C1)C(=O)C=CC=C1","InChI=1S/C14H11NO4/c16-13-8-2-1-3-9-14(13)19-10-11-6-4-5-7-12(11)15(17)18/h1-9H,10H2","GUHSTALJCPCBCR-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(ccc2)C(O)C(=C1)C(=O)C=CC=C1","InChI=1S/C14H11NO4/c16-13-9-3-1-2-7-11(13)14(17)10-6-4-5-8-12(10)15(18)19/h1-9,14,17H","TYBBZOHAZCTKQD-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(ccc2)C(=O)C(=C1)C(=O)C=CC=C1","InChI=1S/C14H9NO4/c16-13-9-3-1-2-7-11(13)14(17)10-6-4-5-8-12(10)15(18)19/h1-9H","YXHHICOYDJWCOU-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)c(ccc2)CC(C=1)=C(O)C(=O)C=CC1","InChI=1S/C14H11NO4/c16-13-8-4-2-6-11(14(13)17)9-10-5-1-3-7-12(10)15(18)19/h1-8H,9H2,(H,16,17)","HOJQSUBDFKNVKD-UHFFFAOYSA-N"
"N#Cc(c2)ccc(c2)COC(=C1)C(=O)C=CC=C1","InChI=1S/C15H11NO2/c16-10-12-6-8-13(9-7-12)11-18-15-5-3-1-2-4-14(15)17/h1-9H,11H2","WQJUWUHKKDMSPZ-UHFFFAOYSA-N"
"N#Cc(c2)ccc(c2)C(O)C(=C1)C(=O)C=CC=C1","InChI=1S/C15H11NO2/c16-10-11-6-8-12(9-7-11)15(18)13-4-2-1-3-5-14(13)17/h1-9,15,18H","SORHFSQLOUGOPY-UHFFFAOYSA-N"
"N#Cc(c2)ccc(c2)CC(C=1)=C(O)C(=O)C=CC1","InChI=1S/C15H11NO2/c16-10-12-7-5-11(6-8-12)9-13-3-1-2-4-14(17)15(13)18/h1-8H,9H2,(H,17,18)","WQDUXUJAXAOQBE-UHFFFAOYSA-N"
"N#Cc(c2)ccc(c2)C(=O)C(=C1)C(=O)C=CC=C1","InChI=1S/C15H9NO2/c16-10-11-6-8-12(9-7-11)15(18)13-4-2-1-3-5-14(13)17/h1-9H","KRIPUWQLSDXBOL-UHFFFAOYSA-N"
"O=C(C=1)C=C(Cc(c2)c(=O)ccc(=O)2)C(=O)C(=O)C1","InChI=1S/C14H8O5/c15-10-1-3-12(17)8(6-10)5-9-7-11(16)2-4-13(18)14(9)19/h1-4,6-7H,5H2","YLLPXPYEYICKHQ-UHFFFAOYSA-N"
"COC(C=1)=CC(Cc(c2)c(OC)ccc(OC)2)=C(O)C(=O)C1","InChI=1S/C17H18O5/c1-20-13-4-6-15(18)17(19)12(10-13)8-11-9-14(21-2)5-7-16(11)22-3/h4-7,9-10H,8H2,1-3H3,(H,18,19)","NMNFOMPWPNEJQZ-UHFFFAOYSA-N"
"COC(C=1)=CC=C(OCc(c2)c(OC)ccc(OC)2)C(=O)C1","InChI=1S/C17H18O5/c1-19-13-4-7-15(18)17(9-5-13)22-11-12-10-14(20-2)6-8-16(12)21-3/h4-10H,11H2,1-3H3","OXGLZJKALWCSBY-UHFFFAOYSA-N"
"COc(c1)cc(COC(C=2)=CC=C(OCc(c3)c(OC)ccc(OC)3)C(=O)C2)c(OC)c1","InChI=1S/C25H26O7/c1-27-20-7-10-23(29-3)17(13-20)15-31-19-5-9-22(26)25(12-6-19)32-16-18-14-21(28-2)8-11-24(18)30-4/h5-14H,15-16H2,1-4H3","BTDOHJVONCBIDJ-UHFFFAOYSA-N"
"COC(C=1)=CC(Cc(c2)c(O)ccc(O)2)=C(O)C(=O)C1","InChI=1S/C15H14O5/c1-20-12-3-5-14(18)15(19)10(8-12)6-9-7-11(16)2-4-13(9)17/h2-5,7-8,16-17H,6H2,1H3,(H,18,19)","HJUCPFRBLHIFQK-UHFFFAOYSA-N"
"Oc(c2)cc(c(O)c2)CC(C=1)=C(O)C(=O)C=CC1","InChI=1S/C14H12O4/c15-11-5-6-12(16)10(8-11)7-9-3-1-2-4-13(17)14(9)18/h1-6,8,15-16H,7H2,(H,17,18)","UHEXLZKTMXICMW-UHFFFAOYSA-N"
"[H]C(=C([H])5)C([H])(C6)C([H])(C(=O)2)C([H])(C([H])56)C(O)(O1)C([H])(C([H])43)C([H])(C([H])(C([H])=C([H])4)C3)C(O)12","InChI=1S/C17H18O4/c18-15-11-7-1-2-8(5-7)12(11)16(19)13-9-3-4-10(6-9)14(13)17(15,20)21-16/h1-4,7-14,19-20H,5-6H2/t7-,8+,9-,10+,11-,12+,13-,14+,16+,17+/m1/s1","SKRUUDMFLAUSSA-VCKMBKSSSA-N"
"[O-1][N+1](=O)c(c3)ccc(c3)C(=C1)C(=O)C(CO)(C=2)OOC([H])(C2)1","InChI=1S/C14H11NO6/c16-8-14-6-5-11(20-21-14)7-12(13(14)17)9-1-3-10(4-2-9)15(18)19/h1-7,11,16H,8H2/t11-,14-/m1/s1","UEPTVYSFHFQVPN-BXUZGUMPSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)C(O)C(C=1)=C(O)C(=O)C=CC(O)1","InChI=1S/C14H11NO6/c16-10-5-6-12(17)14(19)11(7-10)13(18)8-1-3-9(4-2-8)15(20)21/h1-7,13,16,18H,(H,17,19)","CLBFYQWYKNULEN-UHFFFAOYSA-N"
"OC(C=1)=C(O)C=C(O)C(=O)C1","InChI=1S/C7H6O4/c8-4-1-2-5(9)7(11)3-6(4)10/h1-3,8,10H,(H,9,11)","ZAPHQLHLADILCT-UHFFFAOYSA-N"
"OC(C=1)=CC(O)=C(O)C(=O)C1","InChI=1S/C7H6O4/c8-4-1-2-5(9)7(11)6(10)3-4/h1-3,8H,(H2,9,10,11)","BOMIBDWIMZZUQG-UHFFFAOYSA-N"
"OC(=C1)C=C(O)C(=O)C=C1","InChI=1S/C7H6O3/c8-5-2-1-3-6(9)7(10)4-5/h1-4,8H,(H,9,10)","RKXGVTMRMCCCBZ-UHFFFAOYSA-N"
"CC(=O)OC(C=1)=C(O)C=CC(=O)C(OC(C)=O)1","InChI=1S/C11H10O6/c1-6(12)16-10-5-11(17-7(2)13)9(15)4-3-8(10)14/h3-5,14H,1-2H3","UMOQNBAISYUNIS-UHFFFAOYSA-N"
"OC(=C1)C(O)=C(O)C(=O)C(O)=C(O)1","InChI=1S/C7H6O6/c8-2-1-3(9)5(11)7(13)6(12)4(2)10/h1H,(H5,8,9,10,11,12,13)","VABYACDHEFDFHB-UHFFFAOYSA-N"
"Oc(c(=O)1)c(Br)c(=O)c(O)c(Br)1","InChI=1S/C6H2Br2O4/c7-1-3(9)5(11)2(8)6(12)4(1)10/h9,12H","GMZWPTALVQRAFV-UHFFFAOYSA-N"
"CC(=O)OC(C=1)=CC=C(Cl)C(=O)C1","InChI=1S/C9H7ClO3/c1-6(11)13-7-2-4-8(10)9(12)5-3-7/h2-5H,1H3","KRFUKQNYRDCNMT-UHFFFAOYSA-N"
"CC(=O)OC(=C1)C=C(OC(C)=O)C(=O)C=C1","InChI=1S/C11H10O5/c1-7(12)15-9-4-3-5-10(14)11(6-9)16-8(2)13/h3-6H,1-2H3","ZUSXPTRTFGWRGC-UHFFFAOYSA-N"
"CC(=O)OC(C=1)=CC=C(OC(C)=O)C(=O)C1","InChI=1S/C11H10O5/c1-7(12)15-9-3-5-10(14)11(6-4-9)16-8(2)13/h3-6H,1-2H3","GPEJEGNRYNDERJ-UHFFFAOYSA-N"
"CC(=O)OC(C)(O1)OC(=C2)C(=CC=CC(=O)2)1","InChI=1S/C11H10O5/c1-7(12)14-11(2)15-9-5-3-4-8(13)6-10(9)16-11/h3-6H,1-2H3","ZEYVRYAHQHZYAS-UHFFFAOYSA-N"
"CC(=O)OC(C=2)=C(O1)C(=CC(=O)C2)OC(C)(OC(C)=O)1","InChI=1S/C13H12O7/c1-7(14)17-10-5-4-9(16)6-11-12(10)20-13(3,19-11)18-8(2)15/h4-6H,1-3H3","ZJERKLLBVPHICY-UHFFFAOYSA-N"
"CC(=O)OC(C(=O)1)=CC(OC(C)=O)=C(OC(C)=O)C=C1","InChI=1S/C13H12O7/c1-7(14)18-11-5-4-10(17)12(19-8(2)15)6-13(11)20-9(3)16/h4-6H,1-3H3","CZVMIRNVNYDTAP-UHFFFAOYSA-N"
"OC(=C1)C(O)=CC(=O)C(O)=C(O)1","InChI=1S/C7H6O5/c8-3-1-5(10)7(12)6(11)2-4(3)9/h1-2,8-9H,(H2,10,11,12)","OYNOLDLNCWFUGQ-UHFFFAOYSA-N"
"CC(=O)OC(C=1)=C(OC(C)=O)C(=O)C(OC(C)=O)=C(OC(C)=O)C(OC(C)=O)1","InChI=1S/C17H16O11/c1-7(18)24-12-6-13(25-8(2)19)16(27-10(4)21)17(28-11(5)22)14(23)15(12)26-9(3)20/h6H,1-5H3","JOPGSNJBUJIPBG-UHFFFAOYSA-N"
"CC(=O)OC(C(=O)1)=C(OC(C)=O)C(OC(C)=O)=C(OC(C)=O)C(OC(C)=O)=C(OC(C)=O)1","InChI=1S/C19H18O13/c1-7(20)27-14-13(26)15(28-8(2)21)17(30-10(4)23)19(32-12(6)25)18(31-11(5)24)16(14)29-9(3)22/h1-6H3","HPDMRQSEFFTVEP-UHFFFAOYSA-N"
"CC(=O)OC(C(=O)1)=C(OC(C)=O)C(Br)=C(OC(C)=O)C(Br)=C(OC(C)=O)1","InChI=1S/C15H12Br2O9/c1-5(18)23-12-9(16)13(24-6(2)19)11(22)15(26-8(4)21)14(10(12)17)25-7(3)20/h1-4H3","ZBEBBYOEUQBQIN-UHFFFAOYSA-N"
"CC(=O)OC(C(OC(C)=O)=1)=C(OC(C)=O)C(OC(C)=O)=C(Br)C(=O)C(Br)1","InChI=1S/C15H12Br2O9/c1-5(18)23-12-9(16)11(22)10(17)13(24-6(2)19)15(26-8(4)21)14(12)25-7(3)20/h1-4H3","OVLXPKLMKCUCCT-UHFFFAOYSA-N"
"CC(=O)OC(C(=O)1)=CC(=CC=C1)C(C)(C)C(C)=O","InChI=1S/C14H16O4/c1-9(15)14(3,4)11-6-5-7-12(17)13(8-11)18-10(2)16/h5-8H,1-4H3","CTDUBIYVRQYYGP-UHFFFAOYSA-N"
"CC(=O)OC(=C1)C(=O)C(Br)=CC=C(C(C)=C)1","InChI=1S/C12H11BrO3/c1-7(2)9-4-5-10(13)12(15)11(6-9)16-8(3)14/h4-6H,1H2,2-3H3","HIBFSWCZVGKBTJ-UHFFFAOYSA-N"
"CC(=O)OC(=C1)C(=O)C(Br)=CC(Br)=C(C(C)C)1","InChI=1S/C12H12Br2O3/c1-6(2)8-4-11(17-7(3)15)12(16)10(14)5-9(8)13/h4-6H,1-3H3","GIBNCJOKXOOCQH-UHFFFAOYSA-N"
"CC(=O)OC(=C1)C(=O)C(Br)=CC(C(C)C)=C1","InChI=1S/C12H13BrO3/c1-7(2)9-4-5-11(16-8(3)14)12(15)10(13)6-9/h4-7H,1-3H3","QZMPRHJMCLUQKR-UHFFFAOYSA-N"
"CC(=O)OC(=C1)C(=O)C(Br)=CC=C(C(C)C)1","InChI=1S/C12H13BrO3/c1-7(2)9-4-5-10(13)12(15)11(6-9)16-8(3)14/h4-7H,1-3H3","SYQLLXDEKXXDMQ-UHFFFAOYSA-N"
"CC(=O)OC(=C(Br)1)C(=O)C(Br)=CC(C(C)C)=C1","InChI=1S/C12H12Br2O3/c1-6(2)8-4-9(13)11(16)12(10(14)5-8)17-7(3)15/h4-6H,1-3H3","XJELUYXYWMSKQQ-UHFFFAOYSA-N"
"CC(=O)OC(=C1)C(=O)C(OC(C)=O)=C(OC(C)=O)C=C1C(C)(C)C(C)=O","InChI=1S/C18H20O8/c1-9(19)18(5,6)13-7-14(24-10(2)20)16(23)17(26-12(4)22)15(8-13)25-11(3)21/h7-8H,1-6H3","VMFYQCVEDSAPFV-UHFFFAOYSA-N"
"CC(=O)OC(=C1)C(=O)C(OC(C)=O)=CC(OC(C)=O)=C(C(C)C)1","InChI=1S/C16H18O7/c1-8(2)12-6-14(22-10(4)18)16(20)15(23-11(5)19)7-13(12)21-9(3)17/h6-8H,1-5H3","NYJSQJPBAPPHFB-UHFFFAOYSA-N"
"COC(C=1)=CC=C(OC(C)=O)C(=O)C1","InChI=1S/C10H10O4/c1-7(11)14-10-6-4-8(13-2)3-5-9(10)12/h3-6H,1-2H3","NDHISNMUYAMLPD-UHFFFAOYSA-N"
"COc(c(=O)1)c(C=2)c(=CC=CC2)o1","InChI=1S/C10H8O3/c1-12-9-7-5-3-2-4-6-8(7)13-10(9)11/h2-6H,1H3","KXRAZATUPOYORP-UHFFFAOYSA-N"
"COC(=O)C(=O)C(=C1)C(=O)C=CC=C1","InChI=1S/C10H8O4/c1-14-10(13)9(12)7-5-3-2-4-6-8(7)11/h2-6H,1H3","KKPYXPMMTHQRSE-UHFFFAOYSA-N"
"COC(=O)C=CC(O)C(=C1)C(=O)C=CC=C1","InChI=1S/C12H12O4/c1-16-12(15)8-7-11(14)9-5-3-2-4-6-10(9)13/h2-8,11,14H,1H3/b8-7+","PYVWHKSVWRXPFG-BQYQJAHWSA-N"
"COC(=O)COC(=C1)C(=O)C=CC=C1","InChI=1S/C10H10O4/c1-13-10(12)7-14-9-6-4-2-3-5-8(9)11/h2-6H,7H2,1H3","ABVAAXUFYQFKAF-UHFFFAOYSA-N"
"COC(=O)CC(O1)C(=O)C(C=2)=C(CC=CC2)1","InChI=1S/C12H12O4/c1-15-11(13)7-10-12(14)8-5-3-2-4-6-9(8)16-10/h2-5,10H,6-7H2,1H3","ZBSKGQBBAXFNSN-UHFFFAOYSA-N"
"N#CC(=C1)C(OC)(OC)C(C)=CC(=O)C(OC)(OC)1","InChI=1S/C13H17NO5/c1-9-6-11(15)12(16-2,17-3)7-10(8-14)13(9,18-4)19-5/h6-7H,1-5H3","CRYFZCOBWRLGAO-UHFFFAOYSA-N"
"COC(=C1)C(=O)C=C(C)C(OC)=C(C#N)1","InChI=1S/C11H11NO3/c1-7-4-9(13)10(14-2)5-8(6-12)11(7)15-3/h4-5H,1-3H3","XOMRSXZBQITBJM-UHFFFAOYSA-N"
"ON=CC(C=1)=C(OC)C(C)=CC(=O)C(OC)1","InChI=1S/C11H13NO4/c1-7-4-9(13)10(15-2)5-8(6-12-14)11(7)16-3/h4-6,14H,1-3H3/b12-6+","HOXZHEKIYPQARD-WUXMJOGZSA-N"
"COC(=C1)C(=O)C=C(C)C(OC)=C(C=O)1","InChI=1S/C11H12O4/c1-7-4-9(13)10(14-2)5-8(6-12)11(7)15-3/h4-6H,1-3H3","ZOBRQZZPTDYMAZ-UHFFFAOYSA-N"
"COC(=C1)C(=O)C=C(CCl)C(OC)=C(C=O)1","InChI=1S/C11H11ClO4/c1-15-10-4-8(6-13)11(16-2)7(5-12)3-9(10)14/h3-4,6H,5H2,1-2H3","RHSKIWXYNHODDC-UHFFFAOYSA-N"
"COC(=C1)C(=O)C=C(CCl)C(OC)=C(COC(C)=O)1","InChI=1S/C13H15ClO5/c1-8(15)19-7-10-5-12(17-2)11(16)4-9(6-14)13(10)18-3/h4-5H,6-7H2,1-3H3","ICKSNKDROIPJMM-UHFFFAOYSA-N"
"COC(=C1)C(=O)C=C(CCl)C(OC)=C(CCl)1","InChI=1S/C11H12Cl2O3/c1-15-10-4-8(6-13)11(16-2)7(5-12)3-9(10)14/h3-4H,5-6H2,1-2H3","FXGDKIXACHRQHF-UHFFFAOYSA-N"
"[H]C(=C([H])1)C(=O)C(O)(O2)C([H])=C([H])C(C)12","InChI=1S/C8H8O3/c1-7-3-2-6(9)8(10,11-7)5-4-7/h2-5,10H,1H3","KCASXUNOGTWUGY-UHFFFAOYSA-N"
"CCCCC(C=1)(C=2)OC(O)(C2)C(=O)C1","InChI=1S/C11H14O3/c1-2-3-5-10-6-4-9(12)11(13,14-10)8-7-10/h4,6-8,13H,2-3,5H2,1H3","WVIFTNWOWQFOCS-UHFFFAOYSA-N"
"COC(=O)CC(C21)C(C=C(OCc(c3)cccc3)CC2)1","InChI=1S/C17H20O3/c1-19-17(18)10-16-14-8-7-13(9-15(14)16)20-11-12-5-3-2-4-6-12/h2-6,9,14-16H,7-8,10-11H2,1H3","UVINBQOYXMKEEA-UHFFFAOYSA-N"
"BrCC(C)c(c1)cccc1","InChI=1S/C9H11Br/c1-8(7-10)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3","XJWVCWQKZQENDS-UHFFFAOYSA-N"
"Nc(n1)scc1","InChI=1S/C3H4N2S/c4-3-5-1-2-6-3/h1-2H,(H2,4,5)","RAIPHJJURHTUIC-UHFFFAOYSA-N"
"N#Cc(c1)ccc(Br)c1","InChI=1S/C7H4BrN/c8-7-3-1-6(5-9)2-4-7/h1-4H","HQSCPPCMBMFJJN-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cnc(Cl)c1","InChI=1S/C5H3ClN2O2/c6-5-2-1-4(3-7-5)8(9)10/h1-3H","BAZVFQBTJPBRTJ-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)cc(c3)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C20H14/c1-3-7-17-13-19(11-9-15(17)5-1)20-12-10-16-6-2-4-8-18(16)14-20/h1-14H","MSBVBOUOMVTWKE-UHFFFAOYSA-N"
"CC(C)C(C3)=CC(=C2)C([H])(C3)C(C)(C1)C([H])(C2)C(C)(C(O)=O)CC1","InChI=1S/C20H30O2/c1-13(2)14-6-8-16-15(12-14)7-9-17-19(16,3)10-5-11-20(17,4)18(21)22/h7,12-13,16-17H,5-6,8-11H2,1-4H3,(H,21,22)/t16-,17+,19+,20+/m0/s1","RSWGJHLUYNHPMX-ONCXSQPRSA-N"
"C1=CC2=NNN=C2C=C1","InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)","QRUDEWIWKLJBPS-UHFFFAOYSA-N"
"c(c3)cc(n1)c(c3)c(c2)c(ccc2)n1","InChI=1S/C12H8N2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)14-13-11/h1-8H","SWJXWSAKHXBQSY-UHFFFAOYSA-N"
"CC(=O)c(c1)ccc(C(C)=O)c1","InChI=1S/C10H10O2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h3-6H,1-2H3","SKBBQSLSGRSQAJ-UHFFFAOYSA-N"
"NCc(c1)ccc(OC)c1","InChI=1S/C8H11NO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,6,9H2,1H3","IDPURXSQCKYKIJ-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C3=CC=CC=C3N2","InChI=1S/C12H9N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8,13H","UJOBWOGCFQCDNV-UHFFFAOYSA-N"
"OC(=O)C=C(C)C(O)=O","InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2-","HNEGQIOMVPPMNR-IHWYPQMZSA-N"
"Cc(c2)ccc(c2)C(=O)c(c1)ccc(C)c1","InChI=1S/C15H14O/c1-11-3-7-13(8-4-11)15(16)14-9-5-12(2)6-10-14/h3-10H,1-2H3","ZWPWLKXZYNXATK-UHFFFAOYSA-N"
"N#Cc(c1)ccc(Cl)c1","InChI=1S/C7H4ClN/c8-7-3-1-6(5-9)2-4-7/h1-4H","GJNGXPDXRVXSEH-UHFFFAOYSA-N"
"O=c(c(=O)1)c(Cl)c(Cl)c(Cl)c(Cl)1","InChI=1S/C6Cl4O2/c7-1-2(8)4(10)6(12)5(11)3(1)9","VRGCYEIGVVTZCC-UHFFFAOYSA-N"
"Oc(c1)cc(Cl)c(O)c1","InChI=1S/C6H5ClO2/c7-5-3-4(8)1-2-6(5)9/h1-3,8-9H","AJPXTSMULZANCB-UHFFFAOYSA-N"
"ON=C(C)C(C)=O","InChI=1S/C4H7NO2/c1-3(5-7)4(2)6/h7H,1-2H3/b5-3-","FSEUPUDHEBLWJY-HYXAFXHYSA-N"
"Clc(c3)c(c(=O)1)c(cc3)c(=O)c(c2)c(ccc2)1","InChI=1S/C14H7ClO2/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7H","BOCJQSFSGAZAPQ-UHFFFAOYSA-N"
"N(C43[H])(C(C4([H])NC(c(c5)cccc5)=O)=O)C([H])(C(C)(C)S3=O)C(=O)OC(c(c2)cccc2)c(c1)cccc1","InChI=1S/C28H26N2O5S/c1-28(2)23(27(33)35-22(18-12-6-3-7-13-18)19-14-8-4-9-15-19)30-25(32)21(26(30)36(28)34)29-24(31)20-16-10-5-11-17-20/h3-17,21-23,26H,1-2H3,(H,29,31)/t21-,23+,26-,36?/m1/s1","MPRIHCHLMOZDFF-ANSIFLQFSA-N"
"[H]C(C1)(O5)C(C(C)C5(C6)OCC(C6)C)([H])C(C4)(C1(C([H])(C3)C(C4)([H])C(C)(C2)C(C3)([H])C(OC(C)=O)C(C2OC(C)=O)OC(C)=O)[H])C","InChI=1S/C33H50O8/c1-17-10-13-33(37-16-17)18(2)28-26(41-33)14-25-22-8-9-24-29(39-20(4)35)30(40-21(5)36)27(38-19(3)34)15-32(24,7)23(22)11-12-31(25,28)6/h17-18,22-30H,8-16H2,1-7H3/t17-,18+,22-,23+,24-,25+,26+,27+,28+,29-,30-,31+,32-,33-/m1/s1","NDAJYCUWBPMDDU-DSEUKREJSA-N"
"COC(=O)C(C)Cc(c1)ccc(c1)C(C)C(=O)OC","InChI=1S/C15H20O4/c1-10(14(16)18-3)9-12-5-7-13(8-6-12)11(2)15(17)19-4/h5-8,10-11H,9H2,1-4H3","HWGFJGIDJHBXPQ-UHFFFAOYSA-N"
"OC(=O)C(C)Cc(c1)ccc(c1)C(C)C(O)=O","InChI=1S/C13H16O4/c1-8(12(14)15)7-10-3-5-11(6-4-10)9(2)13(16)17/h3-6,8-9H,7H2,1-2H3,(H,14,15)(H,16,17)","DIVLBIVDYADZPL-UHFFFAOYSA-N"
"[H]C(C(C)C)(CC)C=CC([H])(C)C(C1)([H])C(C)(C4)C(C(=C2[H])C([H])(C4)C(C)(C3)C([H])(CC(OC(C)=O)(C3)[H])C2)([H])C1","InChI=1S/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-10,12,20-21,23-25,27-29H,8,11,13-19H2,1-7H3/b10-9+/t21-,23-,24+,25+,27-,28+,29+,30+,31-/m1/s1","VQLULFBGTFJDEB-LSEHKVPYSA-N"
"","InChI=1S/C36H68O5Si3/c1-23-16-19-36(37-22-23)24(2)31-29(38-36)20-28-25-14-15-27-32(40-43(8,9)10)33(41-44(11,12)13)30(39-42(5,6)7)21-35(27,4)26(25)17-18-34(28,31)3/h23-33H,14-22H2,1-13H3/t23-,24+,25-,26+,27-,28+,29+,30+,31+,32-,33-,34+,35-,36-/m1/s1","KHMJYEMFAXORTC-QJGHFXDPSA-N"
"C(C4)(C([H])(C(C(C)3C4)(CCC3(C(CCC([H])(C(C)C)CC)([H])C)[H])[H])2)([H])C(C([H])1CC2)(C)CCC(OC(C)=O)([H])C1","InChI=1S/C31H54O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h20-21,23-29H,8-19H2,1-7H3/t21-,23-,24+,25+,26+,27-,28+,29+,30+,31-/m1/s1","UOLJGJFAVGOXAH-FATFFRGYSA-N"
"OCc(c1)c(Cl)ccc(Cl)1","InChI=1S/C7H6Cl2O/c8-6-1-2-7(9)5(3-6)4-10/h1-3,10H,4H2","LCEIGNVIDJNUGF-UHFFFAOYSA-N"
"O=Cc(c(Cl)1)c(Cl)ccc1","InChI=1S/C7H4Cl2O/c8-6-2-1-3-7(9)5(6)4-10/h1-4H","DMIYKWPEFRFTPY-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)NC(=S)Nc(c1)ccc(C)c1","InChI=1S/C15H16N2S/c1-11-3-7-13(8-4-11)16-15(18)17-14-9-5-12(2)6-10-14/h3-10H,1-2H3,(H2,16,17,18)","ULNVBRUIKLYGDF-UHFFFAOYSA-N"
"N#CCc(c1)cc(OC)c(OC)c1","InChI=1S/C10H11NO2/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,7H,5H2,1-2H3","ASLSUMISAQDOOB-UHFFFAOYSA-N"
"c(c3)cc(C1)c(c3)Cc(c2)c(ccc2)1","InChI=1S/C14H12/c1-2-6-12-10-14-8-4-3-7-13(14)9-11(12)5-1/h1-8H,9-10H2","WPDAVTSOEQEGMS-UHFFFAOYSA-N"
"COC(=O)C(C)c(c1)ccc(c1)CC(C)(C)O[Si](C)(C)C","InChI=1S/C17H28O3Si/c1-13(16(18)19-4)15-10-8-14(9-11-15)12-17(2,3)20-21(5,6)7/h8-11,13H,12H2,1-7H3","WFEHSHGOHBYVIW-UHFFFAOYSA-N"
"Nc(c1)c(N)cnc1","InChI=1S/C5H7N3/c6-4-1-2-8-3-5(4)7/h1-3H,7H2,(H2,6,8)","OYTKINVCDFNREN-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)SSc(c1)ccc(N)c1","InChI=1S/C12H12N2S2/c13-9-1-5-11(6-2-9)15-16-12-7-3-10(14)4-8-12/h1-8H,13-14H2","MERLDGDYUMSLAY-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(Cl)cc(Cl)1","InChI=1S/C7H4Cl2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)","CXKCZFDUOYMOOP-UHFFFAOYSA-N"
"[O-1][n+1](c1)cc(C)c([N+1]([O-1])=O)c(C)1","InChI=1S/C7H8N2O3/c1-5-3-8(10)4-6(2)7(5)9(11)12/h3-4H,1-2H3","VLKVMXPKEDVNBO-UHFFFAOYSA-N"
"OC(=O)c(c1)c(F)cc(F)c1","InChI=1S/C7H4F2O2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)","NJYBIFYEWYWYAN-UHFFFAOYSA-N"
"Nc(c1)cc(Cl)c(c1)[N+1]([O-1])=O","InChI=1S/C6H5ClN2O2/c7-5-3-4(8)1-2-6(5)9(10)11/h1-3H,8H2","LDSIOPGMLLPSSR-UHFFFAOYSA-N"
"CC(=O)c(c1)cc(Cl)c(Cl)c1","InChI=1S/C8H6Cl2O/c1-5(11)6-2-3-7(9)8(10)4-6/h2-4H,1H3","WBPAOUHWPONFEQ-UHFFFAOYSA-N"
"CC(C)NC(=S)NC(C)C","InChI=1S/C7H16N2S/c1-5(2)8-7(10)9-6(3)4/h5-6H,1-4H3,(H2,8,9,10)","KREOCUNMMFZOOS-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(=O)c(c1)ccc(Cl)c1","InChI=1S/C13H8Cl2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H","OKISUZLXOYGIFP-UHFFFAOYSA-N"
"OCc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C7H7NO3/c9-5-6-1-3-7(4-2-6)8(10)11/h1-4,9H,5H2","JKTYGPATCNUWKN-UHFFFAOYSA-N"
"CN=Cc(c1)cc(c2)c(ccc2)c1","InChI=1S/C12H11N/c1-13-9-10-6-7-11-4-2-3-5-12(11)8-10/h2-9H,1H3/b13-9+","AGGXQDCVTKTEKZ-UKTHLTGXSA-N"
"O=C(OCc(c2)cc(Br)cc2)c(c1)cccc1","InChI=1S/C14H11BrO2/c15-13-8-4-5-11(9-13)10-17-14(16)12-6-2-1-3-7-12/h1-9H,10H2","WXYMOFXETVOVOQ-UHFFFAOYSA-N"
"O=C(OCc(c3)ccc(c3)Oc(c2)cccc2)c(c1)cccc1","InChI=1S/C20H16O3/c21-20(17-7-3-1-4-8-17)22-15-16-11-13-19(14-12-16)23-18-9-5-2-6-10-18/h1-14H,15H2","HFCGLKMZOCCWJM-UHFFFAOYSA-N"
"COc(c2)ccc(c2)COC(=O)c(c1)cccc1","InChI=1S/C15H14O3/c1-17-14-9-7-12(8-10-14)11-18-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3","CSEIPVUFFJWROQ-UHFFFAOYSA-N"
"CC(C)c(c2)ccc(c2)COC(=O)c(c1)cccc1","InChI=1S/C17H18O2/c1-13(2)15-10-8-14(9-11-15)12-19-17(18)16-6-4-3-5-7-16/h3-11,13H,12H2,1-2H3","OQURVZTUQABOQM-UHFFFAOYSA-N"
"CCc(c2)ccc(c2)COC(=O)c(c1)cccc1","InChI=1S/C16H16O2/c1-2-13-8-10-14(11-9-13)12-18-16(17)15-6-4-3-5-7-15/h3-11H,2,12H2,1H3","FUFNEZBKELYSFQ-UHFFFAOYSA-N"
"O=C(OCc(c4)cc(c2)c(c4)cc(c3)c(ccc3)2)c(c1)cccc1","InChI=1S/C22H16O2/c23-22(17-6-2-1-3-7-17)24-15-16-10-11-20-13-18-8-4-5-9-19(18)14-21(20)12-16/h1-14H,15H2","UODPUBSZQFTKCR-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(=O)OCc(c3)c(c1)c(cc3)cc(c2)c(ccc2)1","InChI=1S/C22H16O2/c23-22(16-7-2-1-3-8-16)24-15-20-12-6-11-19-13-17-9-4-5-10-18(17)14-21(19)20/h1-14H,15H2","YAIFFFPHLGMLMV-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(=O)OCc(c1)c(c3)c(ccc3)c(c2)c(ccc2)1","InChI=1S/C22H16O2/c23-22(16-8-2-1-3-9-16)24-15-18-14-17-10-4-5-11-19(17)21-13-7-6-12-20(18)21/h1-14H,15H2","FWBGAUWDNWOMIK-UHFFFAOYSA-N"
"O=C(OCc(c4)cc(c(c4)2)c(c3)c(ccc3)cc2)c(c1)cccc1","InChI=1S/C22H16O2/c23-22(19-7-2-1-3-8-19)24-15-16-10-11-18-13-12-17-6-4-5-9-20(17)21(18)14-16/h1-14H,15H2","XAFQMORPGNCYES-UHFFFAOYSA-N"
"O=C(OCc(c4)cc(c2)c(c4)c(c3)c(ccc3)c2)c(c1)cccc1","InChI=1S/C22H16O2/c23-22(18-7-2-1-3-8-18)24-15-16-10-13-21-19(14-16)12-11-17-6-4-5-9-20(17)21/h1-14H,15H2","TZUZYSURWJLIHM-UHFFFAOYSA-N"
"O=C(OCc(c2)c(Cl)ccc2)c(c1)cccc1","InChI=1S/C14H11ClO2/c15-13-9-5-4-8-12(13)10-17-14(16)11-6-2-1-3-7-11/h1-9H,10H2","GTNDJMMELYTFKN-UHFFFAOYSA-N"
"CCOc(c2)c(ccc2)COC(=O)c(c1)cccc1","InChI=1S/C16H16O3/c1-2-18-15-11-7-6-10-14(15)12-19-16(17)13-8-4-3-5-9-13/h3-11H,2,12H2,1H3","KSHGBOHKBAUECJ-UHFFFAOYSA-N"
"O=C(OCc(c2)cc(c3)c(ccc3)c2)c(c1)cccc1","InChI=1S/C18H14O2/c19-18(16-7-2-1-3-8-16)20-13-14-10-11-15-6-4-5-9-17(15)12-14/h1-12H,13H2","PLGZVZHAMUXIRR-UHFFFAOYSA-N"
"O=C(OCc(c2)c(c3)c(ccc3)cc2)c(c1)cccc1","InChI=1S/C18H14O2/c19-18(15-8-2-1-3-9-15)20-13-16-11-6-10-14-7-4-5-12-17(14)16/h1-12H,13H2","GTIYNZXGIAGLFB-UHFFFAOYSA-N"
"O=C(OCc(c4)cc(C2)c(c4)c(c3)c(ccc3)2)c(c1)cccc1","InChI=1S/C21H16O2/c22-21(16-6-2-1-3-7-16)23-14-15-10-11-20-18(12-15)13-17-8-4-5-9-19(17)20/h1-12H,13-14H2","LQPJXAWZOHNCKS-UHFFFAOYSA-N"
"O=C(OCc(c3)cc(cc3)c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H16O2/c21-20(18-11-5-2-6-12-18)22-15-16-8-7-13-19(14-16)17-9-3-1-4-10-17/h1-14H,15H2","FDPBBCMRELYSTJ-UHFFFAOYSA-N"
"O=C(OCc(c3)ccc(c3)c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H16O2/c21-20(19-9-5-2-6-10-19)22-15-16-11-13-18(14-12-16)17-7-3-1-4-8-17/h1-14H,15H2","OANDQJPNJDEYHN-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c(C)1)c(C)cc(COC(=O)c(c2)cccc2)c1","InChI=1S/C16H15NO4/c1-11-8-13(9-12(2)15(11)17(19)20)10-21-16(18)14-6-4-3-5-7-14/h3-9H,10H2,1-2H3","KCQCEOIBHFFCEK-UHFFFAOYSA-N"
"O=C(OCc(c2)c(Br)ccc2)c(c1)cccc1","InChI=1S/C14H11BrO2/c15-13-9-5-4-8-12(13)10-17-14(16)11-6-2-1-3-7-11/h1-9H,10H2","DETHHGJSHHWELU-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc(cc2)COC(=O)c(c1)cccc1","InChI=1S/C14H11NO4/c16-14(12-6-2-1-3-7-12)19-10-11-5-4-8-13(9-11)15(17)18/h1-9H,10H2","XYHCAQKUZAEVJN-UHFFFAOYSA-N"
"O=C(OCc(c2)cc(cc2)S(C)(=O)=O)c(c1)cccc1","InChI=1S/C15H14O4S/c1-20(17,18)14-9-5-6-12(10-14)11-19-15(16)13-7-3-2-4-8-13/h2-10H,11H2,1H3","JXJFREBCZWEBPA-UHFFFAOYSA-N"
"N#Cc(c2)cc(cc2)COC(=O)c(c1)cccc1","InChI=1S/C15H11NO2/c16-10-12-5-4-6-13(9-12)11-18-15(17)14-7-2-1-3-8-14/h1-9H,11H2","MBZWZTKBDXXWON-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(COC(=O)c(c2)cccc2)c1","InChI=1S/C14H11NO4/c16-14(12-4-2-1-3-5-12)19-10-11-6-8-13(9-7-11)15(17)18/h1-9H,10H2","CRTADXBPEXSZLH-UHFFFAOYSA-N"
"O=C(OCc(c2)ccc(c2)S(C)(=O)=O)c(c1)cccc1","InChI=1S/C15H14O4S/c1-20(17,18)14-9-7-12(8-10-14)11-19-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3","MGLQGYMIDWSOTL-UHFFFAOYSA-N"
"CS(=O)c(c1)ccc(COC(=O)c(c2)cccc2)c1","InChI=1S/C15H14O3S/c1-19(17)14-9-7-12(8-10-14)11-18-15(16)13-5-3-2-4-6-13/h2-10H,11H2,1H3","HKUADHPETBQPPU-UHFFFAOYSA-N"
"N#Cc(c2)ccc(c2)COC(=O)c(c1)cccc1","InChI=1S/C15H11NO2/c16-10-12-6-8-13(9-7-12)11-18-15(17)14-4-2-1-3-5-14/h1-9H,11H2","NLLRGSOJQLUKFM-UHFFFAOYSA-N"
"O=C(OCc(c2)ccc(c2)C(C)(C)C)c(c1)cccc1","InChI=1S/C18H20O2/c1-18(2,3)16-11-9-14(10-12-16)13-20-17(19)15-7-5-4-6-8-15/h4-12H,13H2,1-3H3","GPHOLSWHPRJMDQ-UHFFFAOYSA-N"
"COc(c2)c(ccc2)COC(=O)c(c1)cccc1","InChI=1S/C15H14O3/c1-17-14-10-6-5-9-13(14)11-18-15(16)12-7-3-2-4-8-12/h2-10H,11H2,1H3","BZUHSQFJABFAHL-UHFFFAOYSA-N"
"OCC([H])(O1)C([H])(O)C([H])(O)C([H])(O)C([H])(OC)1","InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4?,5-,6-,7?/m1/s1","HOVAGTYPODGVJG-HJPAEZFKSA-N"
"OCC([H])(O1)C([H])(O)C([H])(O)C([H])(O)C([H])(OC)1","InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4?,5-,6+,7?/m1/s1","HOVAGTYPODGVJG-WMYZWQRYSA-N"
"OCC(O1)C(O)C(O)C(OC)1","InChI=1S/C6H12O5/c1-10-6-5(9)4(8)3(2-7)11-6/h3-9H,2H2,1H3/t3-,4-,5-,6+/m1/s1","NALRCAPFICWVAQ-KAZBKCHUSA-N"
"OCC(O1)C(O)C(O)C(OC)1","InChI=1S/C6H12O5/c1-10-6-5(9)4(8)3(2-7)11-6/h3-9H,2H2,1H3/t3-,4-,5-,6-/m1/s1","NALRCAPFICWVAQ-KVTDHHQDSA-N"
"[O-1][N+1](=O)c(c2)c(ccc2)COC(=O)c(c1)cccc1","InChI=1S/C14H11NO4/c16-14(11-6-2-1-3-7-11)19-10-12-8-4-5-9-13(12)15(17)18/h1-9H,10H2","IFNWVKHDWYPTRH-UHFFFAOYSA-N"
"O=C(C1)C=CN=C1","InChI=1S/C5H5NO/c7-5-1-3-6-4-2-5/h1,3-4H,2H2","MPOYBFYHRQBZPM-UHFFFAOYSA-N"
"O=C(C=1)c(c2)c(ccc2)NC1","InChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6H,(H,10,11)","PMZDQRJGMBOQBF-UHFFFAOYSA-N"
"O=C(C1)c(c3)c(ccc3)N(C(=O)2)C1N(C)C(=O)N(C)2","InChI=1S/C13H13N3O3/c1-14-11-7-10(17)8-5-3-4-6-9(8)16(11)13(19)15(2)12(14)18/h3-6,11H,7H2,1-2H3","QZQGHWFEIUGPCM-UHFFFAOYSA-N"
"O=C(C=1)c(c3)c(ccc3)N(C(=O)2)C1N(C)C(=O)N(C)2","InChI=1S/C13H11N3O3/c1-14-11-7-10(17)8-5-3-4-6-9(8)16(11)13(19)15(2)12(14)18/h3-7H,1-2H3","SOSVIGDJLBZSBE-UHFFFAOYSA-N"
"CCN(C(=O)1)C(=O)N(c32)C(CC(=O)c(cccc3)2)N(CC)1","InChI=1S/C15H17N3O3/c1-3-16-13-9-12(19)10-7-5-6-8-11(10)18(13)15(21)17(4-2)14(16)20/h5-8,13H,3-4,9H2,1-2H3","ZSGVKLDFLDCXII-UHFFFAOYSA-N"
"CC(C)N(C(=O)1)C(=O)N(c32)C(CC(=O)c(cccc3)2)N(C(C)C)1","InChI=1S/C17H21N3O3/c1-10(2)18-15-9-14(21)12-7-5-6-8-13(12)20(15)17(23)19(11(3)4)16(18)22/h5-8,10-11,15H,9H2,1-4H3","CMEXHSKNMGAZGH-UHFFFAOYSA-N"
"CCCCN(C(=O)1)C(=O)N(c32)C(CC(=O)c(cccc3)2)N(CCCC)1","InChI=1S/C19H25N3O3/c1-3-5-11-20-17-13-16(23)14-9-7-8-10-15(14)22(17)19(25)21(18(20)24)12-6-4-2/h7-10,17H,3-6,11-13H2,1-2H3","CIRCGMQRWBBGDH-UHFFFAOYSA-N"
"c(c5)ccc(c5)CN(C(=O)1)C(=O)N(c43)C(CC(=O)c(cccc4)3)N(Cc(c2)cccc2)1","InChI=1S/C25H21N3O3/c29-22-15-23-26(16-18-9-3-1-4-10-18)24(30)27(17-19-11-5-2-6-12-19)25(31)28(23)21-14-8-7-13-20(21)22/h1-14,23H,15-17H2","FCBJZQPHTRBDDA-UHFFFAOYSA-N"
"c(c4)ccc(c4)CN(C(=O)1)C(=O)N(c32)C(CC(=O)c(cccc3)2)N(C)1","InChI=1S/C19H17N3O3/c1-20-17-11-16(23)14-9-5-6-10-15(14)22(17)19(25)21(18(20)24)12-13-7-3-2-4-8-13/h2-10,17H,11-12H2,1H3","JCTQHUHKWKEIOF-UHFFFAOYSA-N"
"[H]C(C(=O)2)=C([H])N(C(=O)1)C(N2)N(C)C(=O)N(C)1","InChI=1S/C8H10N4O3/c1-10-6-9-5(13)3-4-12(6)8(15)11(2)7(10)14/h3-4,6H,1-2H3,(H,9,13)","DKISKIJEFSNOLW-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)C(=O)c(c1)cccc1","InChI=1S/C14H12O/c1-11-7-9-13(10-8-11)14(15)12-5-3-2-4-6-12/h2-10H,1H3","WXPWZZHELZEVPO-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)C(=O)c(c1)cccc1","InChI=1S/C13H9FO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H","OGTSHGYHILFRHD-UHFFFAOYSA-N"
"Cc(c2)cc(cc2)C(=O)c(c1)cccc1","InChI=1S/C14H12O/c1-11-6-5-9-13(10-11)14(15)12-7-3-2-4-8-12/h2-10H,1H3","URBLVRAVOIVZFJ-UHFFFAOYSA-N"
"Clc(c2)cc(cc2)C(=O)c(c1)cccc1","InChI=1S/C13H9ClO/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9H","CPLWKNRPZVNELG-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=O)c(c1)cc(cc1)C(F)(F)F","InChI=1S/C14H9F3O/c15-14(16,17)12-8-4-7-11(9-12)13(18)10-5-2-1-3-6-10/h1-9H","IOXDAYKKVHAKSX-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc(cc2)C(=O)c(c1)cccc1","InChI=1S/C13H9NO3/c15-13(10-5-2-1-3-6-10)11-7-4-8-12(9-11)14(16)17/h1-9H","MFYLRNKOXORIPK-UHFFFAOYSA-N"
"COc(c2)c(ccc2)C(=O)c(c1)cccc1","InChI=1S/C14H12O2/c1-16-13-10-6-5-9-12(13)14(15)11-7-3-2-4-8-11/h2-10H,1H3","CSUUDNFYSFENAE-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(=O)c(c1)c(Cl)ccc1","InChI=1S/C13H9ClO/c14-12-9-5-4-8-11(12)13(15)10-6-2-1-3-7-10/h1-9H","VMHYWKBKHMYRNF-UHFFFAOYSA-N"
"Cc(c2)cc(C)c(c2)C(=O)c(c1)cccc1","InChI=1S/C15H14O/c1-11-8-9-14(12(2)10-11)15(16)13-6-4-3-5-7-13/h3-10H,1-2H3","UYSQHMXRROFKRN-UHFFFAOYSA-N"
"Cc(c2)cc(C)c(c(C)2)C(=O)c(c1)cccc1","InChI=1S/C16H16O/c1-11-9-12(2)15(13(3)10-11)16(17)14-7-5-4-6-8-14/h4-10H,1-3H3","HPAFOABSQZMTHE-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)C(O)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H18O/c1-16-12-14-19(15-13-16)20(21,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,21H,1H3","QUMADPCRQDGMNX-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(O)(c(c2)cccc2)c(c1)c(C)ccc1","InChI=1S/C20H18O/c1-16-10-8-9-15-19(16)20(21,17-11-4-2-5-12-17)18-13-6-3-7-14-18/h2-15,21H,1H3","RCHCPDVJDGLJNS-UHFFFAOYSA-N"
"c(c3)ccc(c3)CC(O)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H18O/c21-20(18-12-6-2-7-13-18,19-14-8-3-9-15-19)16-17-10-4-1-5-11-17/h1-15,21H,16H2","QMPKJVBRCQVFLL-UHFFFAOYSA-N"
"CN=Cc(c1)cccc1","InChI=1S/C8H9N/c1-9-7-8-5-3-2-4-6-8/h2-7H,1H3/b9-7+","HXTGGPKOEKKUQO-VQHVLOKHSA-N"
"CN=Cc(c1)ccc(Cl)c1","InChI=1S/C8H8ClN/c1-10-6-7-2-4-8(9)5-3-7/h2-6H,1H3/b10-6+","MVKUBKNVOVQEAV-UXBLZVDNSA-N"
"CN=Cc(c1)cc(cc1)C(F)(F)F","InChI=1S/C9H8F3N/c1-13-6-7-3-2-4-8(5-7)9(10,11)12/h2-6H,1H3/b13-6+","PYFNALSBVCFOLS-AWNIVKPZSA-N"
"CN=Cc(c1)c(O)ccc1","InChI=1S/C8H9NO/c1-9-6-7-4-2-3-5-8(7)10/h2-6,10H,1H3/b9-6+","XFDQQADEQRAUEK-RMKNXTFCSA-N"
"CCN=Cc(c1)cccc1","InChI=1S/C9H11N/c1-2-10-8-9-6-4-3-5-7-9/h3-8H,2H2,1H3/b10-8+","IIVYBNBDIDWPQV-CSKARUKUSA-N"
"CN=Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H11N/c1-13-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-9H,1H3/b13-9+","JPFXXCHVHVZOIN-UKTHLTGXSA-N"
"c(c2)ccc(c2)C(=O)c(c1)c(ccc1)C(F)(F)F","InChI=1S/C14H9F3O/c15-14(16,17)12-9-5-4-8-11(12)13(18)10-6-2-1-3-7-10/h1-9H","JXIWJBWMQXDALU-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C)(O)c(c1)cccc1","InChI=1S/C14H14O/c1-14(15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,15H,1H3","GIMDPFBLSKQRNP-UHFFFAOYSA-N"
"[H]C(C(=O)2)=C([H])N(C(=O)1)C(=N2)N(C)C(=O)N(C)1","InChI=1S/C8H8N4O3/c1-10-6-9-5(13)3-4-12(6)8(15)11(2)7(10)14/h3-4H,1-2H3","HCPJFABTTFNIRP-UHFFFAOYSA-N"
"O=C(N=1)c(c2)c(ccc2)NC1","InChI=1S/C8H6N2O/c11-8-6-3-1-2-4-7(6)9-5-10-8/h1-5H,(H,9,10,11)","QMNUDYFKZYBWQX-UHFFFAOYSA-N"
"O=C(N1)c(c3)c(ccc3)N(C(=O)2)C1N(C)C(=O)N(C)2","InChI=1S/C12H12N4O3/c1-14-10-13-9(17)7-5-3-4-6-8(7)16(10)12(19)15(2)11(14)18/h3-6,10H,1-2H3,(H,13,17)","CBBILJACUYRJLM-UHFFFAOYSA-N"
"c(c4)ccc(c4)N(C(=O)1)C(=O)N(c(c3)cccc3)C(=O)N(c(c2)cccc2)1","InChI=1S/C21H15N3O3/c25-19-22(16-10-4-1-5-11-16)20(26)24(18-14-8-3-9-15-18)21(27)23(19)17-12-6-2-7-13-17/h1-15H","YEACGXMAEGBJSM-UHFFFAOYSA-N"
"c(c3)ccc(c3)n(c(=O)1)c(=O)n(c(c2)cccc2)1","InChI=1S/C14H10N2O2/c17-13-15(11-7-3-1-4-8-11)14(18)16(13)12-9-5-2-6-10-12/h1-10H","ZDIXQAFFNKGCNG-UHFFFAOYSA-N"
"c(c5)ccc(c5)CN(C(=O)1)C(=O)N(c43)C(=CC(=O)c(cccc4)3)N(Cc(c2)cccc2)1","InChI=1S/C25H19N3O3/c29-22-15-23-26(16-18-9-3-1-4-10-18)24(30)27(17-19-11-5-2-6-12-19)25(31)28(23)21-14-8-7-13-20(21)22/h1-15H,16-17H2","YOQHFMHTERFQNX-UHFFFAOYSA-N"
"O=C(C=1)NC(=NC1)SC","InChI=1S/C5H6N2OS/c1-9-5-6-3-2-4(8)7-5/h2-3H,1H3,(H,6,7,8)","UYHSQVMHSFXUOA-UHFFFAOYSA-N"
"O=C(C=2)N=C(N1)N(C2)C(=O)NC(=O)1","InChI=1S/C6H4N4O3/c11-3-1-2-10-4(7-3)8-5(12)9-6(10)13/h1-2H,(H2,7,8,9,11,12,13)","KRKHYEGWNVQRIP-UHFFFAOYSA-N"
"c(c4)ccc(c4)CN(C(=O)1)C(=O)N(C([H])=3)C(=NC(=O)C([H])3)N(Cc(c2)cccc2)1","InChI=1S/C20H16N4O3/c25-17-11-12-22-18(21-17)23(13-15-7-3-1-4-8-15)20(27)24(19(22)26)14-16-9-5-2-6-10-16/h1-12H,13-14H2","MTHWPJNAKAQTFK-UHFFFAOYSA-N"
"CCC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)C(=O)OCC","InChI=1S/C18H21NO4/c1-4-14-12(3)15(19-16(14)18(21)22-5-2)17(20)23-11-13-9-7-6-8-10-13/h6-10,19H,4-5,11H2,1-3H3","ACIHICHTZKRCGJ-UHFFFAOYSA-N"
"COc(c1)c(OC)c(cc1)C(O)=O","InChI=1S/C9H10O4/c1-12-7-5-3-4-6(9(10)11)8(7)13-2/h3-5H,1-2H3,(H,10,11)","FODBVCSYJKNBLO-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(c1)C(O)=O","InChI=1S/C9H10O4/c1-12-6-3-4-7(9(10)11)8(5-6)13-2/h3-5H,1-2H3,(H,10,11)","GPVDHNVGGIAOQT-UHFFFAOYSA-N"
"COc(c1)cc(C(O)=O)c(OC)c1","InChI=1S/C9H10O4/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)","NYJBTJMNTNCTCP-UHFFFAOYSA-N"
"COc(c1)cc(C(O)=O)cc(OC)1","InChI=1S/C9H10O4/c1-12-7-3-6(9(10)11)4-8(5-7)13-2/h3-5H,1-2H3,(H,10,11)","IWPZKOJSYQZABD-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)c(C(O)=O)c1","InChI=1S/C10H12O5/c1-13-7-5-4-6(10(11)12)8(14-2)9(7)15-3/h4-5H,1-3H3,(H,11,12)","HZNQSWJZTWOTKM-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(C(O)=O)c(OC)1","InChI=1S/C10H12O5/c1-13-7-5-9(15-3)8(14-2)4-6(7)10(11)12/h4-5H,1-3H3,(H,11,12)","KVZUCOGWKYOPID-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)cc(C(O)=O)1","InChI=1S/C10H12O5/c1-13-7-4-6(10(11)12)5-8(14-2)9(7)15-3/h4-5H,1-3H3,(H,11,12)","SJSOFNCYXJUNBT-UHFFFAOYSA-N"
"COc(c1)c(C(O)=O)c(OC)cc1","InChI=1S/C9H10O4/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)","MBIZFBDREVRUHY-UHFFFAOYSA-N"
"OC(=O)c(c(Cl)1)c(Cl)ccc1","InChI=1S/C7H4Cl2O2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11)","MRUDNSFOFOQZDA-UHFFFAOYSA-N"
"OC(=O)c(c2)c(ccc2)Cc(c1)cccc1","InChI=1S/C14H12O2/c15-14(16)13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,15,16)","FESDHLLVLYZNFY-UHFFFAOYSA-N"
"OC(=O)CCC(=O)c(c1)cccc1","InChI=1S/C10H10O3/c11-9(6-7-10(12)13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,12,13)","KMQLIDDEQAJAGJ-UHFFFAOYSA-N"
"OC(=O)CCCC(=O)c(c1)cccc1","InChI=1S/C11H12O3/c12-10(7-4-8-11(13)14)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,13,14)","SHKWSBAVRQZYLE-UHFFFAOYSA-N"
"OC(=O)Cc(c1)ccc(Cl)c1","InChI=1S/C8H7ClO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)","CDPKJZJVTHSESZ-UHFFFAOYSA-N"
"OC(=O)Cc(c1)ccc(Br)c1","InChI=1S/C8H7BrO2/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5H2,(H,10,11)","QOWSWEBLNVACCL-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(Br)cc1","InChI=1S/C8H7BrO2/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4H,5H2,(H,10,11)","KYNNBXCGXUOREX-UHFFFAOYSA-N"
"OC(=O)Cc(c1)c(Br)ccc1","InChI=1S/C8H7BrO2/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2,(H,10,11)","DWXSYDKEWORWBT-UHFFFAOYSA-N"
"OC(=O)Cc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C8H7NO4/c10-8(11)5-6-1-3-7(4-2-6)9(12)13/h1-4H,5H2,(H,10,11)","YBADLXQNJCMBKR-UHFFFAOYSA-N"
"COc(c1)cc(cc1)CC(O)=O","InChI=1S/C9H10O3/c1-12-8-4-2-3-7(5-8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)","LEGPZHPSIPPYIO-UHFFFAOYSA-N"
"COc(c1)c(ccc1)CC(O)=O","InChI=1S/C9H10O3/c1-12-8-5-3-2-4-7(8)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)","IVEWTCACRDEAOB-UHFFFAOYSA-N"
"CCOc(c1)ccc(CC(O)=O)c1","InChI=1S/C10H12O3/c1-2-13-9-5-3-8(4-6-9)7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12)","ZVVWZNFSMIFGEP-UHFFFAOYSA-N"
"OC(=O)Cc(c(Cl)1)c(Cl)ccc1","InChI=1S/C8H6Cl2O2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H,11,12)","SFAILOOQFZNOAU-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(Cl)c(Cl)c1","InChI=1S/C8H6Cl2O2/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3H,4H2,(H,11,12)","ZOUPGSMSNQLUNW-UHFFFAOYSA-N"
"COc(c1)cc(CC(O)=O)c(OC)c1","InChI=1S/C10H12O4/c1-13-8-3-4-9(14-2)7(5-8)6-10(11)12/h3-5H,6H2,1-2H3,(H,11,12)","BBZDYQUXRFATHZ-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C9H8O4/c10-9(11)4-6-1-2-7-8(3-6)13-5-12-7/h1-3H,4-5H2,(H,10,11)","ODVLMCWNGKLROU-UHFFFAOYSA-N"
"OC(=O)Cc(c1)c([N+1]([O-1])=O)cc(c1)[N+1]([O-1])=O","InChI=1S/C8H6N2O6/c11-8(12)3-5-1-2-6(9(13)14)4-7(5)10(15)16/h1-2,4H,3H2,(H,11,12)","KCNISYPADDTFDO-UHFFFAOYSA-N"
"OC(=O)Cc(c(F)1)c(F)ccc1","InChI=1S/C8H6F2O2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H,11,12)","FUGDCKXBUZFEON-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)cc(CC(O)=O)1","InChI=1S/C11H14O5/c1-14-8-4-7(6-10(12)13)5-9(15-2)11(8)16-3/h4-5H,6H2,1-3H3,(H,12,13)","DDSJXCGGOXKGSJ-UHFFFAOYSA-N"
"COc(c1)c(OC)c(C=CC(O)=O)cc1","InChI=1S/C11H12O4/c1-14-9-5-3-4-8(11(9)15-2)6-7-10(12)13/h3-7H,1-2H3,(H,12,13)/b7-6+","QAXPUWGAGVERSJ-VOTSOKGWSA-N"
"COc(c1)cc(C=CC(O)=O)c(OC)c1","InChI=1S/C11H12O4/c1-14-9-4-5-10(15-2)8(7-9)3-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-3+","JPQWWJZORKTMIZ-ZZXKWVIFSA-N"
"COc(c1)c(OC)cc(C=CC(O)=O)c1","InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)/b6-4+","HJBWJAPEBGSQPR-GQCTYLIASA-N"
"COc(c1)cc(C=CC(O)=O)cc(OC)1","InChI=1S/C11H12O4/c1-14-9-5-8(3-4-11(12)13)6-10(7-9)15-2/h3-7H,1-2H3,(H,12,13)/b4-3+","VLSRUFWCGBMYDJ-ONEGZZNKSA-N"
"OC(=O)C=Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C10H8O4/c11-10(12)4-2-7-1-3-8-9(5-7)14-6-13-8/h1-5H,6H2,(H,11,12)/b4-2+","QFQYZMGOKIROEC-DUXPYHPUSA-N"
"OC(=O)C([H])=C([H])c(c(Cl)1)c(Cl)ccc1","InChI=1S/C9H6Cl2O2/c10-7-2-1-3-8(11)6(7)4-5-9(12)13/h1-5H,(H,12,13)/b5-4+","OIPVGRCXMFBNAN-SNAWJCMRSA-N"
"OC(=O)C=Cc(c1)cc(OC)c(OC)c(OC)1","InChI=1S/C12H14O5/c1-15-9-6-8(4-5-11(13)14)7-10(16-2)12(9)17-3/h4-7H,1-3H3,(H,13,14)/b5-4+","YTFVRYKNXDADBI-SNAWJCMRSA-N"
"OC(=O)C=Cc(c1)ccc(c1)C(F)(F)F","InChI=1S/C10H7F3O2/c11-10(12,13)8-4-1-7(2-5-8)3-6-9(14)15/h1-6H,(H,14,15)/b6-3+","ANRMAUMHJREENI-ZZXKWVIFSA-N"
"OC(=O)C=Cc(c1)cc(cc1)C(F)(F)F","InChI=1S/C10H7F3O2/c11-10(12,13)8-3-1-2-7(6-8)4-5-9(14)15/h1-6H,(H,14,15)/b5-4+","KSBWHDDGWSYETA-SNAWJCMRSA-N"
"OC(=O)C=Cc(c1)c(ccc1)C(F)(F)F","InChI=1S/C10H7F3O2/c11-10(12,13)8-4-2-1-3-7(8)5-6-9(14)15/h1-6H,(H,14,15)/b6-5+","AMVYAIXPAGBXOM-AATRIKPKSA-N"
"OC(=O)Cc(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C8H3F5O2/c9-4-2(1-3(14)15)5(10)7(12)8(13)6(4)11/h1H2,(H,14,15)","LGCODSNZJOVMHV-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(Cl)cc1","InChI=1S/C8H7ClO2/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4H,5H2,(H,10,11)","WFPMUFXQDKMVCO-UHFFFAOYSA-N"
"OC(=O)Cc(c1)c(Cl)ccc1","InChI=1S/C8H7ClO2/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4H,5H2,(H,10,11)","IUJAAIZKRJJZGQ-UHFFFAOYSA-N"
"OC(=O)C(C(O)=O)Cc(c1)cccc1","InChI=1S/C10H10O4/c11-9(12)8(10(13)14)6-7-4-2-1-3-5-7/h1-5,8H,6H2,(H,11,12)(H,13,14)","JAEJSNFTJMYIEF-UHFFFAOYSA-N"
"OC(=O)C(C(O)=O)c(c1)cccc1","InChI=1S/C9H8O4/c10-8(11)7(9(12)13)6-4-2-1-3-5-6/h1-5,7H,(H,10,11)(H,12,13)","WWYDYZMNFQIYPT-UHFFFAOYSA-N"
"CCC(C(O)=O)C(O)=O","InChI=1S/C5H8O4/c1-2-3(4(6)7)5(8)9/h3H,2H2,1H3,(H,6,7)(H,8,9)","UKFXDFUAPNAMPJ-UHFFFAOYSA-N"
"OC(=O)C(C)C(O)=O","InChI=1S/C4H6O4/c1-2(3(5)6)4(7)8/h2H,1H3,(H,5,6)(H,7,8)","ZIYVHBGGAOATLY-UHFFFAOYSA-N"
"CN(C)CC(C)O","InChI=1S/C5H13NO/c1-5(7)4-6(2)3/h5,7H,4H2,1-3H3","NCXUNZWLEYGQAH-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(I)ccc1","InChI=1S/C6H4INO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H","JXMZUNPWVXQADG-UHFFFAOYSA-N"
"FC(F)(F)Oc(c1)cccc1","InChI=1S/C7H5F3O/c8-7(9,10)11-6-4-2-1-3-5-6/h1-5H","GQHWSLKNULCZGI-UHFFFAOYSA-N"
"OC(C(F)(F)F)C(F)(F)F","InChI=1S/C3H2F6O/c4-2(5,6)1(10)3(7,8)9/h1,10H","BYEAHWXPCBROCE-UHFFFAOYSA-N"
"CCOC(OCC)(OCC)OCC","InChI=1S/C9H20O4/c1-5-10-9(11-6-2,12-7-3)13-8-4/h5-8H2,1-4H3","CWLNAJYDRSIKJS-UHFFFAOYSA-N"
"O=C(Oc(c1)cccc1)C(F)(F)F","InChI=1S/C8H5F3O2/c9-8(10,11)7(12)13-6-4-2-1-3-5-6/h1-5H","DVCMYAIUSOSIQP-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(Br)ccc1","InChI=1S/C6H4BrNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H","ORPVVAKYSXQCJI-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(Br)cc1","InChI=1S/C6H4BrNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H","FWIROFMBWVMWLB-UHFFFAOYSA-N"
"c(c4)cc(c1)c(c4)cc(c2)c(cc(c3)c(ccc3)2)1","InChI=1S/C18H12/c1-2-6-14-10-18-12-16-8-4-3-7-15(16)11-17(18)9-13(14)5-1/h1-12H","IFLREYGFSNHWGE-UHFFFAOYSA-N"
"CC(=O)CC(=O)Nc(c1)ccc(Cl)c1","InChI=1S/C10H10ClNO2/c1-7(13)6-10(14)12-9-4-2-8(11)3-5-9/h2-5H,6H2,1H3,(H,12,14)","JMRJWEJJUKUBEA-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(Cl)cc1","InChI=1S/C6H4ClNO2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H","KMAQZIILEGKYQZ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)c(Cl)ccc1","InChI=1S/C6H4ClNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H","BFCFYVKQTRLZHA-UHFFFAOYSA-N"
"BrC(Br)(Br)Br","InChI=1S/CBr4/c2-1(3,4)5","HJUGFYREWKUQJT-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)NC(=O)c(c1)cccc1","InChI=1S/C13H10N2O3/c16-13(10-4-2-1-3-5-10)14-11-6-8-12(9-7-11)15(17)18/h1-9H,(H,14,16)","GMGQGZYFQSCZCW-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)Sc(c1)ccc(N)c1","InChI=1S/C12H12N2S/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,13-14H2","ICNFHJVPAJKPHW-UHFFFAOYSA-N"
"O=C(C(F)(F)F)C(F)(F)F","InChI=1S/C3F6O/c4-2(5,6)1(10)3(7,8)9","VBZWSGALLODQNC-UHFFFAOYSA-N"
"CCCO[Si](OCCC)(OCCC)OCCC","InChI=1S/C12H28O4Si/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4/h5-12H2,1-4H3","ZQZCOBSUOFHDEE-UHFFFAOYSA-N"
"Oc(c1)c(ccc1)C(F)(F)F","InChI=1S/C7H5F3O/c8-7(9,10)5-3-1-2-4-6(5)11/h1-4,11H","ZOQOPXVJANRGJZ-UHFFFAOYSA-N"
"CCOC(=O)C([H])(C1)C([H])(CCC1)C(=O)OCC","InChI=1S/C12H20O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h9-10H,3-8H2,1-2H3/t9-,10+","ZTUZDYWYNQDJKR-AOOOYVTPSA-N"
"CCOC(=O)C(C1)C(CCC1)C(=O)OCC","InChI=1S/C12H20O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h9-10H,3-8H2,1-2H3/t9-,10-/m1/s1","ZTUZDYWYNQDJKR-NXEZZACHSA-N"
"C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)N","InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)/t9-/m0/s1","QIVBCDIJIAJPQS-VIFPVBQESA-N"
"NC(=S)c(c1)cccc1","InChI=1S/C7H7NS/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)","QIOZLISABUUKJY-UHFFFAOYSA-N"
"CNCC([H])(O)C([H])(O)C([H])(O)C([H])(O)CO","InChI=1S/C7H17NO5/c1-8-2-4(10)6(12)7(13)5(11)3-9/h4-13H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1","MBBZMMPHUWSWHV-BDVNFPICSA-N"
"C=COCC(C)C","InChI=1S/C6H12O/c1-4-7-5-6(2)3/h4,6H,1,5H2,2-3H3","OZCMOJQQLBXBKI-UHFFFAOYSA-N"
"OC(=O)c(c1)c(O)c(c2)c(ccc2)c1","InChI=1S/C11H8O3/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6,12H,(H,13,14)","SJJCQDRGABAVBB-UHFFFAOYSA-N"
"OC(=O)CCC(=O)c(c1)ccc(F)c1","InChI=1S/C10H9FO3/c11-8-3-1-7(2-4-8)9(12)5-6-10(13)14/h1-4H,5-6H2,(H,13,14)","WUYWHIAAQYQKPP-UHFFFAOYSA-N"
"CCOCC(O)COCC","InChI=1S/C7H16O3/c1-3-9-5-7(8)6-10-4-2/h7-8H,3-6H2,1-2H3","WIHIUTUAHOZVLE-UHFFFAOYSA-N"
"CC(O)c(c1)ccc(Cl)c1","InChI=1S/C8H9ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3","MVOSNPUNXINWAD-UHFFFAOYSA-N"
"CCCCCCCCOc(c1)c(ccc1)[N+1]([O-1])=O","InChI=1S/C14H21NO3/c1-2-3-4-5-6-9-12-18-14-11-8-7-10-13(14)15(16)17/h7-8,10-11H,2-6,9,12H2,1H3","CXVOIIMJZFREMM-UHFFFAOYSA-N"
"CC(C)N(C)C","InChI=1S/C5H13N/c1-5(2)6(3)4/h5H,1-4H3","VMOWKUTXPNPTEN-UHFFFAOYSA-N"
"CCN(C(C)C)C(C)C","InChI=1S/C8H19N/c1-6-9(7(2)3)8(4)5/h7-8H,6H2,1-5H3","JGFZNNIVVJXRND-UHFFFAOYSA-N"
"Nc(c1)cc(c2)c(ccc2)n1","InChI=1S/C9H8N2/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-6H,10H2","SVNCRRZKBNSMIV-UHFFFAOYSA-N"
"Nc(c1)c(n2)c(ccc2)cc1","InChI=1S/C9H8N2/c10-8-5-1-3-7-4-2-6-11-9(7)8/h1-6H,10H2","WREVVZMUNPAPOV-UHFFFAOYSA-N"
"CN(C)C(=O)N(C)C","InChI=1S/C5H12N2O/c1-6(2)5(8)7(3)4/h1-4H3","AVQQQNCBBIEMEU-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)OCC)c(c1)cccc1","InChI=1S/C13H16O4/c1-3-16-12(14)11(13(15)17-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3","FGYDHYCFHBSNPE-UHFFFAOYSA-N"
"O=C(C1)C(C)(C2)C(C)(C)C([H])(C2)1","InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3/t7-,10+/m0/s1","DSSYKIVIOFKYAU-OIBJUYFYSA-N"
"OC(=O)C(S)c(c1)c(Cl)ccc(Cl)1","InChI=1S/C8H6Cl2O2S/c9-4-1-2-6(10)5(3-4)7(13)8(11)12/h1-3,7,13H,(H,11,12)","CRTGVRQQKMHWLD-UHFFFAOYSA-N"
"CC(=O)OC(C(O)=O)C(OC(C)=O)C(O)=O","InChI=1S/C8H10O8/c1-3(9)15-5(7(11)12)6(8(13)14)16-4(2)10/h5-6H,1-2H3,(H,11,12)(H,13,14)","DNISEZBAYYIQFB-UHFFFAOYSA-N"
"C1=C(NC=N1)CC(C(=O)O)N.O.Cl","InChI=1S/C6H9N3O2.ClH.H2O/c7-5(6(10)11)1-4-2-8-3-9-4;;/h2-3,5H,1,7H2,(H,8,9)(H,10,11);1H;1H2","CMXXUDSWGMGYLZ-UHFFFAOYSA-N"
"CCOC(=O)C(NC(C)=O)C(=O)OCC","InChI=1S/C9H15NO5/c1-4-14-8(12)7(10-6(3)11)9(13)15-5-2/h7H,4-5H2,1-3H3,(H,10,11)","ISOLMABRZPQKOV-UHFFFAOYSA-N"
"CC(=O)NCC(O)=O","InChI=1S/C4H7NO3/c1-3(6)5-2-4(7)8/h2H2,1H3,(H,5,6)(H,7,8)","OKJIRPAQVSHGFK-UHFFFAOYSA-N"
"O=c(c1)oc(=O)c1","InChI=1S/C4H2O3/c5-3-1-2-4(6)7-3/h1-2H","FPYJFEHAWHCUMM-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(C1)C(=O)CC1","InChI=1S/C6H10O/c1-5-3-2-4-6(5)7/h5H,2-4H2,1H3/i1D3","ZIXLDMFVRPABBX-FIBGUPNXSA-N"
"[2H]C([H])([H])C(C1)C(=O)C(C1)C([2H])([H])[H]","InChI=1S/C7H12O/c1-5-3-4-6(2)7(5)8/h5-6H,3-4H2,1-2H3/i1D,2D","MKLARKDYEBNZFK-QDNHWIQGSA-N"
"O=C(C1)C(C)(C)CC1","InChI=1S/C7H12O/c1-7(2)5-3-4-6(7)8/h3-5H2,1-2H3","FTGZMZBYOHMEPS-UHFFFAOYSA-N"
"[2H]C([2H])([2H])C(C1)(C([2H])([2H])[2H])C(=O)CC1","InChI=1S/C7H12O/c1-7(2)5-3-4-6(7)8/h3-5H2,1-2H3/i1D3,2D3","FTGZMZBYOHMEPS-WFGJKAKNSA-N"
"CC(C1)C(=O)C(C)(C)C1","InChI=1S/C8H14O/c1-6-4-5-8(2,3)7(6)9/h6H,4-5H2,1-3H3","KWJHOYYJYPCTBS-UHFFFAOYSA-N"
"O=C(C(C)(C)1)C(C)(C)CC1","InChI=1S/C9H16O/c1-8(2)5-6-9(3,4)7(8)10/h5-6H2,1-4H3","BXYUQRQZHXARGL-UHFFFAOYSA-N"
"[2H]C([2H])(N1)C(=O)NC([2H])([2H])C(=O)1","InChI=1S/C4H6N2O2/c7-3-1-5-4(8)2-6-3/h1-2H2,(H,5,8)(H,6,7)/i1D2,2D2","BXRNXXXXHLBUKK-LNLMKGTHSA-N"
"OC(C2)CC(O)(C1)C(C)(C2)C(O)C1","InChI=1S/C10H18O3/c1-9-4-2-7(11)6-10(9,13)5-3-8(9)12/h7-8,11-13H,2-6H2,1H3","QNFLQEIYODCTMR-UHFFFAOYSA-N"
"O=C(C2)CC(O)(C1)C(C)(C2)C(=O)C1","InChI=1S/C10H14O3/c1-9-4-2-7(11)6-10(9,13)5-3-8(9)12/h13H,2-6H2,1H3","PUHCDQVSBDIJTM-UHFFFAOYSA-N"
"CC(C)[SiH](C)C","InChI=1S/C5H14Si/c1-5(2)6(3)4/h5-6H,1-4H3","IIRAZPOUDJHBPM-UHFFFAOYSA-N"
"CC(C)[Si]([2H])(C)C","InChI=1S/C5H14Si/c1-5(2)6(3)4/h5-6H,1-4H3/i6D","IIRAZPOUDJHBPM-RAMDWTOOSA-N"
"C[SiH2][Si](C)(C)C","InChI=1S/C4H14Si2/c1-5-6(2,3)4/h5H2,1-4H3","VIPCDVWYAADTGR-UHFFFAOYSA-N"
"[2H][Si]([2H])(C)[Si](C)(C)C","InChI=1S/C4H14Si2/c1-5-6(2,3)4/h5H2,1-4H3/i5D2","VIPCDVWYAADTGR-BFWBPSQCSA-N"
"C[Si](C)(C)[SiH3]","InChI=1S/C3H12Si2/c1-5(2,3)4/h1-4H3","ZVGUNGATIFIZOL-UHFFFAOYSA-N"
"C[SiH](C)[Si](C)(C)C","InChI=1S/C5H16Si2/c1-6(2)7(3,4)5/h6H,1-5H3","FHQRQPAFALORSL-UHFFFAOYSA-N"
"C(C1)CC[SiH2]C1","InChI=1S/C5H12Si/c1-2-4-6-5-3-1/h1-6H2","VMNDCBPWBMKDBI-UHFFFAOYSA-N"
"C[SiH](C1)CCCC1","InChI=1S/C6H14Si/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3","SVXKLJJAGXDRDF-UHFFFAOYSA-N"
"C(C1)CC[Si](C)(C)C1","InChI=1S/C7H16Si/c1-8(2)6-4-3-5-7-8/h3-7H2,1-2H3","VPVXTYYXTKCTPM-UHFFFAOYSA-N"
"[2H][Si]([2H])(C1)CCCC1","InChI=1S/C5H12Si/c1-2-4-6-5-3-1/h1-6H2/i6D2","VMNDCBPWBMKDBI-NCYHJHSESA-N"
"[2H]C([2H])([2H])[Si](C1)(CCCC1)C([2H])([2H])[2H]","InChI=1S/C7H16Si/c1-8(2)6-4-3-5-7-8/h3-7H2,1-2H3/i1D3,2D3","VPVXTYYXTKCTPM-WFGJKAKNSA-N"
"[2H][Si](C)(C1)CCCC1","InChI=1S/C6H14Si/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3/i7D","SVXKLJJAGXDRDF-WHRKIXHSSA-N"
"[2H]C([2H])([2H])[SiH](C1)CCCC1","InChI=1S/C6H14Si/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3/i1D3","SVXKLJJAGXDRDF-FIBGUPNXSA-N"
"[2H]C([2H])([2H])[Si](C)(C1)CCCC1","InChI=1S/C7H16Si/c1-8(2)6-4-3-5-7-8/h3-7H2,1-2H3/i1D3","VPVXTYYXTKCTPM-FIBGUPNXSA-N"
"[2H][SiH](C1)CCCC1","InChI=1S/C5H12Si/c1-2-4-6-5-3-1/h1-6H2/i6D","VMNDCBPWBMKDBI-RAMDWTOOSA-N"
"[2H]C([2H])(C1)[SiH](C)C([2H])([2H])CC1","InChI=1S/C6H14Si/c1-7-5-3-2-4-6-7/h7H,2-6H2,1H3/i5D2,6D2","SVXKLJJAGXDRDF-NZLXMSDQSA-N"
"COC(=O)C(C(=O)1)C(C2)C(CCC(C(C)C)C2)O1","InChI=1S/C14H22O4/c1-8(2)9-4-6-10-11(7-5-9)18-14(16)12(10)13(15)17-3/h8-12H,4-7H2,1-3H3","BTBGIRSEZXWHEE-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)2)C(C1)C(O2)C(=O)CC(C(C)C)C1","InChI=1S/C15H22O5/c1-4-19-14(17)12-10-6-5-9(8(2)3)7-11(16)13(10)20-15(12)18/h8-10,12-13H,4-7H2,1-3H3","GOLXPQWCEJWVSR-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)1)C(C2)C(CCC(C(C)C)C2)O1","InChI=1S/C15H24O4/c1-4-18-14(16)13-11-7-5-10(9(2)3)6-8-12(11)19-15(13)17/h9-13H,4-8H2,1-3H3","RGOPUEJOQWLLPT-UHFFFAOYSA-N"
"CC(C)C(C2)C(C(=C)1)C(CCC2)OC(=O)1","InChI=1S/C13H20O2/c1-8(2)10-6-4-5-7-11-12(10)9(3)13(14)15-11/h8,10-12H,3-7H2,1-2H3","AUGHXHZIGLSKLS-UHFFFAOYSA-N"
"CC(=CC[Sn](C)(C)C)C[Sn](C)(C)C","InChI=1S/C5H8.6CH3.2Sn/c1-4-5(2)3;;;;;;;;/h4H,1-2H2,3H3;6*1H3;;/b5-4-;;;;;;;;","JUVFDQMUBKKZOB-XPOPMFIKSA-N"
"CC(=CC[Si](C)(C)C)C[Si](C)(C)C","InChI=1S/C11H26Si2/c1-11(10-13(5,6)7)8-9-12(2,3)4/h8H,9-10H2,1-7H3/b11-8+","VSXNVFHRYDHBRC-DHZHZOJOSA-N"
"C[Sn](C)(C)CC=CC[Sn](C)(C)C","InChI=1S/C4H6.6CH3.2Sn/c1-3-4-2;;;;;;;;/h3-4H,1-2H2;6*1H3;;/b4-3+;;;;;;;;","CFJUYISNWQKCKP-FSEHQYEXSA-N"
"C(C=CC[Sn](CCCC)(CCCC)CCCC)[Sn](CCCC)(CCCC)CCCC","InChI=1S/6C4H9.C4H6.2Sn/c7*1-3-4-2;;/h6*1,3-4H2,2H3;3-4H,1-2H2;;/b;;;;;;4-3+;;","VDQCIJNLWBPEDB-NGJXEQNTSA-N"
"OC(=O)C(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C13H15NO4/c15-12(16)11-7-4-8-14(11)13(17)18-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H,15,16)/t11-/m0/s1","JXGVXCZADZNAMJ-NSHDSACASA-N"
"COC(=O)C(C2)N(CC2)C(=O)OCc(c1)cccc1","InChI=1S/C14H17NO4/c1-18-13(16)12-8-5-9-15(12)14(17)19-10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3/t12-/m0/s1","BLQYEDXWEDWCNJ-LBPRGKRZSA-N"
"CCCCCCCC(C1)OC(CCCCCCC)C(C=C)1","InChI=1S/C20H38O/c1-4-7-9-11-13-15-19-17-18(6-3)20(21-19)16-14-12-10-8-5-2/h6,18-20H,3-5,7-17H2,1-2H3","PJPJMIPPHVYOFO-UHFFFAOYSA-N"
"CCCCCCCC(OC)C(C=C)C[Si](C)(C)C","InChI=1S/C16H34OSi/c1-7-9-10-11-12-13-16(17-3)15(8-2)14-18(4,5)6/h8,15-16H,2,7,9-14H2,1,3-6H3","WHLNIXZXZWJMBT-UHFFFAOYSA-N"
"COC(CC(C)C)C(C=C)C[Si](C)(C)C","InChI=1S/C13H28OSi/c1-8-12(10-15(5,6)7)13(14-4)9-11(2)3/h8,11-13H,1,9-10H2,2-7H3","NQDYFUFXDDHZLI-UHFFFAOYSA-N"
"C(=CC([H])(C)C(C)C)C(C(C4)([H])C(C3(C4)[H])(CCC(C=23)(C(C1)(C)C(=CC2)CC(O)C1)[H])C)([H])C","InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+/t19-,20-,22+,24-,25+,26+,27+,28-/m1/s1","DNVPQKQSNYMLRS-NBEWGGKZSA-N"
"CC(C)=CCCC(=C)C(C[Si](C)(C)C)C(OC)CC(C)C","InChI=1S/C19H38OSi/c1-15(2)11-10-12-17(5)18(14-21(7,8)9)19(20-6)13-16(3)4/h11,16,18-19H,5,10,12-14H2,1-4,6-9H3","ZJJKDNJZLGKDGV-UHFFFAOYSA-N"
"CCCCC(OC)C(C=C)C[Si](C)(C)C","InChI=1S/C13H28OSi/c1-7-9-10-13(14-3)12(8-2)11-15(4,5)6/h8,12-13H,2,7,9-11H2,1,3-6H3","BLPVQRKCHUVWDZ-UHFFFAOYSA-N"
"CCCC(OC)CC(=C)C[Si](C)(C)C","InChI=1S/C12H26OSi/c1-7-8-12(13-3)9-11(2)10-14(4,5)6/h12H,2,7-10H2,1,3-6H3","GFJSMWFWSLNDHO-UHFFFAOYSA-N"
"CCCCC(=O)C(C=C)C[Si](C)(C)C","InChI=1S/C12H24OSi/c1-6-8-9-12(13)11(7-2)10-14(3,4)5/h7,11H,2,6,8-10H2,1,3-5H3","XEQPALKIEVLRRQ-UHFFFAOYSA-N"
"CC(C)CC(=O)C(C=C)C[Si](C)(C)C","InChI=1S/C12H24OSi/c1-7-11(9-14(4,5)6)12(13)8-10(2)3/h7,10-11H,1,8-9H2,2-6H3","XOMWHWHZCDVEAJ-UHFFFAOYSA-N"
"CCCC(=O)C(C=C)C[Si](C)(C)C","InChI=1S/C11H22OSi/c1-6-8-11(12)10(7-2)9-13(3,4)5/h7,10H,2,6,8-9H2,1,3-5H3","HZMBUJNSEJGMND-UHFFFAOYSA-N"
"CC(C)=CCCC(=C)CC[Si](C)(C)C","InChI=1S/C13H26Si/c1-12(2)8-7-9-13(3)10-11-14(4,5)6/h8H,3,7,9-11H2,1-2,4-6H3","JAMFQSRTFAGHMG-UHFFFAOYSA-N"
"CCCCC(OC)C(C(=C)CCC=C(C)C)C[Si](C)(C)C","InChI=1S/C19H38OSi/c1-9-10-14-19(20-5)18(15-21(6,7)8)17(4)13-11-12-16(2)3/h12,18-19H,4,9-11,13-15H2,1-3,5-8H3","DHDKZORTHXTREN-UHFFFAOYSA-N"
"CCCC(OC)C(C(=C)CCC=C(C)C)C[Si](C)(C)C","InChI=1S/C18H36OSi/c1-9-11-18(19-5)17(14-20(6,7)8)16(4)13-10-12-15(2)3/h12,17-18H,4,9-11,13-14H2,1-3,5-8H3","CHILDVNDWKTFNC-UHFFFAOYSA-N"
"CCCCCCCC(OC)C(C[Si](C)(C)C)C(=C)CCC=C(C)C","InChI=1S/C22H44OSi/c1-9-10-11-12-13-17-22(23-5)21(18-24(6,7)8)20(4)16-14-15-19(2)3/h15,21-22H,4,9-14,16-18H2,1-3,5-8H3","VVUBCPPTYJMBNS-UHFFFAOYSA-N"
"C=CC(C(=O)C(C)C)C[Si](C)(C)C","InChI=1S/C11H22OSi/c1-7-10(8-13(4,5)6)11(12)9(2)3/h7,9-10H,1,8H2,2-6H3","IRXDIOWOELNKOQ-UHFFFAOYSA-N"
"CCCC(C1)OC(CCC)C(C=C)1","InChI=1S/C12H22O/c1-4-7-11-9-10(6-3)12(13-11)8-5-2/h6,10-12H,3-5,7-9H2,1-2H3","RGUDGBPPEKIZQX-UHFFFAOYSA-N"
"C=CC(C[Si](C)(C)C)C(O)c(c1)cccc1","InChI=1S/C14H22OSi/c1-5-12(11-16(2,3)4)14(15)13-9-7-6-8-10-13/h5-10,12,14-15H,1,11H2,2-4H3","QJMIILNHQISUMY-UHFFFAOYSA-N"
"CC(C)CC(C1)OC(CC(C)C)C(C=C)1","InChI=1S/C14H26O/c1-6-12-9-13(7-10(2)3)15-14(12)8-11(4)5/h6,10-14H,1,7-9H2,2-5H3","ITEQWNDUNHFRAG-UHFFFAOYSA-N"
"C=CC(C[Si](C)(C)C)C(=O)C(C)(C)C","InChI=1S/C12H24OSi/c1-8-10(9-14(5,6)7)11(13)12(2,3)4/h8,10H,1,9H2,2-7H3","INDDZOADHRZSTG-UHFFFAOYSA-N"
"CC(C)CC(O)C(C=C)C[Si](C)(C)C","InChI=1S/C12H26OSi/c1-7-11(9-14(4,5)6)12(13)8-10(2)3/h7,10-13H,1,8-9H2,2-6H3","XMDRTAVKUHDSRY-UHFFFAOYSA-N"
"CC(C)=CCCC(C=C)(C1)C(CC(C)C)OC(CC(C)C)1","InChI=1S/C20H36O/c1-8-20(11-9-10-15(2)3)14-18(12-16(4)5)21-19(20)13-17(6)7/h8,10,16-19H,1,9,11-14H2,2-7H3","IYZIXNDGGPPYAM-UHFFFAOYSA-N"
"CC(C)=CCCC(C=C)(C1)C(C(C)C)OC(C(C)C)1","InChI=1S/C18H32O/c1-8-18(11-9-10-13(2)3)12-16(14(4)5)19-17(18)15(6)7/h8,10,14-17H,1,9,11-12H2,2-7H3","WTBSTODNZOIJQY-UHFFFAOYSA-N"
"CCCCC(O1)CC(C=C)(CCC=C(C)C)C(CCCC)1","InChI=1S/C20H36O/c1-6-9-13-18-16-20(8-3,15-11-12-17(4)5)19(21-18)14-10-7-2/h8,12,18-19H,3,6-7,9-11,13-16H2,1-2,4-5H3","CORRSPQDYCFIHB-UHFFFAOYSA-N"
"O=C(C4)CC([H])(C3)C(C)(C4)C([H])(C1)C([H])(C3)C([H])(C2)C(C)(CC2)C1","InChI=1S/C19H30O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h13,15-17H,3-12H2,1-2H3/t13-,15-,16-,17-,18-,19-/m0/s1","VMNRNUNYBVFVQI-QYXZOKGRSA-N"
"O=C(C=4)CC([H])(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,12,14-16H,3-6,8,10-11H2,1-2H3/t12-,14-,15-,16-,18-,19-/m0/s1","WJIQCDPCDVWDDE-WZNAKSSCSA-N"
"O=C(C([H])=4)C([H])=C(C3)C(C)(C([H])4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C([H])(O)C1","InChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-17,21H,3-6,8,10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1","RSIHSRDYCUFFLA-DYKIIFRCSA-N"
"O=C(C4)CC([H])(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-16H,3-11H2,1-2H3/t12-,14+,15+,16+,18+,19+/m1/s1","RAJWOBJTTGJROA-QJISAEMRSA-N"
"C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@H]2O)CCC4=CC(=O)CC[C@]34C","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17+,18-,19-/m0/s1","MUMGGOZAMZWBJJ-KZYORJDKSA-N"
"O=C(C4)CC([H])(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-16H,3-11H2,1-2H3/t12-,14-,15-,16-,18-,19-/m0/s1","RAJWOBJTTGJROA-WZNAKSSCSA-N"
"CC(=O)OC([H])(C4)C(C)(C3)C([H])(C4)C([H])(C2)C([H])(C3)C(C)(C([H])=1)C(C2)=C([H])C(=O)C([H])1","InChI=1S/C21H28O3/c1-13(22)24-19-7-6-17-16-5-4-14-12-15(23)8-10-20(14,2)18(16)9-11-21(17,19)3/h8,10,12,16-19H,4-7,9,11H2,1-3H3/t16-,17-,18-,19-,20-,21-/m0/s1","KPCDGGNHYODURF-PXQJOHHUSA-N"
"C(OC(C2)C(C)(C5)C(C(C([H])3C5)([H])CCC([H])(C4)C3(C)CCC4=O)([H])C2)(=O)c(c1)cccc1","InChI=1S/C26H34O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-7,18,20-23H,8-16H2,1-2H3/t18-,20-,21-,22-,23-,25-,26-/m0/s1","ZGDZDAPCWHIIKB-LVYWIKMTSA-N"
"CC(=O)OCC(=O)C([H])(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C2)C(=CC(=O)C2)C1","InChI=1S/C23H32O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h12,17-20H,4-11,13H2,1-3H3/t17-,18-,19-,20+,22-,23-/m0/s1","VPGRYOFKCNULNK-ACXQXYJUSA-N"
"","InChI=1S/C26H30O3/c1-25-14-12-19(27)16-18(25)8-9-20-21-10-11-23(26(21,2)15-13-22(20)25)29-24(28)17-6-4-3-5-7-17/h3-7,12,14,16,20-23H,8-11,13,15H2,1-2H3/t20-,21-,22-,23-,25-,26-/m0/s1","QYOIZDDZJSQWGQ-IXKNJLPQSA-N"
"CC(=O)OC(C(C)=O)(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C3)C(C)(C2)C(=C([H])C(=O)C2)C1","InChI=1S/C23H32O4/c1-14(24)23(27-15(2)25)12-9-20-18-6-5-16-13-17(26)7-10-21(16,3)19(18)8-11-22(20,23)4/h13,18-20H,5-12H2,1-4H3/t18-,19+,20+,21+,22+,23+/m1/s1","VTHUYJIXSMGYOQ-KOORYGTMSA-N"
"COc(c1)c(ccc1)C(C)=O","InChI=1S/C9H10O2/c1-7(10)8-5-3-4-6-9(8)11-2/h3-6H,1-2H3","DWPLEOPKBWNPQV-UHFFFAOYSA-N"
"COc(c1)cc(OC)cc(OC)1","InChI=1S/C9H12O3/c1-10-7-4-8(11-2)6-9(5-7)12-3/h4-6H,1-3H3","LKUDPHPHKOZXCD-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(OC)cc1","InChI=1S/C9H10O3/c1-11-8-5-3-4-7(6-8)9(10)12-2/h3-6H,1-2H3","DUKYPQBGYRJVAN-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(c1)C(=O)OC","InChI=1S/C10H12O4/c1-12-7-4-5-8(10(11)14-3)9(6-7)13-2/h4-6H,1-3H3","IHIJFZWLGPEYPJ-UHFFFAOYSA-N"
"COc(c1)cc(C(=O)OC)c(OC)c1","InChI=1S/C10H12O4/c1-12-7-4-5-9(13-2)8(6-7)10(11)14-3/h4-6H,1-3H3","AKAPOSLZQKGWGT-UHFFFAOYSA-N"
"COC(=O)c(c(OC)1)c(OC)ccc1","InChI=1S/C10H12O4/c1-12-7-5-4-6-8(13-2)9(7)10(11)14-3/h4-6H,1-3H3","XLXVNKPXOIYLLE-UHFFFAOYSA-N"
"COC(=O)c(c1)c(O)c(OC)cc1","InChI=1S/C9H10O4/c1-12-7-5-3-4-6(8(7)10)9(11)13-2/h3-5,10H,1-2H3","BWRCJLJJIXYLNV-UHFFFAOYSA-N"
"COC(=O)c(c1)cc(O)c(OC)c1","InChI=1S/C9H10O4/c1-12-8-4-3-6(5-7(8)10)9(11)13-2/h3-5,10H,1-2H3","QXOXUEFXRSIYSW-UHFFFAOYSA-N"
"COc(c1)c(O)c(cc1)C(O)=O","InChI=1S/C8H8O4/c1-12-6-4-2-3-5(7(6)9)8(10)11/h2-4,9H,1H3,(H,10,11)","AUZQQIPZESHNMG-UHFFFAOYSA-N"
"COc(c1)c(O)cc(c1)C(O)=O","InChI=1S/C8H8O4/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,9H,1H3,(H,10,11)","LBKFGYZQBSGRHY-UHFFFAOYSA-N"
"N#CCc(c1)cc(O2)c(OC2)c1","InChI=1S/C9H7NO2/c10-4-3-7-1-2-8-9(5-7)12-6-11-8/h1-2,5H,3,6H2","ZQPBOYASBNAXOZ-UHFFFAOYSA-N"
"COc(c3)cc(C(=O)1)c(c3)OC(c(c2)cccc2)=C(O)1","InChI=1S/C16H12O4/c1-19-11-7-8-13-12(9-11)14(17)15(18)16(20-13)10-5-3-2-4-6-10/h2-9,18H,1H3","OGURJSOPVFCIOO-UHFFFAOYSA-N"
"COc(c3)c(C(=O)1)c(cc3)OC(c(c2)cccc2)=C(O)1","InChI=1S/C16H12O4/c1-19-11-8-5-9-12-13(11)14(17)15(18)16(20-12)10-6-3-2-4-7-10/h2-9,18H,1H3","WHLQVYWQNZFUPW-UHFFFAOYSA-N"
"CCOC(=O)N(C1)C(CO)CC1","InChI=1S/C8H15NO3/c1-2-12-8(11)9-5-3-4-7(9)6-10/h7,10H,2-6H2,1H3","VWWDYDCOZHYNJG-UHFFFAOYSA-N"
"Cc(c1)c(OCC(C4)C4)c(C)cc1c(c2)cc(C)c(OCC(C3)C3)c(C)2","InChI=1S/C24H30O2/c1-15-9-21(10-16(2)23(15)25-13-19-5-6-19)22-11-17(3)24(18(4)12-22)26-14-20-7-8-20/h9-12,19-20H,5-8,13-14H2,1-4H3","ROUMLMHVPQDDRQ-UHFFFAOYSA-N"
"CC(=O)OCC(O1)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)1","InChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3/t12-,13+,14+,15-,16-/m1/s1","LPTITAGPBXDDGR-LYYZXLFJSA-N"
"[2H]C([2H])([2H])OCC([H])(O1)C([H])(OC([2H])([2H])[2H])C([H])(OC([2H])([2H])[2H])C([H])(OC([2H])([2H])[2H])C([H])1OC([H])(O2)C([H])(OC([2H])([2H])[2H])C([H])(OC([2H])([2H])[2H])C([H])(OC([2H])([2H])[2H])C([H])(COC([2H])([2H])[2H])2","InChI=1S/C20H38O11/c1-21-9-11-13(23-3)15(25-5)17(27-7)19(29-11)31-20-18(28-8)16(26-6)14(24-4)12(30-20)10-22-2/h11-20H,9-10H2,1-8H3/i1D3,2D3,3D3,4D3,5D3,6D3,7D3,8D3","PREGLBRFCLDAND-JFUAVBILSA-N"
"[3H]C([3H])([3H])OC([H])(O1)C([H])(O)C([H])(O)C([H])(O)C([H])(CO)1","InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/i1T3","HOVAGTYPODGVJG-RLXJOQACSA-N"
"[2H]C([2H])([2H])OCC([H])(O1)C([H])(OC([2H])([2H])[2H])C([H])(OC([2H])([2H])[2H])C([H])(OC([2H])([2H])[2H])C([H])(OC)1","InChI=1S/C11H22O6/c1-12-6-7-8(13-2)9(14-3)10(15-4)11(16-5)17-7/h7-11H,6H2,1-5H3/t7?,8-,9-,10?,11+/m1/s1/i1D3,2D3,3D3,4D3","ZYGZAHUNAGVTEC-GMXVFYJPSA-N"
"CCCCCCCCC(C1)O1","InChI=1S/C10H20O/c1-2-3-4-5-6-7-8-10-9-11-10/h10H,2-9H2,1H3","AAMHBRRZYSORSH-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)COC(=O)c(c1)c(C)ccc1","InChI=1S/C15H13ClO2/c1-11-4-2-3-5-14(11)15(17)18-10-12-6-8-13(16)9-7-12/h2-9H,10H2,1H3","DACJFLLVIFTDCX-UHFFFAOYSA-N"
"Clc(c2)cc(cc2)COC(=O)c(c1)c(C)ccc1","InChI=1S/C15H13ClO2/c1-11-5-2-3-8-14(11)15(17)18-10-12-6-4-7-13(16)9-12/h2-9H,10H2,1H3","JDSAPFZIJUADTD-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc(cc2)COC(=O)c(c1)c(C)ccc1","InChI=1S/C15H13NO4/c1-11-5-2-3-8-14(11)15(17)20-10-12-6-4-7-13(9-12)16(18)19/h2-9H,10H2,1H3","TUTITNMJRNVZEO-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(COC(=O)c(c2)c(C)ccc2)c1","InChI=1S/C15H13NO4/c1-11-4-2-3-5-14(11)15(17)20-10-12-6-8-13(9-7-12)16(18)19/h2-9H,10H2,1H3","XCRHOGKPDBYWJW-UHFFFAOYSA-N"
"Cc(c2)c(ccc2)C(=O)OCc(c1)nccc1","InChI=1S/C14H13NO2/c1-11-6-2-3-8-13(11)14(16)17-10-12-7-4-5-9-15-12/h2-9H,10H2,1H3","GBUUDAAJVDQGIY-UHFFFAOYSA-N"
"Cc(c2)c(ccc2)C(=O)OCc(c1)cncc1","InChI=1S/C14H13NO2/c1-11-5-2-3-7-13(11)14(16)17-10-12-6-4-8-15-9-12/h2-9H,10H2,1H3","UKWSQGOFAPMMCG-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)C(=O)OCc(c1)cc(c2)c(ccc2)n1","InChI=1S/C18H15NO2/c1-13-6-2-4-8-16(13)18(20)21-12-14-10-15-7-3-5-9-17(15)19-11-14/h2-11H,12H2,1H3","KKFPCXIMNQALBG-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)C(=O)OCc(c1)c(c2)c(ccc2)nc1","InChI=1S/C18H15NO2/c1-13-6-2-3-7-15(13)18(20)21-12-14-10-11-19-17-9-5-4-8-16(14)17/h2-11H,12H2,1H3","WUEPOTIALDBBBY-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)C(=O)OCc(c1)c(c2)c(ncc2)cc1","InChI=1S/C18H15NO2/c1-13-6-2-3-8-15(13)18(20)21-12-14-7-4-10-17-16(14)9-5-11-19-17/h2-11H,12H2,1H3","DEMBFYWIAASJQR-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)C(=O)OCc(c1)cc(c2)c(ncc2)c1","InChI=1S/C18H15NO2/c1-13-5-2-3-7-16(13)18(20)21-12-14-8-9-17-15(11-14)6-4-10-19-17/h2-11H,12H2,1H3","OXTADCIUYHDWPS-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)C(=O)OCc(c1)cc(n2)c(ccc2)c1","InChI=1S/C18H15NO2/c1-13-5-2-3-7-16(13)18(20)21-12-14-8-9-15-6-4-10-19-17(15)11-14/h2-11H,12H2,1H3","KAZSXOXSTGUMJZ-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)C(=O)OCc(c1)c(n2)c(ccc2)cc1","InChI=1S/C18H15NO2/c1-13-6-2-3-10-16(13)18(20)21-12-15-8-4-7-14-9-5-11-19-17(14)15/h2-11H,12H2,1H3","GJVZYYVLYSMMHW-UHFFFAOYSA-N"
"Cc(c3)c(ccc3)C(=O)OCc(n1)c(c2)c(ccc2)cc1","InChI=1S/C18H15NO2/c1-13-6-2-4-8-15(13)18(20)21-12-17-16-9-5-3-7-14(16)10-11-19-17/h2-11H,12H2,1H3","AZZFAKNRCBCLEK-UHFFFAOYSA-N"
"OCc(c3)cc(C1)c(c3)c(c2)c(ccc2)1","InChI=1S/C14H12O/c15-9-10-5-6-14-12(7-10)8-11-3-1-2-4-13(11)14/h1-7,15H,8-9H2","NVRRCUVMHFKHCL-UHFFFAOYSA-N"
"OCc(c2)ccc(c2)c(c1)cccc1","InChI=1S/C13H12O/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,14H,10H2","AXCHZLOJGKSWLV-UHFFFAOYSA-N"
"OCc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C13H12O2/c14-10-11-6-8-13(9-7-11)15-12-4-2-1-3-5-12/h1-9,14H,10H2","FEOMFFKZOZMBKD-UHFFFAOYSA-N"
"OCc(c1)c(Br)ccc1","InChI=1S/C7H7BrO/c8-7-4-2-1-3-6(7)5-9/h1-4,9H,5H2","IOWGHQGLUMEZKG-UHFFFAOYSA-N"
"OCc(c2)cc(cc2)c(c1)cccc1","InChI=1S/C13H12O/c14-10-11-5-4-8-13(9-11)12-6-2-1-3-7-12/h1-9,14H,10H2","WGUZZTGZDPJWSG-UHFFFAOYSA-N"
"OCc(c1)ccc(Cl)c1","InChI=1S/C7H7ClO/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2","PTHGDVCPCZKZKR-UHFFFAOYSA-N"
"CCOC(=O)Cc(c3)cc(C1)c(c3)c(c2)c(ccc2)1","InChI=1S/C17H16O2/c1-2-19-17(18)10-12-7-8-16-14(9-12)11-13-5-3-4-6-15(13)16/h3-9H,2,10-11H2,1H3","JIUOWDAPJJNCNT-UHFFFAOYSA-N"
"CCC1=C(NC=C1C)C(=O)OCC","InChI=1S/C10H15NO2/c1-4-8-7(3)6-11-9(8)10(12)13-5-2/h6,11H,4-5H2,1-3H3","IJIMBHGENKKALU-UHFFFAOYSA-N"
"CCOC(=O)C1=C(C=C(N1)C)C","InChI=1S/C9H13NO2/c1-4-12-9(11)8-6(2)5-7(3)10-8/h5,10H,4H2,1-3H3","IZSBSZYFPYIJDI-UHFFFAOYSA-N"
"CCC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)COCC","InChI=1S/C18H23NO3/c1-4-15-13(3)17(19-16(15)12-21-5-2)18(20)22-11-14-9-7-6-8-10-14/h6-10,19H,4-5,11-12H2,1-3H3","NAHUUKINEAKKQM-UHFFFAOYSA-N"
"CCC1=C(NC=C1C)C(=O)OCC2=CC=CC=C2","InChI=1S/C15H17NO2/c1-3-13-11(2)9-16-14(13)15(17)18-10-12-7-5-4-6-8-12/h4-9,16H,3,10H2,1-2H3","QQDVJEVOWNBCDV-UHFFFAOYSA-N"
"COc(c(C)2)c(C)cc(c2)c(c1)cc(C)c(OC)c(C)1","InChI=1S/C18H22O2/c1-11-7-15(8-12(2)17(11)19-5)16-9-13(3)18(20-6)14(4)10-16/h7-10H,1-6H3","LZRFEVSDBKMZJX-UHFFFAOYSA-N"
"CCOC(=O)c(c1)nc(cc(Cl)1)C(=O)OCC","InChI=1S/C11H12ClNO4/c1-3-16-10(14)8-5-7(12)6-9(13-8)11(15)17-4-2/h5-6H,3-4H2,1-2H3","XQVRVZXJZVVBLW-UHFFFAOYSA-N"
"OC(=O)c(c1)nc(cc1)C(O)=O","InChI=1S/C7H5NO4/c9-6(10)4-2-1-3-5(8-4)7(11)12/h1-3H,(H,9,10)(H,11,12)","WJJMNDUMQPNECX-UHFFFAOYSA-N"
"COc(c2)ccc(c2)c(c1)ccc(OC)c1","InChI=1S/C14H14O2/c1-15-13-7-3-11(4-8-13)12-5-9-14(16-2)10-6-12/h3-10H,1-2H3","UIMPAOAAAYDUKQ-UHFFFAOYSA-N"
"COc(c(C)3)c(C)cc(c3)c(c2)ccc(c2)c(c1)cc(C)c(OC)c(C)1","InChI=1S/C24H26O2/c1-15-11-21(12-16(2)23(15)25-5)19-7-9-20(10-8-19)22-13-17(3)24(26-6)18(4)14-22/h7-14H,1-6H3","NESXEOLYZMMQRA-UHFFFAOYSA-N"
"CC(=O)OCC([H])(O1)C([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(OC(C)=O)C([H])(OC(C)=O)1","InChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3","LPTITAGPBXDDGR-UHFFFAOYSA-N"
"CC(=O)OCC(O1)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)C(OC(C)=O)1","InChI=1S/C16H22O11/c1-7(17)22-6-12-13(23-8(2)18)14(24-9(3)19)15(25-10(4)20)16(27-12)26-11(5)21/h12-16H,6H2,1-5H3/t12-,13-,14+,15-,16-/m1/s1","LPTITAGPBXDDGR-IBEHDNSVSA-N"
"COCC([H])(O1)C([H])(OC)C([H])(OC)C([H])(OC)C([H])1OC([H])(O2)C([H])(OC)C([H])(OC)C([H])(OC)C([H])(COC)2","InChI=1S/C20H38O11/c1-21-9-11-13(23-3)15(25-5)17(27-7)19(29-11)31-20-18(28-8)16(26-6)14(24-4)12(30-20)10-22-2/h11-20H,9-10H2,1-8H3","PREGLBRFCLDAND-UHFFFAOYSA-N"
"[H]C(C2)(O1)C([H])(CCC2)1","InChI=1S/C6H10O/c1-2-4-6-5(3-1)7-6/h5-6H,1-4H2/t5-,6+","ZWAJLVLEBYIOTI-OLQVQODUSA-N"
"c(c2)ccc(c2)CC(C1)O1","InChI=1S/C9H10O/c1-2-4-8(5-3-1)6-9-7-10-9/h1-5,9H,6-7H2","JFDMLXYWGLECEY-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)C(C1)O1","InChI=1S/C9H10O/c1-7-2-4-8(5-3-7)9-6-10-9/h2-5,9H,6H2,1H3","QAWJAMQTRGCJMH-UHFFFAOYSA-N"
"Cc(c2)c(ccc2)C(=O)OCc(c1)cccc1","InChI=1S/C15H14O2/c1-12-7-5-6-10-14(12)15(16)17-11-13-8-3-2-4-9-13/h2-10H,11H2,1H3","IRNSYGIUGHROTJ-UHFFFAOYSA-N"
"Cc(c1)c(C3)c(C)c(CCc(c(F)2)c(F)c(C3)c(F)c(F)2)c(C)1","InChI=1S/C19H18F4/c1-9-8-10(2)13-5-7-15-16(20)14(6-4-12(9)11(13)3)17(21)19(23)18(15)22/h8H,4-7H2,1-3H3","AVGZVIJRPJSSMB-UHFFFAOYSA-N"
"CCOc(c3)ccc(c3)C(=O)c(n2)c(ns2)C(=O)c(c1)ccc(OCC)c1","InChI=1S/C20H18N2O4S/c1-3-25-15-9-5-13(6-10-15)19(23)17-18(22-27-21-17)20(24)14-7-11-16(12-8-14)26-4-2/h5-12H,3-4H2,1-2H3","TWIJLBSFEGGSQO-UHFFFAOYSA-N"
"COc(c(F)1)c(C3)c(F)c(CCc(c(OC)2)c(F)c(C3)c(OC)c(F)2)c(OC)1","InChI=1S/C20H20F4O4/c1-25-17-9-5-6-11-14(22)12(20(28-4)16(24)19(11)27-3)8-7-10(13(9)21)18(26-2)15(17)23/h5-8H2,1-4H3","QJDOJWNZFOVWFQ-UHFFFAOYSA-N"
"COc(c(F)1)c(C3)c(F)c(CCc(c(C)2)c(C)c(C3)c(C)c2)c(F)1","InChI=1S/C20H21F3O/c1-10-9-11(2)14-6-8-16-17(21)15(7-5-13(10)12(14)3)18(22)19(23)20(16)24-4/h9H,5-8H2,1-4H3","TXSVAOSOAJANMF-UHFFFAOYSA-N"
"COc(c31)c(CSCc(c(F)2)c(F)c(CSC3)c(F)c(F)2)cc(C(C)(C)C)c1","InChI=1S/C21H22F4OS2/c1-21(2,3)13-5-11-7-27-9-14-16(22)15(18(24)19(25)17(14)23)10-28-8-12(6-13)20(11)26-4/h5-6H,7-10H2,1-4H3","ZTPUWTSQSLNXLF-UHFFFAOYSA-N"
"COc(c32)c(cc(C(C)(C)C)c3)CS(=O)(=O)Cc(c(F)1)c(F)c(CS(=O)(=O)C2)c(F)c(F)1","InChI=1S/C21H22F4O5S2/c1-21(2,3)13-5-11-7-31(26,27)9-14-16(22)15(18(24)19(25)17(14)23)10-32(28,29)8-12(6-13)20(11)30-4/h5-6H,7-10H2,1-4H3","SFAFWMSHCNYYOP-UHFFFAOYSA-N"
"c(c1c(n2)c(c(c5)ccc(OC)c5)c(n4)c(ns4)c(c(c3)ccc(OC)c3)2)cccc1OC","InChI=1S/C26H21N3O3S/c1-30-18-12-8-16(9-13-18)22-24(20-6-4-5-7-21(20)32-3)27-23(26-25(22)28-33-29-26)17-10-14-19(31-2)15-11-17/h4-15H,1-3H3","LQQBYBUOTIQQJM-UHFFFAOYSA-N"
"c(c1c(c(c(c5)cccc5)2)c(n4)c(ns4)c(c(c3)ccc(OCC)c3)n2)cc(OCC)cc1","InChI=1S/C27H23N3O2S/c1-3-31-21-14-10-18(11-15-21)23-24(19-8-6-5-7-9-19)28-25(27-26(23)29-33-30-27)20-12-16-22(17-13-20)32-4-2/h5-17H,3-4H2,1-2H3","JBLRLTRXXXKEJO-UHFFFAOYSA-N"
"c(c5OC)(OC)ccc(c5)c(n1)c(c(c4)ccc(OC)c4)c(n3)c(ns3)c(c(c2)ccc(OC)c2)1","InChI=1S/C27H23N3O4S/c1-31-19-10-5-16(6-11-19)23-24(18-9-14-21(33-3)22(15-18)34-4)28-25(27-26(23)29-35-30-27)17-7-12-20(32-2)13-8-17/h5-15H,1-4H3","WJXNEKWOWHAPGC-UHFFFAOYSA-N"
"n(s5)c(c(n5)2)c(c(c4)ccc(OCC)c4)nc(c2c(c3)ccc(OCC)c3)c(c1)ccc(OC)c1","InChI=1S/C28H25N3O3S/c1-4-33-22-14-6-18(7-15-22)24-25(19-8-12-21(32-3)13-9-19)29-26(28-27(24)30-35-31-28)20-10-16-23(17-11-20)34-5-2/h6-17H,4-5H2,1-3H3","RRPMPELCXYRVLJ-UHFFFAOYSA-N"
"n(s5)c(c(n5)2)c(nc(c(c4)c(OC)ccc4)c2c(c3)ccc(OCCCC)c3)c(c1)ccc(OCCCC)c1","InChI=1S/C32H33N3O3S/c1-4-6-20-37-24-16-12-22(13-17-24)28-30(26-10-8-9-11-27(26)36-3)33-29(32-31(28)34-39-35-32)23-14-18-25(19-15-23)38-21-7-5-2/h8-19H,4-7,20-21H2,1-3H3","HKIIDQRZHFXTIB-UHFFFAOYSA-N"
"O(c(c1)ccc(c(c34)nc(c(c5)ccc(c(OC)5)OC)c(c(nsn4)3)c(c2)ccc(OCCCC)c2)c1)CCCC","InChI=1S/C33H35N3O4S/c1-5-7-19-39-25-14-9-22(10-15-25)29-30(24-13-18-27(37-3)28(21-24)38-4)34-31(33-32(29)35-41-36-33)23-11-16-26(17-12-23)40-20-8-6-2/h9-18,21H,5-8,19-20H2,1-4H3","DOAYSCQZBMYDFI-UHFFFAOYSA-N"
"O=C(C1)c(c5)c(ccc5)C(=O)CC(C2)C(C3)=C(Cc(c4)c(ccc4)3)C12","InChI=1S/C23H20O2/c24-22-12-16-9-17(13-23(25)19-8-4-3-7-18(19)22)21-11-15-6-2-1-5-14(15)10-20(16)21/h1-8,16-17H,9-13H2","RTTXIRMJZDXRLK-UHFFFAOYSA-N"
"O=c(c1)c(=C3)c(=CCC(C2)C(C4)=C(Cc(c5)c(ccc5)4)C(C3)2)c(=O)c1","InChI=1S/C23H20O2/c24-22-9-10-23(25)19-8-6-17-11-16(5-7-18(19)22)20-12-14-3-1-2-4-15(14)13-21(17)20/h1-4,7-10,16-17H,5-6,11-13H2/b18-7-,19-8+","CBSAELAQAVAWAU-CLLFQMGYSA-N"
"O=c(c1)c(=C3)c(=CCC(C(=O)2)C(C4)=C(Cc(c5)c(ccc5)4)C(C3)2)c(=O)c1","InChI=1S/C23H18O3/c24-21-9-10-22(25)16-6-8-18-20-12-14-4-2-1-3-13(14)11-19(20)17(23(18)26)7-5-15(16)21/h1-6,9-10,17-18H,7-8,11-12H2/b15-5-,16-6+","ULSLYKJWCTZLPK-OPCYYNASSA-N"
"c(c5)cc(=C2)c(c5)=CCC(C1)C(C3)=C(Cc(c4)c(ccc4)3)C(C2)1","InChI=1S/C23H22/c1-2-6-17-10-12-21-13-20(11-9-16(17)5-1)22-14-18-7-3-4-8-19(18)15-23(21)22/h1-10,20-21H,11-15H2/b16-9-,17-10+","JQXFNZDROKQPAX-ZAGBYUSBSA-N"
"O=C(C1)c(c5)c(ccc5)C(=O)CC(C(=O)2)C(C3)=C(Cc(c4)c(ccc4)3)C12","InChI=1S/C23H18O3/c24-21-11-19-17-9-13-5-1-2-6-14(13)10-18(17)20(23(19)26)12-22(25)16-8-4-3-7-15(16)21/h1-8,19-20H,9-12H2","JRBCXNDSSLTTMN-UHFFFAOYSA-N"
"c(c21)cccc(c(c(C6)c(CC(C5)Cc(c3)c(CC56)cc(c4=O)c3c(c(c4[H])[H])=O)c2=O)=O)1","InChI=1S/C27H20O4/c28-24-5-6-25(29)21-13-17-9-15-7-14(8-16(17)12-20(21)24)10-22-23(11-15)27(31)19-4-2-1-3-18(19)26(22)30/h1-6,12-15H,7-11H2","SONLXENHRKIRAI-UHFFFAOYSA-N"
"c(c21)cccc(c(c(C6)c(CC(C5)Cc(c3=O)c(CC56)c(c(c4)c(ccc4)3)=O)c2=O)=O)1","InChI=1S/C27H20O4/c28-24-16-5-1-2-6-17(16)25(29)21-11-15-9-14(10-20(21)24)12-22-23(13-15)27(31)19-8-4-3-7-18(19)26(22)30/h1-8,14-15H,9-13H2","PWLSXGIFKGNTGP-UHFFFAOYSA-N"
"c(c21)cccc(c(c(C4)c(CC(C3)Cc(c6)c(cc(c65)cccc5)CC34)c2=O)=O)1","InChI=1S/C27H22O2/c28-26-22-7-3-4-8-23(22)27(29)25-13-17-9-16(12-24(25)26)10-20-14-18-5-1-2-6-19(18)15-21(20)11-17/h1-8,14-17H,9-13H2","MBRIKPCLDAAVBY-UHFFFAOYSA-N"
"c(c12)cccc1c(c(C3)c(CC(C4)C(C(Cc(c6)c(cc(c65)cccc5)4)3)=O)c2=O)=O","InChI=1S/C27H20O3/c28-25-19-11-17-9-15-5-1-2-6-16(15)10-18(17)12-20(25)14-24-23(13-19)26(29)21-7-3-4-8-22(21)27(24)30/h1-10,19-20H,11-14H2","QHEPWXNPQUENGQ-UHFFFAOYSA-N"
"c(c12)cccc1c(c(C3)c(CC(C4)C(C(Cc(c5)c4cc(c6=O)c5c(c(c6[H])[H])=O)3)=O)c2=O)=O","InChI=1S/C27H18O5/c28-23-5-6-24(29)20-10-14-8-16-12-22-21(11-15(25(16)30)7-13(14)9-19(20)23)26(31)17-3-1-2-4-18(17)27(22)32/h1-6,9-10,15-16H,7-8,11-12H2","NKNMGRFXWIQORZ-UHFFFAOYSA-N"
"C(C41)C(Cc(c6)c(cc(c65)cccc5)C4)Cc(c3)c(cc(c32)cccc2)C1","InChI=1S/C27H24/c1-2-6-21-15-25-11-19-9-18(10-24(25)14-20(21)5-1)12-26-16-22-7-3-4-8-23(22)17-27(26)13-19/h1-8,14-19H,9-13H2","DOIZPRVCNJSAAK-UHFFFAOYSA-N"
"c(c1c(n2)c(c(c5)ccc(OCC)c5)c(n4)c(ns4)c(c(c3)ccc(OCC)c3)2)cccc1Cl","InChI=1S/C27H22ClN3O2S/c1-3-32-19-13-9-17(10-14-19)23-25(21-7-5-6-8-22(21)28)29-24(27-26(23)30-34-31-27)18-11-15-20(16-12-18)33-4-2/h5-16H,3-4H2,1-2H3","SLECZDXOOZVFDN-UHFFFAOYSA-N"
"n(s5)c(c(n5)2)c(c(c4)ccc(OCC)c4)nc(c2c(c3)ccc(OCC)c3)c(c1)ccc(c1)C","InChI=1S/C28H25N3O2S/c1-4-32-22-14-10-19(11-15-22)24-25(20-8-6-18(3)7-9-20)29-26(28-27(24)30-34-31-28)21-12-16-23(17-13-21)33-5-2/h6-17H,4-5H2,1-3H3","CMNCQXJDIRCBMP-UHFFFAOYSA-N"
"n(c2c(c5)cc(c(OC)c5)OC)c(c(n4)c(ns4)c2c(c3)ccc(OCC)c3)c(c1)ccc(OCC)c1","InChI=1S/C29H27N3O4S/c1-5-35-21-12-7-18(8-13-21)25-26(20-11-16-23(33-3)24(17-20)34-4)30-27(29-28(25)31-37-32-29)19-9-14-22(15-10-19)36-6-2/h7-17H,5-6H2,1-4H3","YAXQHBVMXXPLPS-UHFFFAOYSA-N"
"COc(c5)ccc(c5)c(n1)c(n4)c(ns4)c(c(c3)ccc(OC)c3)c(c(c2)ccnc2)1","InChI=1S/C24H18N4O2S/c1-29-18-7-3-15(4-8-18)20-21(17-11-13-25-14-12-17)26-22(24-23(20)27-31-28-24)16-5-9-19(30-2)10-6-16/h3-14H,1-2H3","UHAWYEIJQQTVGE-UHFFFAOYSA-N"
"c(c1c(c(c(c5)ccnc5)2)c(n4)c(ns4)c(c(c3)ccc(OCC)c3)n2)cc(OCC)cc1","InChI=1S/C26H22N4O2S/c1-3-31-20-9-5-17(6-10-20)22-23(19-13-15-27-16-14-19)28-24(26-25(22)29-33-30-26)18-7-11-21(12-8-18)32-4-2/h5-16H,3-4H2,1-2H3","YRARVLLPDIDVQU-UHFFFAOYSA-N"
"CCOc(c4)ccc(c4)c(n1)c(n3)c(ns3)c(c(c2)ccc(OCC)c2)c(C(=O)OCC)1","InChI=1S/C24H23N3O4S/c1-4-29-17-11-7-15(8-12-17)19-21-23(27-32-26-21)20(25-22(19)24(28)31-6-3)16-9-13-18(14-10-16)30-5-2/h7-14H,4-6H2,1-3H3","OTYJWIJGRCCOGZ-UHFFFAOYSA-N"
"c(c1c(c(C(=O)OCCCC)2)c(n4)c(ns4)c(c(c3)ccc(OCC)c3)n2)cc(OCC)cc1","InChI=1S/C26H27N3O4S/c1-4-7-16-33-26(30)24-21(17-8-12-19(13-9-17)31-5-2)23-25(29-34-28-23)22(27-24)18-10-14-20(15-11-18)32-6-3/h8-15H,4-7,16H2,1-3H3","YGCCCJCUKHUESW-UHFFFAOYSA-N"
"CCOc(c4)ccc(c4)c(c2)c(n3)c(ns3)c(n2)c(c1)ccc(OCC)c1","InChI=1S/C21H19N3O2S/c1-3-25-16-9-5-14(6-10-16)18-13-22-19(21-20(18)23-27-24-21)15-7-11-17(12-8-15)26-4-2/h5-13H,3-4H2,1-2H3","VVHDXLFUUHVKEU-UHFFFAOYSA-N"
"CCOc(c4)ccc(c4)c(n2)c(n3)c(ns3)c(n2)c(c1)ccc(OCC)c1","InChI=1S/C20H18N4O2S/c1-3-25-15-9-5-13(6-10-15)17-19-20(24-27-23-19)18(22-21-17)14-7-11-16(12-8-14)26-4-2/h5-12H,3-4H2,1-2H3","HZUNANIFDICWDA-UHFFFAOYSA-N"
"[2H]C(C)(C1)C(=O)C([2H])(C)C1","InChI=1S/C7H12O/c1-5-3-4-6(2)7(5)8/h5-6H,3-4H2,1-2H3/i5D,6D","MKLARKDYEBNZFK-KCZCTXNHSA-N"
"[2H]C([2H])(C1)[SiH2]C([2H])([2H])CC1","InChI=1S/C5H12Si/c1-2-4-6-5-3-1/h1-6H2/i4D2,5D2","VMNDCBPWBMKDBI-CQOLUAMGSA-N"
"[2H]C([2H])(C1)[Si](C)(C)C([2H])([2H])CC1","InChI=1S/C7H16Si/c1-8(2)6-4-3-5-7-8/h3-7H2,1-2H3/i6D2,7D2","VPVXTYYXTKCTPM-KXGHAPEVSA-N"
"C(C1)C[SiH2]C1","InChI=1S/C4H10Si/c1-2-4-5-3-1/h1-5H2","DWRSCILTXDLQBG-UHFFFAOYSA-N"
"[2H][Si]([2H])(C1)CCC1","InChI=1S/C4H10Si/c1-2-4-5-3-1/h1-5H2/i5D2","DWRSCILTXDLQBG-BFWBPSQCSA-N"
"[2H]C([2H])(C1)[SiH2]C([2H])([2H])C1","InChI=1S/C4H10Si/c1-2-4-5-3-1/h1-5H2/i3D2,4D2","DWRSCILTXDLQBG-KHORGVISSA-N"
"C[SiH](C1)CCC1","InChI=1S/C5H12Si/c1-6-4-2-3-5-6/h6H,2-5H2,1H3","SBWCARQXLPGQNH-UHFFFAOYSA-N"
"[2H][Si](C)(C1)CCC1","InChI=1S/C5H12Si/c1-6-4-2-3-5-6/h6H,2-5H2,1H3/i6D","SBWCARQXLPGQNH-RAMDWTOOSA-N"
"[2H]C([2H])(C1)[SiH](C)C([2H])([2H])C1","InChI=1S/C5H12Si/c1-6-4-2-3-5-6/h6H,2-5H2,1H3/i4D2,5D2","SBWCARQXLPGQNH-CQOLUAMGSA-N"
"C[Si](C)(C1)CCC1","InChI=1S/C6H14Si/c1-7(2)5-3-4-6-7/h3-6H2,1-2H3","KDQBKCRYCZJUAE-UHFFFAOYSA-N"
"[2H]C([2H])(C1)[Si](C)(C)C([2H])([2H])C1","InChI=1S/C6H14Si/c1-7(2)5-3-4-6-7/h3-6H2,1-2H3/i5D2,6D2","KDQBKCRYCZJUAE-NZLXMSDQSA-N"
"C(C1)C[SiH2]1","InChI=1S/C3H8Si/c1-2-4-3-1/h1-4H2","QZYLHXTXFGOILC-UHFFFAOYSA-N"
"[2H][Si]([2H])(C1)CC1","InChI=1S/C3H8Si/c1-2-4-3-1/h1-4H2/i4D2","QZYLHXTXFGOILC-APZFVMQVSA-N"
"C[SiH](C1)CC1","InChI=1S/C4H10Si/c1-5-3-2-4-5/h5H,2-4H2,1H3","CQFRXHDORNUERA-UHFFFAOYSA-N"
"[2H][Si](C)(C1)CC1","InChI=1S/C4H10Si/c1-5-3-2-4-5/h5H,2-4H2,1H3/i5D","CQFRXHDORNUERA-UICOGKGYSA-N"
"C[Si](C)(C1)CC1","InChI=1S/C5H12Si/c1-6(2)4-3-5-6/h3-5H2,1-2H3","YQQFFTNDQFUNHB-UHFFFAOYSA-N"
"[2H]C([2H])([2H])[Si](C1)(CC1)C([2H])([2H])[2H]","InChI=1S/C5H12Si/c1-6(2)4-3-5-6/h3-5H2,1-2H3/i1D3,2D3","YQQFFTNDQFUNHB-WFGJKAKNSA-N"
"CC([Si](C)(C)1)[Si](C)(C)CC1","InChI=1S/C8H20Si2/c1-8-9(2,3)6-7-10(8,4)5/h8H,6-7H2,1-5H3","BRAPPWUWCAUKTQ-UHFFFAOYSA-N"
"C(C1)C[Si](C)(C)[Si](C)(C)C1","InChI=1S/C8H20Si2/c1-9(2)7-5-6-8-10(9,3)4/h5-8H2,1-4H3","KJMGETFPTJFIJX-UHFFFAOYSA-N"
"C[Si](C)(C1)C[Si](C)(C)CC1","InChI=1S/C8H20Si2/c1-9(2)6-5-7-10(3,4)8-9/h5-8H2,1-4H3","CPOLUICVVAWBCV-UHFFFAOYSA-N"
"C[Si](C)(C1)CC[Si](C)(C)C1","InChI=1S/C8H20Si2/c1-9(2)5-7-10(3,4)8-6-9/h5-8H2,1-4H3","PBSFHKRMPPPFIU-UHFFFAOYSA-N"
"C(C2)CC[Si](C2)(C1)CCCC1","InChI=1S/C10H20Si/c1-3-7-11(8-4-1)9-5-2-6-10-11/h1-10H2","HFUJMZDLRNNFDY-UHFFFAOYSA-N"
"C(C2)CC[Si](C2)(C1)CCC1","InChI=1S/C9H18Si/c1-2-6-10(7-3-1)8-4-5-9-10/h1-9H2","ICUSJPNKTSVHAM-UHFFFAOYSA-N"
"C(C1)[SiH2]CC(C2)(CC2)C1","InChI=1S/C8H16Si/c1-3-8(4-1)5-2-6-9-7-8/h1-7,9H2","FLNUVQXINSOEAK-UHFFFAOYSA-N"
"C(C2)C[Si](C2)(C1)CCC1","InChI=1S/C8H16Si/c1-2-6-9(5-1)7-3-4-8-9/h1-8H2","FXRBQAKUIDSTTE-UHFFFAOYSA-N"
"C(C2)C[Si](C2)(C1)CC1","InChI=1S/C7H14Si/c1-2-5-8(4-1)6-3-7-8/h1-7H2","HYJKBOFKAIXWGW-UHFFFAOYSA-N"
"[2H][Si](C)(C)Cc(c1)cccc1","InChI=1S/C9H14Si/c1-10(2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3/i10D","USQQZWZBVGCDBX-MMIHMFRQSA-N"
"C[SiH](C)Cc(c1)cccc1","InChI=1S/C9H14Si/c1-10(2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3","USQQZWZBVGCDBX-UHFFFAOYSA-N"
"c(c1)ccc(c1)[Si]([2H])(C)C","InChI=1S/C8H12Si/c1-9(2)8-6-4-3-5-7-8/h3-7,9H,1-2H3/i9D","ZISUALSZTAEPJH-QOWOAITPSA-N"
"OC(=O)c(c1)c(ncc1)C(O)=O","InChI=1S/C7H5NO4/c9-6(10)4-2-1-3-8-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)","GJAWHXHKYYXBSV-UHFFFAOYSA-N"
"OC(=O)c(c1)cnc(c1)C(O)=O","InChI=1S/C7H5NO4/c9-6(10)4-1-2-5(7(11)12)8-3-4/h1-3H,(H,9,10)(H,11,12)","LVPMIMZXDYBCDF-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(nc1)C(O)=O","InChI=1S/C7H5NO4/c9-6(10)4-1-2-8-5(3-4)7(11)12/h1-3H,(H,9,10)(H,11,12)","MJIVRKPEXXHNJT-UHFFFAOYSA-N"
"Nc(c3)ccc(c3)S(=O)(=O)Nc(c1)nc(c2)c(ccc2)n1","InChI=1S/C14H12N4O2S/c15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14/h1-9H,15H2,(H,17,18)","NHZLNPMOSADWGC-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(O)(C1)CCNC1","InChI=1S/C11H14ClNO/c12-10-3-1-9(2-4-10)11(14)5-7-13-8-6-11/h1-4,13-14H,5-8H2","LZAYOZUFUAMFLD-UHFFFAOYSA-N"
"OC(=O)CCc(c1)cc(O)cc1","InChI=1S/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12)","QVWAEZJXDYOKEH-UHFFFAOYSA-N"
"OC(=O)CCc(c1)ccc(O)c1","InChI=1S/C9H10O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5,10H,3,6H2,(H,11,12)","NMHMNPHRMNGLLB-UHFFFAOYSA-N"
"c(c1=O)(c6)c(ccc6)c(c(c2)c(c(Nc(c5)c(c4=O)c(cc5)c(=O)c(c43)cccc3)cc2)1)=O","InChI=1S/C28H15NO4/c30-25-15-7-1-3-9-17(15)27(32)23-19(25)11-5-13-21(23)29-22-14-6-12-20-24(22)28(33)18-10-4-2-8-16(18)26(20)31/h1-14,29H","WITKIIIPSSFHST-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(C1)=CCNC1","InChI=1S/C11H12ClN/c12-11-3-1-9(2-4-11)10-5-7-13-8-6-10/h1-5,13H,6-8H2","SXOMHACGFSJBIO-UHFFFAOYSA-N"
"OC(=O)c(c2)c(ccc2)Oc(c1)cccc1","InChI=1S/C13H10O3/c14-13(15)11-8-4-5-9-12(11)16-10-6-2-1-3-7-10/h1-9H,(H,14,15)","PKRSYEPBQPFNRB-UHFFFAOYSA-N"
"O=C(OCc(c1)cccc1)CCC([H])(N)C(O)=O","InChI=1S/C12H15NO4/c13-10(12(15)16)6-7-11(14)17-8-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,15,16)/t10-/m1/s1","BGGHCRNCRWQABU-SNVBAGLBSA-N"
"OC(=O)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C14H12O2/c15-14(16)13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H,(H,15,16)","PYHXGXCGESYPCW-UHFFFAOYSA-N"
"OCC([H])(O)C([H])(O)C([H])(O)CN(c21)C(=N3)C(C(=O)NC(=O)3)=Nc(cc(C)c(C)c2)1","InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m0/s1","AUNGANRZJHBGPY-SCRDCRAPSA-N"
"Oc(c3)c(c(=O)1)c(cc3)c(=O)c(c(O)2)c(ccc2)1","InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)8-4-2-6-10(16)12(8)13(7)17/h1-6,15-16H","JPICKYUTICNNNJ-UHFFFAOYSA-N"
"Nc(c3)c(c(=O)1)c(cc3)c(=O)c(c(N)2)c(ccc2)1","InChI=1S/C14H10N2O2/c15-9-5-1-3-7-11(9)14(18)8-4-2-6-10(16)12(8)13(7)17/h1-6H,15-16H2","VWBVCOPVKXNMMZ-UHFFFAOYSA-N"
"Nc(c3)cc(c(=O)1)c(c3)c(=O)c(c2)c(ccc(N)2)1","InChI=1S/C14H10N2O2/c15-7-1-3-9-11(5-7)14(18)10-4-2-8(16)6-12(10)13(9)17/h1-6H,15-16H2","WQOWBWVMZPPPGX-UHFFFAOYSA-N"
"NC(N)=O","InChI=1S/CH4N2O/c2-1(3)4/h(H4,2,3,4)","XSQUKJJJFZCRTK-UHFFFAOYSA-N"
"C1=CC(=C(C=C1N)N)O","InChI=1S/C6H8N2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H,7-8H2","XIWMTQIUUWJNRP-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)cc(cc2)N=[N+1]([O-1])c(c1)cc(cc1)[N+1]([O-1])=O","InChI=1S/C12H8N4O5/c17-14(10-4-2-6-12(8-10)16(20)21)13-9-3-1-5-11(7-9)15(18)19/h1-8H/b14-13+","XTUPRRZRWPZCTF-BUHFOSPRSA-N"
"Oc(c1)c(=O)cc(O)c(=O)1","InChI=1S/C6H4O4/c7-3-1-4(8)6(10)2-5(3)9/h1-2,7,10H","QFSYADJLNBHAKO-UHFFFAOYSA-N"
"COc(c2)cc(O1)c(c2)N=C(CBr)C(=O)1","InChI=1S/C10H8BrNO3/c1-14-6-2-3-7-9(4-6)15-10(13)8(5-11)12-7/h2-4H,5H2,1H3","XFCZURAACWKKIH-UHFFFAOYSA-N"
"Nc(c3)c(c(=O)1)c(c(O)c3)c(=O)c(c2)c(ccc2)1","InChI=1S/C14H9NO3/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6,16H,15H2","AQXYVFBSOOBBQV-UHFFFAOYSA-N"
"Nc(c3)c(c(=O)1)c(c(N)c3)c(=O)c(c2)c(ccc2)1","InChI=1S/C14H10N2O2/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6H,15-16H2","FBMQNRKSAWNXBT-UHFFFAOYSA-N"
"C1=NC2=C(N1)C(=O)N=C(N2)N","InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)","UYTPUPDQBNUYGX-UHFFFAOYSA-N"
"O=C(C4)C=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)(C#C)C1","InChI=1S/C21H28O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,13,16-18,23H,5-12H2,2-3H3/t16-,17+,18+,19+,20+,21+/m1/s1","CHNXZKVNWQUJIB-CEGNMAFCSA-N"
"FC(F)(F)C(F)(F)C(F)(F)C(F)(F)N(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C12F27N/c13-1(14,7(25,26)27)4(19,20)10(34,35)40(11(36,37)5(21,22)2(15,16)8(28,29)30)12(38,39)6(23,24)3(17,18)9(31,32)33","RVZRBWKZFJCCIB-UHFFFAOYSA-N"
"CCCC[B](O)O","InChI=1S/C4H11BO2/c1-2-3-4-5(6)7/h6-7H,2-4H2,1H3","QPKFVRWIISEVCW-UHFFFAOYSA-N"
"Oc(c1)cc(c2)c(ccc2)c(O)1","InChI=1S/C10H8O2/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,11-12H","XOOMNEFVDUTJPP-UHFFFAOYSA-N"
"[O-1][n+1](c1)cc[n+1]([O-1])c1","InChI=1S/C4H4N2O2/c7-5-1-2-6(8)4-3-5/h1-4H","SXTKIFFXFIDYJF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)CBr","InChI=1S/C7H6BrNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2","VOLRSQPSJGXRNJ-UHFFFAOYSA-N"
"C[Si](C)(C)Oc(c4)cc(C3)c(c4)C([H])(C2)C([H])(C3)C(C1)C(C)(C2)C(O)(C#C)C1","InChI=1S/C23H32O2Si/c1-6-23(24)14-12-21-20-9-7-16-15-17(25-26(3,4)5)8-10-18(16)19(20)11-13-22(21,23)2/h1,8,10,15,19-21,24H,7,9,11-14H2,2-5H3/t19-,20-,21?,22+,23+/m1/s1","OPWNBYUFDFXXHX-TYPVITMKSA-N"
"O=C(C4)C=C(C3)C([H])(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-16H,2-9H2,1H3/t13-,14+,15+,16-,18-/m0/s1","JRIZOGLBRPZBLQ-QXUSFIETSA-N"
"ONC(=O)C=CC(C)=CC(C)C(=O)c(c1)ccc(N(C)C)c1","InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-11,13,22H,1-4H3,(H,18,20)/b10-5+,12-11+","RTKIYFITIVXBLE-WKWSCTOISA-N"
"c(c4)ccc(c4)N(N=3)C(=O)C(C(C)3)C(C(C)=1)C(=O)N(c(c2)cccc2)N1","InChI=1S/C20H18N4O2/c1-13-17(19(25)23(21-13)15-9-5-3-6-10-15)18-14(2)22-24(20(18)26)16-11-7-4-8-12-16/h3-12,17-18H,1-2H3","FORCWSNQDMPPOC-UHFFFAOYSA-N"
"C[Si](C)(C1)O[Si](C)(C)C1","InChI=1S/C6H16OSi2/c1-8(2)5-6-9(3,4)7-8/h5-6H2,1-4H3","ZJWXCSUSULCHCK-UHFFFAOYSA-N"
"C(OCC)[SiH](c(c23)cccc(c([SiH](COCC)c(c4)cccc4)ccc3)2)c(c1)cccc1","InChI=1S/C28H32O2Si2/c1-3-29-21-31(23-13-7-5-8-14-23)27-19-11-18-26-25(27)17-12-20-28(26)32(22-30-4-2)24-15-9-6-10-16-24/h5-20,31-32H,3-4,21-22H2,1-2H3","OHCZBDVNWCVGKO-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)c(c3)cc(c(c3)2)C(C(C)(C)1)C(C=C2)([Si](C)(C)C)[Si](C)(C)O1","InChI=1S/C23H42OSi4/c1-22(2)21-20-17-19(27(9,10)26(6,7)8)14-13-18(20)15-16-23(21,25(3,4)5)28(11,12)24-22/h13-17,21H,1-12H3","RSFDNGIJKSFATQ-UHFFFAOYSA-N"
"CCCC[Si](Cl)(CCCC)[Si](Cl)(CCCC)CCCC","InChI=1S/C16H36Cl2Si2/c1-5-9-13-19(17,14-10-6-2)20(18,15-11-7-3)16-12-8-4/h5-16H2,1-4H3","DIQHHFKDWOIRSK-UHFFFAOYSA-N"
"C[Si](C)(C)C#C[Si](c(c2)cccc2)(c(c1)c(C)ccc1)[Si](C)(C)C","InChI=1S/C21H30Si3/c1-19-13-11-12-16-21(19)24(23(5,6)7,18-17-22(2,3)4)20-14-9-8-10-15-20/h8-16H,1-7H3","YYJZUVLJBORMQL-UHFFFAOYSA-N"
"c(c1C)cccc1C([Si]3([Si](C)(C)C)[Si](C)(C)C)(CC(=C(C3)C)C)c(c2)cccc2","InChI=1S/C26H40Si3/c1-21-15-13-14-18-25(21)26(24-16-11-10-12-17-24)19-22(2)23(3)20-29(26,27(4,5)6)28(7,8)9/h10-18H,19-20H2,1-9H3","OXASNBRYTYGECG-UHFFFAOYSA-N"
"CC(C[Si](C)(C)C)=C(C)C[Si](C)(C)C","InChI=1S/C12H28Si2/c1-11(9-13(3,4)5)12(2)10-14(6,7)8/h9-10H2,1-8H3/b12-11-","NWOONZIQJRZSMV-QXMHVHEDSA-N"
"c(c2)ccc(c2)[Si](C)(c(c1)cccc1)[Si](C)(C)C","InChI=1S/C16H22Si2/c1-17(2,3)18(4,15-11-7-5-8-12-15)16-13-9-6-10-14-16/h5-14H,1-4H3","ZQZXXLQCPQMXIO-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)c(cc3)[Si](C)(C)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C22H20Si/c1-23(2,21-15-7-11-17-9-3-5-13-19(17)21)22-16-8-12-18-10-4-6-14-20(18)22/h3-16H,1-2H3","SHCZBMYTPGCRGJ-UHFFFAOYSA-N"
"c(C([Si]5(C)C)([Si](c(c43)cccc3cccc45)(C)C)1)(c2)c(ccc2)C=CC1","InChI=1S/C24H26Si2/c1-25(2)21-15-7-11-19-12-8-16-22(23(19)21)26(3,4)24(25)17-9-13-18-10-5-6-14-20(18)24/h5-16H,17H2,1-4H3","OCLRIMUNJXLNRW-UHFFFAOYSA-N"
"c(c1)ccc(c1)[Si](C)([Si](C)(C)[Si](C)(C)C)[Si](C)(C)[Si](C)(C)C","InChI=1S/C17H38Si5/c1-18(2,3)20(7,8)22(11,17-15-13-12-14-16-17)21(9,10)19(4,5)6/h12-16H,1-11H3","NFLALYPIVCUPHL-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C([H])=1)[Si](C)(C)C(c(c2)cccc2)C([H])1","InChI=1S/C18H20Si/c1-19(2)17(15-9-5-3-6-10-15)13-14-18(19)16-11-7-4-8-12-16/h3-14,17-18H,1-2H3","YRZXTMMJKPLFDH-UHFFFAOYSA-N"
"c(c4)ccc(c4)[Si](C)(Cl)c(c3)c(c2)c(cc3)c(cc2)[Si](C)(Cl)c(c1)cccc1","InChI=1S/C24H22Cl2Si2/c1-27(25,19-11-5-3-6-12-19)23-17-9-16-22-21(23)15-10-18-24(22)28(2,26)20-13-7-4-8-14-20/h3-18H,1-2H3","PUZMVPALKJSHLL-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(C)[Si](c(c1)cccc1)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C20H32Si3/c1-18(19-14-10-8-11-15-19)23(21(2,3)4,22(5,6)7)20-16-12-9-13-17-20/h8-18H,1-7H3","SRINWIMSOLZBIV-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)c(cc3)[Si](C)(C)[Si](C)(C)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C24H26Si2/c1-25(2,23-17-9-13-19-11-5-7-15-21(19)23)26(3,4)24-18-10-14-20-12-6-8-16-22(20)24/h5-18H,1-4H3","RLWPPMCLXCJLGQ-UHFFFAOYSA-N"
"C[Si](C)(C)c(c1)scc1","InChI=1S/C7H12SSi/c1-9(2,3)7-5-4-6-8-7/h4-6H,1-3H3","OANGLGSZPSFVDY-UHFFFAOYSA-N"
"c(c4)ccc(c4)[Si](C)(Cl)c(c2)c(c3)c(ccc3)c(c2)[Si](C)(Cl)c(c1)cccc1","InChI=1S/C24H22Cl2Si2/c1-27(25,19-11-5-3-6-12-19)23-17-18-24(22-16-10-9-15-21(22)23)28(2,26)20-13-7-4-8-14-20/h3-18H,1-2H3","KMXNBQNAAWVWLF-UHFFFAOYSA-N"
"C[Si](C)(O)C(=C1)C([Si](C)(C)C)C([2H])c(c2)c(ccc2[Si](C)(C)[Si](C)(C)C)1","InChI=1S/C20H38OSi4/c1-22(2,3)19-15-17-13-18(25(9,10)23(4,5)6)12-11-16(17)14-20(19)24(7,8)21/h11-14,19,21H,15H2,1-10H3/i15D","OHHXNTFRQNXLRK-RWFJLFJASA-N"
"CC(C)C[Si](C)(C)c(c2)c([Si](C)(C)C)c(c1)c(c2)cc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C24H44Si4/c1-19(2)18-27(9,10)23-16-13-20-17-21(28(11,12)26(6,7)8)14-15-22(20)24(23)25(3,4)5/h13-17,19H,18H2,1-12H3","ZEVGZRBFMFQFRP-UHFFFAOYSA-N"
"CC(=C(C)2)C[Si](C)(C2)c(c1)cccc1","InChI=1S/C13H18Si/c1-11-9-14(3,10-12(11)2)13-7-5-4-6-8-13/h4-8H,9-10H2,1-3H3","OWCZXLLXIGBHOM-UHFFFAOYSA-N"
"c(c3)ccc(c3)[Si](C)(c(c2)sc(Br)c2)c(c1)sc(Br)c1","InChI=1S/C15H12Br2S2Si/c1-20(11-5-3-2-4-6-11,14-9-7-12(16)18-14)15-10-8-13(17)19-15/h2-10H,1H3","JWROVZUCWZMWIQ-UHFFFAOYSA-N"
"[SiH](c(c(C)3)c(C)cc(C)c3)([Si](C)(C)c(c2)cccc2)[Si](C)(C)c(c1)cccc1","InChI=1S/C25H34Si3/c1-20-18-21(2)25(22(3)19-20)26(27(4,5)23-14-10-8-11-15-23)28(6,7)24-16-12-9-13-17-24/h8-19,26H,1-7H3","HTWVIZKVBCZIGX-UHFFFAOYSA-N"
"CC[Si](Cl)(CC)[Si](Cl)(CC)CC","InChI=1S/C8H20Cl2Si2/c1-5-11(9,6-2)12(10,7-3)8-4/h5-8H2,1-4H3","RGDZHSGMSWHBAK-UHFFFAOYSA-N"
"c(c1C)cc(cc1C([Si]3([Si](C)(C)C)[Si](C)(C)C)(CC(=C(C3)C)C)c(c2)cccc2)C","InChI=1S/C27H42Si3/c1-21-16-17-22(2)26(18-21)27(25-14-12-11-13-15-25)19-23(3)24(4)20-30(27,28(5,6)7)29(8,9)10/h11-18H,19-20H2,1-10H3","FWLIDNPVHLYBNP-UHFFFAOYSA-N"
"c(c1)ccc(c1)[SiH](C)[Si](C)(C)C","InChI=1S/C10H18Si2/c1-11(12(2,3)4)10-8-6-5-7-9-10/h5-9,11H,1-4H3","TYOJOOJHYFAQKT-UHFFFAOYSA-N"
"c(c3)ccc(c3)C([Si](C)(C)1)=C([Si](C)(C)C)[SiH](c(c2)c(C)ccc2)C1","InChI=1S/C21H30Si3/c1-17-12-10-11-15-19(17)22-16-24(5,6)20(21(22)23(2,3)4)18-13-8-7-9-14-18/h7-15,22H,16H2,1-6H3","UJAMXEPYCCAXSL-UHFFFAOYSA-N"
"c(c1)cccc1C([Si](C)(C)C)=C([SiH](c(c4)c(C)ccc4)[Si](c(c3)cccc3)(c(c2)cccc2)C)[Si](C)(C)C","InChI=1S/C34H44Si4/c1-28-20-18-19-27-32(28)35(38(8,30-23-14-10-15-24-30)31-25-16-11-17-26-31)34(37(5,6)7)33(36(2,3)4)29-21-12-9-13-22-29/h9-27,35H,1-8H3/b34-33+","XMOJHBAXJBMAJH-JEIPZWNWSA-N"
"Cc(c3)cc(cc3)[Si]([Si](C)(C)C)(c21)C([Si](C)(C)C)=C([H])c(cccc2)1","InChI=1S/C21H30Si3/c1-17-11-10-13-19(15-17)24(23(5,6)7)20-14-9-8-12-18(20)16-21(24)22(2,3)4/h8-16H,1-7H3","CNOMQMUIWZHTOR-UHFFFAOYSA-N"
"C=C[Si](C)(Cl)c(c1)cccc1","InChI=1S/C9H11ClSi/c1-3-11(2,10)9-7-5-4-6-8-9/h3-8H,1H2,2H3","GSXJAPJSIVGONK-UHFFFAOYSA-N"
"CC[Si](CC)(C#1)[Si](CC)(CC)C#C[Si](CC)(CC)[Si](CC)(CC)C1","InChI=1S/C20H40Si4/c1-9-21(10-2)17-18-23(13-5,14-6)24(15-7,16-8)20-19-22(21,11-3)12-4/h9-16H2,1-8H3","LQYQMXQJUXKONI-UHFFFAOYSA-N"
"CC[Si](C)(Cl)[Si](C)(Cl)CC","InChI=1S/C6H16Cl2Si2/c1-5-9(3,7)10(4,8)6-2/h5-6H2,1-4H3","SHNKFHWZADNPMU-UHFFFAOYSA-N"
"c(c2)ccc(c2)[Si](C)(Cl)C#C[Si](C)(Cl)c(c1)cccc1","InChI=1S/C16H16Cl2Si2/c1-19(17,15-9-5-3-6-10-15)13-14-20(2,18)16-11-7-4-8-12-16/h3-12H,1-2H3","ZTFMCSPBSBCTFO-UHFFFAOYSA-N"
"c(c1[Si](C)([Si](C)(CCCCCC)c(c2)cccc2)CCCCCC)cccc1","InChI=1S/C26H42Si2/c1-5-7-9-17-23-27(3,25-19-13-11-14-20-25)28(4,24-18-10-8-6-2)26-21-15-12-16-22-26/h11-16,19-22H,5-10,17-18,23-24H2,1-4H3","BZEWXEKVKZOJLE-UHFFFAOYSA-N"
"ClC[SiH](c(c3)cccc3)c(c2)ccc(c2)[SiH](CCl)c(c1)cccc1","InChI=1S/C20H20Cl2Si2/c21-15-23(17-7-3-1-4-8-17)19-11-13-20(14-12-19)24(16-22)18-9-5-2-6-10-18/h1-14,23-24H,15-16H2","FKOCKWJYGCCZDI-UHFFFAOYSA-N"
"c(c2)cc(c1)c(c2)cc(c1)[Si](C)(C)Cl","InChI=1S/C12H13ClSi/c1-14(2,13)12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,1-2H3","URILQKXUGKSUFB-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)c(c1)cc(c2)c(ccc2[Si](C)(C)[Si](C)(C)C)c1","InChI=1S/C20H36Si4/c1-21(2,3)23(7,8)19-13-11-17-12-14-20(16-18(17)15-19)24(9,10)22(4,5)6/h11-16H,1-10H3","CIUQNKVGDUGZTP-UHFFFAOYSA-N"
"c(c1)ccc(c1)[Si](C)(C#CC=C[Si](C)(C)[Si](C)(C)C)[Si](C)(C)C","InChI=1S/C19H34Si4/c1-20(2,3)22(7,8)17-13-14-18-23(9,21(4,5)6)19-15-11-10-12-16-19/h10-13,15-17H,1-9H3/b17-13+","FHHYPLJAVCZASC-GHRIWEEISA-N"
"C[Si](C)(C)c(c([Si](CC(C)C)(C)c(c4)ccc(c43)cccc3)2)c(c1)c(cc2)ccc1","InChI=1S/C28H34Si2/c1-21(2)20-30(6,25-17-15-22-11-7-8-13-24(22)19-25)27-18-16-23-12-9-10-14-26(23)28(27)29(3,4)5/h7-19,21H,20H2,1-6H3","NWUOBOGYTBAVIH-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)[Si](C#Cc(c1)cccc1)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C21H30Si3/c1-19-13-15-21(16-14-19)24(22(2,3)4,23(5,6)7)18-17-20-11-9-8-10-12-20/h8-16H,1-7H3","KAMAFVFQMVILDR-UHFFFAOYSA-N"
"C[Si](C)(C)c(c1)ccc(c1)[Si](C)(C)C","InChI=1S/C12H22Si2/c1-13(2,3)11-7-9-12(10-8-11)14(4,5)6/h7-10H,1-6H3","NVRBTKMAZQNKPX-UHFFFAOYSA-N"
"c([Si](c(c4)cccc4)(C)[SiH](c(c3C)c(cc(C)c3)C)c(c2)cccc2)(c1)cccc1","InChI=1S/C28H30Si2/c1-22-20-23(2)28(24(3)21-22)29(25-14-8-5-9-15-25)30(4,26-16-10-6-11-17-26)27-18-12-7-13-19-27/h5-21,29H,1-4H3","DBYXZJROQFGNRY-UHFFFAOYSA-N"
"Brc(c3)ccc(c3)[Si](C)(c(c2)cccc2)c(c1)ccc(Br)c1","InChI=1S/C19H16Br2Si/c1-22(17-5-3-2-4-6-17,18-11-7-15(20)8-12-18)19-13-9-16(21)10-14-19/h2-14H,1H3","HKEBXOBIFIZXTE-UHFFFAOYSA-N"
"CC[Si](C)(C#1)[Si](C)(CC)C#C[Si](C)(CC)[Si](C)(CC)C1","InChI=1S/C16H32Si4/c1-9-17(5)13-14-19(7,11-3)20(8,12-4)16-15-18(17,6)10-2/h9-12H2,1-8H3","ZSRIYGVDTADWFF-UHFFFAOYSA-N"
"c(c1)cccc1[Si]([Si](c(c4)cccc4)(c(c3)cccc3)C#C)(c(c2)cccc2)C#C","InChI=1S/C28H22Si2/c1-3-29(25-17-9-5-10-18-25,26-19-11-6-12-20-26)30(4-2,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h1-2,5-24H","BWYKIYGPAWQNGN-UHFFFAOYSA-N"
"c(c1)cccc1[Si](C#C[2H])(c(c4)cccc4)[Si](C#C[2H])(c(c3)cccc3)c(c2)cccc2","InChI=1S/C28H22Si2/c1-3-29(25-17-9-5-10-18-25,26-19-11-6-12-20-26)30(4-2,27-21-13-7-14-22-27)28-23-15-8-16-24-28/h1-2,5-24H/i1D,2D","BWYKIYGPAWQNGN-QDNHWIQGSA-N"
"c(c3)ccc(c3)[Si](C)(Cl)c(c2)oc(c2)[Si](C)(Cl)c(c1)cccc1","InChI=1S/C18H18Cl2OSi2/c1-22(19,15-9-5-3-6-10-15)17-13-14-18(21-17)23(2,20)16-11-7-4-8-12-16/h3-14H,1-2H3","GMFLVRCCIKBFCP-UHFFFAOYSA-N"
"Brc(c2)sc(c2)[Si](C)(C)c(c1)sc(Br)c1","InChI=1S/C10H10Br2S2Si/c1-15(2,9-5-3-7(11)13-9)10-6-4-8(12)14-10/h3-6H,1-2H3","KJJFHNIBGPJTSG-UHFFFAOYSA-N"
"c(c4)c(ccc4)[Si](C)([Si](C)(c(c3)cccc3)c(c2)cccc2)c(c1)cccc1","InChI=1S/C26H26Si2/c1-27(23-15-7-3-8-16-23,24-17-9-4-10-18-24)28(2,25-19-11-5-12-20-25)26-21-13-6-14-22-26/h3-22H,1-2H3","JNZRJYXUMDPPRK-UHFFFAOYSA-N"
"c(c4)ccc(c4)[Si](c(c3)cccc3)(c(c2)csc2)c(c1)csc1","InChI=1S/C20H16S2Si/c1-3-7-17(8-4-1)23(19-11-13-21-15-19,20-12-14-22-16-20)18-9-5-2-6-10-18/h1-16H","JQNWHOFPAXWKMW-UHFFFAOYSA-N"
"[Si](C)(c(c4)cccc4)(c(c3)cccc3)CC(C)=C(C[Si](C)(c(c2)cccc2)c(c1)cccc1)C","InChI=1S/C32H36Si2/c1-27(25-33(3,29-17-9-5-10-18-29)30-19-11-6-12-20-30)28(2)26-34(4,31-21-13-7-14-22-31)32-23-15-8-16-24-32/h5-24H,25-26H2,1-4H3/b28-27-","UGKYGFNFBPZBAP-DQSJHHFOSA-N"
"C[Si](C)(C)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C14H28Si3/c1-15(2,3)13-9-11-14(12-10-13)17(7,8)16(4,5)6/h9-12H,1-8H3","WRILCDHGYNWDFY-UHFFFAOYSA-N"
"C[Si](C)(C)C#C[Si](c(c2)cccc2)(c(c1)cccc1)[Si](C)(C)C","InChI=1S/C20H28Si3/c1-21(2,3)17-18-23(22(4,5)6,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16H,1-6H3","QJACLBMFJRBXMU-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)[Si](C2)(CC(C)=C(C)2)c(c1)ccc(C)c1","InChI=1S/C20H24Si/c1-15-5-9-19(10-6-15)21(13-17(3)18(4)14-21)20-11-7-16(2)8-12-20/h5-12H,13-14H2,1-4H3","WIGCMNCYCAIXEH-UHFFFAOYSA-N"
"CC(C)=C(C)C[Si](C)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C19H24Si/c1-16(2)17(3)15-20(4,18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14H,15H2,1-4H3","JEKZJRAGCKQIDM-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)[Si](Cl)(Cl)c(c1)ccc(C)c1","InChI=1S/C14H14Cl2Si/c1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14/h3-10H,1-2H3","JRAHXNQYHZPMCW-UHFFFAOYSA-N"
"c(c1)ccc(c1)[SiH](Cl)Cl","InChI=1S/C6H6Cl2Si/c7-9(8)6-4-2-1-3-5-6/h1-5,9H","VIRVTHOOZABTPR-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)[SiH](C)CC[Si](C)(Cl)c(c1)ccc(C)c1","InChI=1S/C18H25ClSi2/c1-15-5-9-17(10-6-15)20(3)13-14-21(4,19)18-11-7-16(2)8-12-18/h5-12,20H,13-14H2,1-4H3","OYOFPNYXPNQFJM-UHFFFAOYSA-N"
"c(c3)ccc(c3)[Si]([Si](C)(C)C)(c21)C(=Cc(cccc2)1)[Si](C)(C)C","InChI=1S/C20H28Si3/c1-21(2,3)20-16-17-12-10-11-15-19(17)23(20,22(4,5)6)18-13-8-7-9-14-18/h7-16H,1-6H3","NDSQIVUJPKOZRS-UHFFFAOYSA-N"
"c(c2)ccc(c2)[Si](C)(C)[Si](C)(C)c(c1)cccc1","InChI=1S/C16H22Si2/c1-17(2,15-11-7-5-8-12-15)18(3,4)16-13-9-6-10-14-16/h5-14H,1-4H3","IIOOIYHUTINYQO-UHFFFAOYSA-N"
"C[Si](C)(Cl)c(c1)scc1","InChI=1S/C6H9ClSSi/c1-9(2,7)6-4-3-5-8-6/h3-5H,1-2H3","DEPVFYAOAUKMFL-UHFFFAOYSA-N"
"c(s2)cc(c2)[Si](C)(C)c(c1)csc1","InChI=1S/C10H12S2Si/c1-13(2,9-3-5-11-7-9)10-4-6-12-8-10/h3-8H,1-2H3","VGHQCYAPAKSXHU-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C1)([Si](C)(C)C)[Si](CC1)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C15H42Si6/c1-16(2,3)20(17(4,5)6)14-13-15-21(20,18(7,8)9)19(10,11)12/h13-15H2,1-12H3","AGTOZWQMZJDUSV-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)([Si](C)(C)C)[Si](C)([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C14H42Si6/c1-15(2,3)19(13,16(4,5)6)20(14,17(7,8)9)18(10,11)12/h1-14H3","BJUMZFCRXLCWKE-UHFFFAOYSA-N"
"C[Si](C)(Cl)c(c1)cc(cc1[Si](C)(C)Cl)[Si](C)(C)Cl","InChI=1S/C12H21Cl3Si3/c1-16(2,13)10-7-11(17(3,4)14)9-12(8-10)18(5,6)15/h7-9H,1-6H3","LBFOVAINRVHXRL-UHFFFAOYSA-N"
"C#C[Si](C#C)(C#C)c(c1)cccc1","InChI=1S/C12H8Si/c1-4-13(5-2,6-3)12-10-8-7-9-11-12/h1-3,7-11H","HYVKPKFKOROWNW-UHFFFAOYSA-N"
"CCCCCC[SiH](C)c(c1)sc(c1)[SiH](C)CCCCCC","InChI=1S/C18H36SSi2/c1-5-7-9-11-15-20(3)17-13-14-18(19-17)21(4)16-12-10-8-6-2/h13-14,20-21H,5-12,15-16H2,1-4H3","UIVZUHLZPZAWTR-UHFFFAOYSA-N"
"Brc(s1)cc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C9H17BrSSi2/c1-12(2,3)13(4,5)8-6-9(10)11-7-8/h6-7H,1-5H3","PWFUYVAHZXEALJ-UHFFFAOYSA-N"
"CCCCCCCC[SiH](C)Cl","InChI=1S/C9H21ClSi/c1-3-4-5-6-7-8-9-11(2)10/h11H,3-9H2,1-2H3","AIESGTUSSCKUCZ-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)c(c2)sc(c2)c(c1)sc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C18H34S2Si4/c1-21(2,3)23(7,8)17-13-11-15(19-17)16-12-14-18(20-16)24(9,10)22(4,5)6/h11-14H,1-10H3","WVZJBAHFZQHXQJ-UHFFFAOYSA-N"
"[H]c(c(Br)2)c([H])c(s2)[Si](C)(C)[Si](C)(C)c(s1)c([H])c([H])c(Br)1","InChI=1S/C12H16Br2S2Si2/c1-17(2,11-7-5-9(13)15-11)18(3,4)12-8-6-10(14)16-12/h5-8H,1-4H3","CFQGQBYJPOMGKE-UHFFFAOYSA-N"
"C[Si](C)(C)C[SiH]([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C10H30Si4/c1-12(2,3)10-11(13(4,5)6)14(7,8)9/h11H,10H2,1-9H3","XYJXQHYOIORECY-UHFFFAOYSA-N"
"c(c1[Si]([Si](C)(C)c(c2)ccc([Si](C)(C)[Si](C)(C)c(c3)cccc3)c2)(C)C)cccc1","InChI=1S/C26H38Si4/c1-27(2,23-15-11-9-12-16-23)29(5,6)25-19-21-26(22-20-25)30(7,8)28(3,4)24-17-13-10-14-18-24/h9-22H,1-8H3","SCYVNXZWVXZBKD-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C16H34Si4/c1-17(2,3)19(7,8)15-11-13-16(14-12-15)20(9,10)18(4,5)6/h11-14H,1-10H3","RIZQRIMSIYYFDE-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)c(c1)cc(cc1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C16H34Si4/c1-17(2,3)19(7,8)15-12-11-13-16(14-15)20(9,10)18(4,5)6/h11-14H,1-10H3","MCCGHSQNSMJXJS-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)cc(c3)[Si](C)(C)[Si](C)(C)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C24H26Si2/c1-25(2,23-15-13-19-9-5-7-11-21(19)17-23)26(3,4)24-16-14-20-10-6-8-12-22(20)18-24/h5-18H,1-4H3","VFQZUOTUGBMKPL-UHFFFAOYSA-N"
"c(c4)ccc(c4)[Si](C)(Cl)c(c1)cc(c2)c(ccc2[Si](C)(Cl)c(c3)cccc3)c1","InChI=1S/C24H22Cl2Si2/c1-27(25,21-9-5-3-6-10-21)23-15-13-19-14-16-24(18-20(19)17-23)28(2,26)22-11-7-4-8-12-22/h3-18H,1-2H3","WMPCPWLALQEAIX-UHFFFAOYSA-N"
"c(c2)ccc(c2)[Si](C)(C)[Si](C)(Cl)c(c1)cccc1","InChI=1S/C15H19ClSi2/c1-17(2,14-10-6-4-7-11-14)18(3,16)15-12-8-5-9-13-15/h4-13H,1-3H3","RAPWOOJFCRALDY-UHFFFAOYSA-N"
"C[Si](C)(Cl)c(c2)c(c1)c(cc2)c(cc1)[Si](C)(C)Cl","InChI=1S/C14H18Cl2Si2/c1-17(2,15)13-9-5-8-12-11(13)7-6-10-14(12)18(3,4)16/h5-10H,1-4H3","HLLXILCLJRIWRS-UHFFFAOYSA-N"
"c(c4)ccc(c4)[Si](C)(c(s3)c([H])c([H])c(Br)3)[Si](C)(c(c2)cccc2)c(s1)c([H])c([H])c(Br)1","InChI=1S/C22H20Br2S2Si2/c1-27(17-9-5-3-6-10-17,21-15-13-19(23)25-21)28(2,18-11-7-4-8-12-18)22-16-14-20(24)26-22/h3-16H,1-2H3","RXWBLWOMHGKHMO-UHFFFAOYSA-N"
"c(c4)ccc(c4)[SiH](C)c(c3)c(c2)c(cc3)c(cc2)[SiH](C)c(c1)cccc1","InChI=1S/C24H24Si2/c1-25(19-11-5-3-6-12-19)23-17-9-16-22-21(23)15-10-18-24(22)26(2)20-13-7-4-8-14-20/h3-18,25-26H,1-2H3","WYXNQGKTKYDVSW-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)c(c2)ccc(c2)c(c1)ccc(c1)[Si](C)(C)[Si](C)(C)C","InChI=1S/C22H38Si4/c1-23(2,3)25(7,8)21-15-11-19(12-16-21)20-13-17-22(18-14-20)26(9,10)24(4,5)6/h11-18H,1-10H3","DHBZDKHWHZYFDI-UHFFFAOYSA-N"
"C#CC([H])=C([H])[Si](C)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C17H16Si/c1-3-4-15-18(2,16-11-7-5-8-12-16)17-13-9-6-10-14-17/h1,4-15H,2H3/b15-4+","FWBBJKQAJOCFMO-SYZQJQIISA-N"
"c(c4)ccc(c4)[SiH](C)c(c3)cc(c2)c(c3)cc(c2)[SiH](C)c(c1)cccc1","InChI=1S/C24H24Si2/c1-25(21-9-5-3-6-10-21)23-15-13-20-18-24(16-14-19(20)17-23)26(2)22-11-7-4-8-12-22/h3-18,25-26H,1-2H3","PLVAMQPKLWRSLL-UHFFFAOYSA-N"
"CC#CC([H])=C([H])[Si](C)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C18H18Si/c1-3-4-11-16-19(2,17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-16H,1-2H3/b16-11+","IETJPYGXIFCQBT-LFIBNONCSA-N"
"c(c4)ccc(c4)[SiH](C)c(c1)cc(c2)c(ccc2[SiH](C)c(c3)cccc3)c1","InChI=1S/C24H24Si2/c1-25(21-9-5-3-6-10-21)23-15-13-19-14-16-24(18-20(19)17-23)26(2)22-11-7-4-8-12-22/h3-18,25-26H,1-2H3","BDNUKGQZZTVCSN-UHFFFAOYSA-N"
"Cc(c1)c(ccc1)[SiH](C)Cl","InChI=1S/C8H11ClSi/c1-7-5-3-4-6-8(7)10(2)9/h3-6,10H,1-2H3","IXIOLGYXQUHGAH-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)c(cc3)[SiH](C)c(c2)c(c1cc2)c(ccc1)[Si](C)(C)C","InChI=1S/C24H26Si2/c1-25(21-15-7-11-18-10-5-6-14-20(18)21)22-16-8-12-19-13-9-17-23(24(19)22)26(2,3)4/h5-17,25H,1-4H3","RIUNZCLGVCVFFH-UHFFFAOYSA-N"
"[Si](C)([Si](C)(C)C)(c(c3)cc(c4)c(ccc4)c3)c(c1)cc(c2)c(ccc2)c1","InChI=1S/C24H26Si2/c1-25(2,3)26(4,23-15-13-19-9-5-7-11-21(19)17-23)24-16-14-20-10-6-8-12-22(20)18-24/h5-18H,1-4H3","BCRNXLPGCYHFLZ-UHFFFAOYSA-N"
"c(c4)ccc(c4)[SiH](C)c(c2)c(c3)c(ccc3)c(c2)[SiH](C)c(c1)cccc1","InChI=1S/C24H24Si2/c1-25(19-11-5-3-6-12-19)23-17-18-24(22-16-10-9-15-21(22)23)26(2)20-13-7-4-8-14-20/h3-18,25-26H,1-2H3","TXCYFZLDBJCYCD-UHFFFAOYSA-N"
"[Si](C)([Si](C)(C)C)(c(c3)c(c4)c(ccc4)cc3)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C24H26Si2/c1-25(2,3)26(4,23-17-9-13-19-11-5-7-15-21(19)23)24-18-10-14-20-12-6-8-16-22(20)24/h5-18H,1-4H3","GEYWEFDIDTUDMB-UHFFFAOYSA-N"
"CC(=O)C(F)(F)F","InChI=1S/C3H3F3O/c1-2(7)3(4,5)6/h1H3","FHUDAMLDXFJHJE-UHFFFAOYSA-N"
"Oc(c1)c(F)ccc1","InChI=1S/C6H5FO/c7-5-3-1-2-4-6(5)8/h1-4,8H","HFHFGHLXUCOHLN-UHFFFAOYSA-N"
"COc(c1)cc(cc1)C(C)=O","InChI=1S/C9H10O2/c1-7(10)8-4-3-5-9(6-8)11-2/h3-6H,1-2H3","BAYUSCHCCGXLAY-UHFFFAOYSA-N"
"CCCOC(OCCC)(OCCC)OCCC","InChI=1S/C13H28O4/c1-5-9-14-13(15-10-6-2,16-11-7-3)17-12-8-4/h5-12H2,1-4H3","LFMXSZSVDQJYDU-UHFFFAOYSA-N"
"Fc(c1)c(F)ccc1","InChI=1S/C6H4F2/c7-5-3-1-2-4-6(5)8/h1-4H","GOYDNIKZWGIXJT-UHFFFAOYSA-N"
"Fc(c1)cc(F)cc1","InChI=1S/C6H4F2/c7-5-2-1-3-6(8)4-5/h1-4H","UEMGWPRHOOEKTA-UHFFFAOYSA-N"
"Oc(c1)ccc(F)c1","InChI=1S/C6H5FO/c7-5-1-3-6(8)4-2-5/h1-4,8H","RHMPLDJJXGPMEX-UHFFFAOYSA-N"
"BrCc(c1)cccc1","InChI=1S/C7H7Br/c8-6-7-4-2-1-3-5-7/h1-5H,6H2","AGEZXYOZHKGVCM-UHFFFAOYSA-N"
"Oc(c1)cc(F)cc1","InChI=1S/C6H5FO/c7-5-2-1-3-6(8)4-5/h1-4,8H","SJTBRFHBXDZMPS-UHFFFAOYSA-N"
"OCc(c1)ccc(c1)C(F)(F)F","InChI=1S/C8H7F3O/c9-8(10,11)7-3-1-6(5-12)2-4-7/h1-4,12H,5H2","MOOUWXDQAUXZRG-UHFFFAOYSA-N"
"COc(c1)c(Br)ccc1","InChI=1S/C7H7BrO/c1-9-7-5-3-2-4-6(7)8/h2-5H,1H3","HTDQSWDEWGSAMN-UHFFFAOYSA-N"
"COc(c1)cc(Br)cc1","InChI=1S/C7H7BrO/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3","PLDWAJLZAAHOGG-UHFFFAOYSA-N"
"Oc(c1)ccc(c1)C(F)(F)F","InChI=1S/C7H5F3O/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4,11H","BAYGVMXZJBFEMB-UHFFFAOYSA-N"
"CC(=O)c(c1)c(Br)ccc1","InChI=1S/C8H7BrO/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,1H3","PIMNFNXBTGPCIL-UHFFFAOYSA-N"
"COC(=O)c(c1)ccc(OC(C)=O)c1","InChI=1S/C10H10O4/c1-7(11)14-9-5-3-8(4-6-9)10(12)13-2/h3-6H,1-2H3","PGJQPLVEUVHSFQ-UHFFFAOYSA-N"
"C[Si](C)(C)Cl","InChI=1S/C3H9ClSi/c1-5(2,3)4/h1-3H3","IJOOHPMOJXWVHK-UHFFFAOYSA-N"
"O=Cc(c1)c(F)ccc1","InChI=1S/C7H5FO/c8-7-4-2-1-3-6(7)5-9/h1-5H","ZWDVQMVZZYIAHO-UHFFFAOYSA-N"
"OC(=O)c(c1)c(O)ccc1","InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)","YGSDEFSMJLZEOE-UHFFFAOYSA-N"
"CCO[Si](C)(C)C","InChI=1S/C5H14OSi/c1-5-6-7(2,3)4/h5H2,1-4H3","RSIHJDGMBDPTIM-UHFFFAOYSA-N"
"CO[B](OC)OC","InChI=1S/C3H9BO3/c1-5-4(6-2)7-3/h1-3H3","WRECIMRULFAWHA-UHFFFAOYSA-N"
"Fc(c(F)1)c(F)c(c(F)c(F)1)C(F)(F)F","InChI=1S/C7F8/c8-2-1(7(13,14)15)3(9)5(11)6(12)4(2)10","USPWUOFNOTUBAD-UHFFFAOYSA-N"
"Fc(c1)cc(F)c(C)c1","InChI=1S/C7H6F2/c1-5-2-3-6(8)4-7(5)9/h2-4H,1H3","MPXDAIBTYWGBSL-UHFFFAOYSA-N"
"c(c42)(c71)c(c3)ccc1ccc(c67)ccc(c56)ccc(c45)ccc2c3","InChI=1S/C24H12/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19/h1-12H","VPUGDVKSAQVFFS-UHFFFAOYSA-N"
"Cc(c1)cc(F)c(F)c1","InChI=1S/C7H6F2/c1-5-2-3-6(8)7(9)4-5/h2-4H,1H3","FZMPLKVGINKUJZ-UHFFFAOYSA-N"
"Fc(c1)cc(C)c(F)c1","InChI=1S/C7H6F2/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3","YSNVKDGEALPJGC-UHFFFAOYSA-N"
"c(c2)cc(c1)c(c2)oc1","InChI=1S/C8H6O/c1-2-4-8-7(3-1)5-6-9-8/h1-6H","IANQTJSKSUMEQM-UHFFFAOYSA-N"
"Cc(c1)oc(c2)c(ccc2)1","InChI=1S/C9H8O/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6H,1H3","GBGPVUAOTCNZPT-UHFFFAOYSA-N"
"[2H]C([2H])([2H])Oc(c1)ccc(c1)C(C)=O","InChI=1S/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H3/i2D3","NTPLXRHDUXRPNE-BMSJAHLVSA-N"
"[2H]C([2H])([2H])Oc(c1)cc(cc1)C(C)=O","InChI=1S/C9H10O2/c1-7(10)8-4-3-5-9(6-8)11-2/h3-6H,1-2H3/i2D3","BAYUSCHCCGXLAY-BMSJAHLVSA-N"
"[2H]C([2H])([2H])Oc(c1)c(ccc1)C(C)=O","InChI=1S/C9H10O2/c1-7(10)8-5-3-4-6-9(8)11-2/h3-6H,1-2H3/i2D3","DWPLEOPKBWNPQV-BMSJAHLVSA-N"
"COC(=O)C(CC(C)=C)NC(=O)N(C1)S(=O)(=O)C(C3)(C(C)(C)2)C([H])(CC(C3)2)1","InChI=1S/C18H28N2O5S/c1-11(2)8-14(15(21)25-5)19-16(22)20-10-13-9-12-6-7-18(13,17(12,3)4)26(20,23)24/h12-14H,1,6-10H2,2-5H3,(H,19,22)/t12-,13-,14?,18-/m0/s1","PNXBSELBSBWZLZ-YALINYFNSA-N"
"COC(=O)CNC(=O)N(C(=O)2)C(C)C(O2)c(c1)cccc1","InChI=1S/C14H16N2O5/c1-9-12(10-6-4-3-5-7-10)21-14(19)16(9)13(18)15-8-11(17)20-2/h3-7,9,12H,8H2,1-2H3,(H,15,18)/t9-,12-/m0/s1","SMQRFSJLAUXFKT-CABZTGNLSA-N"
"C=CCC(C(=O)OC(C)C)NC(=O)N(C(=O)1)C(C(C)C)CO1","InChI=1S/C15H24N2O5/c1-6-7-11(13(18)22-10(4)5)16-14(19)17-12(9(2)3)8-21-15(17)20/h6,9-12H,1,7-8H2,2-5H3,(H,16,19)/t11?,12-/m1/s1","LYZLPHKCONHVNV-PIJUOVFKSA-N"
"CC(C)OC(=O)CNC(=O)N(C(=O)1)C(C(C)C)CO1","InChI=1S/C12H20N2O5/c1-7(2)9-6-18-12(17)14(9)11(16)13-5-10(15)19-8(3)4/h7-9H,5-6H2,1-4H3,(H,13,16)/t9-/m1/s1","ZYCQANPJTLYPTL-SECBINFHSA-N"
"COC(=O)CNC(=O)N(C(=O)1)C(CC(C)C)CO1","InChI=1S/C11H18N2O5/c1-7(2)4-8-6-18-11(16)13(8)10(15)12-5-9(14)17-3/h7-8H,4-6H2,1-3H3,(H,12,15)/t8-/m0/s1","FXKVIIWSTZSINQ-QMMMGPOBSA-N"
"C=CCC([H])(C(=O)OC)NC(=O)N(C(=O)1)C(C(C)C)CO1","InChI=1S/C13H20N2O5/c1-5-6-9(11(16)19-4)14-12(17)15-10(8(2)3)7-20-13(15)18/h5,8-10H,1,6-7H2,2-4H3,(H,14,17)/t9-,10+/m0/s1","MTHRSLVRCLZWOL-VHSXEESVSA-N"
"COC(=O)CNC(=O)N(C(=O)1)C(CO1)C(C)(C)C","InChI=1S/C11H18N2O5/c1-11(2,3)7-6-18-10(16)13(7)9(15)12-5-8(14)17-4/h7H,5-6H2,1-4H3,(H,12,15)/t7-/m1/s1","AIBUFYWAAMTDHR-SSDOTTSWSA-N"
"C=CCC(C(=O)OC)NC(=O)N(C(=O)1)C(CO1)C(C)(C)C","InChI=1S/C14H22N2O5/c1-6-7-9(11(17)20-5)15-12(18)16-10(14(2,3)4)8-21-13(16)19/h6,9-10H,1,7-8H2,2-5H3,(H,15,18)/t9?,10-/m1/s1","DZXVWQGQLLFYCV-QVDQXJPCSA-N"
"C(C(NCc(c5)cccc5)(CC(=O)N(S(=O)(=O)2)CC(C4)([H])C(C(C)(C)3)2CCC34)[H])=Cc(c1)cccc1","InChI=1S/C28H34N2O3S/c1-27(2)23-15-16-28(27)24(17-23)20-30(34(28,32)33)26(31)18-25(14-13-21-9-5-3-6-10-21)29-19-22-11-7-4-8-12-22/h3-14,23-25,29H,15-20H2,1-2H3/b14-13+/t23-,24-,25+,28-/m0/s1","MSFYJKCCZZKLNT-MNOIWORRSA-N"
"[H]C(C)=C([H])C([H])=C([H])C(=O)OC([H])(C1)C([H])(C)CCC([H])1C(C)(C)c(c2)cccc2","InChI=1S/C22H30O2/c1-5-6-8-13-21(23)24-20-16-19(15-14-17(20)2)22(3,4)18-11-9-7-10-12-18/h5-13,17,19-20H,14-16H2,1-4H3/b6-5+,13-8+/t17-,19+,20+/m0/s1","GYOXDXZDDLIJON-HUQUJUPYSA-N"
"c(c1C([H])=C(C(N(C(OC(C)(C)C)=O)Cc(c2)cccc2)([H])C(C(O)=O)([H])C([H])(C)O[Si](C(C)(C)C)(C)C)[H])cccc1","InChI=1S/C31H45NO5Si/c1-23(37-38(8,9)31(5,6)7)27(28(33)34)26(21-20-24-16-12-10-13-17-24)32(29(35)36-30(2,3)4)22-25-18-14-11-15-19-25/h10-21,23,26-27H,22H2,1-9H3,(H,33,34)/b21-20+/t23-,26+,27-/m0/s1","LTJSMDXCNXCLDG-SBVGNNLPSA-N"
"C([H])(C(N(Cc(c2)cccc2)C(OC(C)(C)C)=O)(C(C=O)([H])C(O[Si](C(C)(C)C)(C)C)([H])C)[H])=C(c(c1)cccc1)[H]","InChI=1S/C31H45NO4Si/c1-24(36-37(8,9)31(5,6)7)27(23-33)28(21-20-25-16-12-10-13-17-25)32(29(34)35-30(2,3)4)22-26-18-14-11-15-19-26/h10-21,23-24,27-28H,22H2,1-9H3/b21-20+/t24-,27-,28+/m0/s1","VZNZSBRDDIDWSF-WFZVLGQDSA-N"
"c(c3)ccc(c3)CN(C(=O)1)C([H])(C([H])=C([H])c(c2)cccc2)C([H])(C([H])(C)O)1","InChI=1S/C20H21NO2/c1-15(22)19-18(13-12-16-8-4-2-5-9-16)21(20(19)23)14-17-10-6-3-7-11-17/h2-13,15,18-19,22H,14H2,1H3/b13-12+/t15-,18-,19+/m0/s1","KXADUGXXWLWTIX-UWBFTQSISA-N"
"C(C251)(C(CC2N(S(=O)(=O)C5)C(=O)CC(C=Cc(c4)cccc4)NCc(c3)cccc3)CC1)(C)C","InChI=1S/C28H34N2O3S/c1-27(2)23-15-16-28(27)20-34(32,33)30(25(28)17-23)26(31)18-24(14-13-21-9-5-3-6-10-21)29-19-22-11-7-4-8-12-22/h3-14,23-25,29H,15-20H2,1-2H3/b14-13+/t23?,24-,25?,28?/m0/s1","IFEBDMHPODSUQT-LAJVXCNNSA-N"
"[H]C(C2)(CC(OC(=O)C([H])=C([H])C([H])=C([H])c(c3)cccc3)(C(C2)([H])C)[H])C(c(c1)cccc1)(C)C","InChI=1S/C27H32O2/c1-21-18-19-24(27(2,3)23-15-8-5-9-16-23)20-25(21)29-26(28)17-11-10-14-22-12-6-4-7-13-22/h4-17,21,24-25H,18-20H2,1-3H3/b14-10+,17-11+/t21-,24+,25+/m0/s1","ZZWVPAWDVOGMCG-NYXDWXMYSA-N"
"c(c5)c(c4cc5)ccc(c4)C(C(C1)([H])CC(OC(=O)CC([H])(C([H])=C(c(c3)cccc3)[H])NCc(c2)cccc2)([H])C([H])(C)C1)(C)C","InChI=1S/C38H43NO2/c1-28-18-21-34(38(2,3)33-22-20-31-16-10-11-17-32(31)24-33)25-36(28)41-37(40)26-35(23-19-29-12-6-4-7-13-29)39-27-30-14-8-5-9-15-30/h4-17,19-20,22-24,28,34-36,39H,18,21,25-27H2,1-3H3/b23-19+/t28-,34+,35-,36+/m0/s1","LTBKHILYSUKMKP-XGDBSINPSA-N"
"c(c4)(cccc4)C([H])=C(C(NCc(c3)cccc3)([H])CC(OC([H])(C1)C([H])(C)CCC(C(c(c2)cccc2)(C)C)1[H])=O)[H]","InChI=1S/C34H41NO2/c1-26-19-21-30(34(2,3)29-17-11-6-12-18-29)23-32(26)37-33(36)24-31(22-20-27-13-7-4-8-14-27)35-25-28-15-9-5-10-16-28/h4-18,20,22,26,30-32,35H,19,21,23-25H2,1-3H3/b22-20+/t26-,30+,31-,32+/m0/s1","IKGWRXZRUNRTEK-PJSYMAIFSA-N"
"C(C2([H])C)CC(CC([H])2OC(CC(C([H])=C([H])C)([H])NCc(c3)cccc3)=O)([H])C(C)(C)c(c1)cccc1","InChI=1S/C29H39NO2/c1-5-12-26(30-21-23-13-8-6-9-14-23)20-28(31)32-27-19-25(18-17-22(27)2)29(3,4)24-15-10-7-11-16-24/h5-16,22,25-27,30H,17-21H2,1-4H3/b12-5+/t22-,25+,26-,27+/m0/s1","XEILNWYPBDWZCX-FLZPVYCQSA-N"
"O=C(O1)N(Cc(c2)cccc2)C([H])(C)CC1","InChI=1S/C12H15NO2/c1-10-7-8-15-12(14)13(10)9-11-5-3-2-4-6-11/h2-6,10H,7-9H2,1H3/t10-/m0/s1","PHCSJPZLPYZQAY-JTQLQIEISA-N"
"CC(C)(C)OC(=O)CC(NCc(c2)cccc2)C([H])=C([H])c(c1)cccc1","InChI=1S/C22H27NO2/c1-22(2,3)25-21(24)16-20(15-14-18-10-6-4-7-11-18)23-17-19-12-8-5-9-13-19/h4-15,20,23H,16-17H2,1-3H3/b15-14+","SMJOVCLVCALQQS-CCEZHUSRSA-N"
"c(c3)ccc(c3)CN(C(=O)2)C([H])(C2)C([H])=C([H])c(c1)cccc1","InChI=1S/C18H17NO/c20-18-13-17(12-11-15-7-3-1-4-8-15)19(18)14-16-9-5-2-6-10-16/h1-12,17H,13-14H2/b12-11+/t17-/m1/s1","HICWMSZAVNPYKA-FMQWLBJXSA-N"
"c(c4)ccc(c4)C([H])=C([H])C(=C(C(=O)OC(C1([H])C)(CC(C(c(c3)ccc(c32)cccc2)(C)C)([H])CC1)[H])[H])[H]","InChI=1S/C31H34O2/c1-23-17-19-28(31(2,3)27-20-18-25-14-8-9-15-26(25)21-27)22-29(23)33-30(32)16-10-7-13-24-11-5-4-6-12-24/h4-16,18,20-21,23,28-29H,17,19,22H2,1-3H3/b13-7+,16-10+/t23-,28+,29+/m0/s1","FIESORXJLGGJDF-ATBGVQLCSA-N"
"OCCC([H])(NCc(c2)cccc2)C([H])=C([H])c(c1)cccc1","InChI=1S/C18H21NO/c20-14-13-18(12-11-16-7-3-1-4-8-16)19-15-17-9-5-2-6-10-17/h1-12,18-20H,13-15H2/b12-11+","HLIODCUSBCPMJY-VAWYXSNFSA-N"
"","InChI=1S/C18H27O5.3C4H9.Sn/c1-2-11-20-14-6-8-16-17(23-18(14)9-10-19)7-5-13-15(22-16)4-3-12-21-13;3*1-3-4-2;/h2,10-11,13-18H,1,3-9,12H2;3*1,3-4H2,2H3;/b11-2-;;;;/t13-,14+,15+,16-,17+,18-;;;;/m1..../s1","MSTVYJCSNUCWJT-WVGCHXLWSA-N"
"COC(=O)C1=CNC(=C1C(=O)OC)C2=CC=CC=C2","InChI=1S/C14H13NO4/c1-18-13(16)10-8-15-12(11(10)14(17)19-2)9-6-4-3-5-7-9/h3-8,15H,1-2H3","JHOYJHRSOQLJIX-UHFFFAOYSA-N"
"COC(=O)C(C1)=C(C(=O)OC)C(c(c3)cccc3)N(Cc(c2)cccc2)1","InChI=1S/C21H21NO4/c1-25-20(23)17-14-22(13-15-9-5-3-6-10-15)19(18(17)21(24)26-2)16-11-7-4-8-12-16/h3-12,19H,13-14H2,1-2H3","ZOQZAHIJVNSYFS-UHFFFAOYSA-N"
"COC(=O)C(C(c(c3)cccc3)1)=C(C(=O)OC)C(c(c2)cccc2)N(C)1","InChI=1S/C21H21NO4/c1-22-18(14-10-6-4-7-11-14)16(20(23)25-2)17(21(24)26-3)19(22)15-12-8-5-9-13-15/h4-13,18-19H,1-3H3","FGXNOZQWNCQTGN-UHFFFAOYSA-N"
"COC(=O)n(c3)c(cc3)C=c(c(=O)1)c(C(=O)OC)nn(c(c2)cccc2)1","InChI=1S/C18H15N3O5/c1-25-17(23)15-14(11-13-9-6-10-20(13)18(24)26-2)16(22)21(19-15)12-7-4-3-5-8-12/h3-11H,1-2H3/b14-11-","MNBLTQPCVDADPL-KAMYIIQDSA-N"
"COC(=O)C=C(C(=O)OC)N(C)Cc(c1)cccc1","InChI=1S/C14H17NO4/c1-15(10-11-7-5-4-6-8-11)12(14(17)19-3)9-13(16)18-2/h4-9H,10H2,1-3H3/b12-9-","XHXCFKCCRZRAAW-XFXZXTDPSA-N"
"SC(=N1)n(c2)c(cc2)C=N1","InChI=1S/C6H5N3S/c10-6-8-7-4-5-2-1-3-9(5)6/h1-4H,(H,8,10)","YHDJVFRFPVQQBR-UHFFFAOYSA-N"
"CC(C)(C)N(N=1)C(=O)n(c2)c(cc2)C1","InChI=1S/C10H13N3O/c1-10(2,3)13-9(14)12-6-4-5-8(12)7-11-13/h4-7H,1-3H3","BKVYRJITXUGASZ-UHFFFAOYSA-N"
"[H]c(c([H])1)c([H])n(C(=O)2)c1C(=O)NN(C(C)(C)C)2","InChI=1S/C10H13N3O2/c1-10(2,3)13-9(15)12-6-4-5-7(12)8(14)11-13/h4-6H,1-3H3,(H,11,14)","WQLAWOVOLCRKAT-UHFFFAOYSA-N"
"CN(N=1)C(=O)n(c2)c(cc2)C1","InChI=1S/C7H7N3O/c1-9-7(11)10-4-2-3-6(10)5-8-9/h2-5H,1H3","YPIXFRMCJJZKOC-UHFFFAOYSA-N"
"c(c3)ccc(c3)CN(N=1)C(=O)n(c2)c(cc2)C1","InChI=1S/C13H11N3O/c17-13-15-8-4-7-12(15)9-14-16(13)10-11-5-2-1-3-6-11/h1-9H,10H2","UEFIKAMUIWOPPJ-UHFFFAOYSA-N"
"O=C(N1)n(c2)c(cc2)C=N1","InChI=1S/C6H5N3O/c10-6-8-7-4-5-2-1-3-9(5)6/h1-4H,(H,8,10)","OQRPWJFDQXSBRH-UHFFFAOYSA-N"
"CC(C)(C)NC(=O)NC(C)(C)c(c1)cccc1","InChI=1S/C14H22N2O/c1-13(2,3)15-12(17)16-14(4,5)11-9-7-6-8-10-11/h6-10H,1-5H3,(H2,15,16,17)","HDKBXCJPXGAQTP-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(=O)NC([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C14H25NOSi2/c1-17(2,3)14(18(4,5)6)15-13(16)12-10-8-7-9-11-12/h7-11,14H,1-6H3,(H,15,16)","LOLJOUYHPBYQHE-UHFFFAOYSA-N"
"c(c1)ccc(c1)C(=O)N(C)C([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C15H27NOSi2/c1-16(14(17)13-11-9-8-10-12-13)15(18(2,3)4)19(5,6)7/h8-12,15H,1-7H3","NWWLYVWRNWGAEB-UHFFFAOYSA-N"
"COC(=O)c(c([H])1)c(c(c2)cccc2)n(C)c([Si](C)(C)C)1","InChI=1S/C16H21NO2Si/c1-17-14(20(3,4)5)11-13(16(18)19-2)15(17)12-9-7-6-8-10-12/h6-11H,1-5H3","XIPSZFRGMKNJAT-UHFFFAOYSA-N"
"COC(=O)c(c(c(c2)cccc2)1)c(C(=O)OC)c([Si](C)(C)C)n(C)1","InChI=1S/C18H23NO4Si/c1-19-15(12-10-8-7-9-11-12)13(17(20)22-2)14(18(21)23-3)16(19)24(4,5)6/h7-11H,1-6H3","YWPUIMMAJJUFBQ-UHFFFAOYSA-N"
"COC(=O)C1=C(NC(=C1C(=O)OC)[Si](C)(C)C)C2=CC=CC=C2","InChI=1S/C17H21NO4Si/c1-21-16(19)12-13(17(20)22-2)15(23(3,4)5)18-14(12)11-9-7-6-8-10-11/h6-10,18H,1-5H3","QSRJOFCWFWAPJH-UHFFFAOYSA-N"
"C=CCOc(c1)c(ccc1)C=NC([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C17H29NOSi2/c1-8-13-19-16-12-10-9-11-15(16)14-18-17(20(2,3)4)21(5,6)7/h8-12,14,17H,1,13H2,2-7H3/b18-14+","GDNQPQDOMYIIIY-NBVRZTHBSA-N"
"c(c1)ccc(c1)C=NC([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C14H25NSi2/c1-16(2,3)14(17(4,5)6)15-12-13-10-8-7-9-11-13/h7-12,14H,1-6H3/b15-12-","IVNKBXWUJJTCLW-QINSGFPZSA-N"
"COC(=O)c(c1)c(C(=O)OC)nn(C(C)(C)C)c(=O)n(c2)c(cc2)1","InChI=1S/C16H19N3O5/c1-16(2,3)19-15(22)18-8-6-7-10(18)9-11(13(20)23-4)12(17-19)14(21)24-5/h6-9H,1-5H3/b11-9+,17-12+","ZXJAGBZHYUDHNH-KAZNXQFFSA-N"
"COC(=O)c(c1)c(C(=O)OC)nn(C)c(=O)n(c2)c(cc2)1","InChI=1S/C13H13N3O5/c1-15-13(19)16-6-4-5-8(16)7-9(11(17)20-2)10(14-15)12(18)21-3/h4-7H,1-3H3/b9-7+,14-10+","ZSTBUXXHIKVPIZ-IESVIYHPSA-N"
"C(C56[Si](C)(C)C)(C(C(c(c7)cccc7)(N6C)C(C53)C(=O)N(c(c4)cccc4)C3=O)1)C(N(c(c2)cccc2)C(=O)1)=O","InChI=1S/C32H31N3O4Si/c1-33-31(20-14-8-5-9-15-20)23-25(29(38)34(27(23)36)21-16-10-6-11-17-21)32(33,40(2,3)4)26-24(31)28(37)35(30(26)39)22-18-12-7-13-19-22/h5-19,23-26H,1-4H3","QQVIDBZLVINMML-UHFFFAOYSA-N"
"c(c5)ccc(c5)N(N31)C(c(c4)n(cc4)C(=O)3)c(c2)c(ccc2)1","InChI=1S/C18H13N3O/c22-18-19-12-6-11-16(19)17-14-9-4-5-10-15(14)21(18)20(17)13-7-2-1-3-8-13/h1-12,17H","UNCFTRHPAZCHOC-UHFFFAOYSA-N"
"COC(=O)c(n1)c(=Cc(c([H])2)n(C(=O)OC)c([H])c([H])2)c(=O)n(C)1","InChI=1S/C13H13N3O5/c1-15-11(17)9(10(14-15)12(18)20-2)7-8-5-4-6-16(8)13(19)21-3/h4-7H,1-3H3/b9-7+","CBZBTEMGKJECOG-VQHVLOKHSA-N"
"c(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])([Si](C)(C)C)2)C([H])1C(c(c3)cccc3)N2","InChI=1S/C21H24N2O2Si/c1-26(2,3)19-17-16(18(22-19)14-10-6-4-7-11-14)20(24)23(21(17)25)15-12-8-5-9-13-15/h4-13,16-19,22H,1-3H3/t16-,17-,18?,19+/m1/s1","VIMLDWOVFSLUBJ-VPQXAQPCSA-N"
"c(c4)ccc(c4)C(=N3)C([H])(C(=O)1)C([H])(C3)C(=O)N(c(c2)cccc2)1","InChI=1S/C18H14N2O2/c21-17-14-11-19-16(12-7-3-1-4-8-12)15(14)18(22)20(17)13-9-5-2-6-10-13/h1-10,14-15H,11H2/t14-,15-/m1/s1","HLWUBVVHVMJKTP-HUUCEWRRSA-N"
"c(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])([Si](C)(C)C)2)C([H])1C(c(c3)cccc3)=N2","InChI=1S/C21H22N2O2Si/c1-26(2,3)19-17-16(18(22-19)14-10-6-4-7-11-14)20(24)23(21(17)25)15-12-8-5-9-13-15/h4-13,16-17,19H,1-3H3/t16-,17-,19+/m1/s1","NMQPRLMQDAJJKZ-LMMKCTJWSA-N"
"","InChI=1S/C28H28N2O3Si/c1-34(2,3)28-23-22(26(32)29(27(23)33)21-17-11-6-12-18-21)24(19-13-7-4-8-14-19)30(28)25(31)20-15-9-5-10-16-20/h4-18,22-24,28H,1-3H3/t22-,23+,24-,28+/m1/s1","BVDBCALRFHDKGL-PVIBPIFHSA-N"
"c(c4)ccc(c4)N(C(=O)1)C(=O)C([H])(C([H])([Si](C)(C)C)2)C([H])1C(c(c3)cccc3)=N2","InChI=1S/C21H22N2O2Si/c1-26(2,3)19-17-16(18(22-19)14-10-6-4-7-11-14)20(24)23(21(17)25)15-12-8-5-9-13-15/h4-13,16-17,19H,1-3H3/t16-,17+,19+/m1/s1","NMQPRLMQDAJJKZ-AOIWGVFYSA-N"
"C(C13[H])(=O)N(c(c5)cccc5)C(C1([H])CN(C3([H])c(c4)cccc4)C(=O)c(c2)cccc2)=O","InChI=1S/C25H20N2O3/c28-23(18-12-6-2-7-13-18)26-16-20-21(22(26)17-10-4-1-5-11-17)25(30)27(24(20)29)19-14-8-3-9-15-19/h1-15,20-22H,16H2/t20-,21-,22-/m1/s1","LZVNGKZIHPRVON-YPAWHYETSA-N"
"OC(C1)C(C2)C(CCC2)C1","InChI=1S/C9H16O/c10-9-6-5-7-3-1-2-4-8(7)9/h7-10H,1-6H2","WHHUTBUNHHDROB-UHFFFAOYSA-N"
"OC(C1)CC(C2)C(CCC2)1","InChI=1S/C9H16O/c10-9-5-7-3-1-2-4-8(7)6-9/h7-10H,1-6H2","FNTAZLZSKBIIIW-UHFFFAOYSA-N"
"[2H]C(O)(C1)C(C2)C(CCC2)C1","InChI=1S/C9H16O/c10-9-6-5-7-3-1-2-4-8(7)9/h7-10H,1-6H2/i9D","WHHUTBUNHHDROB-QOWOAITPSA-N"
"OC(C1)C([2H])C(C2)C(CCC2)1","InChI=1S/C9H16O/c10-9-5-7-3-1-2-4-8(7)6-9/h7-10H,1-6H2/i5D","FNTAZLZSKBIIIW-UICOGKGYSA-N"
"O=C(C1)C(C2)C(CCC2)C1","InChI=1S/C9H14O/c10-9-6-5-7-3-1-2-4-8(7)9/h7-8H,1-6H2","ATKSQUYIHKMKTG-UHFFFAOYSA-N"
"O=C(C1)CC(C2)C(CCC2)1","InChI=1S/C9H14O/c10-9-5-7-3-1-2-4-8(7)6-9/h7-8H,1-6H2","HAMUKWWZXAKCAU-UHFFFAOYSA-N"
"CN(C)c(c4)cc(C)c(c(C)4)c(c1)c(c3)c(ccc3)c(c2)c(ccc2)1","InChI=1S/C24H23N/c1-16-13-19(25(3)4)14-17(2)24(16)23-15-18-9-5-6-10-20(18)21-11-7-8-12-22(21)23/h5-15H,1-4H3","QJSUZPQTDAZZIE-UHFFFAOYSA-N"
"CN(C)c(c4)ccc(c4)c(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C22H19N/c1-23(2)19-13-11-16(12-14-19)22-20-9-5-3-7-17(20)15-18-8-4-6-10-21(18)22/h3-15H,1-2H3","CPADYVIHWPZXEE-UHFFFAOYSA-N"
"CN(C)c(c4)ccc(c4)C(c21)c(c3)c(ccc3)c(cccc2)1","InChI=1S/C21H19N/c1-22(2)16-13-11-15(12-14-16)21-19-9-5-3-7-17(19)18-8-4-6-10-20(18)21/h3-14,21H,1-2H3","WKIKVLRCRQYTJZ-UHFFFAOYSA-N"
"CN(C)c(c5)ccc(c5)c(c4)c(c1)c(c3c4)c(c2cc3)c(ccc2)c1","InChI=1S/C24H19N/c1-25(2)20-12-8-16(9-13-20)21-14-10-19-7-6-17-4-3-5-18-11-15-22(21)24(19)23(17)18/h3-15H,1-2H3","VYIYLDMJKOXUIV-UHFFFAOYSA-N"
"OC(=O)Cn(c(=O)1)c(=O)c(c2)c(ccc2)1","InChI=1S/C10H7NO4/c12-8(13)5-11-9(14)6-3-1-2-4-7(6)10(11)15/h1-4H,5H2,(H,12,13)","WQINSVOOIJDOLJ-UHFFFAOYSA-N"
"NNc(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C6H7N3O2/c7-8-5-1-3-6(4-2-5)9(10)11/h1-4,8H,7H2","KMVPXBDOWDXXEN-UHFFFAOYSA-N"
"Nc(c1)ccnc1","InChI=1S/C5H6N2/c6-5-1-3-7-4-2-5/h1-4H,(H2,6,7)","NUKYPUAOHBNCPY-UHFFFAOYSA-N"
"OC(=O)CNC(=O)c(c1)ccc(N)c1","InChI=1S/C9H10N2O3/c10-7-3-1-6(2-4-7)9(14)11-5-8(12)13/h1-4H,5,10H2,(H,11,14)(H,12,13)","HSMNQINEKMPTIC-UHFFFAOYSA-N"
"CC(=O)Nc(n1)scc1","InChI=1S/C5H6N2OS/c1-4(8)7-5-6-2-3-9-5/h2-3H,1H3,(H,6,7,8)","WXPLRSVMGRAIGW-UHFFFAOYSA-N"
"NC(=N1)SCC1","InChI=1S/C3H6N2S/c4-3-5-1-2-6-3/h1-2H2,(H2,4,5)","REGFWZVTTFGQOJ-UHFFFAOYSA-N"
"CC(=O)NC(CS)C(O)=O","InChI=1S/C5H9NO3S/c1-3(7)6-4(2-10)5(8)9/h4,10H,2H2,1H3,(H,6,7)(H,8,9)/t4-/m0/s1","PWKSKIMOESPYIA-BYPYZUCNSA-N"
"NCCCC(O)=O","InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)","BTCSSZJGUNDROE-UHFFFAOYSA-N"
"NCCCCC(O)=O","InChI=1S/C5H11NO2/c6-4-2-1-3-5(7)8/h1-4,6H2,(H,7,8)","JJMDCOVWQOJGCB-UHFFFAOYSA-N"
"CNc(c2)c(cc(Cl)c2)C(=O)c(c1)c(Cl)ccc1","InChI=1S/C14H11Cl2NO/c1-17-13-7-6-9(15)8-11(13)14(18)10-4-2-3-5-12(10)16/h2-8,17H,1H3","DQYHYPVCQHTLRO-UHFFFAOYSA-N"
"N#Cc(c1)cc(CBr)cc1","InChI=1S/C8H6BrN/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5H2","CVKOOKPNCVYHNY-UHFFFAOYSA-N"
"BrCc(c1)cc(cc1C(F)(F)F)C(F)(F)F","InChI=1S/C9H5BrF6/c10-4-5-1-6(8(11,12)13)3-7(2-5)9(14,15)16/h1-3H,4H2","ATLQGZVLWOURFU-UHFFFAOYSA-N"
"O[B](O)c(c1)ccc(Br)c1","InChI=1S/C6H6BBrO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4,9-10H","QBLFZIBJXUQVRF-UHFFFAOYSA-N"
"O=C(C1)CC(C)(C)CC(=O)1","InChI=1S/C8H12O2/c1-8(2)4-6(9)3-7(10)5-8/h3-5H2,1-2H3","BADXJIPKFRBFOT-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(Cl)c1","InChI=1S/C6H3ClN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H","VYZAHLCBVHPDDF-UHFFFAOYSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-OELDTZBJSA-N"
"C(C1)COS(=O)(=O)C1","InChI=1S/C4H8O3S/c5-8(6)4-2-1-3-7-8/h1-4H2","MHYFEEDKONKGEB-UHFFFAOYSA-N"
"OC(=O)C=Cc(c1)c(O)ccc1","InChI=1S/C9H8O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-6,10H,(H,11,12)/b6-5+","PMOWTIHVNWZYFI-AATRIKPKSA-N"
"O=C(O1)C(CC(C(=O)3)=C(O)c(c4)c(ccc4)O3)=C(O)c(c2)c(ccc2)1","InChI=1S/C19H12O6/c20-16-10-5-1-3-7-14(10)24-18(22)12(16)9-13-17(21)11-6-2-4-8-15(11)25-19(13)23/h1-8,20-21H,9H2","DOBMPNYZJYQDGZ-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(C)c(N)c1","InChI=1S/C7H8N2O2/c1-5-4-6(9(10)11)2-3-7(5)8/h2-4H,8H2,1H3","XTTIQGSLJBWVIV-UHFFFAOYSA-N"
"c(c2)ncc(c2)C(=O)C(C)(C)c(c1)cncc1","InChI=1S/C14H14N2O/c1-14(2,12-6-4-8-16-10-12)13(17)11-5-3-7-15-9-11/h3-10H,1-2H3","FJLBFSROUSIWMA-UHFFFAOYSA-N"
"OCC(O)=O","InChI=1S/C2H4O3/c3-1-2(4)5/h3H,1H2,(H,4,5)","AEMRFAOFKBGASW-UHFFFAOYSA-N"
"COc(c4)cc(c3c4)c(ccn3)C(O)C(C1)N(C2)CC(C=C)C([H])(C2)1","InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m1/s1","LOUPRKONTZGTKE-FQZPYLGXSA-N"
"COc(c4)cc(c3c4)c(ccn3)C(O)C(C1)N(C2)CC(C=C)C([H])(C2)1","InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19+,20-/m1/s1","LOUPRKONTZGTKE-VPCNSNALSA-N"
"O(C1)C1(C34[H])C(C(C4O)OC(C)=O)(C(C(O3)([H])2)(COC(C)=O)CC(OC(=O)CC(C)C)C(C)=C2)C","InChI=1S/C24H34O9/c1-12(2)7-18(27)32-16-9-23(10-29-14(4)25)17(8-13(16)3)33-21-19(28)20(31-15(5)26)22(23,6)24(21)11-30-24/h8,12,16-17,19-21,28H,7,9-11H2,1-6H3/t16-,17+,19+,20+,21+,22+,23+,24-/m0/s1","BXFOFFBJRFZBQZ-QYWOHJEZSA-N"
"COC(=O)c(c(C)1)c(OC)cc(O)c1","InChI=1S/C10H12O4/c1-6-4-7(11)5-8(13-2)9(6)10(12)14-3/h4-5,11H,1-3H3","ZGYSDRFXXJOWGZ-UHFFFAOYSA-N"
"CCOC(=O)CN.Cl","InChI=1S/C4H9NO2.ClH/c1-2-7-4(6)3-5;/h2-3,5H2,1H3;1H","TXTWXQXDMWILOF-UHFFFAOYSA-N"
"COC(=O)c(c(C)1)c(O)cc(O)c1","InChI=1S/C9H10O4/c1-5-3-6(10)4-7(11)8(5)9(12)13-2/h3-4,10-11H,1-2H3","NCCWCZLEACWJIN-UHFFFAOYSA-N"
"S(S1)SSSSSS1","InChI=1S/S8/c1-2-4-6-8-7-5-3-1","JLQNHALFVCURHW-UHFFFAOYSA-N"
"c(c4)ccc(c4)C(=C3)Oc(c1)c(C(=O)3)c(c2)c(ccc2)c1","InChI=1S/C19H12O2/c20-16-12-18(14-7-2-1-3-8-14)21-17-11-10-13-6-4-5-9-15(13)19(16)17/h1-12H","OUGIDAPQYNCXRA-UHFFFAOYSA-N"
"OCCCCCCCCCCCC(O)=O","InChI=1S/C12H24O3/c13-11-9-7-5-3-1-2-4-6-8-10-12(14)15/h13H,1-11H2,(H,14,15)","ZDHCZVWCTKTBRY-UHFFFAOYSA-N"
"CC(O)C(O)=O","InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)","JVTAAEKCZFNVCJ-UHFFFAOYSA-N"
"O=C(N1)NC(=O)C(N)C(=O)1","InChI=1S/C4H5N3O3/c5-1-2(8)6-4(10)7-3(1)9/h1H,5H2,(H2,6,7,8,9,10)","PSQZLWHRJMYZHD-UHFFFAOYSA-N"
"OCCn(c([H])2)c(C(=O)1)c(n2)N(C)C(=O)N(C)1","InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3","NWPRCRWQMGIBOT-UHFFFAOYSA-N"
"CC(O)Cn(c2)c(C(=O)1)c(n2)N(C)C(=O)N(C)1","InChI=1S/C10H14N4O3/c1-6(15)4-14-5-11-8-7(14)9(16)13(3)10(17)12(8)2/h5-6,15H,4H2,1-3H3","KYHQZNGJUGFTGR-UHFFFAOYSA-N"
"OCC(O)Cn(c2)c(C(=O)1)c(n2)N(C)C(=O)N(C)1","InChI=1S/C10H14N4O4/c1-12-8-7(9(17)13(2)10(12)18)14(5-11-8)3-6(16)4-15/h5-6,15-16H,3-4H2,1-2H3","KSCFJBIXMNOVSH-UHFFFAOYSA-N"
"C[SiH](C)C#Cc(c1)cccc1","InChI=1S/C10H12Si/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7,11H,1-2H3","JPQVPTPDZWZPQT-UHFFFAOYSA-N"
"C[Si](C)(C)C#Cc(c1)cc(N)c(c1)C#C[Si](C)(C)C","InChI=1S/C16H23NSi2/c1-18(2,3)11-9-14-7-8-15(16(17)13-14)10-12-19(4,5)6/h7-8,13H,17H2,1-6H3","OSGZOINJOWXGQI-UHFFFAOYSA-N"
"C#CC(C(C#C)=1)=C([Si](C)(C)C)[Si](C)(C)C([Si](C)(C)C)1","InChI=1S/C16H26Si3/c1-11-13-14(12-2)16(18(6,7)8)19(9,10)15(13)17(3,4)5/h1-2H,3-10H3","CJPAQDRQMODKHS-UHFFFAOYSA-N"
"c(c1)ccc(c1)C#C[Si](C)(C)Cl","InChI=1S/C10H11ClSi/c1-12(2,11)9-8-10-6-4-3-5-7-10/h3-7H,1-2H3","MYOJVBNQQVJWHE-UHFFFAOYSA-N"
"C#CC#C[Si](C)(C)C","InChI=1S/C7H10Si/c1-5-6-7-8(2,3)4/h1H,2-4H3","GVCHYDYMLIWQPE-UHFFFAOYSA-N"
"C[SiH](C)O[Si](C)(C)O[SiH](C)C","InChI=1S/C6H20O2Si3/c1-9(2)7-11(5,6)8-10(3)4/h9-10H,1-6H3","HZBDPZBVINJJET-UHFFFAOYSA-N"
"Brc(c1)cc(cc1)N([Si](C)(C)C)[Si](C)(C)C","InChI=1S/C12H22BrNSi2/c1-15(2,3)14(16(4,5)6)12-9-7-8-11(13)10-12/h7-10H,1-6H3","MDGATTWZVMLJMF-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)[Si](C)(Cl)CC","InChI=1S/C10H15ClSi/c1-4-12(3,11)10-7-5-9(2)6-8-10/h5-8H,4H2,1-3H3","KBTQTCKPXGMEGG-UHFFFAOYSA-N"
"CC[SiH](CC)c(c2)c(ccc2)[Si](CC)(CC)C([H])=C([H])c(c1)cccc1","InChI=1S/C22H32Si2/c1-5-23(6-2)21-16-12-13-17-22(21)24(7-3,8-4)19-18-20-14-10-9-11-15-20/h9-19,23H,5-8H2,1-4H3/b19-18+","FLKOOYUSMGBXQI-VHEBQXMUSA-N"
"CC[Si](CC)(c21)c(c3)c(ccc3)[Si](CC)(CC)c(cccc2)1","InChI=1S/C20H28Si2/c1-5-21(6-2)17-13-9-11-15-19(17)22(7-3,8-4)20-16-12-10-14-18(20)21/h9-16H,5-8H2,1-4H3","XVDULWVRZSBLGW-UHFFFAOYSA-N"
"CC[Si](CC)(C1)c(c2)c(ccc2)[Si](CC)(CC)C1","InChI=1S/C16H28Si2/c1-5-17(6-2)13-14-18(7-3,8-4)16-12-10-9-11-15(16)17/h9-12H,5-8,13-14H2,1-4H3","GRHDPCHHVFWZBM-UHFFFAOYSA-N"
"c(c5)cc(cc5)[Si](c43)(c(c2)c(c3cccc4)ccc2)C(C=1C)(C(=C(C)C(C)1)C)C","InChI=1S/C28H28Si/c1-19-20(2)22(4)28(5,21(19)3)29(23-13-7-6-8-14-23)26-17-11-9-15-24(26)25-16-10-12-18-27(25)29/h6-18H,1-5H3","DKHGQWUZCPYZOG-UHFFFAOYSA-N"
"CC[SiH](CC)c(c2)c(ccc2)[Si](CC)(CC)C#Cc(c1)cccc1","InChI=1S/C22H30Si2/c1-5-23(6-2)21-16-12-13-17-22(21)24(7-3,8-4)19-18-20-14-10-9-11-15-20/h9-17,23H,5-8H2,1-4H3","DDVDTQDACUPAFP-UHFFFAOYSA-N"
"CC[Si](CC)(CC)C#CC#CC#CC#C[Si](CC)(CC)CC","InChI=1S/C20H30Si2/c1-7-21(8-2,9-3)19-17-15-13-14-16-18-20-22(10-4,11-5)12-6/h7-12H2,1-6H3","YXTUPTZXIDLSHB-UHFFFAOYSA-N"
"c(c3)c(ccc3[Si](c(c4)cccc4)(C)Cl)c(c2)ccc(c2)[Si](c(c1)cccc1)(C)Cl","InChI=1S/C26H24Cl2Si2/c1-29(27,23-9-5-3-6-10-23)25-17-13-21(14-18-25)22-15-19-26(20-16-22)30(2,28)24-11-7-4-8-12-24/h3-20H,1-2H3","PQLPMUJETIAKPR-UHFFFAOYSA-N"
"c(c1)ccc(c1)C#C[Si](C)(C)[Si](C)(C)C","InChI=1S/C13H20Si2/c1-14(2,3)15(4,5)12-11-13-9-7-6-8-10-13/h6-10H,1-5H3","BSWIDNCLOWNORA-UHFFFAOYSA-N"
"C[Si](C)(C)C#CC#CC#C[Si](C)(C)C","InChI=1S/C12H18Si2/c1-13(2,3)11-9-7-8-10-12-14(4,5)6/h1-6H3","WFRYFVIBFUVRKZ-UHFFFAOYSA-N"
"Brc(c2)sc(c(Br)2)c(s1)c(Br)cc(Br)1","InChI=1S/C8H2Br4S2/c9-3-1-5(11)13-7(3)8-4(10)2-6(12)14-8/h1-2H","MOMHMPZSZNZLAK-UHFFFAOYSA-N"
"c(c1)c(ccc([Si](c(c4)cccc4)([Si](c(c3)cccc3)(c(c2)ccc(c2)Br)C)C)1)Br","InChI=1S/C26H24Br2Si2/c1-29(23-9-5-3-6-10-23,25-17-13-21(27)14-18-25)30(2,24-11-7-4-8-12-24)26-19-15-22(28)16-20-26/h3-20H,1-2H3","XYZNTWCMWKNRRA-UHFFFAOYSA-N"
"CCO[Si](C)(OCC)c(c1)cccc1","InChI=1S/C11H18O2Si/c1-4-12-14(3,13-5-2)11-9-7-6-8-10-11/h6-10H,4-5H2,1-3H3","MNFGEHQPOWJJBH-UHFFFAOYSA-N"
"COC=CC#C[Si](C)(C)C","InChI=1S/C8H14OSi/c1-9-7-5-6-8-10(2,3)4/h5,7H,1-4H3/b7-5-","KHAWMPYFFORPIN-ALCCZGGFSA-N"
"CC[Si](I)(I)CC","InChI=1S/C4H10I2Si/c1-3-7(5,6)4-2/h3-4H2,1-2H3","GPTNEHSWPUSHFX-UHFFFAOYSA-N"
"CC[Si](I)(CC)CC","InChI=1S/C6H15ISi/c1-4-8(7,5-2)6-3/h4-6H2,1-3H3","PPLMQFARLJLZAO-UHFFFAOYSA-N"
"IC[SiH](c(c2)cccc2)c(c1)cccc1","InChI=1S/C13H13ISi/c14-11-15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2","WDRILLYELKEKFG-UHFFFAOYSA-N"
"CC(C)(C)[Si](C)(C)I","InChI=1S/C6H15ISi/c1-6(2,3)8(4,5)7/h1-5H3","ODGTVVCTZIKYTG-UHFFFAOYSA-N"
"CCCCCC([Si](CC)(CC)1)[Si](CC)(CC)c(c2)c(ccc2)1","InChI=1S/C20H36Si2/c1-6-11-12-17-20-21(7-2,8-3)18-15-13-14-16-19(18)22(20,9-4)10-5/h13-16,20H,6-12,17H2,1-5H3","AVYPDCPCKCFYLU-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)[Si](C)(CC)[Si](C)(CC)c(c1)ccc(C)c1","InChI=1S/C20H30Si2/c1-7-21(5,19-13-9-17(3)10-14-19)22(6,8-2)20-15-11-18(4)12-16-20/h9-16H,7-8H2,1-6H3","DPXWZMNCMNSKSS-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)[SiH](CC)[SiH](CC)C(C)C(C)C","InChI=1S/C16H30Si2/c1-7-17(15(6)13(3)4)18(8-2)16-11-9-14(5)10-12-16/h9-13,15,17-18H,7-8H2,1-6H3","ORBZJDGFDGGPEG-UHFFFAOYSA-N"
"C([Si](c(c4)cccc4)(c(c3)cccc3)c(c2)cccc2)(=O)c(c1C)c(cc(C)c1)C","InChI=1S/C28H26OSi/c1-21-19-22(2)27(23(3)20-21)28(29)30(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-20H,1-3H3","CERAAUHWEOIMMB-UHFFFAOYSA-N"
"CCCCC(C1)[Si](CC)(CC)c(c2)c(ccc2)[Si](CC)(CC)1","InChI=1S/C20H36Si2/c1-6-11-14-18-17-21(7-2,8-3)19-15-12-13-16-20(19)22(18,9-4)10-5/h12-13,15-16,18H,6-11,14,17H2,1-5H3","GOGDOWVJFBUYPC-UHFFFAOYSA-N"
"CCCC[Si](C)(I)CCCC","InChI=1S/C9H21ISi/c1-4-6-8-11(3,10)9-7-5-2/h4-9H2,1-3H3","FXZJDXGJYGYLQK-UHFFFAOYSA-N"
"c(c2)ccc(c2)C#C[Si](C)(C)c(c1)cccc1","InChI=1S/C16H16Si/c1-17(2,16-11-7-4-8-12-16)14-13-15-9-5-3-6-10-15/h3-12H,1-2H3","ZLASSMJFYNXSGL-UHFFFAOYSA-N"
"[2H]C(O)(C1)CC(C2)C(CCC2)1","InChI=1S/C9H16O/c10-9-5-7-3-1-2-4-8(7)6-9/h7-10H,1-6H2/i9D","FNTAZLZSKBIIIW-QOWOAITPSA-N"
"C(C2)CC[Si](C2)(C1)CC1","InChI=1S/C8H16Si/c1-2-5-9(6-3-1)7-4-8-9/h1-8H2","GDUODINLDYPORD-UHFFFAOYSA-N"
"[2H]C([2H])([2H])[Si](C1)(CCC1)C([2H])([2H])[2H]","InChI=1S/C6H14Si/c1-7(2)5-3-4-6-7/h3-6H2,1-2H3/i1D3,2D3","KDQBKCRYCZJUAE-WFGJKAKNSA-N"
"C[SiH](C)C[SiH](C)C","InChI=1S/C5H16Si2/c1-6(2)5-7(3)4/h6-7H,5H2,1-4H3","PTQFHZAGGNQPDA-UHFFFAOYSA-N"
"[2H][Si](C)(C)C[Si]([2H])(C)C","InChI=1S/C5H16Si2/c1-6(2)5-7(3)4/h6-7H,5H2,1-4H3/i6D,7D","PTQFHZAGGNQPDA-QFIQSOQBSA-N"
"C[SiH](C)CCC[SiH](C)C","InChI=1S/C7H20Si2/c1-8(2)6-5-7-9(3)4/h8-9H,5-7H2,1-4H3","NKDJYWYZEVYOLX-UHFFFAOYSA-N"
"[2H][Si](C)(C)CCC[Si]([2H])(C)C","InChI=1S/C7H20Si2/c1-8(2)6-5-7-9(3)4/h8-9H,5-7H2,1-4H3/i8D,9D","NKDJYWYZEVYOLX-XETGXLELSA-N"
"C[SiH2]CC[SiH2]C","InChI=1S/C4H14Si2/c1-5-3-4-6-2/h3-6H2,1-2H3","CBXZGERYGLVXSG-UHFFFAOYSA-N"
"C[SiH2]C([2H])([2H])C([2H])([2H])[SiH2]C","InChI=1S/C4H14Si2/c1-5-3-4-6-2/h3-6H2,1-2H3/i3D2,4D2","CBXZGERYGLVXSG-KHORGVISSA-N"
"CC[SiH](C)[SiH](C)C","InChI=1S/C5H16Si2/c1-5-7(4)6(2)3/h6-7H,5H2,1-4H3","NHHYFIMQHQQRNN-UHFFFAOYSA-N"
"CC[Si]([2H])(C)[Si]([2H])(C)C","InChI=1S/C5H16Si2/c1-5-7(4)6(2)3/h6-7H,5H2,1-4H3/i6D,7D","NHHYFIMQHQQRNN-QFIQSOQBSA-N"
"CC[SiH](C)[SiH](C)CC","InChI=1S/C6H18Si2/c1-5-7(3)8(4)6-2/h7-8H,5-6H2,1-4H3","FYFFMJYIIZPDAG-UHFFFAOYSA-N"
"CC[SiH](CC)[SiH](C)C","InChI=1S/C6H18Si2/c1-5-8(6-2)7(3)4/h7-8H,5-6H2,1-4H3","OONIWCFTRWGZGX-UHFFFAOYSA-N"
"CC[Si]([2H])(CC)[Si]([2H])(C)C","InChI=1S/C6H18Si2/c1-5-8(6-2)7(3)4/h7-8H,5-6H2,1-4H3/i7D,8D","OONIWCFTRWGZGX-QTQOOCSTSA-N"
"CC[SiH](CC)[SiH](CC)CC","InChI=1S/C8H22Si2/c1-5-9(6-2)10(7-3)8-4/h9-10H,5-8H2,1-4H3","IIXGTNXLTMXDDF-UHFFFAOYSA-N"
"CC[Si]([2H])(CC)[Si]([2H])(CC)CC","InChI=1S/C8H22Si2/c1-5-9(6-2)10(7-3)8-4/h9-10H,5-8H2,1-4H3/i9D,10D","IIXGTNXLTMXDDF-QDRJLNDYSA-N"
"C[Si](C)(C)C([2H])([2H])C([2H])([2H])[Si](C)(C)C","InChI=1S/C8H22Si2/c1-9(2,3)7-8-10(4,5)6/h7-8H2,1-6H3/i7D2,8D2","DMKCEJPDZDUPDV-OSEHSPPNSA-N"
"[2H]C([2H])([Si]([2H])(C)C)C([2H])([2H])[Si]([2H])(C)C","InChI=1S/C6H18Si2/c1-7(2)5-6-8(3)4/h7-8H,5-6H2,1-4H3/i5D2,6D2,7D,8D","YZJSARUCMYJHNV-QNBRLEJZSA-N"
"C[SiH](C)C([2H])([2H])C([2H])([2H])C([2H])([2H])[SiH](C)C","InChI=1S/C7H20Si2/c1-8(2)6-5-7-9(3)4/h8-9H,5-7H2,1-4H3/i5D2,6D2,7D2","NKDJYWYZEVYOLX-IPSWUHLQSA-N"
"[2H]C([2H])(C([2H])([2H])[Si]([2H])(C)C)C([2H])([2H])[Si]([2H])(C)C","InChI=1S/C7H20Si2/c1-8(2)6-5-7-9(3)4/h8-9H,5-7H2,1-4H3/i5D2,6D2,7D2,8D,9D","NKDJYWYZEVYOLX-XZHXTBDASA-N"
"C[SiH](C)CCCC[SiH](C)C","InChI=1S/C8H22Si2/c1-9(2)7-5-6-8-10(3)4/h9-10H,5-8H2,1-4H3","QLPZDSWCLQMGCV-UHFFFAOYSA-N"
"[2H][Si](C)(C)CCCC[Si]([2H])(C)C","InChI=1S/C8H22Si2/c1-9(2)7-5-6-8-10(3)4/h9-10H,5-8H2,1-4H3/i9D,10D","QLPZDSWCLQMGCV-QDRJLNDYSA-N"
"C[SiH](C)[Si](C)(C)[SiH](C)C","InChI=1S/C6H20Si3/c1-7(2)9(5,6)8(3)4/h7-8H,1-6H3","JSBOVJABZFDRGV-UHFFFAOYSA-N"
"[2H][Si](C)(C)[Si](C)(C)[Si]([2H])(C)C","InChI=1S/C6H20Si3/c1-7(2)9(5,6)8(3)4/h7-8H,1-6H3/i7D,8D","JSBOVJABZFDRGV-QTQOOCSTSA-N"
"CCC[SiH](C)[SiH](C)C","InChI=1S/C6H18Si2/c1-5-6-8(4)7(2)3/h7-8H,5-6H2,1-4H3","MVBTVTKKXMKCEV-UHFFFAOYSA-N"
"CCC[Si]([2H])(C)[Si]([2H])(C)C","InChI=1S/C6H18Si2/c1-5-6-8(4)7(2)3/h7-8H,5-6H2,1-4H3/i7D,8D","MVBTVTKKXMKCEV-QTQOOCSTSA-N"
"CCC[SiH](C)[SiH](C)CCC","InChI=1S/C8H22Si2/c1-5-7-9(3)10(4)8-6-2/h9-10H,5-8H2,1-4H3","ZHXZTSLNKZHPGH-UHFFFAOYSA-N"
"CCC[Si]([2H])(C)[Si]([2H])(C)CCC","InChI=1S/C8H22Si2/c1-5-7-9(3)10(4)8-6-2/h9-10H,5-8H2,1-4H3/i9D,10D","ZHXZTSLNKZHPGH-QDRJLNDYSA-N"
"CCCC[SiH](C)[SiH](C)C","InChI=1S/C7H20Si2/c1-5-6-7-9(4)8(2)3/h8-9H,5-7H2,1-4H3","UCLLPTUTMNRQBU-UHFFFAOYSA-N"
"CCCC[Si]([2H])(C)[Si]([2H])(C)C","InChI=1S/C7H20Si2/c1-5-6-7-9(4)8(2)3/h8-9H,5-7H2,1-4H3/i8D,9D","UCLLPTUTMNRQBU-XETGXLELSA-N"
"CCCC[SiH](C)[SiH](C)CCCC","InChI=1S/C10H26Si2/c1-5-7-9-11(3)12(4)10-8-6-2/h11-12H,5-10H2,1-4H3","NSYKINUQOKOVNW-UHFFFAOYSA-N"
"CCCC[Si]([2H])(C)[Si]([2H])(C)CCCC","InChI=1S/C10H26Si2/c1-5-7-9-11(3)12(4)10-8-6-2/h11-12H,5-10H2,1-4H3/i11D,12D","NSYKINUQOKOVNW-USUSYXOVSA-N"
"CCC[SiH](CCC)[SiH](C)C","InChI=1S/C8H22Si2/c1-5-7-10(8-6-2)9(3)4/h9-10H,5-8H2,1-4H3","UFXQZDUFUWDYOA-UHFFFAOYSA-N"
"CCC[Si]([2H])(CCC)[Si]([2H])(C)C","InChI=1S/C8H22Si2/c1-5-7-10(8-6-2)9(3)4/h9-10H,5-8H2,1-4H3/i9D,10D","UFXQZDUFUWDYOA-QDRJLNDYSA-N"
"[2H]C([2H])([2H])CI","InChI=1S/C2H5I/c1-2-3/h2H2,1H3/i1D3","HVTICUPFWKNHNG-FIBGUPNXSA-N"
"CCCC[Si]([2H])([2H])C([2H])([2H])[2H]","InChI=1S/C5H14Si/c1-3-4-5-6-2/h3-6H2,1-2H3/i2D3,6D2","MFGTZDMAYACKNE-QKLSXCJMSA-N"
"CCCC[SiH](C)C","InChI=1S/C6H16Si/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3","HXLVDKGPVGFXTH-UHFFFAOYSA-N"
"CCCC[SiH](C([2H])([2H])[2H])C([2H])([2H])[2H]","InChI=1S/C6H16Si/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3/i2D3,3D3","HXLVDKGPVGFXTH-XERRXZQWSA-N"
"CCCC[Si](C)(C)C","InChI=1S/C7H18Si/c1-5-6-7-8(2,3)4/h5-7H2,1-4H3","LYVYUAHSSSHKHC-UHFFFAOYSA-N"
"CCCC[Si](C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]","InChI=1S/C7H18Si/c1-5-6-7-8(2,3)4/h5-7H2,1-4H3/i2D3,3D3,4D3","LYVYUAHSSSHKHC-WVZRYRIDSA-N"
"CC(C)C[SiH](C)CC(C)C","InChI=1S/C9H22Si/c1-8(2)6-10(5)7-9(3)4/h8-10H,6-7H2,1-5H3","YRFUHKCAAALZQQ-UHFFFAOYSA-N"
"CC(=O)c(c1)c(O)c(O)cc1","InChI=1S/C8H8O3/c1-5(9)6-3-2-4-7(10)8(6)11/h2-4,10-11H,1H3","HEJLFBLJYFSKCE-UHFFFAOYSA-N"
"CC(=O)c(c2)c(O)c(cc2)OCc(c1)cccc1","InChI=1S/C15H14O3/c1-11(16)13-8-5-9-14(15(13)17)18-10-12-6-3-2-4-7-12/h2-9,17H,10H2,1H3","PFHZMESRTSZVHD-UHFFFAOYSA-N"
"c(c3)ccc(c3)COc(c1)c(OCc(c2)cccc2)c(cc1)C(C)=O","InChI=1S/C22H20O3/c1-17(23)20-13-8-14-21(24-15-18-9-4-2-5-10-18)22(20)25-16-19-11-6-3-7-12-19/h2-14H,15-16H2,1H3","GVYKCALVGQRGHL-UHFFFAOYSA-N"
"O=Cc(c2)c(OC)c(cc2)OCc(c1)cccc1","InChI=1S/C15H14O3/c1-17-15-13(10-16)8-5-9-14(15)18-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3","QEZYNSXJLFISBS-UHFFFAOYSA-N"
"COc(c1)c(OCc(c2)cccc2)c(cc1)C(C)O","InChI=1S/C16H18O3/c1-12(17)14-9-6-10-15(18-2)16(14)19-11-13-7-4-3-5-8-13/h3-10,12,17H,11H2,1-2H3","RKXGFCPLKBJWJA-UHFFFAOYSA-N"
"COc(c1OCc(c2)cccc2)c(ccc1)C(C)=O","InChI=1S/C16H16O3/c1-12(17)14-9-6-10-15(16(14)18-2)19-11-13-7-4-3-5-8-13/h3-10H,11H2,1-2H3","BCLWYEBEGXAVOG-UHFFFAOYSA-N"
"COc(c2)ccc(c2)COc(c1)cc(O)c(C(C)=O)c1","InChI=1S/C16H16O4/c1-11(17)15-8-7-14(9-16(15)18)20-10-12-3-5-13(19-2)6-4-12/h3-9,18H,10H2,1-2H3","AFHXRFIYCWKUKA-UHFFFAOYSA-N"
"Cc(n1)sc(c2)c(ccc2)1","InChI=1S/C8H7NS/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,1H3","DXYYSGDWQCSKKO-UHFFFAOYSA-N"
"Cc(c2)cc(s1)c(c2)nc(N)1","InChI=1S/C8H8N2S/c1-5-2-3-6-7(4-5)11-8(9)10-6/h2-4H,1H3,(H2,9,10)","DZWTXWPRWRLHIL-UHFFFAOYSA-N"
"CCOc(c2)cc(s1)c(c2)nc(N)1","InChI=1S/C9H10N2OS/c1-2-12-6-3-4-7-8(5-6)13-9(10)11-7/h3-5H,2H2,1H3,(H2,10,11)","KOYJWFGMEBETBU-UHFFFAOYSA-N"
"OC(=O)CCS","InChI=1S/C3H6O2S/c4-3(5)1-2-6/h6H,1-2H2,(H,4,5)","DKIDEFUBRARXTE-UHFFFAOYSA-N"
"OC(=O)CCSC(C)=O","InChI=1S/C5H8O3S/c1-4(6)9-3-2-5(7)8/h2-3H2,1H3,(H,7,8)","AYQXANXXZYKTDL-UHFFFAOYSA-N"
"ClCOC(=O)C(C)(C)C","InChI=1S/C6H11ClO2/c1-6(2,3)5(8)9-4-7/h4H2,1-3H3","GGRHYQCXXYLUTL-UHFFFAOYSA-N"
"CCOC(=O)Cc(c1)nccc1","InChI=1S/C9H11NO2/c1-2-12-9(11)7-8-5-3-4-6-10-8/h3-6H,2,7H2,1H3","IUDKTVXSXWAKJO-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(Br)cn1","InChI=1S/C6H4BrNO2/c7-5-1-4(6(9)10)2-8-3-5/h1-3H,(H,9,10)","FQIUCPGDKPXSLL-UHFFFAOYSA-N"
"CCOC(=O)c(c1)cc(Br)cn1","InChI=1S/C8H8BrNO2/c1-2-12-8(11)6-3-7(9)5-10-4-6/h3-5H,2H2,1H3","PCPIANOJERKFJI-UHFFFAOYSA-N"
"C(C2)CC(=N2)c(c1)cc(Br)cn1","InChI=1S/C9H9BrN2/c10-8-4-7(5-11-6-8)9-2-1-3-12-9/h4-6H,1-3H2","JENATANFRDRZCY-UHFFFAOYSA-N"
"CCOC(=O)C(=C(O)1)C(c(c2)cncc2)N(C)C(=O)1","InChI=1S/C13H14N2O4/c1-3-19-13(18)9-10(8-5-4-6-14-7-8)15(2)12(17)11(9)16/h4-7,10,16H,3H2,1-2H3","ZXVJUKZJQDHOIA-UHFFFAOYSA-N"
"O=C(N(C)1)C([H])(O)CC([H])(c(c2)cncc2)1","InChI=1S/C10H12N2O2/c1-12-8(5-9(13)10(12)14)7-3-2-4-11-6-7/h2-4,6,8-9,13H,5H2,1H3/t8-,9-/m0/s1","XOKCJXZZNAUIQN-IUCAKERBSA-N"
"CCOC(C#C)OCC","InChI=1S/C7H12O2/c1-4-7(8-5-2)9-6-3/h1,7H,5-6H2,2-3H3","RGUXEWWHSQGVRZ-UHFFFAOYSA-N"
"CCCC(O)C#CC(OCC)OCC","InChI=1S/C11H20O3/c1-4-7-10(12)8-9-11(13-5-2)14-6-3/h10-12H,4-7H2,1-3H3","RGYUCYLKZOICPG-UHFFFAOYSA-N"
"CCOC(OCC)C#CC(O)CC","InChI=1S/C10H18O3/c1-4-9(11)7-8-10(12-5-2)13-6-3/h9-11H,4-6H2,1-3H3","KMQZWLILQMKVEI-UHFFFAOYSA-N"
"CCCCCC(O)C#CC(OCC)OCC","InChI=1S/C13H24O3/c1-4-7-8-9-12(14)10-11-13(15-5-2)16-6-3/h12-14H,4-9H2,1-3H3","HKKTYOXRKSVGMF-UHFFFAOYSA-N"
"CCOC(=O)C(=C)CBr","InChI=1S/C6H9BrO2/c1-3-9-6(8)5(2)4-7/h2-4H2,1H3","MTCMFVTVXAOHNQ-UHFFFAOYSA-N"
"OCC([H])(C([H])(C)2)C([H])(C([H])1C([H])=C([H])2)C([H])(CCC1)O[Si](C(C)C)(C(C)C)C(C)C","InChI=1S/C21H40O2Si/c1-14(2)24(15(3)4,16(5)6)23-20-10-8-9-18-12-11-17(7)19(13-22)21(18)20/h11-12,14-22H,8-10,13H2,1-7H3/t17-,18-,19+,20-,21-/m0/s1","BNRUWIZMEBUHHR-WHZJULEDSA-N"
"O=CC([H])(C([H])(C)2)C([H])(C([H])1C([H])=C([H])2)C([H])(CCC1)O[Si](C(C)C)(C(C)C)C(C)C","InChI=1S/C21H38O2Si/c1-14(2)24(15(3)4,16(5)6)23-20-10-8-9-18-12-11-17(7)19(13-22)21(18)20/h11-21H,8-10H2,1-7H3/t17-,18+,19+,20-,21-/m0/s1","QMUCTJUYXBSPAP-ZPAWYTMASA-N"
"CC(C)(O)C([H])(C2)CC([H])(C(C2)1)C([H])(C)C([H])(O)CC([H])(C)1","InChI=1S/C15H28O2/c1-9-7-14(16)10(2)13-8-11(15(3,4)17)5-6-12(9)13/h9-14,16-17H,5-8H2,1-4H3/t9-,10-,11-,12?,13-,14+/m1/s1","LRDUEXWYKQITLS-MBVYDAKFSA-N"
"CC(=C)C([H])(C1)CC([H])(C(C)=2)C(C)(CCC([H])2)C1","InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14-,15-/m1/s1","OZQAPQSEYFAMCY-RBSFLKMASA-N"
"OCC(C)C([H])(C2)CC([H])(C(C)1C2)C([H])(C)C([H])(O)CC1","InChI=1S/C15H28O2/c1-10(9-16)12-4-6-15(3)7-5-14(17)11(2)13(15)8-12/h10-14,16-17H,4-9H2,1-3H3/t10?,11-,12-,13-,14-,15+/m1/s1","ARSHJAOOWKIGRS-CIJFKWAFSA-N"
"COC(=O)C(C)C(C1)CC([H])(C([H])(C)2)C(C)(CCC(=O)2)C1","InChI=1S/C16H26O3/c1-10(15(18)19-4)12-5-7-16(3)8-6-14(17)11(2)13(16)9-12/h10-13H,5-9H2,1-4H3/t10?,11-,12?,13-,16+/m1/s1","KBKKFVFNAGCAQX-DPSUSNHFSA-N"
"CC(C)(O)C([H])(C1)CC([H])(C(C)(O)2)C(C)(CCC2)C1","InChI=1S/C15H28O2/c1-13(2,16)11-6-9-14(3)7-5-8-15(4,17)12(14)10-11/h11-12,16-17H,5-10H2,1-4H3/t11-,12+,14-,15+/m1/s1","LKKDASYGWYYFIK-OSRDXIQISA-N"
"CC(C)=CCCC(=C)C(C[Si](C)(C)C)C(C1)CC(=O)CC1","InChI=1S/C19H34OSi/c1-15(2)9-7-10-16(3)19(14-21(4,5)6)17-11-8-12-18(20)13-17/h9,17,19H,3,7-8,10-14H2,1-2,4-6H3","AONPXOGOSNOJNR-UHFFFAOYSA-N"
"CCC(=O)CCC(C(=C)CCC=C(C)C)C[Si](C)(C)C","InChI=1S/C18H34OSi/c1-8-18(19)13-12-17(14-20(5,6)7)16(4)11-9-10-15(2)3/h10,17H,4,8-9,11-14H2,1-3,5-7H3","MJRLSIJCVDIDRU-UHFFFAOYSA-N"
"CCC(=O)CCC(C=C)C[Si](C)(C)C","InChI=1S/C12H24OSi/c1-6-11(10-14(3,4)5)8-9-12(13)7-2/h6,11H,1,7-10H2,2-5H3","MSJGHQLNYLHARC-UHFFFAOYSA-N"
"CCCCC(=O)CC(=C)C(C(=O)CCCC)C[Si](C)(C)C","InChI=1S/C18H34O2Si/c1-7-9-11-16(19)13-15(3)17(14-21(4,5)6)18(20)12-10-8-2/h17H,3,7-14H2,1-2,4-6H3","YEXWVMSNWQPQHO-UHFFFAOYSA-N"
"CCCCC(=O)CC(C)(C=C)C(=O)CCCC","InChI=1S/C15H26O2/c1-5-8-10-13(16)12-15(4,7-3)14(17)11-9-6-2/h7H,3,5-6,8-12H2,1-2,4H3","REOULBHPBOSYMQ-UHFFFAOYSA-N"
"CC(=C)C(C1)CC(C)(CC(=O)1)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C18H32OSi/c1-13(2)15-9-16(19)11-18(5,10-15)17(14(3)4)12-20(6,7)8/h15,17H,1,3,9-12H2,2,4-8H3","AQWFFLWTSWZNHW-UHFFFAOYSA-N"
"C=CC(C[Si](C)(C)C)C(C1)CC(=O)CC1","InChI=1S/C13H24OSi/c1-5-11(10-15(2,3)4)12-7-6-8-13(14)9-12/h5,11-12H,1,6-10H2,2-4H3","ZDRGHKSWNMUTAK-UHFFFAOYSA-N"
"CC(C)=CCCC(=C)C(C[Si](C)(C)C)C(C1)C(C)C(=O)CC(C(C)=C)1","InChI=1S/C23H40OSi/c1-16(2)11-10-12-18(5)22(15-25(7,8)9)21-13-20(17(3)4)14-23(24)19(21)6/h11,19-22H,3,5,10,12-15H2,1-2,4,6-9H3","ONIYXPBYZAIWFM-UHFFFAOYSA-N"
"C=CC(C[Si](C)(C)C)C(C1)C(C)C(=O)CC(C(C)=C)1","InChI=1S/C17H30OSi/c1-8-14(11-19(5,6)7)16-9-15(12(2)3)10-17(18)13(16)4/h8,13-16H,1-2,9-11H2,3-7H3","YBSDYQVCPCLBQT-UHFFFAOYSA-N"
"O=C(C1)CC(CC1)C(C(C)=C)C[Si](C)(C)C","InChI=1S/C14H26OSi/c1-11(2)14(10-16(3,4)5)12-7-6-8-13(15)9-12/h12,14H,1,6-10H2,2-5H3","LSOIEULYYCJKRO-UHFFFAOYSA-N"
"CC(C)=CCCC(=C)C(CCC(C)=O)C[Si](C)(C)C","InChI=1S/C17H32OSi/c1-14(2)9-8-10-15(3)17(12-11-16(4)18)13-19(5,6)7/h9,17H,3,8,10-13H2,1-2,4-7H3","ICGYNFPQDKXQEN-UHFFFAOYSA-N"
"CCC(=O)CCC(C(C)=C)C[Si](C)(C)C","InChI=1S/C13H26OSi/c1-7-13(14)9-8-12(11(2)3)10-15(4,5)6/h12H,2,7-10H2,1,3-6H3","QTOJCRMBVDQWJP-UHFFFAOYSA-N"
"CC(=O)CCC(C(C)=C)C[Si](C)(C)C","InChI=1S/C12H24OSi/c1-10(2)12(8-7-11(3)13)9-14(4,5)6/h12H,1,7-9H2,2-6H3","AJNMYAQSXRODBL-UHFFFAOYSA-N"
"c(c5)ccc(c5)C(=C(c(c4)cccc4)2)C(C1)C(C=3)C(C(=O)C3)C12","InChI=1S/C22H18O/c23-19-12-11-16-17-13-18(22(16)19)21(15-9-5-2-6-10-15)20(17)14-7-3-1-4-8-14/h1-12,16-18,22H,13H2","APNUTSSHCCOFPX-UHFFFAOYSA-N"
"c(c1)cc(OCC(O3)C3)cc1OCC(O2)C2","InChI=1S/C12H14O4/c1-2-9(13-5-11-7-15-11)4-10(3-1)14-6-12-8-16-12/h1-4,11-12H,5-8H2","WPYCRFCQABTEKC-UHFFFAOYSA-N"
"C(C(c(c6)cccc6)(c(c5)cccc5)c(c4)cccc4)(c(c3)cccc3)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C38H30/c1-7-19-31(20-8-1)37(32-21-9-2-10-22-32,33-23-11-3-12-24-33)38(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36/h1-30H","IPOBVSHPVYWJQC-UHFFFAOYSA-N"
"C[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)[Si](C)(C)C","InChI=1S/C14H42Si6/c1-15(2,3)17(7,8)19(11,12)20(13,14)18(9,10)16(4,5)6/h1-14H3","MYVYLCKNQVLMQO-UHFFFAOYSA-N"
"c(c4)ccc(c4)C=Cc(c3)ccc(c3)C(C(=O)1)C(=O)c(c2)c(ccc2)1","InChI=1S/C23H16O2/c24-22-19-8-4-5-9-20(19)23(25)21(22)18-14-12-17(13-15-18)11-10-16-6-2-1-3-7-16/h1-15,21H/b11-10+","AWDAOSFUOPBPIE-ZHACJKMWSA-N"
"BrC#CCCCOC(C1)OCCC1","InChI=1S/C10H15BrO2/c11-7-3-1-4-8-12-10-6-2-5-9-13-10/h10H,1-2,4-6,8-9H2","NFAQYDQDGGRJQU-UHFFFAOYSA-N"
"Fc(c3)ccc(c3)C(=O)C(C(=O)2)C(=NO2)c(c1)cccc1","InChI=1S/C16H10FNO3/c17-12-8-6-11(7-9-12)15(19)13-14(18-21-16(13)20)10-4-2-1-3-5-10/h1-9,13H","BCECACPCPCOKJZ-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=N2)C(C(=O)O2)C(=O)c(c(F)1)c(F)c(F)c(F)c(F)1","InChI=1S/C16H6F5NO3/c17-9-7(10(18)12(20)13(21)11(9)19)15(23)8-14(22-25-16(8)24)6-4-2-1-3-5-6/h1-5,8H","HPQAVSVVQHKXOS-UHFFFAOYSA-N"
"Fc(c3)cc(F)c(c3)C(=O)C(C(=O)2)C(=NO2)c(c1)cccc1","InChI=1S/C16H9F2NO3/c17-10-6-7-11(12(18)8-10)15(20)13-14(19-22-16(13)21)9-4-2-1-3-5-9/h1-8,13H","MBUZPEVHTORBKX-UHFFFAOYSA-N"
"Clc(c3)cc(Cl)c(c3)C(=O)C(C(=O)2)C(=NO2)c(c1)cccc1","InChI=1S/C16H9Cl2NO3/c17-10-6-7-11(12(18)8-10)15(20)13-14(19-22-16(13)21)9-4-2-1-3-5-9/h1-8,13H","ATULXUIRHBZVCU-UHFFFAOYSA-N"
"Clc(c3)ccc(c3)C(=O)C(N=1)C(=O)OC(c(c2)cccc2)1","InChI=1S/C16H10ClNO3/c17-12-8-6-10(7-9-12)14(19)13-16(20)21-15(18-13)11-4-2-1-3-5-11/h1-9,13H","JQOVUUKWQVLGJM-UHFFFAOYSA-N"
"Clc(c3)cc(cc3)C(=O)C(N=1)C(=O)OC(c(c2)cccc2)1","InChI=1S/C16H10ClNO3/c17-12-8-4-7-11(9-12)14(19)13-16(20)21-15(18-13)10-5-2-1-3-6-10/h1-9,13H","KMASZWZAPIAVKK-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=N2)C(C(=O)O2)C(=O)c(c1)c(Cl)ccc1","InChI=1S/C16H10ClNO3/c17-12-9-5-4-8-11(12)15(19)13-14(18-21-16(13)20)10-6-2-1-3-7-10/h1-9,13H","PLRKKMYNKANJAL-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=N2)C(C(=O)O2)C(=O)c(c(F)1)c(F)ccc1","InChI=1S/C16H9F2NO3/c17-10-7-4-8-11(18)12(10)15(20)13-14(19-22-16(13)21)9-5-2-1-3-6-9/h1-8,13H","BNKWTLOFWODNEM-UHFFFAOYSA-N"
"Fc(c3)cc(cc3)C(=O)C(C(=O)2)C(=NO2)c(c1)cccc1","InChI=1S/C16H10FNO3/c17-12-8-4-7-11(9-12)15(19)13-14(18-21-16(13)20)10-5-2-1-3-6-10/h1-9,13H","CHDLZDDLKCBEJW-UHFFFAOYSA-N"
"Fc(c3)c(ccc3)C(=O)C(C(=O)2)C(=NO2)c(c1)cccc1","InChI=1S/C16H10FNO3/c17-12-9-5-4-8-11(12)15(19)13-14(18-21-16(13)20)10-6-2-1-3-7-10/h1-9,13H","VHRCZUMIDWIWQN-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=O)C(C(=O)2)C(=NO2)c(c1)cccc1","InChI=1S/C16H11NO3/c18-15(12-9-5-2-6-10-12)13-14(17-20-16(13)19)11-7-3-1-4-8-11/h1-10,13H","SVVFJNDRCLYVHB-UHFFFAOYSA-N"
"OCC([H])(C([H])(C)1)C([H])(C2)C([H])(CCC2)C([H])=C([H])1","InChI=1S/C12H20O/c1-9-6-7-10-4-2-3-5-11(10)12(9)8-13/h6-7,9-13H,2-5,8H2,1H3/t9-,10+,11-,12-/m1/s1","TUMHGYLMWUWTEY-WRWGMCAJSA-N"
"COC(=O)C(C(C)1)C([H])(C2)C([H])(CCC2)C(O)C1","InChI=1S/C13H22O3/c1-8-7-11(14)9-5-3-4-6-10(9)12(8)13(15)16-2/h8-12,14H,3-7H2,1-2H3/t8-,9-,10-,11+,12+/m1/s1","PFMCGYTZQRCFBE-JCIQBVFBSA-N"
"COC(=O)C(C(C)1)C([H])(C2)C([H])(CCC2)C(=O)C1","InChI=1S/C13H20O3/c1-8-7-11(14)9-5-3-4-6-10(9)12(8)13(15)16-2/h8-10,12H,3-7H2,1-2H3/t8-,9-,10-,12+/m1/s1","MGMNAJYGRQZXQO-BFLSOPEQSA-N"
"COC(=O)C(C(C)1)C([H])(C(O)2)C([H])(CCC2)C(=O)C1","InChI=1S/C13H20O4/c1-7-6-10(15)8-4-3-5-9(14)12(8)11(7)13(16)17-2/h7-9,11-12,14H,3-6H2,1-2H3/t7-,8+,9-,11+,12+/m1/s1","YWLUZFIMMMHFCW-TWXYISROSA-N"
"COC(=O)C(C(C)1)C(C2OC(=S)n(c3)cnc3)C(CCC2)C(=O)C1","InChI=1S/C17H22N2O4S/c1-10-8-12(20)11-4-3-5-13(15(11)14(10)16(21)22-2)23-17(24)19-7-6-18-9-19/h6-7,9-11,13-15H,3-5,8H2,1-2H3","GVLJXHPXDBXDJW-UHFFFAOYSA-N"
"CCCCCCCCCCC(O1)=CC(OC)=C(C=O)C(=O)1","InChI=1S/C17H26O4/c1-3-4-5-6-7-8-9-10-11-14-12-16(20-2)15(13-18)17(19)21-14/h12-13H,3-11H2,1-2H3","MNCBVHHTEQODCX-UHFFFAOYSA-N"
"CCCC(C)CC","InChI=1S/C7H16/c1-4-6-7(3)5-2/h7H,4-6H2,1-3H3","VLJXXKKOSFGPHI-UHFFFAOYSA-N"
"CCC(CC)CC","InChI=1S/C7H16/c1-4-7(5-2)6-3/h7H,4-6H2,1-3H3","AORMDLNPRGXHHL-UHFFFAOYSA-N"
"CC(C)CC(C)C","InChI=1S/C7H16/c1-6(2)5-7(3)4/h6-7H,5H2,1-4H3","BZHMBWZPUJHVEE-UHFFFAOYSA-N"
"CCCCC(C)CC","InChI=1S/C8H18/c1-4-6-7-8(3)5-2/h8H,4-7H2,1-3H3","LAIUFBWHERIJIH-UHFFFAOYSA-N"
"CCCC(C)CCC","InChI=1S/C8H18/c1-4-6-8(3)7-5-2/h8H,4-7H2,1-3H3","CHBAWFGIXDBEBT-UHFFFAOYSA-N"
"CCCC(CC)CC","InChI=1S/C8H18/c1-4-7-8(5-2)6-3/h8H,4-7H2,1-3H3","SFRKSDZMZHIISH-UHFFFAOYSA-N"
"CCCCC(C)(C)C","InChI=1S/C8H18/c1-5-6-7-8(2,3)4/h5-7H2,1-4H3","FLTJDUOFAQWHDF-UHFFFAOYSA-N"
"CCC(C)CC(C)C","InChI=1S/C8H18/c1-5-8(4)6-7(2)3/h7-8H,5-6H2,1-4H3","HDGQICNBXPAKLR-UHFFFAOYSA-N"
"CC(C)CCC(C)C","InChI=1S/C8H18/c1-7(2)5-6-8(3)4/h7-8H,5-6H2,1-4H3","UWNADWZGEHDQAB-UHFFFAOYSA-N"
"CC(C)C(C)C(C)C","InChI=1S/C8H18/c1-6(2)8(5)7(3)4/h6-8H,1-5H3","RLPGDEORIPLBNF-UHFFFAOYSA-N"
"CCCCCCC(C)C","InChI=1S/C9H20/c1-4-5-6-7-8-9(2)3/h9H,4-8H2,1-3H3","ZUBZATZOEPUUQF-UHFFFAOYSA-N"
"CCCCCC(C)CC","InChI=1S/C9H20/c1-4-6-7-8-9(3)5-2/h9H,4-8H2,1-3H3","SEEOMASXHIJCDV-UHFFFAOYSA-N"
"CCCCC(C)CCC","InChI=1S/C9H20/c1-4-6-8-9(3)7-5-2/h9H,4-8H2,1-3H3","DOGIHOCMZJUJNR-UHFFFAOYSA-N"
"CCCCC(C)C(C)C","InChI=1S/C9H20/c1-5-6-7-9(4)8(2)3/h8-9H,5-7H2,1-4H3","WBRFDUJXCLCKPX-UHFFFAOYSA-N"
"CC(C)CCC(C)(C)C","InChI=1S/C9H20/c1-8(2)6-7-9(3,4)5/h8H,6-7H2,1-5H3","HHOSMYBYIHNXNO-UHFFFAOYSA-N"
"CCCCCCCC(C)C","InChI=1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3","SGVYKUFIHHTIFL-UHFFFAOYSA-N"
"CCCCCCC(C)CC","InChI=1S/C10H22/c1-4-6-7-8-9-10(3)5-2/h10H,4-9H2,1-3H3","PLZDDPSCZHRBOY-UHFFFAOYSA-N"
"CCCCCC(C)CCC","InChI=1S/C10H22/c1-4-6-7-9-10(3)8-5-2/h10H,4-9H2,1-3H3","IALRSQMWHFKJJA-UHFFFAOYSA-N"
"CC(CC(C)(C)C)CC(C)(C)C","InChI=1S/C12H26/c1-10(8-11(2,3)4)9-12(5,6)7/h10H,8-9H2,1-7H3","VKPSKYDESGTTFR-UHFFFAOYSA-N"
"CC(C)(C)CC(C)CC(C)(C)CC(C)(C)C","InChI=1S/C16H34/c1-13(10-14(2,3)4)11-16(8,9)12-15(5,6)7/h13H,10-12H2,1-9H3","VCLJODPNBNEBKW-UHFFFAOYSA-N"
"CCC(C1)CCCC1","InChI=1S/C8H16/c1-2-8-6-4-3-5-7-8/h8H,2-7H2,1H3","IIEWJVIFRVWJOD-UHFFFAOYSA-N"
"CC(C1)C(C)CCC1","InChI=1S/C8H16/c1-7-5-3-4-6-8(7)2/h7-8H,3-6H2,1-2H3","KVZJLSYJROEPSQ-UHFFFAOYSA-N"
"CC(C1)CC(C)CC1","InChI=1S/C8H16/c1-7-4-3-5-8(2)6-7/h7-8H,3-6H2,1-2H3","SGVUHPSBDNVHKL-UHFFFAOYSA-N"
"CC(C1)CCC(C)C1","InChI=1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3","QRMPKOFEUHIBNM-UHFFFAOYSA-N"
"CC(C)C(C1)CCCC1","InChI=1S/C9H18/c1-8(2)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3","GWESVXSMPKAFAS-UHFFFAOYSA-N"
"CC(C1)CC(C)C(C)C1","InChI=1S/C9H18/c1-7-4-5-8(2)9(3)6-7/h7-9H,4-6H2,1-3H3","VCJPCEVERINRSG-UHFFFAOYSA-N"
"CC(C1)CC(C)CC(C)1","InChI=1S/C9H18/c1-7-4-8(2)6-9(3)5-7/h7-9H,4-6H2,1-3H3","ODNRTOSCFYDTKF-UHFFFAOYSA-N"
"CC(C)(C)C(C1)CCCC1","InChI=1S/C10H20/c1-10(2,3)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3","XTVMZZBLCLWBPM-UHFFFAOYSA-N"
"C(C2)CCC(C2)C(C1)CCCC1","InChI=1S/C12H22/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h11-12H,1-10H2","WVIIMZNLDWSIRH-UHFFFAOYSA-N"
"CCCCCCC(C1)CCCC1","InChI=1S/C12H24/c1-2-3-4-6-9-12-10-7-5-8-11-12/h12H,2-11H2,1H3","QHWAQXOSHHKCFK-UHFFFAOYSA-N"
"CCCC=CC","InChI=1S/C6H12/c1-3-5-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+","RYPKRALMXUUNKS-HWKANZROSA-N"
"CCC=CCC","InChI=1S/C6H12/c1-3-5-6-4-2/h5-6H,3-4H2,1-2H3/b6-5+","ZQDPJFUHLCOCRG-AATRIKPKSA-N"
"CCCC(C)=C","InChI=1S/C6H12/c1-4-5-6(2)3/h2,4-5H2,1,3H3","WWUVJRULCWHUSA-UHFFFAOYSA-N"
"CCC=C(C)C","InChI=1S/C6H12/c1-4-5-6(2)3/h5H,4H2,1-3H3","JMMZCWZIJXAGKW-UHFFFAOYSA-N"
"C=CCC(C)C","InChI=1S/C6H12/c1-4-5-6(2)3/h4,6H,1,5H2,2-3H3","WSSSPWUEQFSQQG-UHFFFAOYSA-N"
"C=CC(C)(C)C","InChI=1S/C6H12/c1-5-6(2,3)4/h5H,1H2,2-4H3","PKXHXOTZMFCXSH-UHFFFAOYSA-N"
"CCCCCC=C","InChI=1S/C7H14/c1-3-5-7-6-4-2/h3H,1,4-7H2,2H3","ZGEGCLOFRBLKSE-UHFFFAOYSA-N"
"CCCCC=CC","InChI=1S/C7H14/c1-3-5-7-6-4-2/h3,5H,4,6-7H2,1-2H3/b5-3+","OTTZHAVKAVGASB-HWKANZROSA-N"
"CCCC=CCC","InChI=1S/C7H14/c1-3-5-7-6-4-2/h5,7H,3-4,6H2,1-2H3/b7-5+","WZHKDGJSXCTSCK-FNORWQNLSA-N"
"CCCCC=CCC","InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h5,7H,3-4,6,8H2,1-2H3/b7-5+","YCTDZYMMFQCTEO-FNORWQNLSA-N"
"CCCC=CCCC","InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h7-8H,3-6H2,1-2H3/b8-7+","IRUCBBFNLDIMIK-BQYQJAHWSA-N"
"CCCCC(=C)CC","InChI=1S/C8H16/c1-4-6-7-8(3)5-2/h3-7H2,1-2H3","XTVRLCUJHGUXCP-UHFFFAOYSA-N"
"CC(=C)CC(C)(C)C","InChI=1S/C8H16/c1-7(2)6-8(3,4)5/h1,6H2,2-5H3","FXNDIJDIPNCZQJ-UHFFFAOYSA-N"
"CCCCCCCC=C","InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h3H,1,4-9H2,2H3","JRZJOMJEPLMPRA-UHFFFAOYSA-N"
"CCCCCCC=CC","InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h3,5H,4,6-9H2,1-2H3/b5-3+","IICQZTQZQSBHBY-HWKANZROSA-N"
"CCCCCC=CCC","InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h5,7H,3-4,6,8-9H2,1-2H3/b7-5+","YCBSHDKATAPNIA-FNORWQNLSA-N"
"CCCCC=CCCC","InChI=1S/C9H18/c1-3-5-7-9-8-6-4-2/h7,9H,3-6,8H2,1-2H3/b9-7+","KPADFPAILITQBG-VQHVLOKHSA-N"
"CCCC(C)CC(C)=C","InChI=1S/C9H18/c1-5-6-9(4)7-8(2)3/h9H,2,5-7H2,1,3-4H3","CZGAOHSMVSIJJZ-UHFFFAOYSA-N"
"CCCCCCCCCC=C","InChI=1S/C11H22/c1-3-5-7-9-11-10-8-6-4-2/h3H,1,4-11H2,2H3","DCTOHCCUXLBQMS-UHFFFAOYSA-N"
"CCCCCCCCCCCC=C","InChI=1S/C13H26/c1-3-5-7-9-11-13-12-10-8-6-4-2/h3H,1,4-13H2,2H3","VQOXUMQBYILCKR-UHFFFAOYSA-N"
"CCCCCCCCCCC=C","InChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h3H,1,4-12H2,2H3","CRSBERNSMYQZNG-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC=C","InChI=1S/C15H30/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3H,1,4-15H2,2H3","PJLHTVIBELQURV-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC=C","InChI=1S/C18H36/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h3H,1,4-18H2,2H3","CCCMONHAUSKTEQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC=C","InChI=1S/C19H38/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3H,1,4-19H2,2H3","NHLUYCJZUXOUBX-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCC=C","InChI=1S/C20H40/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3H,1,4-20H2,2H3","VAMFXQBUQXONLZ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCC=C","InChI=1S/C22H44/c1-3-5-7-9-11-13-15-17-19-21-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-22H2,2H3","SPURMHFLEKVAAS-UHFFFAOYSA-N"
"C=Cc(c1)cccc1","InChI=1S/C8H8/c1-2-8-6-4-3-5-7-8/h2-7H,1H2","PPBRXRYQALVLMV-UHFFFAOYSA-N"
"C=Cc(c1)c(C)ccc1","InChI=1S/C9H10/c1-3-9-7-5-4-6-8(9)2/h3-7H,1H2,2H3","NVZWEEGUWXZOKI-UHFFFAOYSA-N"
"C=Cc(c1)cc(C)cc1","InChI=1S/C9H10/c1-3-9-6-4-5-8(2)7-9/h3-7H,1H2,2H3","JZHGRUMIRATHIU-UHFFFAOYSA-N"
"C=Cc(c1)ccc(C)c1","InChI=1S/C9H10/c1-3-9-6-4-8(2)5-7-9/h3-7H,1H2,2H3","JLBJTVDPSNHSKJ-UHFFFAOYSA-N"
"CCc(c1)c(C)ccc1","InChI=1S/C9H12/c1-3-9-7-5-4-6-8(9)2/h4-7H,3H2,1-2H3","HYFLWBNQFMXCPA-UHFFFAOYSA-N"
"CCc(c1)cc(C)cc1","InChI=1S/C9H12/c1-3-9-6-4-5-8(2)7-9/h4-7H,3H2,1-2H3","ZLCSFXXPPANWQY-UHFFFAOYSA-N"
"CCCc(c1)c(C)ccc1","InChI=1S/C10H14/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7-8H,3,6H2,1-2H3","YQZBFMJOASEONC-UHFFFAOYSA-N"
"CCCc(c1)cc(C)cc1","InChI=1S/C10H14/c1-3-5-10-7-4-6-9(2)8-10/h4,6-8H,3,5H2,1-2H3","QUEBYVKXYIKVSO-UHFFFAOYSA-N"
"CCCc(c1)ccc(C)c1","InChI=1S/C10H14/c1-3-4-10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3","JXFVMNFKABWTHD-UHFFFAOYSA-N"
"CC(C)c(c1)c(C)ccc1","InChI=1S/C10H14/c1-8(2)10-7-5-4-6-9(10)3/h4-8H,1-3H3","WWRCMNKATXZARA-UHFFFAOYSA-N"
"CC(C)c(c1)cc(C)cc1","InChI=1S/C10H14/c1-8(2)10-6-4-5-9(3)7-10/h4-8H,1-3H3","XCYJPXQACVEIOS-UHFFFAOYSA-N"
"CCc(c1)c(CC)ccc1","InChI=1S/C10H14/c1-3-9-7-5-6-8-10(9)4-2/h5-8H,3-4H2,1-2H3","KVNYFPKFSJIPBJ-UHFFFAOYSA-N"
"CCc(c1)ccc(CC)c1","InChI=1S/C10H14/c1-3-9-5-7-10(4-2)8-6-9/h5-8H,3-4H2,1-2H3","DSNHSQKRULAAEI-UHFFFAOYSA-N"
"CCc(c1)c(C)c(C)cc1","InChI=1S/C10H14/c1-4-10-7-5-6-8(2)9(10)3/h5-7H,4H2,1-3H3","QUBBAXISAHIDNM-UHFFFAOYSA-N"
"CCc(c1)cc(C)c(C)c1","InChI=1S/C10H14/c1-4-10-6-5-8(2)9(3)7-10/h5-7H,4H2,1-3H3","SBUYFICWQNHBCM-UHFFFAOYSA-N"
"CCc(c1)c(C)cc(C)c1","InChI=1S/C10H14/c1-4-10-6-5-8(2)7-9(10)3/h5-7H,4H2,1-3H3","MEMBJMDZWKVOTB-UHFFFAOYSA-N"
"CCc(c1)cc(C)cc(C)1","InChI=1S/C10H14/c1-4-10-6-8(2)5-9(3)7-10/h5-7H,4H2,1-3H3","LMAUULKNZLEMGN-UHFFFAOYSA-N"
"CCc(c1)c(C)ccc(C)1","InChI=1S/C10H14/c1-4-10-7-8(2)5-6-9(10)3/h5-7H,4H2,1-3H3","AXIUBBVSOWPLDA-UHFFFAOYSA-N"
"CCCC(C)c(c1)cccc1","InChI=1S/C11H16/c1-3-7-10(2)11-8-5-4-6-9-11/h4-6,8-10H,3,7H2,1-2H3","LTHAIAJHDPJXLG-UHFFFAOYSA-N"
"Cc(c1)ccc(c1)C(C)(C)C","InChI=1S/C11H16/c1-9-5-7-10(8-6-9)11(2,3)4/h5-8H,1-4H3","QCWXDVFBZVHKLV-UHFFFAOYSA-N"
"CC(C)c(c1)cc(C)cc(C)1","InChI=1S/C11H16/c1-8(2)11-6-9(3)5-10(4)7-11/h5-8H,1-4H3","RMKJTYPFCFNTGQ-UHFFFAOYSA-N"
"CC(C)c(c1)cc(cc1)C(C)C","InChI=1S/C12H18/c1-9(2)11-6-5-7-12(8-11)10(3)4/h5-10H,1-4H3","UNEATYXSUBPPKP-UHFFFAOYSA-N"
"Cc(c1)cc(cc(C)1)C(C)(C)C","InChI=1S/C12H18/c1-9-6-10(2)8-11(7-9)12(3,4)5/h6-8H,1-5H3","FZSPYHREEHYLCB-UHFFFAOYSA-N"
"CCc(c1)cc(CC)cc(CC)1","InChI=1S/C12H18/c1-4-10-7-11(5-2)9-12(6-3)8-10/h7-9H,4-6H2,1-3H3","WJYMPXJVHNDZHD-UHFFFAOYSA-N"
"CCCCCCCc(c1)cccc1","InChI=1S/C13H20/c1-2-3-4-5-7-10-13-11-8-6-9-12-13/h6,8-9,11-12H,2-5,7,10H2,1H3","LBNXAWYDQUGHGX-UHFFFAOYSA-N"
"CC(C)c(c1)cc(C(C)C)cc(C)1","InChI=1S/C13H20/c1-9(2)12-6-11(5)7-13(8-12)10(3)4/h6-10H,1-5H3","SOALUUXENHDLMW-UHFFFAOYSA-N"
"CCCCCCCCc(c1)cccc1","InChI=1S/C14H22/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14/h7,9-10,12-13H,2-6,8,11H2,1H3","CDKDZKXSXLNROY-UHFFFAOYSA-N"
"CCCCCCCCCc(c1)cccc1","InChI=1S/C15H24/c1-2-3-4-5-6-7-9-12-15-13-10-8-11-14-15/h8,10-11,13-14H,2-7,9,12H2,1H3","LIXVMPBOGDCSRM-UHFFFAOYSA-N"
"CCCCCCCCCCc(c1)cccc1","InChI=1S/C16H26/c1-2-3-4-5-6-7-8-10-13-16-14-11-9-12-15-16/h9,11-12,14-15H,2-8,10,13H2,1H3","UZILCZKGXMQEQR-UHFFFAOYSA-N"
"CCCCCCCCC(C)c(c1)cccc1","InChI=1S/C16H26/c1-3-4-5-6-7-9-12-15(2)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3","DDTJIQUCOLHYDL-UHFFFAOYSA-N"
"CCCCCCCC(CC)c(c1)cccc1","InChI=1S/C16H26/c1-3-5-6-7-9-12-15(4-2)16-13-10-8-11-14-16/h8,10-11,13-15H,3-7,9,12H2,1-2H3","PYVIFMPVFLOTLN-UHFFFAOYSA-N"
"CCCCCCC(CCC)c(c1)cccc1","InChI=1S/C16H26/c1-3-5-6-8-12-15(11-4-2)16-13-9-7-10-14-16/h7,9-10,13-15H,3-6,8,11-12H2,1-2H3","QTDBKYLPIZUTFN-UHFFFAOYSA-N"
"CCCCCC(CCCC)c(c1)cccc1","InChI=1S/C16H26/c1-3-5-8-12-15(11-6-4-2)16-13-9-7-10-14-16/h7,9-10,13-15H,3-6,8,11-12H2,1-2H3","CDOBABYRHNVZQG-UHFFFAOYSA-N"
"CCCCCCCCCCCc(c1)cccc1","InChI=1S/C17H28/c1-2-3-4-5-6-7-8-9-11-14-17-15-12-10-13-16-17/h10,12-13,15-16H,2-9,11,14H2,1H3","XBEADGFTLHRJRB-UHFFFAOYSA-N"
"CCCCCCCCCC(C)c(c1)cccc1","InChI=1S/C17H28/c1-3-4-5-6-7-8-10-13-16(2)17-14-11-9-12-15-17/h9,11-12,14-16H,3-8,10,13H2,1-2H3","YHJBCRBYDBNEIK-UHFFFAOYSA-N"
"CCCCCCCCC(CC)c(c1)cccc1","InChI=1S/C17H28/c1-3-5-6-7-8-10-13-16(4-2)17-14-11-9-12-15-17/h9,11-12,14-16H,3-8,10,13H2,1-2H3","NVHBFHMWJJMQTG-UHFFFAOYSA-N"
"CCCCCCCC(CCC)c(c1)cccc1","InChI=1S/C17H28/c1-3-5-6-7-9-13-16(12-4-2)17-14-10-8-11-15-17/h8,10-11,14-16H,3-7,9,12-13H2,1-2H3","NSQAXMRLBNXEHK-UHFFFAOYSA-N"
"CCCCCCC(CCCC)c(c1)cccc1","InChI=1S/C17H28/c1-3-5-7-9-13-16(12-6-4-2)17-14-10-8-11-15-17/h8,10-11,14-16H,3-7,9,12-13H2,1-2H3","RRPCXIBGXYGQNC-UHFFFAOYSA-N"
"CCCCCC(CCCCC)c(c1)cccc1","InChI=1S/C17H28/c1-3-5-8-12-16(13-9-6-4-2)17-14-10-7-11-15-17/h7,10-11,14-16H,3-6,8-9,12-13H2,1-2H3","WCABIRIFXVXGQH-UHFFFAOYSA-N"
"CCCCCCCCCCCCc(c1)cccc1","InChI=1S/C18H30/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18/h11,13-14,16-17H,2-10,12,15H2,1H3","KWKXNDCHNDYVRT-UHFFFAOYSA-N"
"CCCCCCCCCCC(C)c(c1)cccc1","InChI=1S/C18H30/c1-3-4-5-6-7-8-9-11-14-17(2)18-15-12-10-13-16-18/h10,12-13,15-17H,3-9,11,14H2,1-2H3","VRPRIAVYSREHAN-UHFFFAOYSA-N"
"CCCCCCCCCC(CC)c(c1)cccc1","InChI=1S/C18H30/c1-3-5-6-7-8-9-11-14-17(4-2)18-15-12-10-13-16-18/h10,12-13,15-17H,3-9,11,14H2,1-2H3","PGVOXXHNGYYHHB-UHFFFAOYSA-N"
"CCCCCCCCC(CCC)c(c1)cccc1","InChI=1S/C18H30/c1-3-5-6-7-8-10-14-17(13-4-2)18-15-11-9-12-16-18/h9,11-12,15-17H,3-8,10,13-14H2,1-2H3","RHDHXBLZBVAPTL-UHFFFAOYSA-N"
"CCCCCCCC(CCCC)c(c1)cccc1","InChI=1S/C18H30/c1-3-5-7-8-10-14-17(13-6-4-2)18-15-11-9-12-16-18/h9,11-12,15-17H,3-8,10,13-14H2,1-2H3","NPAWGLOPXKCTCV-UHFFFAOYSA-N"
"CCCCCCC(CCCCC)c(c1)cccc1","InChI=1S/C18H30/c1-3-5-7-10-14-17(13-9-6-4-2)18-15-11-8-12-16-18/h8,11-12,15-17H,3-7,9-10,13-14H2,1-2H3","ZYHJQFMTTFCBKH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCc(c1)cccc1","InChI=1S/C19H32/c1-2-3-4-5-6-7-8-9-10-11-13-16-19-17-14-12-15-18-19/h12,14-15,17-18H,2-11,13,16H2,1H3","MCVUKOYZUCWLQQ-UHFFFAOYSA-N"
"CCCCCCCCCCCC(C)c(c1)cccc1","InChI=1S/C19H32/c1-3-4-5-6-7-8-9-10-12-15-18(2)19-16-13-11-14-17-19/h11,13-14,16-18H,3-10,12,15H2,1-2H3","FCXPVFLEDIQLLO-UHFFFAOYSA-N"
"CCCCCCCCCCC(CC)c(c1)cccc1","InChI=1S/C19H32/c1-3-5-6-7-8-9-10-12-15-18(4-2)19-16-13-11-14-17-19/h11,13-14,16-18H,3-10,12,15H2,1-2H3","VZZMNLVGDGMQQV-UHFFFAOYSA-N"
"CCCCCCCCCC(CCC)c(c1)cccc1","InChI=1S/C19H32/c1-3-5-6-7-8-9-11-15-18(14-4-2)19-16-12-10-13-17-19/h10,12-13,16-18H,3-9,11,14-15H2,1-2H3","RZGVZPAWCGDMCK-UHFFFAOYSA-N"
"CCCCCCCCC(CCCC)c(c1)cccc1","InChI=1S/C19H32/c1-3-5-7-8-9-11-15-18(14-6-4-2)19-16-12-10-13-17-19/h10,12-13,16-18H,3-9,11,14-15H2,1-2H3","MZTIRLOLMGVVEK-UHFFFAOYSA-N"
"CCCCCCCC(CCCCC)c(c1)cccc1","InChI=1S/C19H32/c1-3-5-7-8-11-15-18(14-10-6-4-2)19-16-12-9-13-17-19/h9,12-13,16-18H,3-8,10-11,14-15H2,1-2H3","OTSYFFDVDLHIKX-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCc(c1)cccc1","InChI=1S/C21H36/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21-19-16-14-17-20-21/h14,16-17,19-20H,2-13,15,18H2,1H3","JIRNEODMTPGRGV-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCc(c1)cccc1","InChI=1S/C23H40/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23-21-18-16-19-22-23/h16,18-19,21-22H,2-15,17,20H2,1H3","ZMPPFNHWXMJARX-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCc(c1)cccc1","InChI=1S/C25H44/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-25-23-20-18-21-24-25/h18,20-21,23-24H,2-17,19,22H2,1H3","SHWJJBRTHGGZBE-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)C=C1","InChI=1S/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H2","YBYIRNPNPLQARY-UHFFFAOYSA-N"
"c(c2)cc(C1)c(c2)CC1","InChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4-5H,3,6-7H2","PQNFLJBBNBOBRQ-UHFFFAOYSA-N"
"[H]C(C1)=C([H])c(c2)c(ccc2)C1","InChI=1S/C10H10/c1-2-6-10-8-4-3-7-9(10)5-1/h1-3,5-7H,4,8H2","KEIFWROAQVVDBN-UHFFFAOYSA-N"
"Cc(c1)cc(c2)c(ccc2)c(C)1","InChI=1S/C12H12/c1-9-7-10(2)12-6-4-3-5-11(12)8-9/h3-8H,1-2H3","QHJMFSMPSZREIF-UHFFFAOYSA-N"
"Cc(c1)c(c2)c(ccc2)c(C)c1","InChI=1S/C12H12/c1-9-7-8-10(2)12-6-4-3-5-11(9)12/h3-8H,1-2H3","APQSQLNWAIULLK-UHFFFAOYSA-N"
"c(c2)ccc(c2)C#Cc(c1)cccc1","InChI=1S/C14H10/c1-3-7-13(8-4-1)11-12-14-9-5-2-6-10-14/h1-10H","JRXXLCKWQFKACW-UHFFFAOYSA-N"
"Cc(c3)c(c1)c(cc3)c(c2)c(ccc2)c1","InChI=1S/C15H12/c1-11-5-4-8-15-13(11)10-9-12-6-2-3-7-14(12)15/h2-10H,1H3","DOWJXOHBNXRUOD-UHFFFAOYSA-N"
"Cc(c3)cc(c1)c(c3)cc(c2)c(ccc2)1","InChI=1S/C15H12/c1-11-6-7-14-9-12-4-2-3-5-13(12)10-15(14)8-11/h2-10H,1H3","GYMFBYTZOGMSQJ-UHFFFAOYSA-N"
"Cc(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C15H12/c1-11-14-8-4-2-6-12(14)10-13-7-3-5-9-15(11)13/h2-10H,1H3","CPGPAVAKSZHMBP-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c1)c(c2)c(ccc2)cc1","InChI=1S/C16H12/c1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16/h1-12H","IYDMICQAKLQHLA-UHFFFAOYSA-N"
"c(c4)cc(c1)c(c4)cc(c32)c1Cc(cccc3)2","InChI=1S/C17H12/c1-2-6-13-11-17-15(9-12(13)5-1)10-14-7-3-4-8-16(14)17/h1-9,11H,10H2","HAPOJKSPCGLOOD-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)c(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H","WDECIBYCCFPHNR-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)c(c1c3)c(c2)c(ccc2)cc1","InChI=1S/C18H12/c1-3-7-16-13(5-1)9-11-15-12-10-14-6-2-4-8-17(14)18(15)16/h1-12H","TUAHORSUHVUKBD-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c2)cc(cc2)c(c1)cccc1","InChI=1S/C18H14/c1-3-8-15(9-4-1)17-12-7-13-18(14-17)16-10-5-2-6-11-16/h1-14H","YJTKZCDBKVTVBY-UHFFFAOYSA-N"
"c(c3)ccc(c3)c(c2)ccc(c2)c(c1)cccc1","InChI=1S/C18H14/c1-3-7-15(8-4-1)17-11-13-18(14-12-17)16-9-5-2-6-10-16/h1-14H","XJKSTNDFUHDPQJ-UHFFFAOYSA-N"
"c(c4)cc(c3)c(c4)c(c1)c(c3)c(C)c(c2)c(ccc2)1","InChI=1S/C19H14/c1-13-16-8-4-3-7-15(16)12-19-17(13)11-10-14-6-2-5-9-18(14)19/h2-12H,1H3","DIIFUCUPDHMNIV-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C19H16/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1-15,19H","AAAQKTZKLRYKHR-UHFFFAOYSA-N"
"c(c5)cc(c(c5)1)c(c4)c(c(cc4)3)c(c2cc3)c(ccc2)1","InChI=1S/C20H12/c1-2-8-16-15(7-1)17-9-3-5-13-11-12-14-6-4-10-18(16)20(14)19(13)17/h1-12H","TXVHTIQJNYSSKO-UHFFFAOYSA-N"
"c(c5)cc(c4)c(c5)c(c(c4)1)c(c3)c(c2cc3)c(ccc2)1","InChI=1S/C20H12/c1-2-8-15-13(5-1)11-12-17-16-9-3-6-14-7-4-10-18(19(14)16)20(15)17/h1-12H","KHNYNFUTFKJLDD-UHFFFAOYSA-N"
"c(c4)ccc(c4)c(c21)c(c3)c(ccc3)cc(cccc2)1","InChI=1S/C20H14/c1-2-8-15(9-3-1)20-18-12-6-4-10-16(18)14-17-11-5-7-13-19(17)20/h1-14H","LUBXLGUQZVKOFP-UHFFFAOYSA-N"
"Cc(c5)c(C4)c(c(c5)3)c(C4)c(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C21H16/c1-13-6-7-15-12-20-17-5-3-2-4-14(17)8-9-18(20)19-11-10-16(13)21(15)19/h2-9,12H,10-11H2,1H3","PPQNQXQZIWHJRB-UHFFFAOYSA-N"
"c(c6)cc(c4)c(c65)c(c(cc5)1)c(c34)c(c2cc3)c(ccc2)c1","InChI=1S/C22H12/c1-3-13-7-9-18-12-16-6-2-4-14-8-10-17-11-15(5-1)19(13)21(18)22(17)20(14)16/h1-12H","YFIJJNAKSZUOLT-UHFFFAOYSA-N"
"c(c5)cc(c4)c(c5)c(c3)c(c4)c(c1)c(c3)c(c2)c(ccc2)c1","InChI=1S/C22H14/c1-3-7-17-15(5-1)9-11-21-19(17)13-14-20-18-8-4-2-6-16(18)10-12-22(20)21/h1-14H","GBROPGWFBFCKAG-UHFFFAOYSA-N"
"CC1C2CN3CCC4=C(C3CC2C(=CO1)C(=O)OC)NC5=CC=CC=C45","InChI=1S/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t12-,15-,16+,19-/m0/s1","GRTOGORTSDXSFK-XJTZBENFSA-N"
"Oc(c3)ccc(c3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H","KZNIFHPLKGYRTM-UHFFFAOYSA-N"
"OC(=O)CCCC[C@H](S1)[C@@]([H])(N2)[C@@]([H])(NC(=O)2)C1","InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1","YBJHBAHKTGYVGT-ZKWXMUAHSA-N"
"Oc(c3)cc(O1)c(c(O)3)C(=O)C=C(c(c2)cccc2)1","InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H","RTIXKCRFFJGDFG-UHFFFAOYSA-N"
"C[C@H]1CC[C@@H]2[C@H]([C@H]3[C@@H](N2C1)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5(CC[C@@H](C6)O)C)C)C","InChI=1S/C27H45NO/c1-16-5-8-23-17(2)25-24(28(23)15-16)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h16-25,29H,5-15H2,1-4H3/t16-,17+,18-,19-,20+,21-,22-,23+,24-,25-,26-,27-/m0/s1","JALVTHFTYRPDMB-HRRTYWNUSA-N"
"Cc(c3)cc(c(=O)1)c(c(O)3)c(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3","RHMXXJGYXNZAPX-UHFFFAOYSA-N"
"Oc(c3)c(O)cc(c3)[C@@H](O1)[C@H](O)Cc(c(O)2)c(cc(O)c2)1","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1","PFTAWBLQPZVEMU-UKRRQHHQSA-N"
"Oc(c3)cc(O1)c(c3)C(=O)C(O)=C1c(c2)cc(O)c(O)c2","InChI=1S/C15H10O6/c16-8-2-3-9-12(6-8)21-15(14(20)13(9)19)7-1-4-10(17)11(18)5-7/h1-6,16-18,20H","XHEFDIBZLJXQHF-UHFFFAOYSA-N"
"","InChI=1S/C54H92O23/c1-23(2)10-9-14-54(8,77-48-44(69)40(65)37(62)29(74-48)22-70-46-42(67)38(63)34(59)26(19-55)71-46)24-11-16-53(7)33(24)25(58)18-31-51(5)15-13-32(50(3,4)30(51)12-17-52(31,53)6)75-49-45(41(66)36(61)28(21-57)73-49)76-47-43(68)39(64)35(60)27(20-56)72-47/h10,24-49,55-69H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46+,47-,48-,49-,51-,52+,53+,54-/m0/s1","GZYPWOGIYAIIPV-JBDTYSNRSA-N"
"CC(C)(C1OC(O7)C(OC(C8O)OC(CO)C(C8O)O)C(C(C7CO)O)O)C(C2)C(C(C6)C(C(C(C6O)3)(CCC3C(CCC=C(C)C)(C)OC(O4)C(C(C(C4COC(O5)C(C(O)C(O)C5)O)O)O)O)C)(C)C2)(C)CC1","InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-69-45-41(65)34(58)26(57)21-68-45)24-11-16-52(7)33(24)25(56)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)36(60)28(20-55)71-48)74-46-42(66)38(62)35(59)27(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3","NODILNFGTFIURN-UHFFFAOYSA-N"
"C(O1)(C(O)C(C(OC(C8O)OC(CO)C(C8O)O)C1OC(C2(C)C)CCC(C73)(C2CCC3(C)C(C)(C4C(O)C7)CCC4C(CCC=C(C)C)(C)OC(C6O)OC(C(O)C6O)COC(O5)C(O)C(O)C(CO)5)C)O)CO","InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3","JDCPEKQWFDWQLI-UHFFFAOYSA-N"
"CC1=NC=CC2=C1NC3=C2C=CC(=C3)OC","InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3","BXNJHAXVSOCGBA-UHFFFAOYSA-N"
"COc(c3)c(O)cc(c3)[C@H](C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3/t14-/m0/s1","AIONOLUJZLIMTK-AWEZNQCLSA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)[C@@H]1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1","OVSQVDMCBVZWGM-DTGCRPNFSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1","OVSQVDMCBVZWGM-QSOFNFLRSA-N"
"O([C@H]5C)[C@H]([C@@H]([C@@H]([C@H]5O)O)O)O[C@H]([C@H]4O)[C@@H](O[C@@H]([C@H]4O)CO)Oc(c3)cc(O1)c(c3O)C(C(=C(c(c2)ccc(O)c2)1)O)=O","InChI=1S/C27H30O15/c1-9-17(31)20(34)23(37)26(38-9)42-25-21(35)18(32)15(8-28)41-27(25)39-12-6-13(30)16-14(7-12)40-24(22(36)19(16)33)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-21,23,25-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1","ZEJXENDZTYVXDP-CSJHBIPPSA-N"
"Cc(c2)cc(C=1)c(c2)OC(=O)C1","InChI=1S/C10H8O2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h2-6H,1H3","FXFYOPQLGGEACP-UHFFFAOYSA-N"
"Oc(c3)cc(O1)c(c(O)3)C(=O)C(O)=C1c(c2)cc(O)c(O)c(O)2","InChI=1S/C15H10O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,16-20,22H","IKMDFBPHZNJCSN-UHFFFAOYSA-N"
"Oc(c4)cc(O1)c(c(O)4)C(=O)C(O[C@H](O3)[C@H](O)[C@H](O)[C@@H](O)[C@H](C)3)=C1c(c2)cc(O)c(O)c(O)2","InChI=1S/C21H20O12/c1-6-14(26)17(29)18(30)21(31-6)33-20-16(28)13-9(23)4-8(22)5-12(13)32-19(20)7-2-10(24)15(27)11(25)3-7/h2-6,14,17-18,21-27,29-30H,1H3/t6-,14-,17+,18+,21-/m0/s1","DCYOADKBABEMIQ-OWMUPTOHSA-N"
"Oc(c3)ccc(c3)[C@H](C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1","FTVWIRXFELQLPI-ZDUSSCGKSA-N"
"CO[C@H]([C@@H](O)1)[C@@H]([C@H](O[C@@H](C6)C[C@]([H])([C@](C6)2C)CC[C@]([C@@]43O)([H])[C@@](CC[C@]3(C)[C@@](C(C5)=CC(O5)=O)(CC4)[H])([H])2)O[C@@H](C)1)O","InChI=1S/C30H46O8/c1-16-24(32)26(35-4)25(33)27(37-16)38-19-7-10-28(2)18(14-19)5-6-22-21(28)8-11-29(3)20(9-12-30(22,29)34)17-13-23(31)36-15-17/h13,16,18-22,24-27,32-34H,5-12,14-15H2,1-4H3/t16-,18+,19-,20+,21-,22+,24-,25-,26+,27-,28-,29+,30-/m0/s1","VPUNMTHWNSJUOG-BAOINKAISA-N"
"O([C@H]5C)[C@H]([C@@H]([C@@H]([C@H]5O)O)O)O[C@H]([C@H]4O)[C@@H](O[C@@H]([C@H]4O)CO)Oc(c3)cc(O1)c(c3O)C(C=C(c(c2)ccc(O)c2)1)=O","InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1","RPMNUQRUHXIGHK-PYXJVEIZSA-N"
"O=C(C=3)C(C)=C([C@](C)(C3)2)[C@]([H])(O1)[C@]([H])(CC2)C(C)C(=O)1","InChI=1S/C15H18O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7-8,10,13H,4,6H2,1-3H3/t8-,10-,13-,15-/m0/s1","XJHDMGJURBVLLE-BOCCBSBMSA-N"
"CC=C(C3)C(=O)O[C@H](C1)[C@@]([H])(C(COC(=O)[C@](C)(O)[C@H](C)3)=2)N(CC2)C1","InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-/m1/s1","HKODIGSRFALUTA-JTLQZVBZSA-N"
"CC=C(C3)C(=O)O[C@H](C1)[C@@]([H])(C(COC(=O)[C@](C)(O)C(=C)3)=2)N(CC2)C1","InChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4-/t14-,15-,18-/m1/s1","FCEVNJIUIMLVML-QPSVUOIXSA-N"
"[C@@H](O1)(O[C@H](C9)CC[C@@](C)(C9=8)[C@]([C@](CC8)([H])4)(CC[C@]([C@]57[H])([C@]([H])4C[C@]([H])(N(C6)[C@]([H])([C@H]7C)CC[C@@H]6C)5)C)[H])[C@H](O[C@@H]([C@@H]3O)O[C@H]([C@@H]([C@@H](O)3)O)C)[C@@H](O[C@@H]([C@@H]2O)O[C@@H]([C@H]([C@@H]2O)O)CO)[C@@H](O)[C@H]1CO","InChI=1S/C45H73NO15/c1-19-6-9-27-20(2)31-28(46(27)16-19)15-26-24-8-7-22-14-23(10-12-44(22,4)25(24)11-13-45(26,31)5)57-43-40(61-41-37(54)35(52)32(49)21(3)56-41)39(34(51)30(18-48)59-43)60-42-38(55)36(53)33(50)29(17-47)58-42/h7,19-21,23-43,47-55H,6,8-18H2,1-5H3/t19-,20+,21-,23-,24+,25-,26-,27-,28-,29+,30+,31-,32-,33+,34-,35+,36-,37+,38+,39-,40+,41-,42-,43+,44-,45-/m0/s1","ZGVSETXHNHBTRK-NPQOSWHTSA-N"
"","InChI=1S/C29H44O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3/t13-,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-/m0/s1","LPMXVESGRSUGHW-HBYQJFLCSA-N"
"CCCCCCC[C@@H](C1)OC(=O)C1","InChI=1S/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3/t10-/m0/s1","PHXATPHONSXBIL-JTQLQIEISA-N"
"COc(c3)cc(O1)c(c(O)3)C(=O)C=C1c(c2)cc(OC)c(O)c2","InChI=1S/C17H14O6/c1-21-10-6-12(19)17-13(20)8-14(23-16(17)7-10)9-3-4-11(18)15(5-9)22-2/h3-8,18-19H,1-2H3","ROCUOVBWAWAQFD-UHFFFAOYSA-N"
"Oc(c3)c(O)cc(c3)C(O1)=C(O)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"COc(c3)c(=O)cc(c(=O)3)C(C1)Cc(c2)c(cc(O)c2)O1","InChI=1S/C16H14O5/c1-20-16-7-13(18)12(6-14(16)19)10-4-9-2-3-11(17)5-15(9)21-8-10/h2-3,5-7,10,17H,4,8H2,1H3","PDAKXMIQFUHWQC-UHFFFAOYSA-N"
"Oc(c3)c(c(=O)1)c(cc3)c(=O)c(c2)c(c(O)cc2)1","InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)12-8(13(7)17)4-2-6-10(12)16/h1-6,15-16H","QBPFLULOKWLNNW-UHFFFAOYSA-N"
"OC(C1)C(C)(C)Oc(c32)c1c(=O)c(=O)c(cccc3)2","InChI=1S/C15H14O4/c1-15(2)11(16)7-10-13(18)12(17)8-5-3-4-6-9(8)14(10)19-15/h3-6,11,16H,7H2,1-2H3","MFHPSBRWDZUZHF-UHFFFAOYSA-N"
"COC(=O)c(c2)cc(cc2)NC(=O)c(c1)c(ccc1)[N+1]([O-1])=O","InChI=1S/C15H12N2O5/c1-22-15(19)10-5-4-6-11(9-10)16-14(18)12-7-2-3-8-13(12)17(20)21/h2-9H,1H3,(H,16,18)","OWQNWJPLMHWHSM-UHFFFAOYSA-N"
"COc(c3)c(OC)c(c(=O)1)c(c3)c(=O)c(o2)c(cc2)1","InChI=1S/C14H10O5/c1-17-9-4-3-7-10(14(9)18-2)11(15)8-5-6-19-13(8)12(7)16/h3-6H,1-2H3","VMGYORRTCREVTB-UHFFFAOYSA-N"
"CC(C)(C3)Oc(c(=O)1)c(C3)c(=O)c(c2)c(ccc2)1","InChI=1S/C15H14O3/c1-15(2)8-7-11-12(16)9-5-3-4-6-10(9)13(17)14(11)18-15/h3-6H,7-8H2,1-2H3","PJWHOPKRRBUSDH-UHFFFAOYSA-N"
"CC(C)(C3)Oc(c(C3)1)c(c2)c(ccc2)c(=O)c(=O)1","InChI=1S/C15H14O3/c1-15(2)8-7-11-13(17)12(16)9-5-3-4-6-10(9)14(11)18-15/h3-6H,7-8H2,1-2H3","QZPQTZZNNJUOLS-UHFFFAOYSA-N"
"COc(c4)cc(c3c4)c(ccn3)[C@@H](O)[C@]([H])(C1)N(C2)C[C@H](C=C)[C@H](C2)1","InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14?,19-,20+/m0/s1","LOUPRKONTZGTKE-VOMFEXJBSA-N"
"c(c3)ccc(c3)C(C1)N=C(S2)N(CC2)1","InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2/t10-/m1/s1","HLFSDGLLUJUHTE-SNVBAGLBSA-N"
"CC(C)NCC(C2)Nc(c1)c(C2)cc(CO)c([N+1]([O-1])=O)1","InChI=1S/C14H21N3O3/c1-9(2)15-7-12-4-3-10-5-11(8-18)14(17(19)20)6-13(10)16-12/h5-6,9,12,15-16,18H,3-4,7-8H2,1-2H3","XCGYUJZMCCFSRP-UHFFFAOYSA-N"
"C(C4)CCC(C4)C(=O)N(C1)CC(c32)N(CCc(cccc3)2)C(=O)1","InChI=1S/C19H24N2O2/c22-18-13-20(19(23)15-7-2-1-3-8-15)12-17-16-9-5-4-6-14(16)10-11-21(17)18/h4-6,9,15,17H,1-3,7-8,10-13H2","FSVJFNAIGNNGKK-UHFFFAOYSA-N"
"CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C","InChI=1S/C25H30N3/c1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6/h7-18H,1-6H3/q+1","LGLFFNDHMLKUMI-UHFFFAOYSA-N"
"CCN(CC)CCN([H])c(c1)c(C(=O)2)c(Sc(c3)c(ccc3)2)c(CO)c1","InChI=1S/C20H24N2O2S/c1-3-22(4-2)12-11-21-16-10-9-14(13-23)20-18(16)19(24)15-7-5-6-8-17(15)25-20/h5-10,21,23H,3-4,11-13H2,1-2H3","MFZWMTSUNYWVBU-UHFFFAOYSA-N"
"COc(c3)cc(c(c3)2)C(OC(=O)2)c(c1)oc(C(C)=O)c1","InChI=1S/C15H12O5/c1-8(16)12-5-6-13(19-12)14-11-7-9(18-2)3-4-10(11)15(17)20-14/h3-7,14H,1-2H3","KTVRYSLCSNORPS-UHFFFAOYSA-N"
"COc(c1)ccc(c1)C(=O)N(CC)CC","InChI=1S/C12H17NO2/c1-4-13(5-2)12(14)10-6-8-11(15-3)9-7-10/h6-9H,4-5H2,1-3H3","HCJXEOFLVIFFDG-UHFFFAOYSA-N"
"CCN(CC)C(=O)c(c1)cc(OC)c(OC)c1","InChI=1S/C13H19NO3/c1-5-14(6-2)13(15)10-7-8-11(16-3)12(9-10)17-4/h7-9H,5-6H2,1-4H3","ZQTJMIZZICSOBJ-UHFFFAOYSA-N"
"COc(c1)cc(cc1)C(=O)N(CC)CC","InChI=1S/C12H17NO2/c1-4-13(5-2)12(14)10-7-6-8-11(9-10)15-3/h6-9H,4-5H2,1-3H3","YYTOWTFIPGDNDQ-UHFFFAOYSA-N"
"CCN(CC)C(=O)c(c1)c(OC)cc(OC)c1","InChI=1S/C13H19NO3/c1-5-14(6-2)13(15)11-8-7-10(16-3)9-12(11)17-4/h7-9H,5-6H2,1-4H3","FUTVQQSUNQOZSN-UHFFFAOYSA-N"
"OC(=O)c(c1)scc1","InChI=1S/C5H4O2S/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)","QERYCTSHXKAMIS-UHFFFAOYSA-N"
"OC(=O)c(c1)csc1","InChI=1S/C5H4O2S/c6-5(7)4-1-2-8-3-4/h1-3H,(H,6,7)","YNVOMSDITJMNET-UHFFFAOYSA-N"
"CCN(CC)C(=O)c(c1)c(OC)ccc1","InChI=1S/C12H17NO2/c1-4-13(5-2)12(14)10-8-6-7-9-11(10)15-3/h6-9H,4-5H2,1-3H3","ZFIIUAIWXACNKN-UHFFFAOYSA-N"
"CCN(CC)C(=O)c(c1)ccc(O)c1","InChI=1S/C11H15NO2/c1-3-12(4-2)11(14)9-5-7-10(13)8-6-9/h5-8,13H,3-4H2,1-2H3","WLRVSRJKZYZCJY-UHFFFAOYSA-N"
"O=C(O1)[C@H](C)[C@]([H])(C4)[C@](O2)([C@@]([H])3[C@H](C)C4)[C@]([H])1O[C@@](C)(CC3)O2","InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3/t8-,9-,10+,11+,13-,14-,15-/m1/s1","BLUAFEHZUWYNDE-NNWCWBAJSA-N"
"COc(c3)c(O)cc(c3)C(O1)=C(OC)C(=O)c(c(O)2)c(cc(OC)c(OC)2)1","InChI=1S/C19H18O8/c1-23-11-6-5-9(7-10(11)20)17-19(26-4)16(22)14-12(27-17)8-13(24-2)18(25-3)15(14)21/h5-8,20-21H,1-4H3","PJQLSMYMOKWUJG-UHFFFAOYSA-N"
"COC(=C3)C(=O)C=C(C(NC(C)=O)2)C(=C3)c(c(CC2)1)c(OC)c(OC)c(OC)c1","InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1","IAKHMKGGTNLKSZ-INIZCTEOSA-N"
"c(C(c(c7)cc(OC)c(O)c7OC)4)(c5)c(cc(O6)c5OC6)C(C(C43[H])([H])COC(=O)3)OC(O1)C(C(O)C(O2)([H])C1(COC(C)2)[H])O","InChI=1S/C29H32O13/c1-11-36-9-20-27(40-11)24(31)25(32)29(41-20)42-26-14-7-17-16(38-10-39-17)6-13(14)21(22-15(26)8-37-28(22)33)12-4-18(34-2)23(30)19(5-12)35-3/h4-7,11,15,20-22,24-27,29-32H,8-10H2,1-3H3/t11-,15+,20-,21-,22+,24-,25-,26-,27-,29+/m1/s1","VJJPUSNTGOMMGY-MRVIYFEKSA-N"
"OCC(=O)C(O)(C(C)4)C(C)(C3)C([H])(C4)C([H])(C1)C(F)(C(O)3)C(C)(C=2)C(=CC(=O)C2)C1","InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15+,16+,17+,19+,20+,21+,22+/m1/s1","UREBDLICKHMUKA-CXSFZGCWSA-N"
"[H]N(C)CCC=C(c21)c(c3)c(ccc3)C(C)(C)c(cccc2)1","InChI=1S/C20H23N/c1-20(2)18-12-6-4-9-16(18)15(11-8-14-21-3)17-10-5-7-13-19(17)20/h4-7,9-13,21H,8,14H2,1-3H3","AUZMDLDJTGPIEA-UHFFFAOYSA-N"
"NC(=N)c(c1)ccc(OCCCCCOc(c2)ccc(C(N)=N)c2)c1","InChI=1S/C19H24N4O2/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23)","XDRYMKDFEDOLFX-UHFFFAOYSA-N"
"C1=NNC2=C1C(=O)NC=N2","InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)","OFCNXPDARWKPPY-UHFFFAOYSA-N"
"NCCCC(C)Nc(c1)c(n2)c(ccc2)cc(OC)1","InChI=1S/C15H21N3O/c1-11(5-3-7-16)18-14-10-13(19-2)9-12-6-4-8-17-15(12)14/h4,6,8-11,18H,3,5,7,16H2,1-2H3","INDBQLZJXZLFIT-UHFFFAOYSA-N"
"CCN(CC)CCCC(C)Nc(c21)c(c3)c(ccc(OC)3)nc(cc(Cl)cc2)1","InChI=1S/C23H30ClN3O/c1-5-27(6-2)13-7-8-16(3)25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(28-4)15-20(21)23/h9-12,14-16H,5-8,13H2,1-4H3,(H,25,26)","GPKJTRJOBQGKQK-UHFFFAOYSA-N"
"C=C[C@@H](C3)[C@@H](C4)C[C@@]([H])(N(C4)3)[C@@H](O)c(c1)c(c2)c(ccc2)nc1","InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14?,18+,19-/m0/s1","KMPWYEUPVWOPIM-FGVBSWQGSA-N"
"C1=CC=C2C(=C1)C(=O)C(=O)N2","InChI=1S/C8H5NO2/c10-7-5-3-1-2-4-6(5)9-8(7)11/h1-4H,(H,9,10,11)","JXDYKVIHCLTXOP-UHFFFAOYSA-N"
"[H]N(C=3)c(c2C(=S)N3)n(cn2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C10H13N4O7PS/c15-6-4(1-20-22(17,18)19)21-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)23/h2-4,6-7,10,15-16H,1H2,(H,11,12,23)(H2,17,18,19)/t4-,6-,7-,10-/m1/s1","ZKRFOXLVOKTUTA-KQYNXXCUSA-N"
"C[C@@H](C2)OC(=O)C=C[C@@H](O)[C@]([H])(C1)[C@]([H])(C=CCC2)C[C@H](O)1","InChI=1S/C16H24O4/c1-11-5-3-2-4-6-12-9-13(17)10-14(12)15(18)7-8-16(19)20-11/h4,6-8,11-15,17-18H,2-3,5,9-10H2,1H3/b6-4+,8-7+/t11-,12+,13-,14+,15+/m0/s1","KQNZDYYTLMIZCT-KQPMLPITSA-N"
"C(O7)[C@]([C@@H]57)(C([C@@H]4OC(c(c6)cccc6)=O)[C@]([C@H](C5)O)(C)C(=O)[C@@H](C(C(C)(C)3)=C(C)[C@H](C[C@](O)34)OC([C@H](O)[C@@H](NC(=O)c(c2)cccc2)c(c1)cccc1)=O)OC(C)=O)OC(C)=O","InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38?,40-,45+,46-,47+/m0/s1","RCINICONZNJXQF-VAZQATRQSA-N"
"CC(=O)O[C@@H]([C@@H](O)1)[C@@](C)(O3)[C@](O)(C(=O)C[C@](C)(C=C)3)[C@@](C)([C@@H](O)2)[C@]([H])(C(C)(C)CC2)1","InChI=1S/C22H34O7/c1-8-19(5)11-14(25)22(27)20(6)13(24)9-10-18(3,4)16(20)15(26)17(28-12(2)23)21(22,7)29-19/h8,13,15-17,24,26-27H,1,9-11H2,2-7H3/t13-,15-,16-,17-,19-,20-,21+,22-/m0/s1","OHCQJHSOBUTRHG-KGGHGJDLSA-N"
"[C@@H]([C@@H](C)c(c4=O)cc(c(c41)C(C([C@@]32C)C([C@@H](C)C[C@]([H])2O[C@H](CC3)[C@](C)(C)O)O1)O)=O)([C@@H](C)CC)OC(C)=O","InChI=1S/C30H44O8/c1-9-14(2)26(36-17(5)31)16(4)18-13-19(32)22-25(34)23-27(38-28(22)24(18)33)15(3)12-21-30(23,8)11-10-20(37-21)29(6,7)35/h13-16,20-21,23,25-27,34-35H,9-12H2,1-8H3/t14-,15-,16-,20+,21+,23?,25?,26+,27?,30-/m0/s1","MERDNJKHMKQNFC-PGCPQKQNSA-N"
"[C@@H]([C@@H](C)c(c4O)cc(c(c41)C(C([C@@]32C)C([C@@H](C)C[C@]([H])2O[C@H](CC3)[C@](C)(C)O)O1)=O)O)([C@@H](C)CC)OC(C)=O","InChI=1S/C30H44O8/c1-9-14(2)26(36-17(5)31)16(4)18-13-19(32)22-25(34)23-27(38-28(22)24(18)33)15(3)12-21-30(23,8)11-10-20(37-21)29(6,7)35/h13-16,20-21,23,26-27,32-33,35H,9-12H2,1-8H3/t14-,15-,16-,20+,21+,23?,26+,27?,30-/m0/s1","LNHBZLVBPXKQDO-ZCWCYIRTSA-N"
"CC(C)=CCc(c(O)1)c(=O)c(c2)c(ccc2)c(=O)1","InChI=1S/C15H14O3/c1-9(2)7-8-12-13(16)10-5-3-4-6-11(10)14(17)15(12)18/h3-7,18H,8H2,1-2H3","CIEYTVIYYGTCCI-UHFFFAOYSA-N"
"Oc(c4)c(O)cc(c4)C(O1)=C(O[C@H](O3)[C@H](O)[C@H](O)[C@@H](O)[C@H](C)3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3/t7-,15-,17+,18+,21-/m0/s1","OXGUCUVFOIWWQJ-HQBVPOQASA-N"
"c(c5)(O)cc(c(c52)C(C(O[C@H](O3)[C@@H]([C@H]([C@@H]([C@H]3CO[C@@H]([C@@H]4O)O[C@H]([C@@H]([C@H]4O)O)C)O)O)O)=C(O2)c(c1)ccc(O)c1O)=O)O","InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","IKGXIBQEEMLURG-NVPNHPEKSA-N"
"COc(c3)c(c(cc3)1)c(O)c([C@@H](C)2)c(C(=O)O2)c1","InChI=1S/C14H12O4/c1-7-11-9(14(16)18-7)6-8-4-3-5-10(17-2)12(8)13(11)15/h3-7,15H,1-2H3/t7-/m1/s1","KNLHGXVYZRQSJZ-SSDOTTSWSA-N"
"COc(c3)c(c(=O)1)c(cc3)c(=O)c(C2)c([C@@H](C)O[C@@H](C)2)1","InChI=1S/C16H16O4/c1-8-7-11-13(9(2)20-8)16(18)14-10(15(11)17)5-4-6-12(14)19-3/h4-6,8-9H,7H2,1-3H3/t8-,9+/m0/s1","IAJIIJBMBCZPSW-DTWKUNHWSA-N"
"COc(c3)c(c(=O)1)c(cc3)c(=O)c(C2)c([C@@H](C)OC(C)2)1","InChI=1S/C16H16O4/c1-8-7-11-13(9(2)20-8)16(18)14-10(15(11)17)5-4-6-12(14)19-3/h4-6,8-9H,7H2,1-3H3/t8?,9-/m1/s1","IAJIIJBMBCZPSW-YGPZHTELSA-N"
"OC(=O)C(N)CC(=O)c(c1)c(N)ccc1","InChI=1S/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/t8-/m0/s1","YGPSJZOEDVAXAB-QMMMGPOBSA-N"
"OC(=O)c(c1)nc(c2)c(ccc2)c(O)1","InChI=1S/C10H7NO3/c12-9-5-8(10(13)14)11-7-4-2-1-3-6(7)9/h1-5H,(H,11,12)(H,13,14)","HCZHHEIFKROPDY-UHFFFAOYSA-N"
"OC(=O)C(N)CC(=O)c(c1)c(N)c(O)cc1","InChI=1S/C10H12N2O4/c11-6(10(15)16)4-8(14)5-2-1-3-7(13)9(5)12/h1-3,6,13H,4,11-12H2,(H,15,16)","VCKPUUFAIGNJHC-UHFFFAOYSA-N"
"OC(=O)c(c1)nc(c(O)2)c(ccc2)c(O)1","InChI=1S/C10H7NO4/c12-7-3-1-2-5-8(13)4-6(10(14)15)11-9(5)7/h1-4,12H,(H,11,13)(H,14,15)","FBZONXHGGPHHIY-UHFFFAOYSA-N"
"OC(=O)c(c1)c(N)c(O)cc1","InChI=1S/C7H7NO3/c8-6-4(7(10)11)2-1-3-5(6)9/h1-3,9H,8H2,(H,10,11)","WJXSWCUQABXPFS-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1","OIRDTQYFTABQOQ-KQYNXXCUSA-N"
"O(C(C(C)C)4)C(C(N(C)C(=O)C(OC(C(N(C)C(=O)C(OC(C(N(C)C(=O)4)Cc(c3)cccc3)=O)C(C)C)Cc(c2)cccc2)=O)C(C)C)Cc(c1)cccc1)=O","InChI=1S/C45H57N3O9/c1-28(2)37-40(49)46(7)35(26-32-21-15-11-16-22-32)44(53)56-39(30(5)6)42(51)48(9)36(27-33-23-17-12-18-24-33)45(54)57-38(29(3)4)41(50)47(8)34(43(52)55-37)25-31-19-13-10-14-20-31/h10-24,28-30,34-39H,25-27H2,1-9H3","GYSCAQFHASJXRS-UHFFFAOYSA-N"
"OC[C@H]([C@@H](O)4)O[C@H]([C@H](O)[C@@H](O)4)c(c(O)3)c(O1)c(c(O)c3)C(=O)C=C(c(c2)cc(O)c(O)c2)1","InChI=1S/C21H20O11/c22-6-14-17(28)18(29)19(30)21(32-14)16-11(26)4-10(25)15-12(27)5-13(31-20(15)16)7-1-2-8(23)9(24)3-7/h1-5,14,17-19,21-26,28-30H,6H2/t14-,17-,18+,19-,21+/m1/s1","PLAPMLGJVGLZOV-VPRICQMDSA-N"
"OCC(C(O)4)OC(C(O)C(O)4)c(c(O)1)c(O)c(C(=O)3)c(OC(=C3)c(c2)cc(O)c(O)c2)c1","InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2/t14-,17-,19+,20-,21+/m1/s1","ODBRNZZJSYPIDI-VJXVFPJBSA-N"
"Oc(c([C@H](O5)[C@@H]([C@H]([C@@H]([C@H]5CO)O)O)O)1)c([C@H](O4)[C@@H]([C@@H](O)[C@@H](O)C4)O)c(c(C2=O)c1OC(c(c3)ccc(O)c3)=C2)O","InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)16-20(34)15(25-22(36)17(31)11(30)7-38-25)19(33)14-10(29)5-12(39-24(14)16)8-1-3-9(28)4-2-8/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2/t11-,13+,17-,18+,21-,22+,23+,25-,26-/m0/s1","OVMFOVNOXASTPA-VYUBKLCTSA-N"
"c(c5)(O)cc(c(c51)C(C(O[C@H](O3)[C@@H]([C@H]([C@@H]([C@H]3CO[C@@H]([C@@H]4O)O[C@H]([C@@H]([C@H]4O)O)C)O)O)O)=C(c(c2)ccc(O)c2)O1)=O)O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","RTATXGUCZHCSNG-QHWHWDPRSA-N"
"COc(c1)c(O)c(OC)cc1C(=C2)Oc(c3)c(c(O)cc(O)3)C(=O)2","InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)17(14)21)12-7-11(20)16-10(19)5-9(18)6-13(16)24-12/h3-7,18-19,21H,1-2H3","HRGUSFBJBOKSML-UHFFFAOYSA-N"
"OC[C@H]([C@@H](O)4)O[C@H]([C@H](O)[C@@H](O)4)c(c(O)1)c(O)c(C(=O)3)c(OC(=C3)c(c2)ccc(O)c2)c1","InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1","MYXNWGACZJSMBT-VJXVFPJBSA-N"
"Oc(c4)ccc(c4)C(O1)=C(OC(O3)C(O)C(O)C(O)C(C)3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3/t8-,15-,17+,18+,21-/m0/s1","SOSLMHZOJATCCP-AEIZVZFYSA-N"
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"[C@@]([H])([C@@]([H])49)(C1)[C@](CC[C@@]4([C@](C5=CC9)(CC[C@H](O[C@H](O7)[C@H](O[C@H](O8)[C@H](O)[C@H](O)[C@H]([C@@H]8C)O)[C@@H](O)[C@@H]([C@H]7CO)O[C@@H]([C@H](O)6)O[C@H]([C@H](O)[C@H]6O)C)C5)C)[H])([C@]([C@H](C)2)([H])[C@](O[C@@]2(C3)OC[C@@H](C3)C)([H])1)C","InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-42-39(60-41-36(52)34(50)32(48)22(4)56-41)37(53)38(29(17-46)58-42)59-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19-,20+,21+,22+,24+,25-,26+,27+,28+,29-,30+,31+,32+,33-,34-,35-,36-,37+,38-,39-,40+,41+,42-,43+,44+,45-/m1/s1","VNONINPVFQTJOC-ZGXDEBHDSA-N"
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"C(C(O)4)(C(OC(OC(C(OC(O6)C(O)C(C(C6C)O)O)5)C(CO)OC(O)C(NC(C)=O)5)C4NC(C)=O)CO)OC(O1)C(OC(O3)C(C(O)C(C3)O)O)C(O)C(C1COC(O2)C(C(C(C2CO)O)O)O)O","InChI=1S/C39H66N2O29/c1-9-19(48)24(53)29(58)38(62-9)69-32-18(41-11(3)46)34(59)63-15(6-44)31(32)68-35-17(40-10(2)45)23(52)30(14(5-43)65-35)67-39-33(70-37-27(56)20(49)12(47)7-60-37)26(55)22(51)16(66-39)8-61-36-28(57)25(54)21(50)13(4-42)64-36/h9,12-39,42-44,47-59H,4-8H2,1-3H3,(H,40,45)(H,41,46)/t9-,12+,13+,14+,15+,16+,17+,18+,19+,20-,21+,22+,23+,24+,25-,26-,27+,28-,29-,30+,31+,32+,33-,34+,35-,36-,37-,38-,39-/m0/s1","UNMLVGNWZDHBRA-PVSFMIOHSA-N"
"OC(C1O)C(OCC(O2)C(C(OC(O6)C(C(C(O)C(CO)6)O)O)C(OC(C(O)5)OCC(O)C5O)C2OC(C4CO)C(O)C(C(O4)OC(C3O)C(OC(C3NC(C)=O)O)CO)NC(C)=O)O)OC(C(O)1)CO","InChI=1S/C39H66N2O30/c1-9(46)40-17-23(53)30(14(5-44)63-34(17)60)68-35-18(41-10(2)47)24(54)31(15(6-45)66-35)69-39-33(71-37-27(57)19(49)11(48)7-61-37)32(70-38-29(59)26(56)21(51)13(4-43)65-38)22(52)16(67-39)8-62-36-28(58)25(55)20(50)12(3-42)64-36/h11-39,42-45,48-60H,3-8H2,1-2H3,(H,40,46)(H,41,47)/t11-,12-,13-,14-,15-,16-,17-,18-,19+,20-,21-,22-,23-,24-,25+,26+,27-,28+,29+,30-,31-,32+,33+,34-,35+,36+,37+,38-,39+/m1/s1","ZMOFNTJDOXHCRX-FUBKJYJRSA-N"
"OC(C7O)C(OCC7O)OC(C(OC(C6O)OC(CO)C(O)C6O)1)C(OC(C(CO)3)C(O)C(C(OC(C(OC(O5)C(O)C(C(C5C)O)O)4)C(OC(O)C4NC(C)=O)CO)O3)NC(C)=O)OC(COC(O2)C(O)C(O)C(O)C2CO)C1O","InChI=1S/C45H76N2O34/c1-10-21(55)27(61)32(66)43(71-10)79-36-20(47-12(3)53)39(68)72-17(7-51)35(36)78-40-19(46-11(2)52)26(60)34(16(6-50)75-40)77-45-38(81-42-30(64)22(56)13(54)8-69-42)37(80-44-33(67)29(63)24(58)15(5-49)74-44)25(59)18(76-45)9-70-41-31(65)28(62)23(57)14(4-48)73-41/h10,13-45,48-51,54-68H,4-9H2,1-3H3,(H,46,52)(H,47,53)/t10-,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23+,24+,25+,26+,27+,28-,29-,30+,31-,32-,33-,34+,35+,36+,37-,38-,39+,40-,41-,42-,43-,44+,45-/m0/s1","UDCWMKJVKMPGDB-KWQUQPGISA-N"
"OCC(C(OC(O5)C(C(OC(O8)C(OC(C(NC(C)=O)9)OC(CO)C(O)C9O)C(C(O)C8CO)O)C(C5COC(O6)C(OC(O7)C(NC(C)=O)C(C(C(CO)7)O)O)C(O)C(C(CO)6)O)O)OC(C(O)4)OCC(O)C4O)1)OC(OC(C(OC(C3O)OC(C)C(C(O)3)O)2)C(CO)OC(O)C(NC(C)=O)2)C(C1O)NC(C)=O","InChI=1S/C61H102N4O44/c1-14-31(77)41(87)45(91)58(95-14)105-48-30(65-18(5)75)53(92)96-25(11-71)47(48)104-56-29(64-17(4)74)40(86)46(24(10-70)101-56)103-61-52(109-57-44(90)32(78)19(76)12-93-57)49(106-60-51(43(89)36(82)23(9-69)100-60)108-55-28(63-16(3)73)39(85)34(80)21(7-67)98-55)37(83)26(102-61)13-94-59-50(42(88)35(81)22(8-68)99-59)107-54-27(62-15(2)72)38(84)33(79)20(6-66)97-54/h14,19-61,66-71,76-92H,6-13H2,1-5H3,(H,62,72)(H,63,73)(H,64,74)(H,65,75)/t14-,19+,20+,21+,22+,23+,24+,25+,26+,27+,28+,29+,30+,31+,32-,33+,34+,35+,36+,37+,38+,39+,40+,41+,42-,43-,44+,45-,46+,47+,48+,49-,50-,51-,52-,53+,54-,55-,56-,57-,58-,59-,60+,61-/m0/s1","AVKOSBZBWSUEOK-AUJHOTQJSA-N"
"OCC(O1)C(O)C(O)C(NC(C)=O)C1OC([H])(C=O)C([H])(CO)NC(C)=O","InChI=1S/C14H24N2O9/c1-6(20)15-8(3-17)9(4-18)24-14-11(16-7(2)21)13(23)12(22)10(5-19)25-14/h4,8-14,17,19,22-23H,3,5H2,1-2H3,(H,15,20)(H,16,21)/t8-,9-,10+,11+,12+,13+,14+/m0/s1","CUSVKSYUKVCGOL-UYHBOPCKSA-N"
"CC(=O)NC([H])(CO)C([H])(C=O)OC(O1)C(NC(C)=O)C(OC(O2)C(O)C(O)C(O)C(C)2)C(O)C(CO)1","InChI=1S/C20H34N2O13/c1-7-14(28)16(30)17(31)20(32-7)35-18-13(22-9(3)27)19(34-12(6-25)15(18)29)33-11(5-24)10(4-23)21-8(2)26/h5,7,10-20,23,25,28-31H,4,6H2,1-3H3,(H,21,26)(H,22,27)/t7-,10-,11-,12+,13+,14+,15+,16+,17-,18+,19+,20-/m0/s1","HJGQTBSNOJLBTK-HQXYHDJISA-N"
"CC(=O)NC(C(O)2)C(OC(CO)C(O)2)OC(C(CO)1)C(O)C(NC(C)=O)C(O1)OC([H])(C=O)C([H])(CO)NC(C)=O","InChI=1S/C22H37N3O14/c1-8(30)23-11(4-26)12(5-27)36-21-16(25-10(3)32)19(35)20(14(7-29)38-21)39-22-15(24-9(2)31)18(34)17(33)13(6-28)37-22/h5,11-22,26,28-29,33-35H,4,6-7H2,1-3H3,(H,23,30)(H,24,31)(H,25,32)/t11-,12-,13+,14+,15+,16+,17-,18+,19+,20+,21+,22-/m0/s1","TVGWIJGBIULYAO-RZDKZDEYSA-N"
"N(C(C(OC(C(O)2)C(OC(C3O)C(NC(C)=O)C(OC(C=O)(C(CO)(NC(C)=O)[H])[H])OC3CO)OC(C)C2O)1)C(O)C(O)C(CO)O1)C(C)=O","InChI=1S/C28H47N3O18/c1-9-19(39)23(43)25(49-26-17(30-11(3)37)22(42)20(40)15(7-34)46-26)28(44-9)48-24-18(31-12(4)38)27(47-16(8-35)21(24)41)45-14(6-33)13(5-32)29-10(2)36/h6,9,13-28,32,34-35,39-43H,5,7-8H2,1-4H3,(H,29,36)(H,30,37)(H,31,38)/t9-,13-,14-,15+,16+,17+,18+,19+,20-,21+,22+,23+,24+,25-,26+,27+,28-/m0/s1","YUNDIYNGCYJSTC-IFFAFSIISA-N"
"N(C(C(OC(C(OC(O3)C(O)C(O)C(O)C(C)3)2)C(OC(C(NC(C)=O)2)OC(C=O)(C(CO)(NC(C)=O)[H])[H])CO)1)C(O)C(O)C(CO)O1)C(C)=O","InChI=1S/C28H47N3O18/c1-9-19(39)22(42)23(43)28(44-9)49-25-18(31-12(4)38)27(45-14(6-33)13(5-32)29-10(2)36)47-16(8-35)24(25)48-26-17(30-11(3)37)21(41)20(40)15(7-34)46-26/h6,9,13-28,32,34-35,39-43H,5,7-8H2,1-4H3,(H,29,36)(H,30,37)(H,31,38)/t9-,13-,14-,15+,16+,17+,18+,19+,20-,21+,22+,23-,24+,25+,26-,27+,28-/m0/s1","MZEGXLYZBJHREF-LNVKAKPNSA-N"
"O(C(C4NC(C)=O)C(C(CO)OC4OC(C=O)(C(NC(C)=O)(CO)[H])[H])OC(O3)C(C(O)C(O)C(CO)3)NC(C)=O)C(O2)C(C(O)C(C2C)O)OC(O1)C(NC(C)=O)C(C(O)C1CO)O","InChI=1S/C36H60N4O23/c1-11-24(50)29(55)32(63-34-22(39-14(4)48)28(54)26(52)19(9-44)59-34)36(56-11)62-31-23(40-15(5)49)35(57-17(7-42)16(6-41)37-12(2)46)60-20(10-45)30(31)61-33-21(38-13(3)47)27(53)25(51)18(8-43)58-33/h7,11,16-36,41,43-45,50-55H,6,8-10H2,1-5H3,(H,37,46)(H,38,47)(H,39,48)(H,40,49)/t11-,16-,17-,18+,19+,20+,21+,22+,23+,24+,25-,26-,27+,28+,29+,30+,31+,32-,33-,34+,35+,36-/m0/s1","SVVDSOGSSNNTFJ-HGRKVVHBSA-N"
"O=CCOC(O1)C(NC(C)=O)C(OC(O2)C(O)C(O)C(O)C(C)2)C(O)C(CO)1","InChI=1S/C16H27NO11/c1-6-10(21)12(23)13(24)16(26-6)28-14-9(17-7(2)20)15(25-4-3-18)27-8(5-19)11(14)22/h3,6,8-16,19,21-24H,4-5H2,1-2H3,(H,17,20)/t6-,8+,9+,10+,11+,12+,13-,14+,15+,16-/m0/s1","ZMHFWGFDQOCSHY-GEHFNBAWSA-N"
"O=CCOC(O1)C(NC(C)=O)C(O)C(OC(O2)C(NC(C)=O)C(O)C(O)C(CO)2)C(CO)1","InChI=1S/C18H30N2O12/c1-7(24)19-11-14(27)13(26)9(5-22)30-18(11)32-16-10(6-23)31-17(29-4-3-21)12(15(16)28)20-8(2)25/h3,9-18,22-23,26-28H,4-6H2,1-2H3,(H,19,24)(H,20,25)/t9-,10-,11-,12-,13+,14-,15-,16-,17-,18+/m0/s1","HYNRGMFOPBCTJM-HPSMHGLRSA-N"
"O=CCOC(O1)C(NC(C)=O)C(OC(O2)C(OC(O3)C(NC(C)=O)C(O)C(O)C(CO)3)C(O)C(O)C(C)2)C(O)C(CO)1","InChI=1S/C24H40N2O16/c1-8-15(32)19(36)21(42-23-13(25-9(2)30)18(35)16(33)11(6-28)40-23)24(38-8)41-20-14(26-10(3)31)22(37-5-4-27)39-12(7-29)17(20)34/h4,8,11-24,28-29,32-36H,5-7H2,1-3H3,(H,25,30)(H,26,31)/t8-,11+,12+,13+,14+,15+,16-,17+,18+,19+,20+,21-,22+,23+,24-/m1/s1","HZGGLLIOCMSPGP-XYMGAXSGSA-N"
"O=CCOC(O1)C(NC(C)=O)C(OC(O3)C(O)C(O)C(O)C(C)3)C(OC(O2)C(NC(C)=O)C(O)C(O)C(CO)2)C(CO)1","InChI=1S/C24H40N2O16/c1-8-15(32)18(35)19(36)24(38-8)42-21-14(26-10(3)31)22(37-5-4-27)40-12(7-29)20(21)41-23-13(25-9(2)30)17(34)16(33)11(6-28)39-23/h4,8,11-24,28-29,32-36H,5-7H2,1-3H3,(H,25,30)(H,26,31)/t8-,11+,12+,13+,14+,15+,16-,17+,18+,19-,20+,21+,22+,23-,24-/m0/s1","HVUVLPLEPNJPQG-MKZPGMNCSA-N"
"CC(=O)NC(C1OC(C4O)C(OC(C4O)C)OC(C3NC(C)=O)C(C(CO)OC3OCC=O)OC(C(NC(C)=O)2)OC(CO)C(O)C(O)2)C(C(O)C(CO)O1)O","InChI=1S/C32H53N3O21/c1-10-20(43)25(48)28(56-31-18(34-12(3)41)24(47)22(45)15(8-38)52-31)32(50-10)55-27-19(35-13(4)42)29(49-6-5-36)53-16(9-39)26(27)54-30-17(33-11(2)40)23(46)21(44)14(7-37)51-30/h5,10,14-32,37-39,43-48H,6-9H2,1-4H3,(H,33,40)(H,34,41)(H,35,42)/t10-,14+,15+,16+,17+,18+,19+,20+,21-,22-,23+,24+,25+,26+,27+,28-,29+,30-,31+,32-/m0/s1","BYXUAMYDPJGJNM-GPVKSKMESA-N"
"","InChI=1S/C26H40O8/c1-14-11-25-9-5-16-23(2,7-4-8-24(16,3)22(31)32)17(25)6-10-26(14,13-25)34-21-20(30)19(29)18(28)15(12-27)33-21/h15-21,27-30H,1,4-13H2,2-3H3,(H,31,32)/t15-,16+,17+,18-,19+,20-,21+,23-,24-,25-,26+/m1/s1","QSIDJGUAAUSPMG-CULFPKEHSA-N"
"C(O)(C1OC(O6)C(O)C(C(O)C(CO)6)O)C(C(CO)OC1OC(C4)(C(=C)5)CCC(C43C5)([H])C(C(CC3)2[H])(C)CCCC2(C)C(O)=O)O","InChI=1S/C32H50O13/c1-15-11-31-9-5-18-29(2,7-4-8-30(18,3)28(40)41)19(31)6-10-32(15,14-31)45-27-25(23(38)21(36)17(13-34)43-27)44-26-24(39)22(37)20(35)16(12-33)42-26/h16-27,33-39H,1,4-14H2,2-3H3,(H,40,41)/t16-,17-,18+,19+,20-,21-,22+,23+,24-,25-,26+,27+,29-,30-,31-,32+/m1/s1","OMHUCGDTACNQEX-OSHKXICASA-N"
"C(C1O)(O)C(C(OC(OC(C6)(C2)C(=C)CC(C3)2C(C6)([H])C(C4)(C(C(C)(C(=O)OC(O5)C(C(C(C(CO)5)O)O)O)CC4)([H])C3)C)1)CO)O","InChI=1S/C32H50O13/c1-15-11-31-9-5-18-29(2,7-4-8-30(18,3)28(41)44-26-24(39)22(37)20(35)16(12-33)42-26)19(31)6-10-32(15,14-31)45-27-25(40)23(38)21(36)17(13-34)43-27/h16-27,33-40H,1,4-14H2,2-3H3/t16-,17-,18+,19+,20-,21-,22+,23+,24-,25-,26+,27+,29-,30-,31-,32+/m1/s1","YWPVROCHNBYFTP-OSHKXICASA-N"
"C(O)(=O)C(C)(C7)C([H])(C6(CC7)C)CCC(C1)(C([H])56)CC(C(CC5)(OC(O3)C(OC(O4)C(O)C(O)C(O)C(C)4)C(C(C3CO)O)OC(O2)C(O)C(C(O)C2CO)O)1)=C","InChI=1S/C38H60O17/c1-16-12-37-10-6-20-35(3,8-5-9-36(20,4)34(48)49)21(37)7-11-38(16,15-37)55-33-30(54-31-27(46)25(44)22(41)17(2)50-31)29(24(43)19(14-40)52-33)53-32-28(47)26(45)23(42)18(13-39)51-32/h17-33,39-47H,1,5-15H2,2-4H3,(H,48,49)/t17-,18+,19+,20-,21-,22-,23+,24+,25+,26-,27+,28+,29-,30+,31-,32-,33-,35+,36+,37+,38-/m0/s1","RAIDWZDHEYTVLQ-KKZJXQHPSA-N"
"","InChI=1S/C38H60O17/c1-16-12-37-10-6-20-35(3,8-5-9-36(20,4)34(49)54-32-29(48)26(45)23(42)18(13-39)51-32)21(37)7-11-38(16,15-37)55-33-30(27(46)24(43)19(14-40)52-33)53-31-28(47)25(44)22(41)17(2)50-31/h17-33,39-48H,1,5-15H2,2-4H3/t17-,18+,19+,20-,21-,22-,23+,24+,25+,26-,27-,28+,29+,30+,31-,32-,33-,35+,36+,37+,38-/m0/s1","CANAPGLEBDTCAF-NTIPNFSCSA-N"
"","InChI=1S/C38H60O18/c1-16-11-37-9-5-20-35(2,7-4-8-36(20,3)34(49)50)21(37)6-10-38(16,15-37)56-33-30(55-32-28(48)26(46)23(43)18(13-40)52-32)29(24(44)19(14-41)53-33)54-31-27(47)25(45)22(42)17(12-39)51-31/h17-33,39-48H,1,4-15H2,2-3H3,(H,49,50)/t17-,18-,19-,20+,21+,22-,23-,24-,25+,26+,27-,28-,29+,30-,31+,32+,33+,35-,36-,37-,38+/m1/s1","DRSKVOAJKLUMCL-MMUIXFKXSA-N"
"C(C5=C)(C4)(OC(O6)C(O)C(OC(O7)C(O)C(C(O)C7CO)O)C(O)C6CO)CCC(C(C5)41)(C(C)(C2)C(C(C(=O)OC(C3O)OC(CO)C(C3O)O)(CC2)C)([H])CC1)[H]","InChI=1S/C38H60O18/c1-16-11-37-9-5-20-35(2,7-4-8-36(20,3)34(50)55-32-28(48)26(46)23(43)18(13-40)52-32)21(37)6-10-38(16,15-37)56-33-29(49)30(24(44)19(14-41)53-33)54-31-27(47)25(45)22(42)17(12-39)51-31/h17-33,39-49H,1,4-15H2,2-3H3/t17-,18-,19-,20+,21+,22-,23-,24-,25+,26+,27-,28-,29-,30+,31+,32+,33+,35-,36-,37-,38+/m1/s1","OKPSCKUJXYCMPR-GXTBKCSKSA-N"
"C(C7)C(C)(C(C6)([H])C(C7)(C)C(C5)(C(C2)(C6)CC(C(C5)(OC(O4)C(C(C(O)C(CO)4)O)OC(O3)C(O)C(C(O)C(CO)3)O)2)=C)[H])C(=O)OC(C1O)OC(CO)C(C1O)O","InChI=1S/C38H60O18/c1-16-11-37-9-5-20-35(2,7-4-8-36(20,3)34(50)55-32-29(49)26(46)23(43)18(13-40)52-32)21(37)6-10-38(16,15-37)56-33-30(27(47)24(44)19(14-41)53-33)54-31-28(48)25(45)22(42)17(12-39)51-31/h17-33,39-49H,1,4-15H2,2-3H3/t17-,18-,19-,20+,21+,22-,23-,24-,25+,26+,27+,28-,29-,30-,31+,32+,33+,35-,36-,37-,38+/m1/s1","UEDUENGHJMELGK-HYDKPPNVSA-N"
"[H]C(C8)(C(C([H])(C4)C(C8)(C3)CC(C(OC(C5OC(O7)C(C(C(O)C7C)O)O)OC(CO)C(C(OC(C(O)6)OC(CO)C(O)C6O)5)O)(C4)3)=C)(C)2)C(CCC2)(C)C(=O)OC(C(O)1)OC(C(O)C(O)1)CO","InChI=1S/C44H70O22/c1-17-12-43-10-6-22-41(3,8-5-9-42(22,4)40(58)65-38-33(57)30(54)26(50)20(14-46)61-38)23(43)7-11-44(17,16-43)66-39-35(64-36-31(55)28(52)24(48)18(2)59-36)34(27(51)21(15-47)62-39)63-37-32(56)29(53)25(49)19(13-45)60-37/h18-39,45-57H,1,5-16H2,2-4H3/t18-,19+,20+,21+,22-,23-,24-,25+,26+,27+,28+,29-,30-,31+,32+,33+,34-,35+,36-,37-,38-,39-,41+,42+,43+,44-/m0/s1","QSRAJVGDWKFOGU-WBXIDTKBSA-N"
"C(C(O)7)(C(OC(O8)C(O)C(C(O)C8)O)C(OC7CO)OC(C2)(C(=C)6)CC(C6)(C5)C(C(C3)(C)C([H])(C5)C(C(OC(C4O)OC(C(O)C4O)CO)=O)(CC3)C)(C2)[H])OC(O1)C(C(O)C(O)C(CO)1)O","InChI=1S/C43H68O22/c1-17-11-42-9-5-22-40(2,7-4-8-41(22,3)39(57)64-37-32(56)29(53)26(50)20(13-45)60-37)23(42)6-10-43(17,16-42)65-38-34(63-35-30(54)24(48)18(47)15-58-35)33(27(51)21(14-46)61-38)62-36-31(55)28(52)25(49)19(12-44)59-36/h18-38,44-56H,1,4-16H2,2-3H3/t18-,19-,20-,21-,22+,23+,24+,25-,26-,27-,28+,29+,30-,31-,32-,33+,34-,35+,36+,37+,38+,40-,41-,42-,43+/m1/s1","HYLAUKAHEAUVFE-AVBZULRRSA-N"
"[H]C(C821)(C(C)(C6([H])CC8)CCCC(C)(C(=O)OC(C(O)7)OC(C(O)C(O)7)CO)6)CCC(OC(O4)C(OC(C(O)5)OC(C(O)C5O)CO)C(C(O)C4CO)OC(C(O)3)OC(CO)C(O)C(O)3)(C(=C)C2)C1","InChI=1S/C44H70O23/c1-17-11-43-9-5-22-41(2,7-4-8-42(22,3)40(59)66-38-33(58)30(55)26(51)20(14-47)62-38)23(43)6-10-44(17,16-43)67-39-35(65-37-32(57)29(54)25(50)19(13-46)61-37)34(27(52)21(15-48)63-39)64-36-31(56)28(53)24(49)18(12-45)60-36/h18-39,45-58H,1,4-16H2,2-3H3/t18-,19-,20-,21-,22+,23+,24-,25-,26-,27-,28+,29+,30+,31-,32-,33-,34+,35-,36+,37+,38+,39+,41-,42-,43-,44+/m1/s1","HELXLJCILKEWJH-NCGAPWICSA-N"
"C(O)C(C1O)OC(OC(C8O)C(OC(CO)C(O)8)OC(C2)(C3)C(CC2(C4)C(C(C5)(C(C(C(OC(C(OC(C7O)OC(C(C(O)7)O)CO)6)OC(CO)C(C6O)O)=O)(CC5)C)(C4)[H])C)([H])C3)=C)C(C1O)O","InChI=1S/C44H70O23/c1-17-11-43-9-5-22-41(2,7-4-8-42(22,3)40(59)66-38-34(30(55)26(51)20(14-47)62-38)64-36-32(57)28(53)24(49)18(12-45)60-36)23(43)6-10-44(17,16-43)67-39-35(31(56)27(52)21(15-48)63-39)65-37-33(58)29(54)25(50)19(13-46)61-37/h18-39,45-58H,1,4-16H2,2-3H3/t18-,19-,20-,21-,22+,23+,24-,25-,26-,27-,28+,29+,30+,31+,32-,33-,34-,35-,36+,37+,38+,39+,41-,42-,43-,44+/m1/s1","RLLCWNUIHGPAJY-SFUUMPFESA-N"
"C(C(OC(C9O)OC(C(C(O)9)O)CO)1)(C(OC(C(C8)(C)C(C(C)(CC8)2)([H])CCC(C7)(C3)C2([H])CCC3(C(=C)7)OC(O5)C(C(OC(C6O)OC(CO)C(C6O)O)C(O)C5CO)OC(O4)C(O)C(C(O)C(CO)4)O)=O)OC(C1O)CO)O","InChI=1S/C50H80O28/c1-18-11-49-9-5-24-47(2,7-4-8-48(24,3)46(68)77-44-37(67)38(29(59)22(15-54)72-44)74-41-34(64)31(61)26(56)19(12-51)69-41)25(49)6-10-50(18,17-49)78-45-40(76-43-36(66)33(63)28(58)21(14-53)71-43)39(30(60)23(16-55)73-45)75-42-35(65)32(62)27(57)20(13-52)70-42/h19-45,51-67H,1,4-17H2,2-3H3/t19-,20-,21-,22-,23-,24+,25+,26-,27-,28-,29-,30-,31+,32+,33+,34-,35-,36-,37-,38+,39+,40-,41+,42+,43+,44+,45+,47-,48-,49-,50+/m1/s1","BSVKOVOOJNJHBR-PBQKZBBNSA-N"
"","InChI=1S/C50H80O27/c1-18-12-49-10-6-24-47(3,8-5-9-48(24,4)46(67)76-43-36(65)33(62)29(58)22(15-53)71-43)25(49)7-11-50(18,17-49)77-45-40(39(30(59)23(16-54)72-45)74-42-35(64)32(61)28(57)21(14-52)70-42)75-44-37(66)38(26(55)19(2)68-44)73-41-34(63)31(60)27(56)20(13-51)69-41/h19-45,51-66H,1,5-17H2,2-4H3/t19-,20+,21+,22+,23+,24-,25-,26-,27+,28+,29+,30+,31-,32-,33-,34+,35+,36+,37+,38+,39-,40+,41-,42-,43-,44-,45-,47+,48+,49+,50-/m0/s1","UYOANCNCPRFKOY-PGTJKNIJSA-N"
"","InChI=1S/C50H80O28/c1-18-11-49-9-5-24-47(2,7-4-8-48(24,3)46(68)77-44-39(34(64)29(59)22(15-54)72-44)75-42-36(66)32(62)27(57)20(13-52)70-42)25(49)6-10-50(18,17-49)78-45-40(76-43-37(67)33(63)28(58)21(14-53)71-43)38(30(60)23(16-55)73-45)74-41-35(65)31(61)26(56)19(12-51)69-41/h19-45,51-67H,1,4-17H2,2-3H3/t19-,20-,21-,22-,23-,24+,25+,26-,27-,28-,29-,30-,31+,32+,33+,34+,35-,36-,37-,38+,39-,40-,41+,42+,43+,44+,45+,47-,48-,49-,50+/m1/s1","RPYRMTHVSUWHSV-CUZJHZIBSA-N"
"C(C%10CO)(C(C(C(O%10)OC(C(C)(C9)C(C(C)3CC9)(CCC(C4)(C5)C3(CCC4(OC(O7)C(OC(C8O)OC(CO)C(C(O)8)O)C(C(C7CO)O)OC(O6)C(O)C(C(C(CO)6)O)O)C5=C)[H])[H])=O)OC(O2)C(C(C(C2CO)O)O)O)OC(O1)C(C(O)C(O)C(CO)1)O)O","InChI=1S/C56H90O33/c1-19-11-55-9-5-26-53(2,7-4-8-54(26,3)52(77)88-50-44(86-48-40(75)36(71)30(65)22(14-59)80-48)42(32(67)24(16-61)82-50)84-46-38(73)34(69)28(63)20(12-57)78-46)27(55)6-10-56(19,18-55)89-51-45(87-49-41(76)37(72)31(66)23(15-60)81-49)43(33(68)25(17-62)83-51)85-47-39(74)35(70)29(64)21(13-58)79-47/h20-51,57-76H,1,4-18H2,2-3H3/t20-,21-,22-,23-,24-,25-,26+,27+,28-,29-,30-,31-,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44-,45-,46+,47+,48+,49+,50+,51+,53-,54-,55-,56+/m1/s1","GSGVXNMGMKBGQU-PHESRWQRSA-N"
"C(O)C(O1)C(O)C(C(C1OC(C2OC(C(O)%10)OC(C(O)C(O)%10)C)C(C(OC2OC(C(C9)(C(C8)([H])C(C)(CC9)C(C43C8)([H])CCC(OC(O6)C(C(OC(O7)C(O)C(C(C(CO)7)O)O)C(O)C6CO)OC(C5O)OC(CO)C(C(O)5)O)(C4)C(=C)C3)C)=O)CO)O)O)O","InChI=1S/C56H90O32/c1-19-12-55-10-6-26-53(3,8-5-9-54(26,4)52(76)87-50-44(85-46-38(72)34(68)28(62)20(2)77-46)42(32(66)24(16-60)81-50)83-47-39(73)35(69)29(63)21(13-57)78-47)27(55)7-11-56(19,18-55)88-51-45(86-49-41(75)37(71)31(65)23(15-59)80-49)43(33(67)25(17-61)82-51)84-48-40(74)36(70)30(64)22(14-58)79-48/h20-51,57-75H,1,5-18H2,2-4H3/t20-,21+,22+,23+,24+,25+,26-,27-,28-,29+,30+,31+,32+,33+,34+,35-,36-,37-,38+,39+,40+,41+,42-,43-,44+,45+,46-,47-,48-,49-,50-,51-,53+,54+,55+,56-/m0/s1","AKEKAGBWNXIWSS-ZFXKUSSPSA-N"
"O(C(C(OC(C%10O)OC(C(C%10OC(O%11)C(O)C(C(C%11CO)O)O)O)C)8)OC(C(C8OC(C9O)OC(C(C9O)O)CO)O)CO)C(C(C17[H])(C)CCCC(C)1C([H])(C6)C(C5)(CC7)CC(C6)(C(=C)5)OC(C(OC(O4)C(O)C(C(C(CO)4)O)O)2)OC(CO)C(O)C(OC(C(O)3)OC(C(O)C3O)CO)2)=O","InChI=1S/C62H100O37/c1-20-12-61-10-6-28-59(3,29(61)7-11-62(20,19-61)99-57-50(97-54-44(83)40(79)34(73)25(16-66)90-54)48(36(75)27(18-68)92-57)95-53-43(82)39(78)33(72)24(15-65)89-53)8-5-9-60(28,4)58(85)98-56-49(47(35(74)26(17-67)91-56)94-52-42(81)38(77)32(71)23(14-64)88-52)96-55-45(84)46(30(69)21(2)86-55)93-51-41(80)37(76)31(70)22(13-63)87-51/h21-57,63-84H,1,5-19H2,2-4H3/t21-,22+,23+,24+,25+,26+,27+,28-,29-,30-,31+,32+,33+,34+,35+,36+,37-,38-,39-,40-,41+,42+,43+,44+,45+,46+,47-,48-,49+,50+,51-,52-,53-,54-,55-,56-,57-,59+,60+,61+,62-/m0/s1","KTOQMKFUTRIEQB-GXSUQLSCSA-N"
"CNCC(O)=O","InChI=1S/C3H7NO2/c1-4-2-3(5)6/h4H,2H2,1H3,(H,5,6)","FSYKKLYZXJSNPZ-UHFFFAOYSA-N"
"CC(C)C[C@H](N)C(O)=O","InChI=1S/C6H13NO2/c1-4(2)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1","ROHFNLRQFUQHCH-YFKPBYRVSA-N"
"N#CC[C@H](N)C(O)=O","InChI=1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)/t3-/m0/s1","BXRLWGXPSRYJDZ-VKHMYHEASA-N"
"OC(=O)CC(C)CC(O)=O","InChI=1S/C6H10O4/c1-4(2-5(7)8)3-6(9)10/h4H,2-3H2,1H3,(H,7,8)(H,9,10)","XJMMNTGIMDZPMU-UHFFFAOYSA-N"
"OC(=O)C(N)c(c1)cccc1","InChI=1S/C8H9NO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,9H2,(H,10,11)","ZGUNAGUHMKGQNY-UHFFFAOYSA-N"
"CCSCCC(N)C(C)=O","InChI=1S/C7H15NOS/c1-3-10-5-4-7(8)6(2)9/h7H,3-5,8H2,1-2H3","GBZPGYSVSOUFMP-UHFFFAOYSA-N"
"OC(=O)C(O)C(O)C(O)=O","InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1","FEWJPZIEWOKRBE-JCYAYHJZSA-N"
"NC(=O)C[C@@H](N)C(O)=O","InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1","DCXYFEDJOCDNAF-REOHCLBHSA-N"
"CC(C)[C@H](N)C(O)=O","InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1","KZSNJWFQEVHDMF-BYPYZUCNSA-N"
"CC[C@H](C)[C@H](N)C(O)=O","InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1","AGPKZVBTJJNPAG-WHFBIAKZSA-N"
"OC(=O)C(C)c(c1)cccc1","InChI=1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)","YPGCWEMNNLXISK-UHFFFAOYSA-N"
"CC(=O)NC(C(C)C)C(O)=O","InChI=1S/C7H13NO3/c1-4(2)6(7(10)11)8-5(3)9/h4,6H,1-3H3,(H,8,9)(H,10,11)","IHYJTAOFMMMOPX-UHFFFAOYSA-N"
"NCCS(O)=O","InChI=1S/C2H7NO2S/c3-1-2-6(4)5/h1-3H2,(H,4,5)","VVIUBCNYACGLLV-UHFFFAOYSA-N"
"O=CNC(CCSC)C(O)=O","InChI=1S/C6H11NO3S/c1-11-3-2-5(6(9)10)7-4-8/h4-5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1","PYUSHNKNPOHWEZ-YFKPBYRVSA-N"
"CCC(=O)C(O)=O","InChI=1S/C4H6O3/c1-2-3(5)4(6)7/h2H2,1H3,(H,6,7)","TYEYBOSBBBHJIV-UHFFFAOYSA-N"
"CC(O)C(N)C(O)=O","InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m1/s1","AYFVYJQAPQTCCC-PWNYCUMCSA-N"
"CC(C)C[C@H](NC(C)=O)C(O)=O","InChI=1S/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t7-/m0/s1","WXNXCEHXYPACJF-ZETCQYMHSA-N"
"N[C@@H](CCSC)C(O)=O","InChI=1S/C5H11NO2S/c1-9-3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1","FFEARJCKVFRZRR-BYPYZUCNSA-N"
"OC(=O)Cc(c1)c(O)ccc1","InChI=1S/C8H8O3/c9-7-4-2-1-3-6(7)5-8(10)11/h1-4,9H,5H2,(H,10,11)","CCVYRRGZDBSHFU-UHFFFAOYSA-N"
"OC(=O)CC[C@H](N)C(O)=O","InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1","WHUUTDBJXJRKMK-VKHMYHEASA-N"
"SCCC(N)C(O)=O","InChI=1S/C4H9NO2S/c5-3(1-2-8)4(6)7/h3,8H,1-2,5H2,(H,6,7)","FFFHZYDWPBMWHY-UHFFFAOYSA-N"
"CC(C)C(=O)C(O)=O","InChI=1S/C5H8O3/c1-3(2)4(6)5(7)8/h3H,1-2H3,(H,7,8)","QHKABHOOEWYVLI-UHFFFAOYSA-N"
"CC(C)C(N)C(O)=O","InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)","KZSNJWFQEVHDMF-UHFFFAOYSA-N"
"CC(O)C(N)C(O)=O","InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1","AYFVYJQAPQTCCC-GBXIJSLDSA-N"
"NC(=O)C(C1)NCC1","InChI=1S/C5H10N2O/c6-5(8)4-2-1-3-7-4/h4,7H,1-3H2,(H2,6,8)/t4-/m0/s1","VLJNHYLEOZPXFW-BYPYZUCNSA-N"
"OC(=O)CC(N)C(O)=O","InChI=1S/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1","CKLJMWTZIZZHCS-REOHCLBHSA-N"
"OC(=O)CC(O)(C(C)C)C(O)=O","InChI=1S/C7H12O5/c1-4(2)7(12,6(10)11)3-5(8)9/h4,12H,3H2,1-2H3,(H,8,9)(H,10,11)","BITYXLXUCSKTJS-UHFFFAOYSA-N"
"OC(=O)Cc(c1)cc(O)cc1","InChI=1S/C8H8O3/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)","FVMDYYGIDFPZAX-UHFFFAOYSA-N"
"OC[C@H](N)C(O)=O","InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1","MTCFGRXMJLQNBG-REOHCLBHSA-N"
"OCCC(N)C(O)=O","InChI=1S/C4H9NO3/c5-3(1-2-6)4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m1/s1","UKAUYVFTDYCKQA-GSVOUGTGSA-N"
"O[C@@H](C1)C[C@H](N1)C(O)=O","InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1","PMMYEEVYMWASQN-DMTCNVIQSA-N"
"OC(=O)c(c1)cnc(O)c1","InChI=1S/C6H5NO3/c8-5-2-1-4(3-7-5)6(9)10/h1-3H,(H,7,8)(H,9,10)","BLHCMGRVFXRYRN-UHFFFAOYSA-N"
"CCCC[C@H](N)C(O)=O","InChI=1S/C6H13NO2/c1-2-3-4-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1","LRQKBLKVPFOOQJ-YFKPBYRVSA-N"
"CC(=O)NC(C)C(O)=O","InChI=1S/C5H9NO3/c1-3(5(8)9)6-4(2)7/h3H,1-2H3,(H,6,7)(H,8,9)","KTHDTJVBEPMMGL-UHFFFAOYSA-N"
"NCCC(O)=O","InChI=1S/C3H7NO2/c4-2-1-3(5)6/h1-2,4H2,(H,5,6)","UCMIRNVEIXFBKS-UHFFFAOYSA-N"
"OC(=O)C(=O)C[C@@](C=1)(C=C[C@@H](O)C1)C(O)=O","InChI=1S/C10H10O6/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14/h1-4,6,11H,5H2,(H,13,14)(H,15,16)/t6-,10+","FPWMCUPFBRFMLH-XGAOUMNUSA-N"
"OC(=O)C(N)Cc(c1)cccc1","InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1","COLNVLDHVKWLRT-QMMMGPOBSA-N"
"OCCN(CCO)CC(O)=O","InChI=1S/C6H13NO4/c8-3-1-7(2-4-9)5-6(10)11/h8-9H,1-5H2,(H,10,11)","FSVCELGFZIQNCK-UHFFFAOYSA-N"
"CCC(C)C(=O)C(O)=O","InChI=1S/C6H10O3/c1-3-4(2)5(7)6(8)9/h4H,3H2,1-2H3,(H,8,9)","JVQYSWDUAOAHFM-UHFFFAOYSA-N"
"OCC(=O)C(O)=O","InChI=1S/C3H4O4/c4-1-2(5)3(6)7/h4H,1H2,(H,6,7)","HHDDCCUIIUWNGJ-UHFFFAOYSA-N"
"[H]N(C=O)CC(O)=O","InChI=1S/C3H5NO3/c5-2-4-1-3(6)7/h2H,1H2,(H,4,5)(H,6,7)","UGJBHEZMOKVTIM-UHFFFAOYSA-N"
"NC(=O)C=CC(O)=O","InChI=1S/C4H5NO3/c5-3(6)1-2-4(7)8/h1-2H,(H2,5,6)(H,7,8)/b2-1-","FSQQTNAZHBEJLS-UPHRSURJSA-N"
"NC(CC(O)=O)CC(O)=O","InChI=1S/C5H9NO4/c6-3(1-4(7)8)2-5(9)10/h3H,1-2,6H2,(H,7,8)(H,9,10)","BBJIPMIXTXKYLZ-UHFFFAOYSA-N"
"OC(=O)C(C1)NCC1","InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1","ONIBWKKTOPOVIA-BYPYZUCNSA-N"
"OC(=O)[C@H](O)c(c1)cccc1","InChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)/t7-/m1/s1","IWYDHOAUDWTVEP-SSDOTTSWSA-N"
"O=C(C1)NC(C1)C(O)=O","InChI=1S/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)","ODHCTXKNWHHXJC-UHFFFAOYSA-N"
"OC(=O)C(O)Cc(c1)cccc1","InChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)/t8-/m1/s1","VOXXWSYKYCBWHO-MRVPVSSYSA-N"
"N[C@H](C(O)=O)CS(O)=O","InChI=1S/C3H7NO4S/c4-2(3(5)6)1-9(7)8/h2H,1,4H2,(H,5,6)(H,7,8)/t2-/m0/s1","ADVPTQAUNPRNPO-REOHCLBHSA-N"
"OC(=O)CCC[C@H](N)C(O)=O","InChI=1S/C6H11NO4/c7-4(6(10)11)2-1-3-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11)/t4-/m0/s1","OYIFNHCXNCRBQI-BYPYZUCNSA-N"
"COc(c1)c(O)ccc(CC(O)=O)1","InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12)","QRMZSPFSDQBLIX-UHFFFAOYSA-N"
"NCCC[C@H](N)C(O)=O","InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1","AHLPHDHHMVZTML-BYPYZUCNSA-N"
"NC(=O)CCC(NC(C)=O)C(O)=O","InChI=1S/C7H12N2O4/c1-4(10)9-5(7(12)13)2-3-6(8)11/h5H,2-3H2,1H3,(H2,8,11)(H,9,10)(H,12,13)/t5-/m0/s1","KSMRODHGGIIXDV-YFKPBYRVSA-N"
"OC(=O)CCC(=O)OCC[C@H](N)C(O)=O","InChI=1S/C8H13NO6/c9-5(8(13)14)3-4-15-7(12)2-1-6(10)11/h5H,1-4,9H2,(H,10,11)(H,13,14)/t5-/m0/s1","GNISQJGXJIDKDJ-YFKPBYRVSA-N"
"C1=CC2=C(C=C1O)C(=CN2)CC(=O)O","InChI=1S/C10H9NO3/c12-7-1-2-9-8(4-7)6(5-11-9)3-10(13)14/h1-2,4-5,11-12H,3H2,(H,13,14)","DUUGKQCEGZLZNO-UHFFFAOYSA-N"
"CC(O1)C(O)C(O)C(O)C(O)1","InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6-/m1/s1","SHZGCJCMOBCMKK-FPRJBGLDSA-N"
"OC(=O)C(C1)=C[C@@H](O)[C@@H](O)[C@H](O)1","InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s1","JXOHGGNKMLTUBP-HSUXUTPPSA-N"
"NCCCCC(NC(C)=O)C(O)=O","InChI=1S/C8H16N2O3/c1-6(11)10-7(8(12)13)4-2-3-5-9/h7H,2-5,9H2,1H3,(H,10,11)(H,12,13)/t7-/m0/s1","VEYYWZRYIYDQJM-ZETCQYMHSA-N"
"OC(=O)C(=O)Cc(c1)ccc(O)c1","InChI=1S/C9H8O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,10H,5H2,(H,12,13)","KKADPXVIOXHVKN-UHFFFAOYSA-N"
"NC(=O)CC[C@@H](N)C(O)=O","InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m1/s1","ZDXPYRJPNDTMRX-GSVOUGTGSA-N"
"OC(=O)CCCCC(N)C(O)=O","InChI=1S/C7H13NO4/c8-5(7(11)12)3-1-2-4-6(9)10/h5H,1-4,8H2,(H,9,10)(H,11,12)","JUQLUIFNNFIIKC-UHFFFAOYSA-N"
"CC(N)C(=O)NC(C)C(O)=O","InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-,4-/m0/s1","DEFJQIDDEAULHB-IMJSIDKUSA-N"
"OC(=O)[C@H](N)CCC[C@H](N)C(O)=O","InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5+","GMKMEZVLHJARHF-SYDPRGILSA-N"
"OC(=O)C(N)CSCC(N)C(O)=O","InChI=1S/C6H12N2O4S/c7-3(5(9)10)1-13-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m0/s1","DWPCPZJAHOETAG-IMJSIDKUSA-N"
"N[C@@H](CS)C(O)=O","InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1","XUJNEKJLAYXESH-REOHCLBHSA-N"
"NCCc(n1)cn(C)c1","InChI=1S/C6H11N3/c1-9-4-6(2-3-7)8-5-9/h4-5H,2-3,7H2,1H3","FHQDWPCFSJMNCT-UHFFFAOYSA-N"
"OC(=O)Cc(c1)c(O)ccc(O)1","InChI=1S/C8H8O4/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)","IGMNYECMUMZDDF-UHFFFAOYSA-N"
"OC(=O)[C@@H](N)CCSC[C@H](N)C(O)=O","InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)","ILRYLPWNYFXEMH-UHFFFAOYSA-N"
"OC(=O)C(N)Cc(n1)cn(C)c1","InChI=1S/C7H11N3O2/c1-10-3-5(9-4-10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)","BRMWTNUJHUMWMS-UHFFFAOYSA-N"
"NC(CCS(C)(=O)=O)C(O)=O","InChI=1S/C5H11NO4S/c1-11(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1","UCUNFLYVYCGDHP-BYPYZUCNSA-N"
"OC(=O)[C@@](O)(C1)CC(=O)[C@@H](O)[C@H](O)1","InChI=1S/C7H10O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3,5,8,10,13H,1-2H2,(H,11,12)/t3-,5+,7-/m1/s1","WVMWZWGZRAXUBK-SYTVJDICSA-N"
"NC(=O)NC(CC(O)=O)C(O)=O","InChI=1S/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/t2-/m0/s1","HLKXYZVTANABHZ-REOHCLBHSA-N"
"Oc(c1)ccc(c1)[C@H](O)C(O)=O","InChI=1S/C8H8O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/t7-/m0/s1","YHXHKYRQLYQUIH-ZETCQYMHSA-N"
"NCCCCCN","InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2","VHRGRCVQAFMJIZ-UHFFFAOYSA-N"
"NCCSSCCN","InChI=1S/C4H12N2S2/c5-1-3-7-8-4-2-6/h1-6H2","APQPRKLAWCIJEK-UHFFFAOYSA-N"
"NCCCC[C@H](N)C(O)=O","InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1","KDXKERNSBIXSRK-YFKPBYRVSA-N"
"NCCC[C@H](NC(C)=O)C(O)=O","InChI=1S/C7H14N2O3/c1-5(10)9-6(7(11)12)3-2-4-8/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1","JRLGPAXAGHMNOL-LURJTMIESA-N"
"CC[C@H](O)C(O)=O","InChI=1S/C4H8O3/c1-2-3(5)4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m0/s1","AFENDNXGAFYKQO-VKHMYHEASA-N"
"OC(=O)CC(C)C(O)=O","InChI=1S/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)","WXUAQHNMJWJLTG-UHFFFAOYSA-N"
"Oc(c1)c(O)c(O)cc1","InChI=1S/C6H6O3/c7-4-2-1-3-5(8)6(4)9/h1-3,7-9H","WQGWDDDVZFFDIG-UHFFFAOYSA-N"
"OP(O)(O)=O","InChI=1S/H3O4P/c1-5(2,3)4/h(H3,1,2,3,4)","NBIIXXVUZAFLBC-UHFFFAOYSA-N"
"OCCc(c1)ccc(O)c1","InChI=1S/C8H10O2/c9-6-5-7-1-3-8(10)4-2-7/h1-4,9-10H,5-6H2","YCCILVSKPBXVIP-UHFFFAOYSA-N"
"CC(O)CC(O)=O","InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1","WHBMMWSBFZVSSR-GSVOUGTGSA-N"
"OC(=O)Cc(c1)cncc1","InChI=1S/C7H7NO2/c9-7(10)4-6-2-1-3-8-5-6/h1-3,5H,4H2,(H,9,10)","WGNUNYPERJMVRM-UHFFFAOYSA-N"
"NC(C1)C(=O)OC1","InChI=1S/C4H7NO2/c5-3-1-2-7-4(3)6/h3H,1-2,5H2","QJPWUUJVYOJNMH-UHFFFAOYSA-N"
"OC(=O)CC(C)(O)CC(O)=O","InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)","NPOAOTPXWNWTSH-UHFFFAOYSA-N"
"C[C@@](CC(=O)O)(C(=O)O)O","InChI=1S/C5H8O5/c1-5(10,4(8)9)2-3(6)7/h10H,2H2,1H3,(H,6,7)(H,8,9)/t5-/m1/s1","XFTRTWQBIOMVPK-RXMQYKEDSA-N"
"OCC(O)C=O","InChI=1S/C3H6O3/c4-1-3(6)2-5/h1,3,5-6H,2H2","MNQZXJOMYWMBOU-UHFFFAOYSA-N"
"OCC(=O)CO","InChI=1S/C3H6O3/c4-1-3(6)2-5/h4-5H,1-2H2","RXKJFZQQPQGTFL-UHFFFAOYSA-N"
"O[C@H](C1)[C@H](O)[C@H](O)C(O)O1","InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4+,5?/m1/s1","SRBFZHDQGSBBOR-AGQMPKSLSA-N"
"OC(=O)CC(O)C(O)=O","InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)","BJEPYKJPYRNKOW-UHFFFAOYSA-N"
"C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](O1)O2)O)O)O","InChI=1S/C6H10O5/c7-3-2-1-10-6(11-2)5(9)4(3)8/h2-9H,1H2/t2-,3-,4+,5-,6-/m1/s1","TWNIBLMWSKIRAT-VFUOTHLCSA-N"
"C([C@H]([C@@H](CO)O)O)O","InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2/t3-,4-/m1/s1","UNXHWFMMPAWVPI-QWWZWVQMSA-N"
"O[C@H](C1)[C@H](O)[C@@H](O)[C@@H](O)O1","InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4-,5+/m1/s1","SRBFZHDQGSBBOR-LECHCGJUSA-N"
"OC[C@H](O)[C@@H](O)[C@H](O)CO","InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5+","HEBKCHPVOIAQTA-SCDXWVJYSA-N"
"C([C@H](C([C@@H](CO)O)O)O)O","InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4-/m1/s1","HEBKCHPVOIAQTA-QWWZWVQMSA-N"
"C([C@H]([C@H](CO)O)O)O","InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2/t3-,4+","UNXHWFMMPAWVPI-ZXZARUISSA-N"
"OC[C@@H](O)C(O)=O","InChI=1S/C3H6O4/c4-1-2(5)3(6)7/h2,4-5H,1H2,(H,6,7)/t2-/m1/s1","RBNPOMFGQQGHHO-UWTATZPHSA-N"
"OCC(O)(O1)[C@@H](O)[C@H](O)C1","InChI=1S/C5H10O5/c6-2-5(9)4(8)3(7)1-10-5/h3-4,6-9H,1-2H2/t3-,4+,5?/m1/s1","LQXVFWRQNMEDEE-OVEKKEMJSA-N"
"C([C@@H]([C@@H]([C@H](C=O)O)O)O)O","InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h1,3-5,7-10H,2H2/t3-,4-,5+/m0/s1","PYMYPHUHKUWMLA-VAYJURFESA-N"
"OCC(O)(O1)[C@H](O)[C@H](O)C1","InChI=1S/C5H10O5/c6-2-5(9)4(8)3(7)1-10-5/h3-4,6-9H,1-2H2/t3-,4-,5?/m1/s1","LQXVFWRQNMEDEE-ZZKAVYKESA-N"
"C[C@H](O)C(O)=O","InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m0/s1","JVTAAEKCZFNVCJ-REOHCLBHSA-N"
"C1(=C(N=C(C(=N1)Cl)N)N)C(=O)N=C(N)N","InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)","XSDQTOBWRPYKKA-UHFFFAOYSA-N"
"CC(CCC1=CC=CC=C1)NC(C)C(C2=CC=C(C=C2)O)O","InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3","PTGXAUBQBSGPKF-UHFFFAOYSA-N"
"CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3","InChI=1S/C18H22N2/c1-19-12-14-20(15-13-19)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3","UVKZSORBKUEBAZ-UHFFFAOYSA-N"
"CNCCCN1C2=CC=CC=C2CCC3=CC=CC=C31","InChI=1S/C18H22N2/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20/h2-5,7-10,19H,6,11-14H2,1H3","HCYAFALTSJYZDH-UHFFFAOYSA-N"
"CN(C)CCC=C1C2=CC=CC=C2CSC3=CC=CC=C31","InChI=1S/C19H21NS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3","PHTUQLWOUWZIMZ-UHFFFAOYSA-N"
"CC(CN1CCN(CC1)CCOCCO)CN2C3=CC=CC=C3SC4=CC=CC=C42","InChI=1S/C24H33N3O2S/c1-20(18-26-12-10-25(11-13-26)14-16-29-17-15-28)19-27-21-6-2-4-8-23(21)30-24-9-5-3-7-22(24)27/h2-9,20,28H,10-19H2,1H3","MSYUMPGNGDNTIQ-UHFFFAOYSA-N"
"CCC(CO)NCCNC(CC)CO","InChI=1S/C10H24N2O2/c1-3-9(7-13)11-5-6-12-10(4-2)8-14/h9-14H,3-8H2,1-2H3","AEUTYOVWOVBAKS-UHFFFAOYSA-N"
"CCNCC(C1=CC(=CC=C1)O)O","InChI=1S/C10H15NO2/c1-2-11-7-10(13)8-4-3-5-9(12)6-8/h3-6,10-13H,2,7H2,1H3","SQVIAVUSQAWMKL-UHFFFAOYSA-N"
"CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCO","InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3","NWPRCRWQMGIBOT-UHFFFAOYSA-N"
"CC1(CCCO1)CN(C)S(=O)(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N","InChI=1S/C13H19ClN2O5S2/c1-13(6-3-7-21-13)9-16(2)23(19,20)10-4-5-11(14)12(8-10)22(15,17)18/h4-5,8H,3,6-7,9H2,1-2H3,(H2,15,17,18)","SMNOERSLNYGGOU-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl","InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)","TTWJBBZEZQICBI-UHFFFAOYSA-N"
"CC1=CC(=O)N(N1C)C2=CC=CC=C2","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3","VEQOALNAAJBPNY-UHFFFAOYSA-N"
"CC(C)(CC1=CC=CC=C1)N","InChI=1S/C10H15N/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7H,8,11H2,1-2H3","DHHVAGZRUROJKS-UHFFFAOYSA-N"
"CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)N","InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)","JLKIGFTWXXRPMT-UHFFFAOYSA-N"
"CC1=C(OC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N)C","InChI=1S/C11H13N3O3S/c1-7-8(2)17-11(13-7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6H,12H2,1-2H3,(H,13,14)","CYFLXLSBHQBMFT-UHFFFAOYSA-N"
"C1CCS(=O)(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N","InChI=1S/C10H14N2O4S2/c11-18(15,16)10-5-3-9(4-6-10)12-7-1-2-8-17(12,13)14/h3-6H,1-2,7-8H2,(H2,11,15,16)","HMHVCUVYZFYAJI-UHFFFAOYSA-N"
"CC1(C2CC3C(C(=O)C(=C(N)O)C(=O)C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)N(C)C)O","InChI=1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3","JYHCQVWYCGHXGP-UHFFFAOYSA-N"
"NC(=N)NC(=O)C1=NC(Cl)=C(N)N=C1N","InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)","XSDQTOBWRPYKKA-UHFFFAOYSA-N"
"CN1CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1","InChI=1S/C18H22N2/c1-19-12-14-20(15-13-19)18(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,18H,12-15H2,1H3","UVKZSORBKUEBAZ-UHFFFAOYSA-N"
"CNCCCN1C2=C(CCC3=C1C=CC=C3)C=CC=C2","InChI=1S/C18H22N2/c1-19-13-6-14-20-17-9-4-2-7-15(17)11-12-16-8-3-5-10-18(16)20/h2-5,7-10,19H,6,11-14H2,1H3","HCYAFALTSJYZDH-UHFFFAOYSA-N"
"CCCCOC1=CC(C(=O)NCCN(CC)CC)=C2C=CC=CC2=N1","InChI=1S/C20H29N3O2/c1-4-7-14-25-19-15-17(16-10-8-9-11-18(16)22-19)20(24)21-12-13-23(5-2)6-3/h8-11,15H,4-7,12-14H2,1-3H3,(H,21,24)","PUFQVTATUTYEAL-UHFFFAOYSA-N"
"CC(CN1CCN(CCOCCO)CC1)CN1C2=CC=CC=C2SC2=CC=CC=C12","InChI=1S/C24H33N3O2S/c1-20(18-26-12-10-25(11-13-26)14-16-29-17-15-28)19-27-21-6-2-4-8-23(21)30-24-9-5-3-7-22(24)27/h2-9,20,28H,10-19H2,1H3","MSYUMPGNGDNTIQ-UHFFFAOYSA-N"
"CN(C)CCC=C1C2=CC=CC=C2CSC2=C1C=CC=C2","InChI=1S/C19H21NS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3","PHTUQLWOUWZIMZ-UHFFFAOYSA-N"
"CC[C@@H](CO)NCCN[C@@H](CC)CO","InChI=1S/C10H24N2O2/c1-3-9(7-13)11-5-6-12-10(4-2)8-14/h9-14H,3-8H2,1-2H3/t9-,10-/m0/s1","AEUTYOVWOVBAKS-UWVGGRQHSA-N"
"CN1C2=C(N(CCO)C=N2)C(=O)N(C)C1=O","InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3","NWPRCRWQMGIBOT-UHFFFAOYSA-N"
"CN(CC1(C)CCCO1)S(=O)(=O)C1=CC=C(Cl)C(=C1)S(N)(=O)=O","InChI=1S/C13H19ClN2O5S2/c1-13(6-3-7-21-13)9-16(2)23(19,20)10-4-5-11(14)12(8-10)22(15,17)18/h4-5,8H,3,6-7,9H2,1-2H3,(H2,15,17,18)","SMNOERSLNYGGOU-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)C1=CC(Cl)=C(N)C=C1OC","InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)","TTWJBBZEZQICBI-UHFFFAOYSA-N"
"CC(CCC1=CC=CC=C1)NC(C)C(O)C1=CC=C(O)C=C1","InChI=1S/C19H25NO2/c1-14(8-9-16-6-4-3-5-7-16)20-15(2)19(22)17-10-12-18(21)13-11-17/h3-7,10-15,19-22H,8-9H2,1-2H3","PTGXAUBQBSGPKF-UHFFFAOYSA-N"
"CC(C)(N)CC1=CC=CC=C1","InChI=1S/C10H15N/c1-10(2,11)8-9-6-4-3-5-7-9/h3-7H,8,11H2,1-2H3","DHHVAGZRUROJKS-UHFFFAOYSA-N"
"CC1=C(C)N=C(NS(=O)(=O)C2=CC=C(N)C=C2)O1","InChI=1S/C11H13N3O3S/c1-7-8(2)17-11(13-7)14-18(15,16)10-5-3-9(12)4-6-10/h3-6H,12H2,1-2H3,(H,13,14)","CYFLXLSBHQBMFT-UHFFFAOYSA-N"
"C1(=NC(=NC(=N1)Cl)N)N","InChI=1S/C3H4ClN5/c4-1-7-2(5)9-3(6)8-1/h(H4,5,6,7,8,9)","FVFVNNKYKYZTJU-UHFFFAOYSA-N"
"CCNC1=NC(=NC(=N1)N)Cl","InChI=1S/C5H8ClN5/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H3,7,8,9,10,11)","IVENSCMCQBJAKW-UHFFFAOYSA-N"
"CC(C)NC1=NC(=NC(=N1)N)Cl","InChI=1S/C6H10ClN5/c1-3(2)9-6-11-4(7)10-5(8)12-6/h3H,1-2H3,(H3,8,9,10,11,12)","DFWFIQKMSFGDCQ-UHFFFAOYSA-N"
"OC2=NC=NC(=C2)OC3=CC=CC=C3C#N","InChI=1S/C11H7N3O2/c12-6-8-3-1-2-4-9(8)16-11-5-10(15)13-7-14-11/h1-5,7H,(H,13,14,15)","AEPJWPTWMHUKLG-UHFFFAOYSA-N"
"CC1=CC=C(C2C1O2)N(C(N(C)C)=O)[H]","InChI=1S/C10H14N2O2/c1-6-4-5-7(9-8(6)14-9)11-10(13)12(2)3/h4-5,8-9H,1-3H3,(H,11,13)","MPSFACCMZJXGAU-UHFFFAOYSA-N"
"CC1=CC(=C(C=C1)N)Cl","InChI=1S/C7H8ClN/c1-5-2-3-7(9)6(8)4-5/h2-4H,9H2,1H3","XGYLSRFSXKAYCR-UHFFFAOYSA-N"
"OC(=O)C1=CC=CN=C1OC1=CC(=CC=C1)C(F)(F)F","InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-10(12(18)19)5-2-6-17-11/h1-7H,(H,18,19)","OBRGOFGSXWAVNZ-UHFFFAOYSA-N"
"CC1=CSC(=C1NC(=O)CCl)C","InChI=1S/C8H10ClNOS/c1-5-4-12-6(2)8(5)10-7(11)3-9/h4H,3H2,1-2H3,(H,10,11)","XBLYPENZTYSJMR-UHFFFAOYSA-N"
"","InChI=1S/C17H27NO/c1-13(11-18-12-14(2)19)10-15-6-8-16(9-7-15)17(3,4)5/h6-9,14,18-19H,1,10-12H2,2-5H3","OEQAPPBOOZWSAV-UHFFFAOYSA-N"
"CC1CN(CC(O1)C)CC(C)CC2=CC=C(C=C2)C(C)(C)C(=O)O","InChI=1S/C20H31NO3/c1-14(11-21-12-15(2)24-16(3)13-21)10-17-6-8-18(9-7-17)20(4,5)19(22)23/h6-9,14-16H,10-13H2,1-5H3,(H,22,23)","OZMMLYFAEKBWEE-UHFFFAOYSA-N"
"C1CN(C(=O)N1)CC2=CN=C(C=C2)Cl","InChI=1S/C9H10ClN3O/c10-8-2-1-7(5-12-8)6-13-4-3-11-9(13)14/h1-2,5H,3-4,6H2,(H,11,14)","ADWTYURAFSWNSU-UHFFFAOYSA-N"
"C1CN(C(=N1)NN=O)CC2=CN=C(C=C2)Cl","InChI=1S/C9H10ClN5O/c10-8-2-1-7(5-12-8)6-15-4-3-11-9(15)13-14-16/h1-2,5H,3-4,6H2,(H,11,13,16)","BGJQJWBDOOIKPP-UHFFFAOYSA-N"
"C1=CC(=NC=C1CN2C=CN=C2N[N+](=O)[O-])Cl","InChI=1S/C9H8ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-5H,6H2,(H,11,13)","TYLCDJYHUVCRBH-UHFFFAOYSA-N"
"CC(C)C1=CC=C(C=C1)NC(=O)N(C)","InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)","DOULWWSSZVEPIN-UHFFFAOYSA-N"
"C=C(C)C1=CC=C(C=C1)NC(=O)N(C)C","InChI=1S/C12H16N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-8H,1H2,2-4H3,(H,13,15)","LCZPPCKAMWQGTF-UHFFFAOYSA-N"
"CC1=NN=C(C(=O)N1)C2=CC=CC=C2","InChI=1S/C10H9N3O/c1-7-11-10(14)9(13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,12,14)","OUSYWCQYMPDAEO-UHFFFAOYSA-N"
"CC1=NN=C(N1)C2=CC=CC=C2","InChI=1S/C9H9N3/c1-7-10-9(12-11-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,10,11,12)","UJCLXNPHJKRLPX-UHFFFAOYSA-N"
"CC1=C(C(=CC=C1)C)NC(=O)CCl","InChI=1S/C10H12ClNO/c1-7-4-3-5-8(2)10(7)12-9(13)6-11/h3-5H,6H2,1-2H3,(H,12,13)","FPQQSNUTBWFFLB-UHFFFAOYSA-N"
"CC1=C(C(=CC=C1)C)N(CN2C=CC=N2)C(=O)CO","InChI=1S/C14H17N3O2/c1-11-5-3-6-12(2)14(11)17(13(19)9-18)10-16-8-4-7-15-16/h3-8,18H,9-10H2,1-2H3","IQUFNHHHOOCCDU-UHFFFAOYSA-N"
"CCC1=CC=CC(=C1NC(=O)CCl)C","InChI=1S/C11H14ClNO/c1-3-9-6-4-5-8(2)11(9)13-10(14)7-12/h4-6H,3,7H2,1-2H3,(H,13,14)","SMINYPCTNJDYGK-UHFFFAOYSA-N"
"CCC1=CC=CC(=C1N(C(=C)COC)C(=O)CCl)C","InChI=1S/C15H20ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8H,3,5,9-10H2,1-2,4H3","QBOAJIBUBBAGOB-UHFFFAOYSA-N"
"","InChI=1S/C11H13N3O4/c1-4-5-12-10-9(13(15)16)6-7(2)8(3)11(10)14(17)18/h5-6H,4H2,1-3H3","DTKCXCJMZRSBHZ-UHFFFAOYSA-N"
"NC1=C(C=C(C(=C1[N+](=O)[O-])C)C)[N+](=O)[O-]","InChI=1S/C8H9N3O4/c1-4-3-6(10(12)13)7(9)8(5(4)2)11(14)15/h3H,9H2,1-2H3","MHTNLJYRURGLAC-UHFFFAOYSA-N"
"C1=CC(=CC(=C1)OC2=CC=CC(=N2)C(=O)O)C(F)(F)F","InChI=1S/C13H8F3NO3/c14-13(15,16)8-3-1-4-9(7-8)20-11-6-2-5-10(17-11)12(18)19/h1-7H,(H,18,19)","LFRASJXUIQMIMC-UHFFFAOYSA-N"
"C1=CC(=CC=C1N)F","InChI=1S/C6H6FN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2","KRZCOLNOCZKSDF-UHFFFAOYSA-N"
"NC1=NC(=NC(=N1)Cl)NC(C)(C)C","InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)","LMKQNTMFZLAJDV-UHFFFAOYSA-N"
"C=CNC1=NC(=NC(=N1)Cl)NC(C)(C)C","InChI=1S/C9H14ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H,1H2,2-4H3,(H2,11,12,13,14,15)","BUQMIGOVPVIUER-UHFFFAOYSA-N"
"CCNC1=NC(=NC(=N1)O)NC(C)(C)C","InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)","OYTCZOJKXCTBHG-UHFFFAOYSA-N"
"C=CNC1=NC(=NC(=N1)SC)NC(C)(C)C","InChI=1S/C10H17N5S/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H,1H2,2-5H3,(H2,11,12,13,14,15)","WWGFOVBITPNLNL-UHFFFAOYSA-N"
"NC1=NC(=NC(=N1)SC)NC(C)(C)C","InChI=1S/C8H15N5S/c1-8(2,3)13-6-10-5(9)11-7(12-6)14-4/h1-4H3,(H3,9,10,11,12,13)","MWWBDLRPMWTLRX-UHFFFAOYSA-N"
"CC1=C(C=C(C=C1)NC(=O)NC)Cl","InChI=1S/C9H11ClN2O/c1-6-3-4-7(5-8(6)10)12-9(13)11-2/h3-5H,1-2H3,(H2,11,12,13)","GUMFWXBSFOHZDC-UHFFFAOYSA-N"
"C1=C(C(=O)NC(=C1Cl)Cl)Cl","InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)","WCYYAQFQZQEUEN-UHFFFAOYSA-N"
"OC(=O)C1=CC(OC2=CC=C(O)C=C2)=CC=C1","InChI=1S/C13H10O4/c14-10-4-6-11(7-5-10)17-12-3-1-2-9(8-12)13(15)16/h1-8,14H,(H,15,16)","OSGCDVKVZWMYBG-UHFFFAOYSA-N"
"CC1(C(C1C(=O)O)C=C(Cl)Cl)C","InChI=1S/C8H10Cl2O2/c1-8(2)4(3-5(9)10)6(8)7(11)12/h3-4,6H,1-2H3,(H,11,12)","LLMLSUSAKZVFOA-UHFFFAOYSA-N"
"OC(=O)C(C)CC2=CC=C(C=C2)C(C)(C)C","InChI=1S/C14H20O2/c1-10(13(15)16)9-11-5-7-12(8-6-11)14(2,3)4/h5-8,10H,9H2,1-4H3,(H,15,16)","DWZYELZGJMFEMJ-UHFFFAOYSA-N"
"C1=C(C(O)=C(C(=C1Cl)N2C(=C(C(=N2)C#N)S(=O)C(F)(F)F)N)Cl)C(F)(F)F","InChI=1S/C12H4Cl2F6N4O2S/c13-4-1-3(11(15,16)17)8(25)6(14)7(4)24-10(22)9(5(2-21)23-24)27(26)12(18,19)20/h1,25H,22H2","HQAOXGNSQGPTGQ-UHFFFAOYSA-N"
"C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2","FTVWIRXFELQLPI-UHFFFAOYSA-N"
"C1=CC(=CC=C1C=CC(=O)C2=C(C=C(C=C2O)O)O)O","InChI=1S/C15H12O5/c16-10-4-1-9(2-5-10)3-6-12(18)15-13(19)7-11(17)8-14(15)20/h1-8,16-17,19-20H/b6-3+","YQHMWTPYORBCMF-ZZXKWVIFSA-N"
"C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O","InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H","IYRMWMYZSQPJKC-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C2=COC3=CC(=CC(=C3C2=O)O)O","InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3","WUADCCWRTIWANL-UHFFFAOYSA-N"
"C[N+](C)(C)CCOC(=O)C1=CC=C(C=C1)O","InChI=1S/C12H17NO3/c1-13(2,3)8-9-16-12(15)10-4-6-11(14)7-5-10/h4-7H,8-9H2,1-3H3/p+1","BAPAICNRGIBFJT-UHFFFAOYSA-O"
"C[N+](C)(C)CCOC(=O)C1=CC=CC=C1","InChI=1S/C12H18NO2/c1-13(2,3)9-10-15-12(14)11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3/q+1","HOPVGFKDVOOCHD-UHFFFAOYSA-N"
"C[N+](C)(C)CCOC(=O)C=CC1=CC(=C(C=C1)O)O","InChI=1S/C14H19NO4/c1-15(2,3)8-9-19-14(18)7-5-11-4-6-12(16)13(17)10-11/h4-7,10H,8-9H2,1-3H3,(H-,16,17,18)/p+1","HLGBXKIGYXVIFU-UHFFFAOYSA-O"
"C[N+](C)(C)CCOC(=O)C1=CN=CC=C1","InChI=1S/C11H17N2O2/c1-13(2,3)7-8-15-11(14)10-5-4-6-12-9-10/h4-6,9H,7-8H2,1-3H3/q+1","ZMPGJEYFRZCHQC-UHFFFAOYSA-N"
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"[H]N([H])c(n5)c(n4)c(nc([H])5)n(c([H])4)C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])1C([H])([H])OP(=O)(O[H])OP(=O)(O[H])OC([H])([H])C([H])(O2)C([H])(O[H])C([H])(O[H])C([H])2[n+1](c([H])3)c([H])c(C(N)=O)c([H])c([H])3","InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1","BAWFJGJZGIEFAR-NNYOXOHSSA-O"
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"OC=1C=CC(=CC=1)C=2OC3=CC(O)=CC(O)=C3(C(=O)C=2(O))","InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H","IYRMWMYZSQPJKC-UHFFFAOYSA-N"
"OC=1C=CC(=CC=1)C2CC(=O)C3=C(O)C=C(O)C=C3(O2)","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2/t13-/m0/s1","FTVWIRXFELQLPI-ZDUSSCGKSA-N"
"OC1=CC=C(C(O)=C1)C2=COC3=CC(O)=CC(O)=C3(C2(=O))","InChI=1S/C15H10O6/c16-7-1-2-9(11(18)3-7)10-6-21-13-5-8(17)4-12(19)14(13)15(10)20/h1-6,16-19H","GSSOWCUOWLMMRJ-UHFFFAOYSA-N"
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"OC=1C=CC(=CC=1)C2=CC(=O)C3=C(O)C=C(O)C=C3(O2)","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H","KZNIFHPLKGYRTM-UHFFFAOYSA-N"
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"COC1=C(C=CC(=C1)C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O","InChI=1S/C22H22O11/c1-31-14-4-8(2-3-9(14)24)13-6-12(27)16-10(25)5-11(26)17(21(16)32-13)22-20(30)19(29)18(28)15(7-23)33-22/h2-6,15,18-20,22-26,28-30H,7H2,1H3/t15-,18-,19+,20-,22+/m1/s1","YXHFXGHAELQJGK-PGPONNFDSA-N"
"COC=1C=C(C=CC=1(O))C2=CC(=O)C3=C(O)C=C(C=C3(O2))OC4OC(CO)C(O)C(O)C4(O)","InChI=1S/C22H22O11/c1-30-15-4-9(2-3-11(15)24)14-7-13(26)18-12(25)5-10(6-16(18)32-14)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3/t17-,19-,20+,21-,22-/m1/s1","GAMYVSCDDLXAQW-MIUGBVLSSA-N"
"C1=CC(=CC(=C1C3=COC2=CC(=C(C(=C2C3=O)O)CC=C(C)C)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O","InChI=1S/C32H38O16/c1-12(2)3-5-15-18(46-32-30(43)28(41)26(39)21(10-34)48-32)8-19-22(23(15)36)24(37)16(11-44-19)14-6-4-13(7-17(14)35)45-31-29(42)27(40)25(38)20(9-33)47-31/h3-4,6-8,11,20-21,25-36,38-43H,5,9-10H2,1-2H3/t20-,21-,25-,26-,27+,28+,29-,30-,31-,32-/m1/s1","JVOLPASYNIPHBV-HCSHWHRSSA-N"
"COC=1C=CC(=CC=1)C4=COC=3C(=C(O)C=C(O)C=3(C2OC(CO)C(O)C(O)C2(O)))C4(=O)","InChI=1S/C22H22O10/c1-30-10-4-2-9(3-5-10)11-8-31-21-15(17(11)26)12(24)6-13(25)16(21)22-20(29)19(28)18(27)14(7-23)32-22/h2-6,8,14,18-20,22-25,27-29H,7H2,1H3/t14-,18-,19+,20-,22?/m1/s1","ZLFFEHIHCGIVET-HOSHUCMYSA-N"
"OC=1C=CC(=CC=1)C2=COC3=CC(O)=CC(O)=C3(C2(=O))","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H","TZBJGXHYKVUXJN-UHFFFAOYSA-N"
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"OCC5OC(OC4C(O)C(O)C(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C=3C=CC(O)=CC=3)OC4(CO))C(O)C(O)C5(O)","InChI=1S/C27H30O15/c28-8-17-20(33)21(34)23(36)27(40-17)42-25-18(9-29)41-26(24(37)22(25)35)38-12-5-13(31)19-14(32)7-15(39-16(19)6-12)10-1-3-11(30)4-2-10/h1-7,17-18,20-31,33-37H,8-9H2/t17-,18-,20-,21+,22-,23-,24-,25-,26?,27?/m0/s1","YONLJLRPNAUKHY-MDQCKWPLSA-N"
"OCC4OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C=3C=CC(O)=C(O)C=3)C(O)C(O)C4(O)","InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)30-9-4-12(25)17-13(26)6-14(31-15(17)5-9)8-1-2-10(23)11(24)3-8/h1-6,16,18-25,27-29H,7H2/t16-,18-,19+,20-,21-/m1/s1","PEFNSGRTCBGNAN-QNDFHXLGSA-N"
"OCC4OC(OC=1C=CC(=CC=1(O))C2=CC(=O)C3=C(O)C=C(O)C=C3(O2))C(O)C(O)C4(O)","InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)31-13-2-1-8(3-10(13)24)14-6-12(26)17-11(25)4-9(23)5-15(17)30-14/h1-6,16,18-25,27-29H,7H2/t16-,18-,19+,20-,21-/m1/s1","UHNXUSWGOJMEFO-QNDFHXLGSA-N"
"COC=1C=CC(=CC=1)C2=COC3=CC(O)=CC(O)=C3(C2(=O))","InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3","WUADCCWRTIWANL-UHFFFAOYSA-N"
"OC1=CC(O)=C2C(=O)C(O)=C(OC2(=C1))C3=CC=C(O)C(O)=C3","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C3=CC=C(O)C(O)=C3","InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H","IQPNAANSBPBGFQ-UHFFFAOYSA-N"
"C1=CC(=C(C=C1O)O)C2=COC3=CC(=CC(=C3C2=O)O)OC4C(C(C(C(O4)CO)O)O)O","InChI=1S/C21H20O11/c22-6-15-18(27)19(28)20(29)21(32-15)31-9-4-13(25)16-14(5-9)30-7-11(17(16)26)10-2-1-8(23)3-12(10)24/h1-5,7,15,18-25,27-29H,6H2/t15-,18-,19+,20-,21-/m1/s1","VYYHGKQKCBDQKO-CMWLGVBASA-N"
"OC=1C=CC(=CC=1)C2=CC(=O)C3=CC=C(O)C=C3(O2)","InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-8,16-17H","LCAWNFIFMLXZPQ-UHFFFAOYSA-N"
"OC1=CC(O)=C2C(=O)C(O)=C(OC2(=C1))C=3C=CC=CC=3","InChI=1S/C15H10O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,16-17,19H","VCCRNZQBSJXYJD-UHFFFAOYSA-N"
"C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O","InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1","MYXNWGACZJSMBT-VJXVFPJBSA-N"
"C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O","InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1","JPUKWEQWGBDDQB-QSOFNFLRSA-N"
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"OCC1OC(C(O)C(O)C1(O))C=3C(O)=CC(O)=C2C(=O)C=C(OC2=3)C=4C=CC(O)=CC=4","InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1","SGEWCQFRYRRZDC-VPRICQMDSA-N"
"CCCCC\C=C/C\C=C/C\C=C/C=C/C(=O)CCCC(O)=O","InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-10,12-14,16H,2-5,8,11,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,13-12-,16-14+","MEASLHGILYBXFO-XTDASVJISA-N"
"CCCCC\C=C/C\C=C/C=C/C(O)C\C=C/CCCC(O)=O","InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-13-16-19(21)17-14-11-12-15-18-20(22)23/h6-7,9-11,13-14,16,19,21H,2-5,8,12,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,14-11-,16-13+","NLUNAYAEIJYXRB-HEJOTXCHSA-N"
"C(C(O)=O)CC/C=C\[C@@H](/C=C/C=C\C\C=C/C=C/[C@H](C/C=C\CC)O)O","InChI=1S/C22H32O4/c1-2-3-10-15-20(23)16-11-7-5-4-6-8-12-17-21(24)18-13-9-14-19-22(25)26/h3,5-8,10-13,16-18,20-21,23-24H,2,4,9,14-15,19H2,1H3,(H,25,26)/b7-5-,8-6-,10-3-,16-11+,17-12+,18-13-/t20-,21+/m0/s1","JBRPFYYLEQERPG-XTIXYJHRSA-N"
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"C(CC/C=C\C/C=C\C/C=C\C=C\C(CCCC(=O)O)OO)CC","InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(24-23)17-15-18-20(21)22/h6-7,9-10,12-14,16,19,23H,2-5,8,11,15,17-18H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-14+","JNUUNUQHXIOFDA-XTDASVJISA-N"
"CC\C=C/C\C=C/C\C=C/C\C=C/CC(O)\C=C\C=C/CCC(O)=O","InChI=1S/C22H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-21(23)19-16-13-14-17-20-22(24)25/h3-4,6-7,9-10,12-16,19,21,23H,2,5,8,11,17-18,20H2,1H3,(H,24,25)/b4-3-,7-6-,10-9-,14-13-,15-12-,19-16+","ZHBVYDMSPDDAKE-VTIZNUJUSA-N"
"CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O","InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-,13-12-,16-15-","JAZBEHYOTPTENJ-JLNKQSITSA-N"
"CC\C=C/CC(O)\C=C\C=C/CCCCCCCC(O)=O","InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h3,7,9,11-12,15,17,19H,2,4-6,8,10,13-14,16H2,1H3,(H,20,21)/b9-7-,11-3-,15-12+","KLLGGGQNRTVBSU-JDTPQGGVSA-N"
"C(CC/C=C\C[C@@H](O)/C=C/C=C/C=C\[C@H](C/C=C\C/C=C\CC)O)(O)=O","InChI=1S/C22H32O4/c1-2-3-4-5-6-10-15-20(23)16-11-7-8-12-17-21(24)18-13-9-14-19-22(25)26/h3-4,6-13,16-17,20-21,23-24H,2,5,14-15,18-19H2,1H3,(H,25,26)/b4-3-,8-7+,10-6-,13-9-,16-11-,17-12+/t20-,21-/m0/s1","HLHYXXBCQOUTGK-FHCQLJOMSA-N"
"C(\CC)=C\C/C=C\C[C@@H](/C=C/C=C\C/C=C\CCCC(=O)O)O","InChI=1S/C20H30O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h3-4,7-11,13-14,17,19,21H,2,5-6,12,15-16,18H2,1H3,(H,22,23)/b4-3-,9-7-,11-8-,13-10-,17-14+/t19-/m0/s1","MCRJLMXYVFDXLS-UOLHMMFFSA-N"
"C(CCCCCCC/C=C\C=C\C(CCCCC)O)(=O)O","InChI=1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b9-7-,15-12+","HNICUWMFWZBIFP-BSZOFBHHSA-N"
"CC\C=C/C=C/C(O)C\C=C/C\C=C/C\C=C/C\C=C/CCC(O)=O","InChI=1S/C22H32O3/c1-2-3-4-15-18-21(23)19-16-13-11-9-7-5-6-8-10-12-14-17-20-22(24)25/h3-4,6-9,12-16,18,21,23H,2,5,10-11,17,19-20H2,1H3,(H,24,25)/b4-3-,8-6-,9-7-,14-12-,16-13-,18-15+","CSXQXWHAGLIFIH-VUARBJEWSA-N"
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"C(\CC)=C\C/C=C\C/C=C\CC(/C=C/C=C\CCCC(=O)O)O","InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-10-13-16-19(21)17-14-11-9-12-15-18-20(22)23/h3-4,6-7,9-11,13-14,17,19,21H,2,5,8,12,15-16,18H2,1H3,(H,22,23)/b4-3-,7-6-,11-9-,13-10-,17-14+","OXOPDAZWPWFJEW-IMCWFPBLSA-N"
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"CC\C=C/C\C=C/C=C/C(O)CCCCCCCC(O)=O","InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14,17,19H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b4-3-,8-6-,14-11+","RIGGEAZDTKMXSI-CUHSZNQNSA-N"
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"C([C@@H]([C@@H](/C=C/C=C/C=C\C/C=C\CCCCC)O)O)CCC(=O)O","InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18(21)19(22)16-14-17-20(23)24/h6-7,9-13,15,18-19,21-22H,2-5,8,14,16-17H2,1H3,(H,23,24)/b7-6-,10-9-,12-11+,15-13+/t18-,19+/m1/s1","UVZBUUTTYHTDRR-NSEFZGNTSA-N"
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"[H]C(CCCC(O)=O)=CCC([H])=CC([H])=CC(O)CC([H])=CCCCCC","InChI=1S/C20H32O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h7-11,13-14,17,19,21H,2-6,12,15-16,18H2,1H3,(H,22,23)","ZNHVWPKMFKADKW-UHFFFAOYSA-N"
"CCCCC\C=C/C\C=C/CC(O)\C=C\C=C/CCCC(O)=O","InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-10-13-16-19(21)17-14-11-9-12-15-18-20(22)23/h6-7,9-11,13-14,17,19,21H,2-5,8,12,15-16,18H2,1H3,(H,22,23)/b7-6-,11-9-,13-10-,17-14+","KATOYYZUTNAWSA-OIZRIKEUSA-N"
"CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(O)=O","InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-","YZXBAPSDXZZRGB-DOFZRALJSA-N"
"C(\CC)=C\C/C=C\C/C=C\C\C=C/C=C/C(CCCC(=O)O)O","InChI=1S/C20H30O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h3-4,6-7,9-10,12-14,16,19,21H,2,5,8,11,15,17-18H2,1H3,(H,22,23)/b4-3-,7-6-,10-9-,13-12-,16-14+","FTAGQROYQYQRHF-FCWZHQICSA-N"
"CCCCC\C=C/C\C=C/C\C=C/C=C/C(O)CCCC(O)=O","InChI=1S/C20H32O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19(21)17-15-18-20(22)23/h6-7,9-10,12-14,16,19,21H,2-5,8,11,15,17-18H2,1H3,(H,22,23)/b7-6-,10-9-,13-12-,16-14+","KGIJOOYOSFUGPC-XTDASVJISA-N"
"CCCCC\C=C/C=C/C(O)CCCCCCCC(O)=O","InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/b8-6-,14-11+","NPDSHTNEKLQQIJ-ZJHFMPGASA-N"
"C(CC)(/C=C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O)O","InChI=1S/C20H30O3/c1-2-19(21)17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-20(22)23/h4-7,10-13,15,17,19,21H,2-3,8-9,14,16,18H2,1H3,(H,22,23)/b6-4-,7-5-,12-10-,13-11-,17-15+","LRWYBGFSVUBWMO-UXNZXXPISA-N"
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"CCCCCC(O)\C=C\C=C/C\C=C/C\C=C/CCCC(O)=O","InChI=1S/C20H32O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h4-5,8-11,14,17,19,21H,2-3,6-7,12-13,15-16,18H2,1H3,(H,22,23)/b5-4-,10-8-,11-9-,17-14+","JSFATNQSLKRBCI-USWFWKISSA-N"
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"C(=C/[C@@H](C\C=C/C=C/[C@H](C/C=C\CC)O)O)\C=C\C=C/[C@H](CCC(O)=O)O","InChI=1S/C22H32O5/c1-2-3-7-12-19(23)14-10-6-11-15-20(24)13-8-4-5-9-16-21(25)17-18-22(26)27/h3-11,13-14,16,19-21,23-25H,2,12,15,17-18H2,1H3,(H,26,27)/b5-4+,7-3-,11-6-,13-8+,14-10+,16-9-/t19-,20-,21+/m0/s1","QBTJOLCUKWLTIC-UZAFJXHNSA-N"
"[H][C@]12C[C@@H](O)[C@H](\C=C\[C@@H](O)CCCCC)[C@@]1([H])C\C(O2)=C\CCCC(O)=O","InChI=1S/C20H32O5/c1-2-3-4-7-14(21)10-11-16-17-12-15(8-5-6-9-20(23)24)25-19(17)13-18(16)22/h8,10-11,14,16-19,21-22H,2-7,9,12-13H2,1H3,(H,23,24)/b11-10+,15-8-/t14-,16+,17+,18+,19-/m0/s1","KAQKFAOMNZTLHT-OZUDYXHBSA-N"
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"C(\C/C=C\C/C=C\C/C=C\CC)=C\C/C=C\C/C=C\CCC(=O)O","InChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-","MBMBGCFOFBJSGT-KUBAVDMBSA-N"
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"CC\C=C/C[C@H](O)\C=C\[C@H]1OC(O)C[C@H](O)[C@@H]1C\C=C/CCCC(O)=O","InChI=1S/C20H32O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h3-4,6-7,12-13,15-18,20-22,25H,2,5,8-11,14H2,1H3,(H,23,24)/b6-3-,7-4-,13-12+/t15-,16-,17-,18+,20?/m0/s1","OYPPJMLKAYYWHH-NXJDUNGTSA-N"
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"C(\CCC(O)=O)=C\C[C@@H]([C@@H](\C=C\C=C\C=C/C=C/[C@H](C/C=C\CC)O)O)O","InChI=1S/C22H32O5/c1-2-3-9-14-19(23)15-10-6-4-5-7-11-16-20(24)21(25)17-12-8-13-18-22(26)27/h3-12,15-16,19-21,23-25H,2,13-14,17-18H2,1H3,(H,26,27)/b6-4-,7-5+,9-3-,12-8-,15-10+,16-11+/t19-,20+,21-/m0/s1","OIWTWACQMDFHJG-CCFUIAGSSA-N"
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"C(\CC)=C\CC(/C=C/C=C\C/C=C\C/C=C\CCCC(=O)O)O","InChI=1S/C20H30O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h3-5,8-11,13-14,17,19,21H,2,6-7,12,15-16,18H2,1H3,(H,22,23)/b5-4-,10-8-,11-9-,13-3-,17-14+","WLKCSMCLEKGITB-XWJJKCKWSA-N"
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"CC\C=C/C\C=C/C\C=C/CC(O)\C=C\C=C/C\C=C/CCC(O)=O","InChI=1S/C22H32O3/c1-2-3-4-5-6-7-9-12-15-18-21(23)19-16-13-10-8-11-14-17-20-22(24)25/h3-4,6-7,10-16,19,21,23H,2,5,8-9,17-18,20H2,1H3,(H,24,25)/b4-3-,7-6-,13-10-,14-11-,15-12-,19-16+","LTERDCBCHFKFRI-BGKMTWLOSA-N"
"CC\C=C/C\C=C/C\C=C/C=C/C(O)C\C=C/C\C=C/CCC(O)=O","InChI=1S/C22H32O3/c1-2-3-4-5-6-7-8-9-12-15-18-21(23)19-16-13-10-11-14-17-20-22(24)25/h3-4,6-7,9,11-16,18,21,23H,2,5,8,10,17,19-20H2,1H3,(H,24,25)/b4-3-,7-6-,12-9-,14-11-,16-13-,18-15+","DDCYKEYDTGCKAS-SKSHMZPZSA-N"
"O=C(CCC/C=C\C/C=C\C/C=C\CC1C(O1)C/C=C\CC)O","InChI=1S/C20H30O3/c1-2-3-12-15-18-19(23-18)16-13-10-8-6-4-5-7-9-11-14-17-20(21)22/h3-4,6-7,9-10,12-13,18-19H,2,5,8,11,14-17H2,1H3,(H,21,22)/b6-4-,9-7-,12-3-,13-10-","RGZIXZYRGZWDMI-QXBXTPPVSA-N"
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"CCCCCC(O)C(O)C\C=C/C\C=C/C\C=C/CCCC(O)=O","InChI=1S/C20H34O4/c1-2-3-12-15-18(21)19(22)16-13-10-8-6-4-5-7-9-11-14-17-20(23)24/h4,6-7,9-10,13,18-19,21-22H,2-3,5,8,11-12,14-17H2,1H3,(H,23,24)/b6-4-,9-7-,13-10-","SYAWGTIVOGUZMM-ILYOTBPNSA-N"
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"CCCCC\C=C/CC1OC1C\C=C/C\C=C/CCCC(O)=O","InChI=1S/C20H32O3/c1-2-3-4-5-9-12-15-18-19(23-18)16-13-10-7-6-8-11-14-17-20(21)22/h6,8-10,12-13,18-19H,2-5,7,11,14-17H2,1H3,(H,21,22)/b8-6-,12-9-,13-10-","DXOYQVHGIODESM-KROJNAHFSA-N"
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"CC/C=C\C/C=C\CC(/C=C/C=C\C/C=C\CCCC(=O)O)O","InChI=1S/C20H30O3/c1-2-3-4-5-10-13-16-19(21)17-14-11-8-6-7-9-12-15-18-20(22)23/h3-4,7-11,13-14,17,19,21H,2,5-6,12,15-16,18H2,1H3,(H,22,23)/b4-3-,9-7-,11-8-,13-10-,17-14+","MCRJLMXYVFDXLS-QGQBRVLBSA-N"
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"[C@@]([H])(CC(N)=O)(NC(=O)Cc(c1)c(O)cc(O)c1)C(=O)NCCCCCNC(=O)CCNCCCCNCCCN","InChI=1S/C27H47N7O6/c28-10-6-13-30-11-4-5-12-31-16-9-25(38)32-14-2-1-3-15-33-27(40)22(19-24(29)37)34-26(39)17-20-7-8-21(35)18-23(20)36/h7-8,18,22,30-31,35-36H,1-6,9-17,19,28H2,(H2,29,37)(H,32,38)(H,33,40)(H,34,39)/t22-/m0/s1","SJLRBGDPTALRDM-QFIPXVFZSA-N"
"C[C@@H]1CC[C@]2([C@@H](C[C@H]3[C@](O2)(CC[C@H]4[C@H](O3)C[C@H]5[C@H](O4)C[C@H]6[C@H](O5)C[C@H]7[C@H](O6)C[C@@H]([C@@](O7)(C)CCOS(=O)(=O)O)OS(=O)(=O)O)C)O[C@@H]8[C@@H]1O[C@@H]9[C@@H](C8)O[C@H]1C[C@@H]2[C@H](CC(=C)[C@H](O2)[C@@](C)(/C=C/C(=C)CC=C)O)O[C@@]1([C@@H]9O)C)C","InChI=1S/C55H82O21S2/c1-10-11-28(2)12-15-51(5,57)50-30(4)20-39-38(71-50)26-46-55(9,74-39)49(56)48-42(70-46)24-41-47(72-48)29(3)13-16-53(7)44(69-41)27-43-54(8,76-53)17-14-31-32(68-43)21-34-33(65-31)22-35-36(66-34)23-40-37(67-35)25-45(75-78(61,62)63)52(6,73-40)18-19-64-77(58,59)60/h10,12,15,29,31-50,56-57H,1-2,4,11,13-14,16-27H2,3,5-9H3,(H,58,59,60)(H,61,62,63)/b15-12+/t29-,31+,32-,33-,34+,35+,36-,37-,38-,39+,40+,41+,42-,43+,44-,45+,46+,47-,48-,49-,50+,51-,52-,53+,54-,55+/m1/s1","HCYDZFJGUKMTQB-ROYDEHQTSA-N"
"O=C(NC(C(=O)NC(CCC(O)=O)C(NC(CC(O)=O)C(NC(C(NC(CC(C)C)C(NC(C(NC(CC(O)=O)C(NC(CCCCN)C(O)=O)=O)=O)CCC(N)=O)=O)=O)CCC(O)=O)=O)=O)C(C)O)C(NC(C(CCC(N)=O)NC(=O)C(CCC(N)=O)NC(=O)C(NC(C(CCC(O)=O)NC(C(NC(C(CCC(N)=O)NC(C(Cc(c1)cccc1)N)=O)=O)COP(O)(O)=O)=O)=O)CCC(O)=O)=O)CCC(N)=O","InChI=1S/C81H125N22O39P/c1-36(2)31-50(76(132)94-43(15-24-57(87)108)71(127)101-52(34-64(120)121)78(134)98-49(81(137)138)11-7-8-30-82)99-72(128)47(19-28-61(114)115)95-77(133)51(33-63(118)119)100-73(129)48(20-29-62(116)117)97-80(136)65(37(3)104)103-75(131)44(16-25-58(88)109)92-68(124)42(14-23-56(86)107)90-67(123)41(13-22-55(85)106)91-69(125)45(17-26-59(110)111)93-70(126)46(18-27-60(112)113)96-79(135)53(35-142-143(139,140)141)102-74(130)40(12-21-54(84)105)89-66(122)39(83)32-38-9-5-4-6-10-38/h4-6,9-10,36-37,39-53,65,104H,7-8,11-35,82-83H2,1-3H3,(H2,84,105)(H2,85,106)(H2,86,107)(H2,87,108)(H2,88,109)(H,89,122)(H,90,123)(H,91,125)(H,92,124)(H,93,126)(H,94,132)(H,95,133)(H,96,135)(H,97,136)(H,98,134)(H,99,128)(H,100,129)(H,101,127)(H,102,130)(H,103,131)(H,110,111)(H,112,113)(H,114,115)(H,116,117)(H,118,119)(H,120,121)(H,137,138)(H2,139,140,141)","BECPQYXYKAMYBN-UHFFFAOYSA-N"
"C([C@@](CCC(N)=O)([H])NC(=O)[C@](N3C(=O)[C@](CCCCN)(NC(=O)[C@@](N4C(=O)[C@@]([H])(N)CCCNC(N)=N)(CCC4)[H])[H])([H])CCC3)(=O)N[C@@](CCC(N)=O)(C(N[C@]([H])(C(=O)N[C@](C(NCC(=O)N[C@](C(N[C@@]([H])(CCSC)C(O)=O)=O)(CC(C)C)[H])=O)(Cc(c2)cccc2)[H])Cc(c1)cccc1)=O)[H]","InChI=1S/C63H97N17O14S/c1-37(2)33-45(56(87)76-44(62(93)94)27-32-95-3)72-52(83)36-71-53(84)46(34-38-15-6-4-7-16-38)77-57(88)47(35-39-17-8-5-9-18-39)78-55(86)41(23-25-50(66)81)73-54(85)42(24-26-51(67)82)74-58(89)49-22-14-31-80(49)61(92)43(20-10-11-28-64)75-59(90)48-21-13-30-79(48)60(91)40(65)19-12-29-70-63(68)69/h4-9,15-18,37,40-49H,10-14,19-36,64-65H2,1-3H3,(H2,66,81)(H2,67,82)(H,71,84)(H,72,83)(H,73,85)(H,74,89)(H,75,90)(H,76,87)(H,77,88)(H,78,86)(H,93,94)(H4,68,69,70)/t40-,41-,42-,43-,44-,45-,46-,47-,48-,49-/m0/s1","XHWDVRRNQHMAPE-CUZNLEPHSA-N"
"NC(=N)NCCC[C@@]([H])(C(N[C@]([H])(C(=O)N(C4)[C@@](C(N[C@](Cc(c5)ccc(O)c5)([H])C(=O)N[C@@]([H])([C@@](CC)([H])C)C(=O)N[C@@]([H])(CC(C)C)C(O)=O)=O)([H])CC4)CCCNC(N)=N)=O)NC([C@]([H])(C1)N(C(=O)[C@@](CCCCN)([H])NC([C@@](CC(N)=O)([H])NC([C@@](NC([C@](NC(=O)[C@]([H])(CC(C)C)NC([C@@](C3)([H])NC(C3)=O)=O)([H])Cc(c2)ccc(O)c2)=O)(CCC(O)=O)[H])=O)=O)CC1)=O","InChI=1S/C78H121N21O20/c1-7-43(6)63(73(115)96-57(76(118)119)37-42(4)5)97-70(112)55(39-45-21-25-47(101)26-22-45)95-72(114)59-18-13-35-99(59)75(117)52(16-11-33-86-78(83)84)90-64(106)48(15-10-32-85-77(81)82)89-71(113)58-17-12-34-98(58)74(116)51(14-8-9-31-79)91-69(111)56(40-60(80)102)94-66(108)50(28-30-62(104)105)88-68(110)54(38-44-19-23-46(100)24-20-44)93-67(109)53(36-41(2)3)92-65(107)49-27-29-61(103)87-49/h19-26,41-43,48-59,63,100-101H,7-18,27-40,79H2,1-6H3,(H2,80,102)(H,87,103)(H,88,110)(H,89,113)(H,90,106)(H,91,111)(H,92,107)(H,93,109)(H,94,108)(H,95,114)(H,96,115)(H,97,112)(H,104,105)(H,118,119)(H4,81,82,85)(H4,83,84,86)/t43-,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,63-/m0/s1","PCJGZPGTCUMMOT-ISULXFBGSA-N"
"CC[C@H](C)[C@@H](/C(=N\[C@@H](Cc1cnc[nH]1)C(=O)N2CCC[C@H]2/C(=N\[C@@H](Cc3ccccc3)/C(=N/[C@@H](Cc4cnc[nH]4)/C(=N/[C@@H](CC(C)C)/C(=N/[C@@H](C(C)C)/C(=N/[C@@H]([C@@H](C)CC)/C(=N/[C@@H](Cc5cnc[nH]5)/C(=N/[C@@H](CC(=N)O)C(=O)O)/O)/O)/O)/O)/O)/O)/O)/O)/N=C(\[C@H](Cc6ccc(cc6)O)/N=C(\[C@H](C(C)C)/N=C(\[C@H](CCCNC(=N)N)/N=C(\[C@H](CC(=O)O)N)/O)/O)/O)/O","InChI=1S/C83H122N24O19/c1-11-45(9)67(105-75(118)57(30-48-22-24-52(108)25-23-48)99-77(120)65(43(5)6)103-70(113)54(20-16-26-91-83(86)87)95-69(112)53(84)34-64(110)111)80(123)101-60(33-51-38-90-41-94-51)81(124)107-27-17-21-62(107)76(119)98-56(29-47-18-14-13-15-19-47)71(114)97-58(31-49-36-88-39-92-49)72(115)96-55(28-42(3)4)74(117)104-66(44(7)8)78(121)106-68(46(10)12-2)79(122)100-59(32-50-37-89-40-93-50)73(116)102-61(82(125)126)35-63(85)109/h13-15,18-19,22-25,36-46,53-62,65-68,108H,11-12,16-17,20-21,26-35,84H2,1-10H3,(H2,85,109)(H,88,92)(H,89,93)(H,90,94)(H,95,112)(H,96,115)(H,97,114)(H,98,119)(H,99,120)(H,100,122)(H,101,123)(H,102,116)(H,103,113)(H,104,117)(H,105,118)(H,106,121)(H,110,111)(H,125,126)(H4,86,87,91)/t45-,46-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,65-,66-,67-,68-/m0/s1","UYYRANYWSOXAEK-CYHHWISKSA-N"
"c(c1O)(C(C)(C)C)cc(CCC(OCCSCCOC(CCc(c2)cc(c(c(C(C)(C)C)2)O)C(C)(C)C)=O)=O)cc1C(C)(C)C","InChI=1S/C38H58O6S/c1-35(2,3)27-21-25(22-28(33(27)41)36(4,5)6)13-15-31(39)43-17-19-45-20-18-44-32(40)16-14-26-23-29(37(7,8)9)34(42)30(24-26)38(10,11)12/h21-24,41-42H,13-20H2,1-12H3","VFBJXXJYHWLXRM-UHFFFAOYSA-N"
"CC(C)(C)c(c1)c(c(C(C)(C)C)cc(CN(C(=O)2)C(=O)N(Cc(c4)cc(C(C)(C)C)c(c(C(C)(C)C)4)O)C(=O)N(Cc(c3)cc(C(C)(C)C)c(c(C(C)(C)C)3)O)2)1)O","InChI=1S/C48H69N3O6/c1-43(2,3)31-19-28(20-32(37(31)52)44(4,5)6)25-49-40(55)50(26-29-21-33(45(7,8)9)38(53)34(22-29)46(10,11)12)42(57)51(41(49)56)27-30-23-35(47(13,14)15)39(54)36(24-30)48(16,17)18/h19-24,52-54H,25-27H2,1-18H3","VNQNXQYZMPJLQX-UHFFFAOYSA-N"
"CCNc(n1)nc(SC)nc(NC(C)C)1","InChI=1S/C9H17N5S/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)","RQVYBGPQFYCBGX-UHFFFAOYSA-N"
"COc(n1)nc(NC(C)C)nc(NC(C)C)1","InChI=1S/C10H19N5O/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)","ISEUFVQQFVOBCY-UHFFFAOYSA-N"
"CC(C)Nc(n1)nc(NC(C)C)nc(Cl)1","InChI=1S/C9H16ClN5/c1-5(2)11-8-13-7(10)14-9(15-8)12-6(3)4/h5-6H,1-4H3,(H2,11,12,13,14,15)","WJNRPILHGGKWCK-UHFFFAOYSA-N"
"CCNc(n1)nc(SC)nc(NCC)1","InChI=1S/C8H15N5S/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13)","MGLWZSOBALDPEK-UHFFFAOYSA-N"
"CCNc(n1)nc(SC)nc(NC(C)(C)C)1","InChI=1S/C10H19N5S/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15)","IROINLKCQGIITA-UHFFFAOYSA-N"
"C1C[C@H](NC1)C(=O)N2CCC[C@H]2C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O","InChI=1S/C44H61N11O10/c45-44(46)48-20-8-16-30(43(64)65)51-38(59)32(24-28-13-5-2-6-14-28)52-40(61)35-18-10-22-55(35)42(63)33(26-56)53-37(58)31(23-27-11-3-1-4-12-27)50-36(57)25-49-39(60)34-17-9-21-54(34)41(62)29-15-7-19-47-29/h1-6,11-14,29-35,47,56H,7-10,15-26H2,(H,49,60)(H,50,57)(H,51,59)(H,52,61)(H,53,58)(H,64,65)(H4,45,46,48)/t29-,30-,31-,32-,33-,34-,35-/m0/s1","ZZHVXIPXTCBVBE-POFDKVPJSA-N"
"C(Cc(c4)cc(C(C)(C)C)c(c4C(C)(C)C)O)C(=O)OCC(COC(CCc(c3)cc(C(C)(C)C)c(c3C(C)(C)C)O)=O)(COC(CCc(c2)cc(C(C)(C)C)c(c2C(C)(C)C)O)=O)COC(CCc(c1)cc(C(C)(C)C)c(c1C(C)(C)C)O)=O","InChI=1S/C73H108O12/c1-65(2,3)49-33-45(34-50(61(49)78)66(4,5)6)25-29-57(74)82-41-73(42-83-58(75)30-26-46-35-51(67(7,8)9)62(79)52(36-46)68(10,11)12,43-84-59(76)31-27-47-37-53(69(13,14)15)63(80)54(38-47)70(16,17)18)44-85-60(77)32-28-48-39-55(71(19,20)21)64(81)56(40-48)72(22,23)24/h33-40,78-81H,25-32,41-44H2,1-24H3","BGYHLZZASRKEJE-UHFFFAOYSA-N"
"CC[C@H](C)[C@@H](C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(=O)N)N","InChI=1S/C70H131N19O15/c1-17-40(11)55(75)69(103)88-53(35-54(74)90)68(102)87-52(34-39(9)10)67(101)83-46(25-19-22-28-71)62(96)78-45(16)61(95)86-50(32-37(5)6)65(99)79-42(13)58(92)77-43(14)60(94)85-51(33-38(7)8)66(100)80-44(15)59(93)81-47(26-20-23-29-72)63(97)82-48(27-21-24-30-73)64(98)89-56(41(12)18-2)70(104)84-49(57(76)91)31-36(3)4/h36-53,55-56H,17-35,71-73,75H2,1-16H3,(H2,74,90)(H2,76,91)(H,77,92)(H,78,96)(H,79,99)(H,80,100)(H,81,93)(H,82,97)(H,83,101)(H,84,104)(H,85,94)(H,86,95)(H,87,102)(H,88,103)(H,89,98)/t40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,55-,56-/m0/s1","MASXKPLGZRMBJF-MVSGICTGSA-N"
"COc(c4)cc(c3c4)c(ccn3)[C@@H](O)[C@]([H])(C1)N(C2)C[C@H](C=C)[C@@H](C2)1","InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19-,20+/m0/s1","LOUPRKONTZGTKE-WZBLMQSHSA-N"
"COC(=O)[C@@H]([C@@H](OC(=O)c(c3)cccc3)1)[C@@]([H])(C2)N(C)[C@@]([H])(C2)C1","InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1","ZPUCINDJVBIVPJ-LJISPDSOSA-N"
"Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N(C)2)c(c1)cccc1","InChI=1S/C16H13ClN2O2/c1-19-13-8-7-11(17)9-12(13)14(18-15(20)16(19)21)10-5-3-2-4-6-10/h2-9,15,20H,1H3","SEQDDYPDSLOBDC-UHFFFAOYSA-N"
"C1=CC(=CC=C1/C=C(\C#N)/C(=O)O)O","InChI=1S/C10H7NO3/c11-6-8(10(13)14)5-7-1-3-9(12)4-2-7/h1-5,12H,(H,13,14)/b8-5+","AFVLVVWMAFSXCK-VMPITWQZSA-N"
"c(c3)cc(c1)c(n3)c(n2)c(ccc2)c1","InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H","DGEZNRSVGBDHLK-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)C[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)/t5-,6+,7+/m0/s1","OLXZPDWKRNYJJZ-RRKCRQDMSA-N"
"NCCP(O)(O)=O","InChI=1S/C2H8NO3P/c3-1-2-7(4,5)6/h1-3H2,(H2,4,5,6)","QQVDJLLNRSOCEL-UHFFFAOYSA-N"
"CN(C=1)C(=N2)C(N=C2)=C(N)N1","InChI=1S/C6H7N5/c1-11-3-10-5(7)4-6(11)9-2-8-4/h2-3H,7H2,1H3","FSASIHFSFGAIJM-UHFFFAOYSA-N"
"CC(=C1)C(N)=NC(=O)N1","InChI=1S/C5H7N3O/c1-3-2-7-5(9)8-4(3)6/h2H,1H3,(H3,6,7,8,9)","LRSASMSXMSNRBT-UHFFFAOYSA-N"
"OC(=O)CCCCC(C1)SSC1","InChI=1S/C8H14O2S2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H,9,10)","AGBQKNBQESQNJD-UHFFFAOYSA-N"
"C1=NC2=C(N1)C(=NC=N2)N","InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)","GFFGJBXGBJISGV-UHFFFAOYSA-N"
"NC(C3)(C1)CC(C2)CC(CC23)1","InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2","DKNWSYNQZKUICI-UHFFFAOYSA-N"
"OC(=O)CC(O)(CC(O)=O)C(O)=O","InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)","KRKNYBCHXYNGOX-UHFFFAOYSA-N"
"NCCS","InChI=1S/C2H7NS/c3-1-2-4/h4H,1-3H2","UFULAYFCSOUIOV-UHFFFAOYSA-N"
"O[C@H](C1)[C@@H](O)[C@H](O)C(O)O1","InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3-,4+,5?/m1/s1","SRBFZHDQGSBBOR-ZRMNMSDTSA-N"
"OCC(=O)C(O)C(O)C(O)COP(O)(O)=O","InChI=1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h4-7,9-11H,1-2H2,(H2,12,13,14)/t4-,5-,6-/m1/s1","GSXOAOHZAIYLCY-HSUXUTPPSA-N"
"OC(=O)C[C@H](O)C(O)=O","InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m1/s1","BJEPYKJPYRNKOW-UWTATZPHSA-N"
"OC[C@@H](O1)[C@@H](O)[C@@H](O)C(O)1","InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2/t2-,3-,4-,5?/m1/s1","HMFHBZSHGGEWLO-SOOFDHNKSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@@H](O2)[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)2","InChI=1S/C12H22O11/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1","HDTRYLNUVZCQOY-LIZSDCNHSA-N"
"OCC(O)(O1)C(O)C(O)C1","InChI=1S/C5H10O5/c6-2-5(9)4(8)3(7)1-10-5/h3-4,6-9H,1-2H2/t3-,4+,5?/m1/s1","LQXVFWRQNMEDEE-OVEKKEMJSA-N"
"OC(=O)[C@@H](N)CCC[C@H](N)C(O)=O","InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1","GMKMEZVLHJARHF-WHFBIAKZSA-N"
"CNC(=O)Oc(c3)cc(c(c3)1)C(C)(C2)C(N(C)C2)N(C)1","InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1","PIJVFDBKTWXHHD-HIFRSBDPSA-N"
"OC(=O)CC(C(O)=O)C(O)C(O)=O","InChI=1S/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)","ODBLHEXUDAPZAU-UHFFFAOYSA-N"
"OC(=O)C(C1)N=CCC1","InChI=1S/C6H9NO2/c8-6(9)5-3-1-2-4-7-5/h4-5H,1-3H2,(H,8,9)","CSDPVAKVEWETFG-UHFFFAOYSA-N"
"OC(=O)c(c1)ccnc1","InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)","TWBYWOBDOCUKOW-UHFFFAOYSA-N"
"NC(=O)CC[C@H](N)C(O)=O","InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1","ZDXPYRJPNDTMRX-VKHMYHEASA-N"
"C1=C(NC=N1)C[C@@H](C(=O)O)N","InChI=1S/C6H9N3O2/c7-5(6(10)11)1-4-2-8-3-9-4/h2-3,5H,1,7H2,(H,8,9)(H,10,11)/t5-/m0/s1","HNDVDQJCIGZPNO-YFKPBYRVSA-N"
"C1=C(NC=N1)C[C@@H](CO)N","InChI=1S/C6H11N3O/c7-5(3-10)1-6-2-8-4-9-6/h2,4-5,10H,1,3,7H2,(H,8,9)/t5-/m0/s1","ZQISRDCJNBUVMM-YFKPBYRVSA-N"
"C1=C(NC=N1)C[C@@H](C(=O)O)NC(=O)CCCN","InChI=1S/C10H16N4O3/c11-3-1-2-9(15)14-8(10(16)17)4-7-5-12-6-13-7/h5-6,8H,1-4,11H2,(H,12,13)(H,14,15)(H,16,17)/t8-/m0/s1","CCLQKVKJOGVQLU-QMMMGPOBSA-N"
"OC[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5+,6+/m0/s1","FBPFZTCFMRRESA-UNTFVMJOSA-N"
"OC(=O)C([H])(N)Cc(c1)cccc1","InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)/t8-/m0/s1","COLNVLDHVKWLRT-QMMMGPOBSA-N"
"OC(=O)C(N)Cc(c1)ccc(O)c1","InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)/t8-/m0/s1","OUYCCCASQSFEME-QMMMGPOBSA-N"
"CCCCCC=CCC=CCCCCCCCC(O)=O","InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-","OYHQOLUKZRVURQ-HZJYTTRNSA-N"
"CCC=CCC=CCC=CCCCCCCCC(O)=O","InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10H,2,5,8,11-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-","DTOSIQBPPRVQHS-PDBXOOCHSA-N"
"OC(=O)C=C(C)C(O)=O","InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2+","HNEGQIOMVPPMNR-NSCUHMNNSA-N"
"Nc(c1)[n+1]([O-1])c(N)nc1N(C2)CCCC2","InChI=1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6H,1-5,10H2,(H2,11,12)","ZFMITUMMTDLWHR-UHFFFAOYSA-N"
"CC(C)=CCNc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(CO)1","InChI=1S/C15H21N5O4/c1-8(2)3-4-16-13-10-14(18-6-17-13)20(7-19-10)15-12(23)11(22)9(5-21)24-15/h3,6-7,9,11-12,15,21-23H,4-5H2,1-2H3,(H,16,17,18)/t9-,11-,12-,15-/m1/s1","USVMJSALORZVDV-SDBHATRESA-N"
"[H]C(=O)N[C@@H](CCSC)C(O)=O","InChI=1S/C6H11NO3S/c1-11-3-2-5(6(9)10)7-4-8/h4-5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1","PYUSHNKNPOHWEZ-YFKPBYRVSA-N"
"OCC(C)(C)[C@@H](O)C(=O)NCCC(O)=O","InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1","GHOKWGTUZJEAQD-ZETCQYMHSA-N"
"CNC[C@H](O)c(c1)cc(O)cc1","InChI=1S/C9H13NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7/h2-5,9-12H,6H2,1H3/t9-/m0/s1","SONNWYBIRXJNDC-VIFPVBQESA-N"
"O=C(C=3)Oc(c1)c(C3)cc(c2)c(oc2)1","InChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6H","ZCCUUQDIBDJBTK-UHFFFAOYSA-N"
"OC(=O)CCCCCCCCC(O)=O","InChI=1S/C10H18O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h1-8H2,(H,11,12)(H,13,14)","CXMXRPHRNRROMY-UHFFFAOYSA-N"
"OC(=O)C(C1)=CC([H])(O)C([H])(O)C([H])(O)1","InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)/t4-,5-,6-/m1/s1","JXOHGGNKMLTUBP-HSUXUTPPSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@](CO)(O2)[C@@H](O)[C@H](O)[C@@H](CO)2","InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12+/m1/s1","CZMRCDWAGMRECN-UGDNZRGBSA-N"
"NCCS(O)(=O)=O","InChI=1S/C2H7NO3S/c3-1-2-7(4,5)6/h1-3H2,(H,4,5,6)","XOAAWQZATWQOTB-UHFFFAOYSA-N"
"OC(=O)CCC(=O)C(O)=O","InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)","KPGXRSRHYNQIFN-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)[C@@H]1O[C@H]([C@@H](CO)2)[C@H](O)[C@@H](O)[C@@H](O)O2","InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11+,12+/m1/s1","GUBGYTABKSRVRQ-XLOQQCSPSA-N"
"OC(=O)C(=O)Cc(c1)cccc1","InChI=1S/C9H8O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,11,12)","BTNMPGBKDVTSJY-UHFFFAOYSA-N"
"OC(=O)CC(C(O)=O)=C([H])C(O)=O","InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1-","GTZCVFVGUGFEME-IWQZZHSRSA-N"
"NCCCCCC(O)=O","InChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9)","SLXKOJJOQWFEFD-UHFFFAOYSA-N"
"OC(=O)[C@@H](C)[C@H](N)C(O)=O","InChI=1S/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)/t2-,3-/m0/s1","LXRUAYBIUSUULX-HRFVKAFMSA-N"
"OC(=O)C=Cc(c1)cccc1","InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)/b7-6+","WBYWAXJHAXSJNI-VOTSOKGWSA-N"
"OCCCCCCCCCCCCCCCC(O)=O","InChI=1S/C16H32O3/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h17H,1-15H2,(H,18,19)","UGAGPNKCDRTDHP-UHFFFAOYSA-N"
"OC(=O)C(N)(C1)C1","InChI=1S/C4H7NO2/c5-4(1-2-4)3(6)7/h1-2,5H2,(H,6,7)","PAJPWUMXBYXFCZ-UHFFFAOYSA-N"
"NCC(N)C(O)=O","InChI=1S/C3H8N2O2/c4-1-2(5)3(6)7/h2H,1,4-5H2,(H,6,7)","PECYZEOJVXMISF-UHFFFAOYSA-N"
"OC(=O)C([H])(N)Cc(c1)cc(O)c(O)c1","InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)/t6-/m0/s1","WTDRDQBEARUVNC-LURJTMIESA-N"
"OC(=O)Cc(c1)cc(O)c(O)c1","InChI=1S/C8H8O4/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)","CFFZDZCDUFSOFZ-UHFFFAOYSA-N"
"CC(C)CC(=O)C(O)=O","InChI=1S/C6H10O3/c1-4(2)3-5(7)6(8)9/h4H,3H2,1-2H3,(H,8,9)","BKAJNAXTPSGJCU-UHFFFAOYSA-N"
"NCC(=O)CCC(O)=O","InChI=1S/C5H9NO3/c6-3-4(7)1-2-5(8)9/h1-3,6H2,(H,8,9)","ZGXJTSGNIOSYLO-UHFFFAOYSA-N"
"OC[C@@](C)(N)C(O)=O","InChI=1S/C4H9NO3/c1-4(5,2-6)3(7)8/h6H,2,5H2,1H3,(H,7,8)/t4-/m1/s1","CDUUKBXTEOFITR-SCSAIBSYSA-N"
"O(C(CCCC(C)CCCC(C)CCCC(C)C)1C)c(c(C)2)c(c(C)c(O)c2C)CC1","InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3/t21-,22-,29-/m1/s1","GVJHHUAWPYXKBD-IEOSBIPESA-N"
"OC[C@@H](O)[C@@H](O)[C@H](O)C(=O)CO","InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5-,6-/m1/s1","BJHIKXHVCXFQLS-UYFOZJQFSA-N"
"OCC([H])(O)C([H])(O)C([H])(O)C([H])(O)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5-,6-/m1/s1","FBPFZTCFMRRESA-KVTDHHQDSA-N"
"OC(=O)[C@H](N)C(C)(C)S","InChI=1S/C5H11NO2S/c1-5(2,9)3(6)4(7)8/h3,9H,6H2,1-2H3,(H,7,8)/t3-/m0/s1","VVNCNSJFMMFHPL-VKHMYHEASA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)C(O)1","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6?/m1/s1","WQZGKKKJIJFFOK-SVZMEOIVSA-N"
"OCC(O1)C(O)C(O)C(N)C(O)1","InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6-/m1/s1","MSWZFWKMSRAUBD-QZABAPFNSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)C(O)1","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6?/m1/s1","WQZGKKKJIJFFOK-GASJEMHNSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@H]([C@@H](CO)2)[C@H](O)[C@@H](O)C(O)O2","InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8-,9-,10-,11?,12-/m1/s1","GUBGYTABKSRVRQ-PICCSMPSSA-N"
"OCC(O1)C(O)C(O)C(O)C(O)1","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5+,6?/m1/s1","WQZGKKKJIJFFOK-QTVWNMPRSA-N"
"O=CC(N)C(O)C(O)C(O)CO","InChI=1S/C6H13NO5/c7-3(1-8)5(11)6(12)4(10)2-9/h1,3-6,9-12H,2,7H2/t3-,4+,5+,6-/m0/s1","FZHXIRIBWMQPQF-KCDKBNATSA-N"
"OC(O1)[C@H](O)[C@@H](O)[C@H](O)[C@H]1COP(O)(O)=O","InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6?/m1/s1","NBSCHQHZLSJFNQ-GASJEMHNSA-N"
"OC(=O)[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)C(O)1","InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2-,3+,4-,6?/m0/s1","AEMOLEFTQBMNLQ-AQKNRBDQSA-N"
"OC(O1)[C@H](O)[C@H](O)[C@H]1COP(O)(O)=O","InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5?/m1/s1","KTVPXOYAKDPRHY-SOOFDHNKSA-N"
"OC(=O)CNC(=O)[C@H](CSSC[C@H](NC(=O)CC[C@H](N)C(O)=O)C(=O)NCC(O)=O)NC(=O)CC[C@H](N)C(O)=O","InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)/t9-,10-,11-,12-/m0/s1","YPZRWBKMTBYPTK-BJDJZHNGSA-N"
"OCC(O)COP(O)(O)=O","InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)/t3-/m0/s1","AWUCVROLDVIAJX-VKHMYHEASA-N"
"COc(c3)cc(=N1)c(c3)=C(C2)C(=C(C)NC2)1","InChI=1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,14H,5-6H2,1-2H3","QJOZJXNKVMFAET-UHFFFAOYSA-N"
"C1=C(NC=N1)CCN","InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8)","NTYJJOPFIAHURM-UHFFFAOYSA-N"
"C([C@@H](C([C@H](CO)O)O)O)O","InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4-/m0/s1","HEBKCHPVOIAQTA-IMJSIDKUSA-N"
"OC(=O)CC(O)C(O)=O","InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1","BJEPYKJPYRNKOW-REOHCLBHSA-N"
"NC(=N)NCCC[C@H](N)C(O)=O","InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1","ODKSFYDXXFIFQN-BYPYZUCNSA-N"
"OC(=O)C([H])(N)CSSCC([H])(N)C(O)=O","InChI=1S/C6H12N2O4S2/c7-3(5(9)10)1-13-14-2-4(8)6(11)12/h3-4H,1-2,7-8H2,(H,9,10)(H,11,12)/t3-,4-/m0/s1","LEVWYRKDKASIDU-IMJSIDKUSA-N"
"OC(=O)CNC(=O)C(CS)NC(=O)CCC(N)C(O)=O","InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1","RWSXRVCMGQZWBV-WDSKDSINSA-N"
"SCCC(N)C(O)=O","InChI=1S/C4H9NO2S/c5-3(1-2-8)4(6)7/h3,8H,1-2,5H2,(H,6,7)/t3-/m0/s1","FFFHZYDWPBMWHY-VKHMYHEASA-N"
"OCC[C@H](N)C(O)=O","InChI=1S/C4H9NO3/c5-3(1-2-6)4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1","UKAUYVFTDYCKQA-VKHMYHEASA-N"
"OC(C1)CC(N1)C(O)=O","InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3?,4-/m0/s1","PMMYEEVYMWASQN-BKLSDQPFSA-N"
"SCCC(S)CCCCC(O)=O","InChI=1S/C8H16O2S2/c9-8(10)4-2-1-3-7(12)5-6-11/h7,11-12H,1-6H2,(H,9,10)","IZFHEQBZOYJLPK-UHFFFAOYSA-N"
"CCC[C@H](N)C(O)=O","InChI=1S/C5H11NO2/c1-2-3-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)/t4-/m0/s1","SNDPXSYFESPGGJ-BYPYZUCNSA-N"
"[H]C(C)(O)C([H])(N)C(O)=O","InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1","AYFVYJQAPQTCCC-GBXIJSLDSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(CO)3)C(O)C(O)C(O3)OC(C(CO)2)C(O)C(O)C(O)O2","InChI=1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14-,15-,16?,17-,18-/m1/s1","FYGDTMLNYKFZSV-DZOUCCHMSA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)[C@@H](OC[C@@H](O2)[C@@H](O)[C@H](O)[C@@H](O)C(O)2)1","InChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5+,6-,7+,8+,9-,10-,11?,12+/m1/s1","DLRVVLDZNNYCBX-ABXHMFFYSA-N"
"O[C@H]([C@@H](O)1)[C@H](O)[C@@H](O)[C@@H](O)[C@@H](O)1","InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-","CDAISMWEOUEBRE-GPIVLXJGSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](NC(C)=O)C(O)1","InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5-,6-,7-,8?/m1/s1","OVRNDRQMDRJTHS-RTRLPJTCSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H](NC(C)=O)C(O)1","InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)/t4-,5+,6-,7-,8?/m1/s1","OVRNDRQMDRJTHS-ZTVVOAFPSA-N"
"NCCCCNC(C)=O","InChI=1S/C6H14N2O/c1-6(9)8-5-3-2-4-7/h2-5,7H2,1H3,(H,8,9)","KLZGKIDSEJWEDW-UHFFFAOYSA-N"
"CC(=O)OC[C@H](N)C(O)=O","InChI=1S/C5H9NO4/c1-3(7)10-2-4(6)5(8)9/h4H,2,6H2,1H3,(H,8,9)/t4-/m0/s1","VZXPDPZARILFQX-BYPYZUCNSA-N"
"N[C@@H](COP(O)(O)=O)C(O)=O","InChI=1S/C3H8NO6P/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)/t2-/m0/s1","BZQFBWGGLXLEPQ-REOHCLBHSA-N"
"OC([C@H]([C@H]([C@H](CO)O)O)O)","InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5-","HEBKCHPVOIAQTA-ZXFHETKHSA-N"
"[O-1]C(=O)C(N)CC[S+1](C)CC(O1)C(O)C(O)C1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25)/t7-,8+,10+,11+,14+,27?/m0/s1","MEFKEPWMEQBLKI-AIRLBKTGSA-N"
"NCCCNCCCCNCCCN","InChI=1S/C10H26N4/c11-5-3-9-13-7-1-2-8-14-10-4-6-12/h13-14H,1-12H2","PFNFFQXMRSDOHW-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1N(C=2)C(=O)NC(=O)C2","InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1","DRTQHJPVMGBUCF-XVFCMESISA-N"
"C[C@@H](N)C(O)=O","InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1","QNAYBMKLOCPYGJ-UWTATZPHSA-N"
"OCC(O)C(O)C([H])(O1)C(NC(C)=O)C(O)CC(O)(C(O)=O)1","InChI=1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)/t5-,6+,7+,8+,9+,11?/m0/s1","SQVRNKJHWKZAKO-LUWBGTNYSA-N"
"CC(=O)NC(CCC(O)=O)C(O)=O","InChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)/t5-/m0/s1","RFMMMVDNIPUKGG-YFKPBYRVSA-N"
"NCCCC(NC(C)=O)C(O)=O","InChI=1S/C7H14N2O3/c1-5(10)9-6(7(11)12)3-2-4-8/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1","JRLGPAXAGHMNOL-LURJTMIESA-N"
"OC(=O)CC(C(O)=O)Nc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(COP(O)(O)=O)1","InChI=1S/C14H18N5O11P/c20-7(21)1-5(14(24)25)18-11-8-12(16-3-15-11)19(4-17-8)13-10(23)9(22)6(30-13)2-29-31(26,27)28/h3-6,9-10,13,22-23H,1-2H2,(H,20,21)(H,24,25)(H,15,16,18)(H2,26,27,28)/t5-,6+,9+,10+,13+/m0/s1","OFBHPPMPBOJXRT-VWJPMABRSA-N"
"OC(=O)CC(C(O)=O)NC(=N)NCCCC(N)C(O)=O","InChI=1S/C10H18N4O6/c11-5(8(17)18)2-1-3-13-10(12)14-6(9(19)20)4-7(15)16/h5-6H,1-4,11H2,(H,15,16)(H,17,18)(H,19,20)(H3,12,13,14)/t5-,6-/m0/s1","KDZOASGQNOPSCU-WDSKDSINSA-N"
"C1=CC=C2C(=C1)NC(=N2)N","InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)","JWYUFVNJZUSCSM-UHFFFAOYSA-N"
"C1=NNC(=N1)N","InChI=1S/C2H4N4/c3-2-4-1-5-6-2/h1H,(H3,3,4,5,6)","KLSJWNVTNUYHDU-UHFFFAOYSA-N"
"OC(=O)C(C)(C)N","InChI=1S/C4H9NO2/c1-4(2,5)3(6)7/h5H2,1-2H3,(H,6,7)","FUOOLUPWFVMBKG-UHFFFAOYSA-N"
"OC(=O)C(N)(C1)CCC1","InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9)","NILQLFBWTXNUOE-UHFFFAOYSA-N"
"CC(N)P(O)(O)=O","InChI=1S/C2H8NO3P/c1-2(3)7(4,5)6/h2H,3H2,1H3,(H2,4,5,6)/t2-/m1/s1","UIQSKEDQPSEGAU-UWTATZPHSA-N"
"OC(=O)C(N)CSCC(O)=O","InChI=1S/C5H9NO4S/c6-3(5(9)10)1-11-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1","GBFLZEXEOZUWRN-VKHMYHEASA-N"
"OC(=O)CCCCCCCC(O)=O","InChI=1S/C9H16O4/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H,10,11)(H,12,13)","BDJRBEYXGGNYIS-UHFFFAOYSA-N"
"CSCC[C@H](NC(C)=O)C(O)=O","InChI=1S/C7H13NO3S/c1-5(9)8-6(7(10)11)3-4-12-2/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1","XUYPXLNMDZIRQH-LURJTMIESA-N"
"CC(=O)N[C@H](C(O)=O)Cc(c1)cccc1","InChI=1S/C11H13NO3/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15)/t10-/m0/s1","CBQJSKKFNMDLON-JTQLQIEISA-N"
"OCCOCn(c2)c(N1)c(n2)C(=O)N=C(N)1","InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15)","MKUXAQIIEYXACX-UHFFFAOYSA-N"
"CC(=O)N[C@@H](CC1=CN=CN1)C(=O)O","InChI=1S/C8H11N3O3/c1-5(12)11-7(8(13)14)2-6-3-9-4-10-6/h3-4,7H,2H2,1H3,(H,9,10)(H,11,12)(H,13,14)/t7-/m0/s1","KBOJOGQFRVVWBH-ZETCQYMHSA-N"
"CCC(N)C(O)=O","InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m1/s1","QWCKQJZIFLGMSD-GSVOUGTGSA-N"
"CC(=O)CCCC(O)=O","InChI=1S/C6H10O3/c1-5(7)3-2-4-6(8)9/h2-4H2,1H3,(H,8,9)","MGTZCLMLSSAXLD-UHFFFAOYSA-N"
"CC(=O)NCCC1=CN=CN1","InChI=1S/C7H11N3O/c1-6(11)9-3-2-7-4-8-5-10-7/h4-5H,2-3H2,1H3,(H,8,10)(H,9,11)","XJWPISBUKWZALE-UHFFFAOYSA-N"
"OC(=O)CC(=CC(O)=O)C(O)=O","InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1+","GTZCVFVGUGFEME-HNQUOIGGSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](NC(C)=O)[C@H]1OP(O)(O)=O","InChI=1S/C8H16NO9P/c1-3(11)9-5-7(13)6(12)4(2-10)17-8(5)18-19(14,15)16/h4-8,10,12-13H,2H2,1H3,(H,9,11)(H2,14,15,16)/t4-,5-,6-,7-,8-/m1/s1","FZLJPEPAYPUMMR-FMDGEEDCSA-N"
"NCCCC[C@@H](C(O)=O)NC(=O)CCN","InChI=1S/C9H19N3O3/c10-5-2-1-3-7(9(14)15)12-8(13)4-6-11/h7H,1-6,10-11H2,(H,12,13)(H,14,15)/t7-/m0/s1","PLDCWKCPEXNWJH-ZETCQYMHSA-N"
"OC(=O)C#CC(O)=O","InChI=1S/C4H2O4/c5-3(6)1-2-4(7)8/h(H,5,6)(H,7,8)","YTIVTFGABIZHHX-UHFFFAOYSA-N"
"Nc(c1)cc(O)c(c1)C(O)=O","InChI=1S/C7H7NO3/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3,9H,8H2,(H,10,11)","WUBBRNOQWQTFEX-UHFFFAOYSA-N"
"NC(C(O)=O)CP(O)(O)=O","InChI=1S/C3H8NO5P/c4-2(3(5)6)1-10(7,8)9/h2H,1,4H2,(H,5,6)(H2,7,8,9)","LBTABPSJONFLPO-UHFFFAOYSA-N"
"NC(=O)c(n2)c(N)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C9H15N4O8P/c10-7-4(8(11)16)12-2-13(7)9-6(15)5(14)3(21-9)1-20-22(17,18)19/h2-3,5-6,9,14-15H,1,10H2,(H2,11,16)(H2,17,18,19)/t3-,5-,6-,9-/m1/s1","NOTGFIUVDGNKRI-UUOKFMHZSA-N"
"C1=NC(=C(N1)C(=O)N)N","InChI=1S/C4H6N4O/c5-3-2(4(6)9)7-1-8-3/h1H,5H2,(H2,6,9)(H,7,8)","DVNYTAVYBRSTGK-UHFFFAOYSA-N"
"CC(=O)NCCC(O)=O","InChI=1S/C5H9NO3/c1-4(7)6-3-2-5(8)9/h2-3H2,1H3,(H,6,7)(H,8,9)","LJLLAWRMBZNPMO-UHFFFAOYSA-N"
"NC(=O)NC(NC(N)=O)C(O)=O","InChI=1S/C4H8N4O4/c5-3(11)7-1(2(9)10)8-4(6)12/h1H,(H,9,10)(H3,5,7,11)(H3,6,8,12)","NUCLJNSWZCHRKL-UHFFFAOYSA-N"
"NCCC(=O)N[C@H](C(O)=O)Cc(c1)n(C)cn1","InChI=1S/C10H16N4O3/c1-14-6-12-5-7(14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)/t8-/m0/s1","MYYIAHXIVFADCU-QMMMGPOBSA-N"
"CC(=O)N[C@@H](CC(O)=O)C(O)=O","InChI=1S/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)/t4-/m0/s1","OTCCIMWXFLJLIA-BYPYZUCNSA-N"
"CC(=O)NC(C(O)1)C(O)C(O)C(O1)COP(O)(O)=O","InChI=1S/C8H16NO9P/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16/h4-8,11-13H,2H2,1H3,(H,9,10)(H2,14,15,16)/t4-,5-,6-,7-,8?/m1/s1","BRGMHAYQAZFZDJ-RTRLPJTCSA-N"
"O=C[C@@H](O)[C@H](O)[C@H](O)COP(O)(O)=O","InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h1,3-5,7-9H,2H2,(H2,10,11,12)/t3-,4-,5+/m1/s1","PPQRONHOSHZGFQ-WDCZJNDASA-N"
"CC(=O)CC(N)=O","InChI=1S/C4H7NO2/c1-3(6)2-4(5)7/h2H2,1H3,(H2,5,7)","GCPWJFKTWGFEHH-UHFFFAOYSA-N"
"CC(=O)NCCCC[C@H](N)C(O)=O","InChI=1S/C8H16N2O3/c1-6(11)10-5-3-2-4-7(9)8(12)13/h7H,2-5,9H2,1H3,(H,10,11)(H,12,13)/t7-/m0/s1","DTERQYGMUDWYAZ-ZETCQYMHSA-N"
"OC(=O)CC(N)c(c1)ccc(O)c1","InChI=1S/C9H11NO3/c10-8(5-9(12)13)6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)","JYPHNHPXFNEZBR-UHFFFAOYSA-N"
"c(c3)ccc(c3)Nc(c2)c(c(cc2)1)c(ccc1)S(O)(=O)=O","InChI=1S/C16H13NO3S/c18-21(19,20)15-11-5-7-12-6-4-10-14(16(12)15)17-13-8-2-1-3-9-13/h1-11,17H,(H,18,19,20)","FWEOQOXTVHGIFQ-UHFFFAOYSA-N"
"CC(=O)NC(C(O)1)C(O)C(O)C(O1)COS(O)(=O)=O","InChI=1S/C8H15NO9S/c1-3(10)9-5-7(12)6(11)4(18-8(5)13)2-17-19(14,15)16/h4-8,11-13H,2H2,1H3,(H,9,10)(H,14,15,16)/t4-,5-,6+,7-,8-/m1/s1","WJFVEEAIYIOATH-JAJWTYFOSA-N"
"CCC(C)(N)C(O)=O","InChI=1S/C5H11NO2/c1-3-5(2,6)4(7)8/h3,6H2,1-2H3,(H,7,8)","GCHPUFAZSONQIV-UHFFFAOYSA-N"
"OCC(O1)C(O)C(OC(C)C(O)=O)C(NC(C)=O)C(O)1","InChI=1S/C11H19NO8/c1-4(10(16)17)19-9-7(12-5(2)14)11(18)20-6(3-13)8(9)15/h4,6-9,11,13,15,18H,3H2,1-2H3,(H,12,14)(H,16,17)/t4-,6-,7-,8-,9-,11?/m1/s1","MNLRQHMNZILYPY-MKFCKLDKSA-N"
"CCNC(=N1)NC(NC(C)C)=NC(=O)1","InChI=1S/C8H15N5O/c1-4-9-6-11-7(10-5(2)3)13-8(14)12-6/h5H,4H2,1-3H3,(H3,9,10,11,12,13,14)","NFMIMWNQWAWNDW-UHFFFAOYSA-N"
"OC(=O)[C@H](C1)NC1","InChI=1S/C4H7NO2/c6-4(7)3-1-2-5-3/h3,5H,1-2H2,(H,6,7)/t3-/m0/s1","IADUEWIQBXOCDZ-VKHMYHEASA-N"
"Nc(c2)ccc(c2)S(=O)(=O)c(c1)ccc(N)c1","InChI=1S/C12H12N2O2S/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12/h1-8H,13-14H2","MQJKPEGWNLWLTK-UHFFFAOYSA-N"
"NCP(O)(O)=O","InChI=1S/CH6NO3P/c2-1-6(3,4)5/h1-2H2,(H2,3,4,5)","MGRVRXRGTBOSHW-UHFFFAOYSA-N"
"CC[C@H](N)C(O)=O","InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)/t3-/m0/s1","QWCKQJZIFLGMSD-VKHMYHEASA-N"
"OC(=O)CC(C(O)=O)Cc(c1)cccc1","InChI=1S/C11H12O4/c12-10(13)7-9(11(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)(H,14,15)/t9-/m1/s1","GTOFKXZQQDSVFH-SECBINFHSA-N"
"C1=CC=C2C(=C1)NC=N2","InChI=1S/C7H6N2/c1-2-4-7-6(3-1)8-5-9-7/h1-5H,(H,8,9)","HYZJCKYKOHLVJF-UHFFFAOYSA-N"
"C1=CC=C(C=C1)CNC2=NC=NC3=C2NC=N3","InChI=1S/C12H11N5/c1-2-4-9(5-3-1)6-13-11-10-12(15-7-14-10)17-8-16-11/h1-5,7-8H,6H2,(H2,13,14,15,16,17)","NWBJYWHLCVSVIJ-UHFFFAOYSA-N"
"CC(C)CC(C(O)=O)NC(=O)C(O)C(N)Cc(c1)cccc1","InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)","VGGGPCQERPFHOB-UHFFFAOYSA-N"
"NC(=N)N(C)CC[C@@H](N)CC(=O)N[C@@H](C=2)[C@@H](C(O)=O)O[C@H](C2)N(C=1)C(=O)N=C(N)C1","InChI=1S/C17H26N8O5/c1-24(16(20)21)6-4-9(18)8-12(26)22-10-2-3-13(30-14(10)15(27)28)25-7-5-11(19)23-17(25)29/h2-3,5,7,9-10,13-14H,4,6,8,18H2,1H3,(H3,20,21)(H,22,26)(H,27,28)(H2,19,23,29)","CXNPLSGKWMLZPZ-UHFFFAOYSA-N"
"OC(=O)CCCC[C@H](S1)[C@@H](N2)[C@@H](NC(=O)2)C1","InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1","YBJHBAHKTGYVGT-ZKWXMUAHSA-N"
"NC(=O)C[C@@H](C(O)=O)NC(=O)OC(C)(C)C","InChI=1S/C9H16N2O5/c1-9(2,3)16-8(15)11-5(7(13)14)4-6(10)12/h5H,4H2,1-3H3,(H2,10,12)(H,11,15)(H,13,14)/t5-/m0/s1","FYYSQDHBALBGHX-YFKPBYRVSA-N"
"OC(=O)C(=O)c(c1)cccc1","InChI=1S/C8H6O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5H,(H,10,11)","FAQJJMHZNSSFSM-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c2)ccc(c2)OP(O)(=O)Oc(c1)ccc([N+1]([O-1])=O)c1","InChI=1S/C12H9N2O8P/c15-13(16)9-1-5-11(6-2-9)21-23(19,20)22-12-7-3-10(4-8-12)14(17)18/h1-8H,(H,19,20)","MHSVUSZEHNVFKW-UHFFFAOYSA-N"
"CC(C)N(C(=O)1)S(=O)(=O)Nc(c2)c(ccc2)1","InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3","ZOMSMJKLGFBRBS-UHFFFAOYSA-N"
"CCCCNc(c1)c(Oc(c2)cccc2)c(cc(C(O)=O)1)S(N)(=O)=O","InChI=1S/C17H20N2O5S/c1-2-3-9-19-14-10-12(17(20)21)11-15(25(18,22)23)16(14)24-13-7-5-4-6-8-13/h4-8,10-11,19H,2-3,9H2,1H3,(H,20,21)(H2,18,22,23)","MAEIEVLCKWDQJH-UHFFFAOYSA-N"
"C1=C(NC=N1)C[C@@H](C(=O)O)NC(=O)CCN","InChI=1S/C9H14N4O3/c10-2-1-8(14)13-7(9(15)16)3-6-4-11-5-12-6/h4-5,7H,1-3,10H2,(H,11,12)(H,13,14)(H,15,16)/t7-/m0/s1","CQOVPNPJLQNMDC-ZETCQYMHSA-N"
"NC(=O)NCCC[C@H](N)C(O)=O","InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)/t4-/m0/s1","RHGKLRLOHDJJDR-BYPYZUCNSA-N"
"NC(=O)N[C@@H](CC(O)=O)C(O)=O","InChI=1S/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/t2-/m0/s1","HLKXYZVTANABHZ-REOHCLBHSA-N"
"NC(C=1)=NC(=O)NC1","InChI=1S/C4H5N3O/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8)","OPTASPLRGRRNAP-UHFFFAOYSA-N"
"O=C(C1)NC(=N)N(C)1","InChI=1S/C4H7N3O/c1-7-2-3(8)6-4(7)5/h2H2,1H3,(H2,5,6,8)","DDRJAANPRJIHGJ-UHFFFAOYSA-N"
"O=Cc(c1)c(ccc1)C(O)=O","InChI=1S/C8H6O3/c9-5-6-3-1-2-4-7(6)8(10)11/h1-5H,(H,10,11)","DYNFCHNNOHNJFG-UHFFFAOYSA-N"
"OC[C@H](NC(=O)C(Cl)Cl)[C@@H](O)c(c1)ccc(c1)[N+1]([O-1])=O","InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)/t8-,9-/m0/s1","WIIZWVCIJKGZOK-IUCAKERBSA-N"
"OC(=O)CC[C@@H](C)[C@@H](C4)[C@](C)([C@@H](O)3)[C@@H](C4)[C@H]([C@H](O)1)[C@H](C3)[C@](C)(C2)[C@@H](C[C@H](O)C2)C1","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-OELDTZBJSA-N"
"Cc(n2)nc(N)c(c2)C[n+1](c1)c(C)c(CCOP(O)(=O)OP(O)(O)=O)s1","InChI=1S/C12H18N4O7P2S/c1-8-11(3-4-22-25(20,21)23-24(17,18)19)26-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H4-,13,14,15,17,18,19,20,21)/p+1","AYEKOFBPNLCAJY-UHFFFAOYSA-O"
"OC(=O)CC[C@H](NC(N)=O)C(O)=O","InChI=1S/C6H10N2O5/c7-6(13)8-3(5(11)12)1-2-4(9)10/h3H,1-2H2,(H,9,10)(H,11,12)(H3,7,8,13)/t3-/m0/s1","LCQLHJZYVOQKHU-VKHMYHEASA-N"
"NC(=N)NOCCC(N)C(O)=O","InChI=1S/C5H12N4O3/c6-3(4(10)11)1-2-12-9-5(7)8/h3H,1-2,6H2,(H,10,11)(H4,7,8,9)/t3-/m0/s1","FSBIGDSBMBYOPN-VKHMYHEASA-N"
"C[C@](CC(=O)O)(C(=O)O)O","InChI=1S/C5H8O5/c1-5(10,4(8)9)2-3(6)7/h10H,2H2,1H3,(H,6,7)(H,8,9)/t5-/m0/s1","XFTRTWQBIOMVPK-YFKPBYRVSA-N"
"OC(=O)C=Cc(c1)cc(O)c(O)c1","InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2-","QAIPRVGONGVQAS-RQOWECAXSA-N"
"OCC(O1)C(O)C(O)C1N(C=2)C(=O)N=C(N)C2","InChI=1S/C9H13N3O5/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8/h1-2,4,6-8,13-15H,3H2,(H2,10,11,16)/t4-,6-,7+,8-/m1/s1","UHDGCWIWMRVCDJ-CCXZUQQUSA-N"
"N[C@H](C(O)=O)CSS(O)(=O)=O","InChI=1S/C3H7NO5S2/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1","NOKPBJYHPHHWAN-REOHCLBHSA-N"
"OC(=O)COc(c1)ccc(Cl)c1","InChI=1S/C8H7ClO3/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4H,5H2,(H,10,11)","SODPIMGUZLOIPE-UHFFFAOYSA-N"
"CC(C)c(c1)ccc(c1)C(O)=O","InChI=1S/C10H12O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H,11,12)","CKMXAIVXVKGGFM-UHFFFAOYSA-N"
"OCC(O1)C(O)CC1OP(O)(O)=O","InChI=1S/C5H11O7P/c6-2-4-3(7)1-5(11-4)12-13(8,9)10/h3-7H,1-2H2,(H2,8,9,10)/t3-,4+,5+/m0/s1","KBDKAJNTYKVSEK-VPENINKCSA-N"
"OCC(=O)COP(O)(O)=O","InChI=1S/C3H7O6P/c4-1-3(5)2-9-10(6,7)8/h4H,1-2H2,(H2,6,7,8)","GNGACRATGGDKBX-UHFFFAOYSA-N"
"OC(=O)[C@@H](COP(O)(O)=O)OP(O)(O)=O","InChI=1S/C3H8O10P2/c4-3(5)2(13-15(9,10)11)1-12-14(6,7)8/h2H,1H2,(H,4,5)(H2,6,7,8)(H2,9,10,11)/t2-/m1/s1","XOHUEYCVLUUEJJ-UWTATZPHSA-N"
"OC(C1)O[C@H](COP(O)(O)=O)[C@@H](O)1","InChI=1S/C5H11O7P/c6-3-1-5(7)12-4(3)2-11-13(8,9)10/h3-7H,1-2H2,(H2,8,9,10)/t3-,4+,5?/m0/s1","KKZFLSZAWCYPOC-PYHARJCCSA-N"
"OC(=O)C(Cl)Cl","InChI=1S/C2H2Cl2O2/c3-1(4)2(5)6/h1H,(H,5,6)","JXTHNDFMNIQAHM-UHFFFAOYSA-N"
"NCCc(c1)cc(O)c(O)c1","InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2","VYFYYTLLBUKUHU-UHFFFAOYSA-N"
"OC(=O)CCc(c1)cc(O)c(O)c1","InChI=1S/C9H10O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1,3,5,10-11H,2,4H2,(H,12,13)","DZAUWHJDUNRCTF-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)cc(Cl)c(N)c(Cl)1","InChI=1S/C6H4Cl2N2O2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H,9H2","BIXZHMJUSMUDOQ-UHFFFAOYSA-N"
"OC(=O)CCCCCCCCCCC(O)=O","InChI=1S/C12H22O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h1-10H2,(H,13,14)(H,15,16)","TVIDDXQYHWJXFK-UHFFFAOYSA-N"
"OC(=O)c(c1)c(O)c([N+1]([O-1])=O)cc([N+1]([O-1])=O)1","InChI=1S/C7H4N2O7/c10-6-4(7(11)12)1-3(8(13)14)2-5(6)9(15)16/h1-2,10H,(H,11,12)","LWFUFLREGJMOIZ-UHFFFAOYSA-N"
"CC(N1)=NS(=O)(=O)c(c2)c(ccc(Cl)2)1","InChI=1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11)","GDLBFKVLRPITMI-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)C[C@@H]1N(C=2)C(=O)N=C(N)C2","InChI=1S/C9H13N3O4/c10-7-1-2-12(9(15)11-7)8-3-5(14)6(4-13)16-8/h1-2,5-6,8,13-14H,3-4H2,(H2,10,11,15)/t5-,6+,8+/m0/s1","CKTSBUTUHBMZGZ-SHYZEUOFSA-N"
"OC(=O)[C@@H](N)Cc(c1)cc(I)c(O)c(I)1","InChI=1S/C9H9I2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m0/s1","NYPYHUZRZVSYKL-ZETCQYMHSA-N"
"OC[C@@H](O1)[C@@H](O)C[C@@H]1n(c3)c(N=2)c(n3)C(=O)NC(N)2","InChI=1S/C10H13N5O4/c11-10-13-8-7(9(18)14-10)12-3-15(8)6-1-4(17)5(2-16)19-6/h3-6,16-17H,1-2H2,(H3,11,13,14,18)/t4-,5+,6+/m0/s1","YKBGVTZYEHREMT-KVQBGUIXSA-N"
"Fc(c2)cc(F)c(c2)c(c1)cc(C(O)=O)c(O)c1","InChI=1S/C13H8F2O3/c14-8-2-3-9(11(15)6-8)7-1-4-12(16)10(5-7)13(17)18/h1-6,16H,(H,17,18)","HUPFGZXOMWLGNK-UHFFFAOYSA-N"
"c(c43)(C[C@](C(=O)CO)(C[C@@H]4OC(C5)O[C@@H](C)[C@@H](O)[C@@H](N)5)O)c(O)c(c1c(O)3)c(c(c2)c(c(OC)cc2)c1=O)=O","InChI=1S/C27H29NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3","AOJJSUZBOXZQNB-UHFFFAOYSA-N"
"OC(=O)C(O)c(c1)cc(O)c(O)c1","InChI=1S/C8H8O5/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7,9-11H,(H,12,13)","RGHMISIYKIHAJW-UHFFFAOYSA-N"
"OC(=O)C(O1)C(O)C(O)C(O)C1OC(C(O)2)C(C(O)=O)OC(O)C(O)2","InChI=1S/C12H18O13/c13-1-2(14)7(9(18)19)25-12(5(1)17)24-6-3(15)4(16)11(22)23-8(6)10(20)21/h1-8,11-17,22H,(H,18,19)(H,20,21)/t1-,2+,3+,4+,5+,6+,7-,8-,11?,12-/m0/s1","IGSYEZFZPOZFNC-LKIWRGPLSA-N"
"OC(C1)O[C@H](COP(O)(O)=O)[C@@H](O)[C@H](O)1","InChI=1S/C6H13O8P/c7-3-1-5(8)14-4(6(3)9)2-13-15(10,11)12/h3-9H,1-2H2,(H2,10,11,12)/t3-,4-,5?,6+/m1/s1","UQJFZAAGZAYVKZ-CERMHHMHSA-N"
"CCOP(O)(=S)OCC","InChI=1S/C4H11O3PS/c1-3-6-8(5,9)7-4-2/h3-4H2,1-2H3,(H,5,9)","PKUWKAXTAVNIJR-UHFFFAOYSA-N"
"CN(C)[C@@H](CC1=CN=CN1)C(=O)O","InChI=1S/C8H13N3O2/c1-11(2)7(8(12)13)3-6-4-9-5-10-6/h4-5,7H,3H2,1-2H3,(H,9,10)(H,12,13)/t7-/m0/s1","IMOBSLOLPCWZKQ-ZETCQYMHSA-N"
"OC(=O)c(c1)c(Cl)cc(Cl)c1","InChI=1S/C7H4Cl2O2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)","ATCRIUVQKHMXSH-UHFFFAOYSA-N"
"CCOP(O)(=O)OCC","InChI=1S/C4H11O4P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H,5,6)","UCQFCFPECQILOL-UHFFFAOYSA-N"
"CCNC(=O)CC[C@H](N)C(O)=O","InChI=1S/C7H14N2O3/c1-2-9-6(10)4-3-5(8)7(11)12/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t5-/m0/s1","DATAGRPVKZEWHA-YFKPBYRVSA-N"
"NCCOP(O)(O)=O","InChI=1S/C2H8NO4P/c3-1-2-7-8(4,5)6/h1-3H2,(H2,4,5,6)","SUHOOTKUPISOBE-UHFFFAOYSA-N"
"CC(O)(P(O)(O)=O)P(O)(O)=O","InChI=1S/C2H8O7P2/c1-2(3,10(4,5)6)11(7,8)9/h3H,1H3,(H2,4,5,6)(H2,7,8,9)","DBVJJBKOTRCVKF-UHFFFAOYSA-N"
"CC(N1)=NC(CC1)C(O)=O","InChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)","WQXNXVUDBPYKBA-UHFFFAOYSA-N"
"CCc(n1)cc(cc1)C(N)=S","InChI=1S/C8H10N2S/c1-2-7-5-6(8(9)11)3-4-10-7/h3-5H,2H2,1H3,(H2,9,11)","AEOCXXJPGCBFJA-UHFFFAOYSA-N"
"NC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)C(O1)C(C(O)=O)1","InChI=1S/C15H27N5O5/c1-8(2)7-9(20-13(22)10-11(25-10)14(23)24)12(21)18-5-3-4-6-19-15(16)17/h8-11H,3-7H2,1-2H3,(H,18,21)(H,20,22)(H,23,24)(H4,16,17,19)","LTLYEAJONXGNFG-UHFFFAOYSA-N"
"CCOc(c1)cc(cc1)C(O)=O","InChI=1S/C9H10O3/c1-2-12-8-5-3-4-7(6-8)9(10)11/h3-6H,2H2,1H3,(H,10,11)","DTFQMPQJMDEWKJ-UHFFFAOYSA-N"
"CNC[C@H](O)c(c1)cc(O)c(O)c1","InChI=1S/C9H13NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,9-13H,5H2,1H3/t9-/m0/s1","UCTWMZQNUQWSLP-VIFPVBQESA-N"
"CCC1=CC=CC2=C1NC3=C2CCOC3(CC)CC(=O)O","InChI=1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)","NNYBQONXHNTVIJ-UHFFFAOYSA-N"
"OCC(O)(O1)C(O)C(O)C(COP(O)(O)=O)1","InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6?/m1/s1","BGWGXPAPYGQALX-VRPWFDPXSA-N"
"OC(COP(O)(O)=O)C(O)C(O)C(=O)COP(O)(O)=O","InChI=1S/C6H14O12P2/c7-3(1-17-19(11,12)13)5(9)6(10)4(8)2-18-20(14,15)16/h3,5-7,9-10H,1-2H2,(H2,11,12,13)(H2,14,15,16)/t3-,5-,6-/m1/s1","XPYBSIWDXQFNMH-UYFOZJQFSA-N"
"OC(C(COP(O)(O)=O)1)C(O)C(O)(COP(O)(O)=O)O1","InChI=1S/C6H14O12P2/c7-4-3(1-16-19(10,11)12)18-6(9,5(4)8)2-17-20(13,14)15/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6?/m1/s1","RNBGYGVWRKECFJ-VRPWFDPXSA-N"
"OCC(O)C(O)C(O)C(=O)COP(O)(O)=O","InChI=1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h3,5-8,10-11H,1-2H2,(H2,12,13,14)/t3-,5-,6-/m1/s1","ZKLLSNQJRLJIGT-UYFOZJQFSA-N"
"OCC(O1)C(O)C(O)C(O)1COP(O)(O)=O","InChI=1S/C6H13O9P/c7-1-3-4(8)5(9)6(10,15-3)2-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6?/m1/s1","RHKKZBWRNHGJEZ-VRPWFDPXSA-N"
"OCC(O1)(C(O)C(O)C(COP(O)(O)=O)1)OP(O)(O)=O","InChI=1S/C6H14O12P2/c7-2-6(18-20(13,14)15)5(9)4(8)3(17-6)1-16-19(10,11)12/h3-5,7-9H,1-2H2,(H2,10,11,12)(H2,13,14,15)/t3-,4-,5+,6+/m1/s1","YXWOAJXNVLXPMU-ZXXMMSQZSA-N"
"OC(=O)c(c1)occ1","InChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)","SMNDYUVBFMFKNZ-UHFFFAOYSA-N"
"O=CN[C@@H](CC(O)=O)C(O)=O","InChI=1S/C5H7NO5/c7-2-6-3(5(10)11)1-4(8)9/h2-3H,1H2,(H,6,7)(H,8,9)(H,10,11)/t3-/m0/s1","MQUUQXIFCBBFDP-VKHMYHEASA-N"
"N=CN[C@@H](CC(O)=O)C(O)=O","InChI=1S/C5H8N2O4/c6-2-7-3(5(10)11)1-4(8)9/h2-3H,1H2,(H2,6,7)(H,8,9)(H,10,11)/t3-/m0/s1","XTPIFIMCFHNJOH-VKHMYHEASA-N"
"OC(=O)CC[C@@H](N)C(O)=O","InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m1/s1","WHUUTDBJXJRKMK-GSVOUGTGSA-N"
"O=CC(O)=O","InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5)","HHLFWLYXYJOTON-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(O)C1OP(O)(O)=O","InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1","HXXFSFRBOHSIMQ-VFUOTHLCSA-N"
"OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C(O)=O","InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)/t2-,3-,4+,5-/m1/s1","RGHNJXZEOKUKBD-SQOUGZDYSA-N"
"NC(=N)NCCCC(O)=O","InChI=1S/C5H11N3O2/c6-5(7)8-3-1-2-4(9)10/h1-3H2,(H,9,10)(H4,6,7,8)","TUHVEAJXIMEOSA-UHFFFAOYSA-N"
"OC(=O)CCC(N)C(=O)NC(CCC(O)=O)C(O)=O","InChI=1S/C10H16N2O7/c11-5(1-3-7(13)14)9(17)12-6(10(18)19)2-4-8(15)16/h5-6H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)","KOSRFJWDECSPRO-UHFFFAOYSA-N"
"OC(=O)CCC(N)C(=O)NC(CCC(O)=O)C(O)=O","InChI=1S/C10H16N2O7/c11-5(1-3-7(13)14)9(17)12-6(10(18)19)2-4-8(15)16/h5-6H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1","KOSRFJWDECSPRO-WDSKDSINSA-N"
"","InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1","RFDAIACWWDREDC-FRVQLJSFSA-N"
"OC(=O)C(C)(C7)CC(C(C)(C7)1)(C(=C6)C(C)(C(C5([H])C6=O)(CCC([H])(C25C)C(C)(C)C(OC(O3)C(OC(O4)C(O)C(C(C4C(O)=O)O)O)C(C(C3C(O)=O)O)O)CC2)C)CC1)[H]","InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+/m0/s1","LPLVUJXQOOQHMX-QWBHMCJMSA-N"
"OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](N)C(O)=O","InChI=1S/C6H13NO6/c7-3(6(12)13)5(11)4(10)2(9)1-8/h2-5,8-11H,1,7H2,(H,12,13)/t2-,3-,4-,5-/m1/s1","UFYKDFXCZBTLOO-TXICZTDVSA-N"
"OCC(=O)N[C@H]([C@@H](O)1)[C@H]([C@H](O)[C@H](O)CO)O[C@@](O)(C(O)=O)C1","InChI=1S/C11H19NO10/c13-2-5(16)8(18)9-7(12-6(17)3-14)4(15)1-11(21,22-9)10(19)20/h4-5,7-9,13-16,18,21H,1-3H2,(H,12,17)(H,19,20)/t4-,5+,7+,8+,9+,11-/m0/s1","FDJKUWYYUZCUJX-AJKRCSPLSA-N"
"OCC(O1)C(O)C(O)C(N)C1OP(O)(O)=O","InChI=1S/C6H14NO8P/c7-3-5(10)4(9)2(1-8)14-6(3)15-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4+,5-,6?/m1/s1","YMJBYRVFGYXULK-GASJEMHNSA-N"
"OC(=O)C(O1)C(O)C(O)C(O)C1OP(O)(O)=O","InChI=1S/C6H11O10P/c7-1-2(8)4(5(10)11)15-6(3(1)9)16-17(12,13)14/h1-4,6-9H,(H,10,11)(H2,12,13,14)/t1-,2+,3+,4-,6+/m0/s1","AIQDYKMWENWVQJ-DTEWXJGMSA-N"
"NCC(=O)N[C@@H](CC(C)C)C(O)=O","InChI=1S/C8H16N2O3/c1-5(2)3-6(8(12)13)10-7(11)4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)/t6-/m0/s1","DKEXFJVMVGETOO-LURJTMIESA-N"
"OC(=O)[C@@H]([C@H]21)C(C5)(C4)[C@@H](CC[C@](O)(C(=C)5)4)[C@](C=3)(OC(=O)[C@@](C)([C@@H](O)C3)2)1","InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)","IXORZMNAPKEEDV-UHFFFAOYSA-N"
"C(C1(C)C(O)=O)C(C=52)([H])C(CCC2(C(C3([H])C(=O)C5)(C)CCC(C(C)(C)4)([H])C(C)3CCC(O)4)C)(C)CC1","InChI=1S/C30H46O4/c1-25(2)21-8-11-30(7)23(28(21,5)10-9-22(25)32)20(31)16-18-19-17-27(4,24(33)34)13-12-26(19,3)14-15-29(18,30)6/h16,19,21-23,32H,8-15,17H2,1-7H3,(H,33,34)/t19-,21-,22-,23+,26+,27-,28-,29+,30+/m0/s1","MPDGHEJMBKOTSU-YKLVYJNSSA-N"
"OCC(CO)OCn(c2)c(N=1)c(n2)C(=O)NC(N)1","InChI=1S/C9H13N5O4/c10-9-12-7-6(8(17)13-9)11-3-14(7)4-18-5(1-15)2-16/h3,5,15-16H,1-2,4H2,(H3,10,12,13,17)","IRSCQMHQWWYFCW-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)NC(=N2)N=C(N)N","InChI=1S/C8H9N5/c9-7(10)13-8-11-5-3-1-2-4-6(5)12-8/h1-4H,(H5,9,10,11,12,13)","JJWCTKUQWXYIIU-UHFFFAOYSA-N"
"C1C[C@H](N(C1)C(=O)[C@H](CC2=CN=CN2)NC(=O)[C@@H]3CCC(=O)N3)C(=O)N","InChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25)/t10-,11-,12-/m0/s1","XNSAINXGIQZQOO-SRVKXCTJSA-N"
"O=C(C=1)NC=C(C1)C(O)=O","InChI=1S/C6H5NO3/c8-5-2-1-4(3-7-5)6(9)10/h1-3H,(H,7,8)(H,9,10)","BLHCMGRVFXRYRN-UHFFFAOYSA-N"
"C[C@@H](O)CC(O)=O","InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1","WHBMMWSBFZVSSR-GSVOUGTGSA-N"
"OC(=O)CNC(=O)c(c1)c(O)ccc1","InChI=1S/C9H9NO4/c11-7-4-2-1-3-6(7)9(14)10-5-8(12)13/h1-4,11H,5H2,(H,10,14)(H,12,13)","ONJSZLXSECQROL-UHFFFAOYSA-N"
"OCCCCCCCC(O)=O","InChI=1S/C8H16O3/c9-7-5-3-1-2-4-6-8(10)11/h9H,1-7H2,(H,10,11)","KDMSVYIHKLZKET-UHFFFAOYSA-N"
"CCCCCCC(O)C(O)=O","InChI=1S/C8H16O3/c1-2-3-4-5-6-7(9)8(10)11/h7,9H,2-6H2,1H3,(H,10,11)","JKRDADVRIYVCCY-UHFFFAOYSA-N"
"CCCCC(O)C(O)=O","InChI=1S/C6H12O3/c1-2-3-4-5(7)6(8)9/h5,7H,2-4H2,1H3,(H,8,9)","NYHNVHGFPZAZGA-UHFFFAOYSA-N"
"OC(=O)C(N)CCSSCCC(N)C(O)=O","InChI=1S/C8H16N2O4S2/c9-5(7(11)12)1-3-15-16-4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)","ZTVZLYBCZNMWCF-UHFFFAOYSA-N"
"O[C@@H](C1)C[C@@H](N1)C(O)=O","InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4-/m1/s1","PMMYEEVYMWASQN-QWWZWVQMSA-N"
"COc(c1)c(O)ccc1C(O)C(O)=O","InChI=1S/C9H10O5/c1-14-7-4-5(2-3-6(7)10)8(11)9(12)13/h2-4,8,10-11H,1H3,(H,12,13)","CGQCWMIAEPEHNQ-UHFFFAOYSA-N"
"OCCCCCC(O)=O","InChI=1S/C6H12O3/c7-5-3-1-2-4-6(8)9/h7H,1-5H2,(H,8,9)","IWHLYPDWHHPVAA-UHFFFAOYSA-N"
"NCC(O)CC[C@H](N)C(O)=O","InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)/t4?,5-/m0/s1","YSMODUONRAFBET-AKGZTFGVSA-N"
"NC(=N)NCCCC[C@H](N)C(O)=O","InChI=1S/C7H16N4O2/c8-5(6(12)13)3-1-2-4-11-7(9)10/h5H,1-4,8H2,(H,12,13)(H4,9,10,11)/t5-/m0/s1","QUOGESRFPZDMMT-YFKPBYRVSA-N"
"OCCCCCCCCCC(O)=O","InChI=1S/C10H20O3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h11H,1-9H2,(H,12,13)","YJCJVMMDTBEITC-UHFFFAOYSA-N"
"Oc(c1)ccc(c1)[C@@H](O)C(O)=O","InChI=1S/C8H8O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)/t7-/m1/s1","YHXHKYRQLYQUIH-SSDOTTSWSA-N"
"OC(=O)C(N)C(O)C(O)=O","InChI=1S/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)","YYLQUHNPNCGKJQ-UHFFFAOYSA-N"
"CC(C)CC(O)C(O)=O","InChI=1S/C6H12O3/c1-4(2)3-5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)/t5-/m1/s1","LVRFTAZAXQPQHI-RXMQYKEDSA-N"
"N[C@@H](COS(O)(=O)=O)C(O)=O","InChI=1S/C3H7NO6S/c4-2(3(5)6)1-10-11(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1","LFZGUGJDVUUGLK-REOHCLBHSA-N"
"OC(=O)C(C)c(c1)ccc(O)c1","InChI=1S/C9H10O3/c1-6(9(11)12)7-2-4-8(10)5-3-7/h2-6,10H,1H3,(H,11,12)","ZHMMPVANGNPCBW-UHFFFAOYSA-N"
"OCCC(O)=O","InChI=1S/C3H6O3/c4-2-1-3(5)6/h4H,1-2H2,(H,5,6)","ALRHLSYJTWAHJZ-UHFFFAOYSA-N"
"Oc(c1)c(c2)c(ccc2)nc1","InChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6H,(H,10,11)","PMZDQRJGMBOQBF-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CC(=O)C(=O)O","InChI=1S/C11H9NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H,14,15)","RSTKLPZEZYGQPY-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(N=2)c(n3)C(=O)NC2","InChI=1S/C10H12N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)/t4-,6-,7-,10-/m1/s1","UGQMRVRMYYASKQ-KQYNXXCUSA-N"
"OC(=O)CC(=C)C(O)=O","InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)","LVHBHZANLOWSRM-UHFFFAOYSA-N"
"OC(=O)C(C1)=CCNC1","InChI=1S/C6H9NO2/c8-6(9)5-1-3-7-4-2-5/h1,7H,2-4H2,(H,8,9)","KRVDMABBKYMBHG-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CCO","InChI=1S/C10H11NO/c12-6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,7,11-12H,5-6H2","MBBOMCVGYCRMEA-UHFFFAOYSA-N"
"COc(c1)c(O)cc(C=CC(O)=O)c1","InChI=1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+","QURCVMIEKCOAJU-HWKANZROSA-N"
"C1=CC=C2C(=C1)C(=CN2)CC(=O)N","InChI=1S/C10H10N2O/c11-10(13)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H2,11,13)","ZOAMBXDOGPRZLP-UHFFFAOYSA-N"
"OCCS(O)(=O)=O","InChI=1S/C2H6O4S/c3-1-2-7(4,5)6/h3H,1-2H2,(H,4,5,6)","SUMDYPCJJOFFON-UHFFFAOYSA-N"
"OC(=O)[C@@H](N)Cc(c1)cc(I)c(O)c1","InChI=1S/C9H10INO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1","UQTZMGFTRHFAAM-ZETCQYMHSA-N"
"C1=CC=C2C(=C1)C(=CN2)OS(=O)(=O)O","InChI=1S/C8H7NO4S/c10-14(11,12)13-8-5-9-7-4-2-1-3-6(7)8/h1-5,9H,(H,10,11,12)","BXFFHSIDQOFMLE-UHFFFAOYSA-N"
"NNC(=O)c(c1)ccnc1","InChI=1S/C6H7N3O/c7-9-6(10)5-1-3-8-4-2-5/h1-4H,7H2,(H,9,10)","QRXWMOHMRWLFEY-UHFFFAOYSA-N"
"OC(=O)CCCC(=O)C(O)=O","InChI=1S/C6H8O5/c7-4(6(10)11)2-1-3-5(8)9/h1-3H2,(H,8,9)(H,10,11)","FGSBNBBHOZHUBO-UHFFFAOYSA-N"
"NC(=N)NCCC[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(C)=O","InChI=1S/C20H38N6O4/c1-12(2)9-16(24-14(5)28)19(30)26-17(10-13(3)4)18(29)25-15(11-27)7-6-8-23-20(21)22/h11-13,15-17H,6-10H2,1-5H3,(H,24,28)(H,25,29)(H,26,30)(H4,21,22,23)","GDBQQVLCIARPGH-UHFFFAOYSA-N"
"CC(C)CC(N)C(=O)NC(CC(C)C)C(=O)NC(C(O)=O)Cc(c1)ccc(O)c1","InChI=1S/C21H33N3O5/c1-12(2)9-16(22)19(26)23-17(10-13(3)4)20(27)24-18(21(28)29)11-14-5-7-15(25)8-6-14/h5-8,12-13,16-18,25H,9-11,22H2,1-4H3,(H,23,26)(H,24,27)(H,28,29)/t16-,17-,18-/m0/s1","UCNNZELZXFXXJQ-BZSNNMDCSA-N"
"OC(=O)CNC(=O)[C@@H](NC(=O)CC[C@H](N)C(O)=O)CSC(=O)[C@@H](C)O","InChI=1S/C13H21N3O8S/c1-6(17)13(24)25-5-8(11(21)15-4-10(19)20)16-9(18)3-2-7(14)12(22)23/h6-8,17H,2-5,14H2,1H3,(H,15,21)(H,16,18)(H,19,20)(H,22,23)/t6-,7+,8+/m1/s1","VDYDCVUWILIYQF-CSMHCCOUSA-N"
"OCC(C(O)1)OC([H])(OC(O2)C(C(C)3)C(CC(O)3)C(C(O)=O)=C2)C(O)C(O)1","InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)/t5-,6+,8-,9+,10+,11+,12-,13+,15-,16-/m0/s1","JNNGEAWILNVFFD-CDJYTOATSA-N"
"OC(=O)C[C@H](O)C(O)=O","InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1","BJEPYKJPYRNKOW-REOHCLBHSA-N"
"O[C@H](O1)[C@@H](O)[C@@H](O)[C@H](O)[C@H]1COP(O)(O)=O","InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6?/m1/s1","NBSCHQHZLSJFNQ-QTVWNMPRSA-N"
"CS(O)(=O)=O","InChI=1S/CH4O3S/c1-5(2,3)4/h1H3,(H,2,3,4)","AFVFQIVMOAPDHO-UHFFFAOYSA-N"
"CNC(C)C(O)=O","InChI=1S/C4H9NO2/c1-3(5-2)4(6)7/h3,5H,1-2H3,(H,6,7)/t3-/m0/s1","GDFAOVXKHJXLEI-VKHMYHEASA-N"
"Nc(c1)n(=O)c(N)nc1N(C2)CCCC2","InChI=1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6H,1-5,10H2,(H2,11,12)","ZFMITUMMTDLWHR-UHFFFAOYSA-N"
"N#CC(C(=O)2)=CC(=C(C)N2)c(c1)ccnc1","InChI=1S/C12H9N3O/c1-8-11(9-2-4-14-5-3-9)6-10(7-13)12(16)15-8/h2-6H,1H3,(H,15,16)","PZRHRDRVRGEVNW-UHFFFAOYSA-N"
"COC1=CC2=C(C=C1)NC=C2CCN","InChI=1S/C11H14N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3","JTEJPPKMYBDEMY-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(O)=O","InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)","TUNFSRHWOTWDNC-UHFFFAOYSA-N"
"CN1C2=C(C(=O)N=C1N)NC=N2","InChI=1S/C6H7N5O/c1-11-4-3(8-2-9-4)5(12)10-6(11)7/h2H,1H3,(H,8,9)(H2,7,10,12)","XHBSBNYEHDQRCP-UHFFFAOYSA-N"
"NC(N1)=Nc(n2)c(n(C)c2)C(=O)1","InChI=1S/C6H7N5O/c1-11-2-8-4-3(11)5(12)10-6(7)9-4/h2H,1H3,(H3,7,9,10,12)","FZWGECJQACGGTI-UHFFFAOYSA-N"
"CCCCC=CCCCCCCCC(O)=O","InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h5-6H,2-4,7-13H2,1H3,(H,15,16)/b6-5+","YWWVWXASSLXJHU-AATRIKPKSA-N"
"CCCCC=CCCCCCCCC(O)=O","InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h5-6H,2-4,7-13H2,1H3,(H,15,16)/b6-5-","YWWVWXASSLXJHU-WAYWQWQTSA-N"
"CC(=O)NCCC1=CNC2=C1C=C(C=C2)OC","InChI=1S/C13H16N2O2/c1-9(16)14-6-5-10-8-15-13-4-3-11(17-2)7-12(10)13/h3-4,7-8,15H,5-6H2,1-2H3,(H,14,16)","DRLFMBDRBRZALE-UHFFFAOYSA-N"
"C1=NC2=C(N1)C(=S)N=CN2","InChI=1S/C5H4N4S/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10)","GLVAUDGFNGKCSF-UHFFFAOYSA-N"
"OC(=O)[C@@H](O)c(c1)cccc1","InChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)/t7-/m0/s1","IWYDHOAUDWTVEP-ZETCQYMHSA-N"
"COS(O)(=O)=O","InChI=1S/CH4O4S/c1-5-6(2,3)4/h1H3,(H,2,3,4)","JZMJDSHXVKJFKW-UHFFFAOYSA-N"
"OC(=O)C(O)C(O)C(O)C(O)C(O)=O","InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2+,3+,4-","DSLZVSRJTYRBFB-DUHBMQHGSA-N"
"CN[C@@H](CCC(O)=O)C(O)=O","InChI=1S/C6H11NO4/c1-7-4(6(10)11)2-3-5(8)9/h4,7H,2-3H2,1H3,(H,8,9)(H,10,11)/t4-/m0/s1","XLBVNMSMFQMKEY-BYPYZUCNSA-N"
"CNC1=NC=NC2=C1NC=N2","InChI=1S/C6H7N5/c1-7-5-4-6(10-2-8-4)11-3-9-5/h2-3H,1H3,(H2,7,8,9,10,11)","CKOMXBHMKXXTNW-UHFFFAOYSA-N"
"CN1C=NC2=C(C1=N)NC=N2","InChI=1S/C6H7N5/c1-11-3-10-6-4(5(11)7)8-2-9-6/h2-3,7H,1H3,(H,8,9)","SATCOUWSAZBIJO-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H](O)[C@H]1OP(O)(O)=O","InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5+,6-/m1/s1","HXXFSFRBOHSIMQ-RWOPYEJCSA-N"
"OC(=O)c(c2)c(ccc2)Nc(c1)c(C)c(C)cc1","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","HYYBABOKPJLUIN-UHFFFAOYSA-N"
"CSC1=NC=NC2=C1NC=N2","InChI=1S/C6H6N4S/c1-11-6-4-5(8-2-7-4)9-3-10-6/h2-3H,1H3,(H,7,8,9,10)","UIJIQXGRFSPYQW-UHFFFAOYSA-N"
"OC(=O)C=CC=CC(O)=O","InChI=1S/C6H6O4/c7-5(8)3-1-2-4-6(9)10/h1-4H,(H,7,8)(H,9,10)/b3-1-,4-2-","TXXHDPDFNKHHGW-CCAGOZQPSA-N"
"NC(CCS(C)(=N)=O)C(O)=O","InChI=1S/C5H12N2O3S/c1-11(7,10)3-2-4(6)5(8)9/h4,7H,2-3,6H2,1H3,(H,8,9)/t4-,11?/m0/s1","SXTAYKAGBXMACB-DPVSGNNYSA-N"
"CNc(c1)c(ccc1)C(O)=O","InChI=1S/C8H9NO2/c1-9-7-5-3-2-4-6(7)8(10)11/h2-5,9H,1H3,(H,10,11)","WVMBPWMAQDVZCM-UHFFFAOYSA-N"
"CN(C)c(c4)c(C3)c(c(O)c4)C(=O)C(C32)=C(O)C(O)(C(=O)1)C(C2)C(N(C)C)C(O)=C(C(N)=O)1","InChI=1S/C23H27N3O7/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32)/t9-,11-,17-,23-/m0/s1","DYKFCLLONBREIL-KVUCHLLUSA-N"
"OC(=O)CSC","InChI=1S/C3H6O2S/c1-6-2-3(4)5/h2H2,1H3,(H,4,5)","HGTBAIVLETUVCG-UHFFFAOYSA-N"
"[O-1][N+1](=O)c(c1)ccc(c1)OP(O)(O)=O","InChI=1S/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)","XZKIHKMTEMTJQX-UHFFFAOYSA-N"
"COc(c2)cc(c1)c(c2)cc(c1)C(C)C(O)=O","InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m0/s1","CMWTZPSULFXXJA-VIFPVBQESA-N"
"O=C(C1)NC(C1)C(O)=O","InChI=1S/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)/t3-/m0/s1","ODHCTXKNWHHXJC-VKHMYHEASA-N"
"NC(=N)NCCC[C@@H](C(O)=O)N[C@@H](C)C(O)=O","InChI=1S/C9H18N4O4/c1-5(7(14)15)13-6(8(16)17)3-2-4-12-9(10)11/h5-6,13H,2-4H2,1H3,(H,14,15)(H,16,17)(H4,10,11,12)/t5-,6-/m0/s1","IMXSCCDUAFEIOE-WDSKDSINSA-N"
"NC(=O)C(O)=O","InChI=1S/C2H3NO3/c3-1(4)2(5)6/h(H2,3,4)(H,5,6)","SOWBFZRMHSNYGE-UHFFFAOYSA-N"
"CCC(=O)CCC(O)=O","InChI=1S/C6H10O3/c1-2-5(7)3-4-6(8)9/h2-4H2,1H3,(H,8,9)","CLJBDOUIEHLLEN-UHFFFAOYSA-N"
"OC(=O)C(=C2)N(C(=O)NC(=O)2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C10H13N2O11P/c13-5-1-3(9(16)17)12(10(18)11-5)8-7(15)6(14)4(23-8)2-22-24(19,20)21/h1,4,6-8,14-15H,2H2,(H,16,17)(H,11,13,18)(H2,19,20,21)/t4-,6-,7-,8-/m1/s1","KYOBSHFOBAOFBF-XVFCMESISA-N"
"C=C(C(O)=O)OP(O)(O)=O","InChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)","DTBNBXWJWCWCIK-UHFFFAOYSA-N"
"OCc(c1)c(C=O)c(O)c(C)n1","InChI=1S/C8H9NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,4,10,12H,3H2,1H3","RADKZDMFGJYCBB-UHFFFAOYSA-N"
"O[C@@H]([C@@H](O)1)[C@@H](COP(O)(O)=O)O[C@H]1OP(O)(=O)OP(O)(O)=O","InChI=1S/C5H13O14P3/c6-3-2(1-16-20(8,9)10)17-5(4(3)7)18-22(14,15)19-21(11,12)13/h2-7H,1H2,(H,14,15)(H2,8,9,10)(H2,11,12,13)/t2-,3-,4-,5+/m1/s1","PQGCEDQWHSBAJP-AIHAYLRMSA-N"
"OC[C@H](C(O)=O)OP(O)(O)=O","InChI=1S/C3H7O7P/c4-1-2(3(5)6)10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m1/s1","GXIURPTVHJPJLF-UWTATZPHSA-N"
"OC(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)COP(O)(O)=O","InChI=1S/C6H13O10P/c7-2(1-16-17(13,14)15)3(8)4(9)5(10)6(11)12/h2-5,7-10H,1H2,(H,11,12)(H2,13,14,15)/t2-,3-,4+,5-/m1/s1","BIRSGZKFKXLSJQ-SQOUGZDYSA-N"
"c(c1)ccc(c1)OP(O)(O)=O","InChI=1S/C6H7O4P/c7-11(8,9)10-6-4-2-1-3-5-6/h1-5H,(H2,7,8,9)","CMPQUABWPXYYSH-UHFFFAOYSA-N"
"O=Cc(c(O)1)c(cnc(C)1)COP(O)(O)=O","InChI=1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14)","NGVDGCNFYWLIFO-UHFFFAOYSA-N"
"CCN(C4)C(=O)C(=O)N(C4)C(=O)NC(c(c3)cccc3)C(=O)NC(C(=O)1)C(S2)N1C(C(O)=O)C(C)(C)2","InChI=1S/C23H27N5O7S/c1-4-26-10-11-27(19(32)18(26)31)22(35)25-13(12-8-6-5-7-9-12)16(29)24-14-17(30)28-15(21(33)34)23(2,3)36-20(14)28/h5-9,13-15,20H,4,10-11H2,1-3H3,(H,24,29)(H,25,35)(H,33,34)/t13-,14-,15+,20-/m1/s1","IVBHGBMCVLDMKU-GXNBUGAJSA-N"
"C#CC(O)=O","InChI=1S/C3H2O2/c1-2-3(4)5/h1H,(H,4,5)","UORVCLMRJXCDCP-UHFFFAOYSA-N"
"CCCCCCC=CCCCCCCCC(O)=O","InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8H,2-6,9-15H2,1H3,(H,17,18)/b8-7-","SECPZKHBENQXJG-FPLPWBNLSA-N"
"OC(=O)C([H])(C1)NCCC1","InChI=1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1","HXEACLLIILLPRG-YFKPBYRVSA-N"
"CCCC(=C1)NC(=S)NC(=O)1","InChI=1S/C7H10N2OS/c1-2-3-5-4-6(10)9-7(11)8-5/h4H,2-3H2,1H3,(H2,8,9,10,11)","KNAHARQHSZJURB-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC=C[C@@H](O)[C@@H](N)CO[C@H](O1)[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)1","InChI=1S/C24H47NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(27)18(25)17-31-24-23(30)22(29)21(28)20(16-26)32-24/h14-15,18-24,26-30H,2-13,16-17,25H2,1H3/b15-14+/t18-,19+,20+,21-,22-,23+,24+/m0/s1","HHJTWTPUPVQKNA-PIIMIWFASA-N"
"c(c3)cnc(c3)NC(=O)C(=C(O)1)N(C)S(=O)(=O)c(c2)c(ccc2)1","InChI=1S/C15H13N3O4S/c1-18-13(15(20)17-12-8-4-5-9-16-12)14(19)10-6-2-3-7-11(10)23(18,21)22/h2-9,19H,1H3,(H,16,17,20)","QYSPLQLAKJAUJT-UHFFFAOYSA-N"
"OC(=O)CCc(c1)c(O)ccc1","InChI=1S/C9H10O3/c10-8-4-2-1-3-7(8)5-6-9(11)12/h1-4,10H,5-6H2,(H,11,12)","CJBDUOMQLFKVQC-UHFFFAOYSA-N"
"COc(c4)ccc(c4)CC(N)C(=O)NC(C(CO)3)C(O)C(O3)n(c2)c(n1)c(n2)c(N(C)C)nc1","InChI=1S/C22H29N7O5/c1-28(2)19-17-20(25-10-24-19)29(11-26-17)22-18(31)16(15(9-30)34-22)27-21(32)14(23)8-12-4-6-13(33-3)7-5-12/h4-7,10-11,14-16,18,22,30-31H,8-9,23H2,1-3H3,(H,27,32)/t14-,15+,16+,18+,22+/m0/s1","RXWNCPJZOCPEPQ-NVWDDTSBSA-N"
"O=C(C1)N[C@H](C1)C(O)=O","InChI=1S/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)/t3-/m1/s1","ODHCTXKNWHHXJC-GSVOUGTGSA-N"
"OC(=O)C(O)Cc(c1)cccc1","InChI=1S/C9H10O3/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8,10H,6H2,(H,11,12)","VOXXWSYKYCBWHO-UHFFFAOYSA-N"
"C1=CNC(=C1)C(=O)O","InChI=1S/C5H5NO2/c7-5(8)4-2-1-3-6-4/h1-3,6H,(H,7,8)","WRHZVMBBRYBTKZ-UHFFFAOYSA-N"
"NCc(c(O)1)c(cnc(C)1)COP(O)(O)=O","InChI=1S/C8H13N2O5P/c1-5-8(11)7(2-9)6(3-10-5)4-15-16(12,13)14/h3,11H,2,4,9H2,1H3,(H2,12,13,14)","ZMJGSOSNSPKHNH-UHFFFAOYSA-N"
"OCc(c1)c(CN)c(O)c(C)n1","InChI=1S/C8H12N2O2/c1-5-8(12)7(2-9)6(4-11)3-10-5/h3,11-12H,2,4,9H2,1H3","NHZMQXZHNVQTQA-UHFFFAOYSA-N"
"C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OP(=O)(N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O)O)O)O)O","InChI=1S/C23H34N3O10P/c1-11(2)8-16(26-37(33,34)36-23-20(29)19(28)18(27)12(3)35-23)21(30)25-17(22(31)32)9-13-10-24-15-7-5-4-6-14(13)15/h4-7,10-12,16-20,23-24,27-29H,8-9H2,1-3H3,(H,25,30)(H,31,32)(H2,26,33,34)/t12-,16-,17-,18-,19+,20+,23-/m0/s1","ZPHBZEQOLSRPAK-XLCYBJAPSA-N"
"N[C@H](C(O)=O)CN(O1)C(=O)NC(=O)1","InChI=1S/C5H7N3O5/c6-2(3(9)10)1-8-4(11)7-5(12)13-8/h2H,1,6H2,(H,9,10)(H,7,11,12)/t2-/m0/s1","ASNFTDCKZKHJSW-REOHCLBHSA-N"
"OC(=O)[C@@](O)(C1)C[C@@H](O)[C@H](O)[C@H](O)1","InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m1/s1","AAWZDTNXLSGCEK-WYWMIBKRSA-N"
"O[C@@H](O1)[C@H](O)[C@H](O)[C@H]1COP(O)(O)=O","InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5+/m1/s1","KTVPXOYAKDPRHY-AIHAYLRMSA-N"
"O[C@H](COP(O)(O)=O)[C@@H](O)C(=O)COP(O)(O)=O","InChI=1S/C5H12O11P2/c6-3(1-15-17(9,10)11)5(8)4(7)2-16-18(12,13)14/h3,5-6,8H,1-2H2,(H2,9,10,11)(H2,12,13,14)/t3-,5-/m1/s1","YAHZABJORDUQGO-NQXXGFSBSA-N"
"NC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](N)[C@H]1O[C@H]([C@@H](N)2)[C@H](O[C@H](O3)[C@H](O)[C@H](O)[C@@H](CO)3)[C@@H](O)[C@H](N)C2","InChI=1S/C17H34N4O10/c18-2-6-10(24)12(26)8(21)16(28-6)30-14-5(20)1-4(19)9(23)15(14)31-17-13(27)11(25)7(3-22)29-17/h4-17,22-27H,1-3,18-21H2/t4-,5+,6-,7-,8-,9+,10-,11-,12-,13-,14-,15-,16-,17-/m1/s1","NSKGQURZWSPSBC-DLBSIDPUSA-N"
"OCC(O1)C(O)C(O)C1OP(O)(O)=O","InChI=1S/C5H11O8P/c6-1-2-3(7)4(8)5(12-2)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3-,4-,5-/m1/s1","YXJDFQJKERBOBM-TXICZTDVSA-N"
"OC(=O)c(c3)cc(c(=O)1)c(c(O)3)c(=O)c(c(O)2)c(ccc2)1","InChI=1S/C15H8O6/c16-9-3-1-2-7-11(9)14(19)12-8(13(7)18)4-6(15(20)21)5-10(12)17/h1-5,16-17H,(H,20,21)","FCDLCPWAQCPTKC-UHFFFAOYSA-N"
"CNC(NCCSCc(c1)oc(CN(C)C)c1)=C[N+1]([O-1])=O","InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+","VMXUWOKSQNHOCA-UKTHLTGXSA-N"
"COc(c1)c(O)c(OC)cc(C(O)=O)1","InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12)","JMSVCTWVEWCHDZ-UHFFFAOYSA-N"
"OC(=O)C(O)C(O)C(O)C(O)C(O)=O","InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)/t1-,2-,3-,4+/m0/s1","DSLZVSRJTYRBFB-LLEIAEIESA-N"
"NC(=N)NC(C(O)1)C(O)C(NC(N)=N)C(OC(O2)C(OC(O3)C(NC)C(O)C(O)C(CO)3)C(O)(C=O)C(C)2)C(O)1","InChI=1S/C21H39N7O12/c1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35/h4-18,26,29,31-36H,3H2,1-2H3,(H4,22,23,27)(H4,24,25,28)/t5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+/m0/s1","UCSJYZPVAKXKNQ-HZYVHMACSA-N"
"NCC(=C3)O[C@@H]([C@H](N)C3)O[C@H]([C@@H](N)1)[C@H](O)[C@@H](O[C@@H](O2)[C@H](O)[C@@H](NC)[C@](C)(O)C2)[C@H](N)C1","InChI=1S/C19H37N5O7/c1-19(27)7-28-18(13(26)16(19)24-2)31-15-11(23)5-10(22)14(12(15)25)30-17-9(21)4-3-8(6-20)29-17/h3,9-18,24-27H,4-7,20-23H2,1-2H3/t9-,10+,11-,12+,13-,14-,15+,16-,17-,18-,19+/m1/s1","URWAJWIAIPFPJE-YFMIWBNJSA-N"
"OC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)COP(O)(O)=O","InChI=1S/C6H15O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h3-11H,1-2H2,(H2,12,13,14)/t3-,4+,5+,6+/m0/s1","GACTWZZMVMUKNG-SLPGGIOYSA-N"
"OC(=O)c(c1)ccc(c1)S(O)(=O)=O","InChI=1S/C7H6O5S/c8-7(9)5-1-3-6(4-2-5)13(10,11)12/h1-4H,(H,8,9)(H,10,11,12)","HWAQOZGATRIYQG-UHFFFAOYSA-N"
"Nc(c2)ccc(c2)S(=O)(=O)Nc(n1)scc1","InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)","JNMRHUJNCSQMMB-UHFFFAOYSA-N"
"OCC(=O)C(O)C(O)C(O)C(O)COP(O)(O)=O","InChI=1S/C7H15O10P/c8-1-3(9)5(11)7(13)6(12)4(10)2-17-18(14,15)16/h4-8,10-13H,1-2H2,(H2,14,15,16)","JDTUMPKOJBQPKX-UHFFFAOYSA-N"
"C[C@H](O)[C@H](N)C(O)=O","InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m0/s1","AYFVYJQAPQTCCC-HRFVKAFMSA-N"
"OC[C@@H](O1)[C@@H](O)C[C@@H]1N(C=2)C(=O)NC(=O)C(C)2","InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)/t6-,7+,8+/m0/s1","IQFYYKKMVGJFEH-XLPZGREQSA-N"
"CC=C(C)C(O)=O","InChI=1S/C5H8O2/c1-3-4(2)5(6)7/h3H,1-2H3,(H,6,7)/b4-3+","UIERETOOQGIECD-ONEGZZNKSA-N"
"C[C@@H](O)[C@H](N)C(O)=O","InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1","AYFVYJQAPQTCCC-GBXIJSLDSA-N"
"OC(=O)C([H])(O)C([H])(O)C(O)=O","InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1","FEWJPZIEWOKRBE-JCYAYHJZSA-N"
"OC(=O)[C@@H](N)Cc(c1)cc(I)c(Oc(c2)cc(I)c(O)c2)c(I)1","InChI=1S/C15H12I3NO4/c16-9-6-8(1-2-13(9)20)23-14-10(17)3-7(4-11(14)18)5-12(19)15(21)22/h1-4,6,12,20H,5,19H2,(H,21,22)/t12-/m0/s1","AUYYCJSJGJYCDS-LBPRGKRZSA-N"
"[C@H](C1)(O)CC[C@]([C@H]24)(C)[C@@H]1C[C@H]([C@H]2[C@@H]([C@@](C)([C@H](C4)O)3)CC[C@H]([C@H](C)CCC(=O)NCCS(O)(=O)=O)3)O","InChI=1S/C26H45NO7S/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1","WBWWGRHZICKQGZ-HZAMXZRMSA-N"
"OC(C(O)=O)C(O)=O","InChI=1S/C3H4O5/c4-1(2(5)6)3(7)8/h1,4H,(H,5,6)(H,7,8)","ROBFUDYVXSDBQM-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)N)N","InChI=1S/C11H13N3O/c12-9(11(13)15)5-7-6-14-10-4-2-1-3-8(7)10/h1-4,6,9,14H,5,12H2,(H2,13,15)/t9-/m0/s1","JLSKPBDKNIXMBS-VIFPVBQESA-N"
"OCCc(s2)c(C)[n+1](c2)Cc(c1)c(N)nc(C)n1","InChI=1S/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1","JZRWCGZRTZMZEH-UHFFFAOYSA-N"
"Cc(n2)nc(N)c(c2)C[n+1](c1)c(C)c(CCOP(O)(O)=O)s1","InChI=1S/C12H17N4O4PS/c1-8-11(3-4-20-21(17,18)19)22-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H3-,13,14,15,17,18,19)/p+1","HZSAJDVWZRBGIF-UHFFFAOYSA-O"
"OCC(O1)C(O)C(O)C(O)C1OC(O2)C(O)C(O)C(O)C(COP(O)(O)=O)2","InChI=1S/C12H23O14P/c13-1-3-5(14)7(16)9(18)11(24-3)26-12-10(19)8(17)6(15)4(25-12)2-23-27(20,21)22/h3-19H,1-2H2,(H2,20,21,22)/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1","LABSPYBHMPDTEL-LIZSDCNHSA-N"
"","InChI=1S/C26H45NO8S2/c1-17(4-9-24(28)27-14-15-36(29,30)31)21-7-8-22-20-6-5-18-16-19(35-37(32,33)34)10-12-25(18,2)23(20)11-13-26(21,22)3/h17-23H,4-16H2,1-3H3,(H,27,28)(H,29,30,31)(H,32,33,34)/t17-,18-,19-,20+,21-,22+,23+,25+,26-/m1/s1","HSNPMXROZIQAQD-GBURMNQMSA-N"
"","InChI=1S/C26H45NO5S/c1-17(4-9-24(29)27-14-15-33(30,31)32)21-7-8-22-20-6-5-18-16-19(28)10-12-25(18,2)23(20)11-13-26(21,22)3/h17-23,28H,4-16H2,1-3H3,(H,27,29)(H,30,31,32)/t17-,18-,19-,20+,21-,22+,23+,25+,26-/m1/s1","QBYUNVOYXHFVKC-GBURMNQMSA-N"
"Clc(c2)ccc(c2)OC(n(c1)ncn1)C(=O)C(C)(C)C","InChI=1S/C14H16ClN3O2/c1-14(2,3)12(19)13(18-9-16-8-17-18)20-11-6-4-10(15)5-7-11/h4-9,13H,1-3H3","WURBVZBTWMNKQT-UHFFFAOYSA-N"
"OC(=O)COc(c1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C8H5Cl3O3/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h1-2H,3H2,(H,12,13)","SMYMJHWAQXWPDB-UHFFFAOYSA-N"
"CCCC(CCC)C(O)=O","InChI=1S/C8H16O2/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H,9,10)","NIJJYAXOARWZEE-UHFFFAOYSA-N"
"OC(C1)C(O)C(O)C(O1)OP(O)(O)=O","InChI=1S/C5H11O8P/c6-2-1-12-5(4(8)3(2)7)13-14(9,10)11/h2-8H,1H2,(H2,9,10,11)/t2-,3+,4-,5-/m1/s1","ILXHFXFPPZGENN-KKQCNMDGSA-N"
"OCC(C2)OC(C2)N(C=1)C(=O)N=C(N)C1","InChI=1S/C9H13N3O3/c10-7-3-4-12(9(14)11-7)8-2-1-6(5-13)15-8/h3-4,6,8,13H,1-2,5H2,(H2,10,11,14)/t6-,8+/m0/s1","WREGKURFCTUGRC-POYBYMJQSA-N"
"C/C(=C\CNC1=NC=NC2=C1NC=N2)/CO","InChI=1S/C10H13N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h2,5-6,16H,3-4H2,1H3,(H2,11,12,13,14,15)/b7-2+","UZKQTCBAMSWPJD-FARCUNLSSA-N"
"O=C(OCc(c2)cccc2)NCC(=O)N(C1)C(CC1)C(O)=O","InChI=1S/C15H18N2O5/c18-13(17-8-4-7-12(17)14(19)20)9-16-15(21)22-10-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H,16,21)(H,19,20)","ZTUKZKYDJMGJDC-UHFFFAOYSA-N"
"OC(=O)[C@@H](N)CC[S+1](C)C[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C15H22N6O5S/c1-27(3-2-7(16)15(24)25)4-8-10(22)11(23)14(26-8)21-6-20-9-12(17)18-5-19-13(9)21/h5-8,10-11,14,22-23H,2-4,16H2,1H3,(H2-,17,18,19,24,25)/p+1/t7-,8+,10+,11+,14+,27?/m0/s1","MEFKEPWMEQBLKI-AIRLBKTGSA-O"
"C1=CC2=C(C=CN2)C(=C1)N","InChI=1S/C8H8N2/c9-7-2-1-3-8-6(7)4-5-10-8/h1-5,10H,9H2","LUNUNJFSHKSXGQ-UHFFFAOYSA-N"
"C1=CC2=C(C=CN2)C=C1N","InChI=1S/C8H8N2/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H,9H2","ZCBIFHNDZBSCEP-UHFFFAOYSA-N"
"NCC(O)CO","InChI=1S/C3H9NO2/c4-1-3(6)2-5/h3,5-6H,1-2,4H2","KQIGMPWTAHJUMN-UHFFFAOYSA-N"
"CC(=O)OCC[N+1](C)(C)C","InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1","OIPILFWXSMYKGL-UHFFFAOYSA-N"
"C=CCS(=O)C[C@H](N)C(O)=O","InChI=1S/C6H11NO3S/c1-2-3-11(10)4-5(7)6(8)9/h2,5H,1,3-4,7H2,(H,8,9)/t5-,11?/m0/s1","XUHLIQGRKRUKPH-ITZCMCNPSA-N"
"C(C2)CNC(C2)c(c1)cncc1","InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2/t10-/m0/s1","MTXSIJUGVMTTMU-JTQLQIEISA-N"
"OCC(C(=O)OC(C2)CC(C3)N(C)C(C3)2)c(c1)cccc1","InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16?","RKUNBYITZUJHSG-SPUOUPEWSA-N"
"OC[C@@H](O1)[C@@H](N)[C@H](O)[C@@H](O)[C@H]1O[C@H](O2)[C@@H](NC)[C@@H](O)[C@@H](O3)[C@@H](C[C@@H](N)[C@@H](O[C@H]([C@@H](N)4)[C@H](O)[C@@H](O)[C@H](N)C4)3)2","InChI=1S/C21H41N5O11/c1-26-11-14(30)18-8(33-20(11)37-21-16(32)13(29)10(25)9(4-27)34-21)3-7(24)19(36-18)35-17-6(23)2-5(22)12(28)15(17)31/h5-21,26-32H,2-4,22-25H2,1H3/t5-,6+,7-,8-,9-,10-,11+,12+,13+,14-,15-,16-,17-,18+,19+,20+,21-/m1/s1","XZNUGFQTQHRASN-UXNWEDNLSA-N"
"CCOC(=O)C(N)CCCNC(N)=N","InChI=1S/C8H18N4O2/c1-2-14-7(13)6(9)4-3-5-12-8(10)11/h6H,2-5,9H2,1H3,(H4,10,11,12)","AKGWUHIOEVNNPC-UHFFFAOYSA-N"
"NCCCCNC(N)=N","InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)","QYPPJABKJHAVHS-UHFFFAOYSA-N"
"NCCCNCCCCNCCCNC(C)=O","InChI=1S/C12H28N4O/c1-12(17)16-11-5-10-15-8-3-2-7-14-9-4-6-13/h14-15H,2-11,13H2,1H3,(H,16,17)","GUNURVWAJRRUAV-UHFFFAOYSA-N"
"NCCCNCCCCNC(C)=O","InChI=1S/C9H21N3O/c1-9(13)12-8-3-2-6-11-7-4-5-10/h11H,2-8,10H2,1H3,(H,12,13)","FONIWJIDLJEJTL-UHFFFAOYSA-N"
"Nc(c21)c(c3)c(ccc3)nc(CCCC2)1","InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)","YLJREFDVOIBQDA-UHFFFAOYSA-N"
"COc(c4)c(OC)c(C3)c(c4)CC(=O)c(c1)c(CCN(C)3)cc(O2)c(OC2)1","InChI=1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22/h4-5,9-10H,6-8,11-12H2,1-3H3","HYBRYAPKQCZIAE-UHFFFAOYSA-N"
"CC(=O)O[C@@H](CC(O)=O)C[N+1](C)(C)C","InChI=1S/C9H17NO4/c1-7(11)14-8(5-9(12)13)6-10(2,3)4/h8H,5-6H2,1-4H3/p+1/t8-/m0/s1","RDHQFKQIGNGIED-QMMMGPOBSA-O"
"NCCCNCCSP(O)(O)=O","InChI=1S/C5H15N2O3PS/c6-2-1-3-7-4-5-12-11(8,9)10/h7H,1-6H2,(H2,8,9,10)","JKOQGQFVAUAYPM-UHFFFAOYSA-N"
"OCC(N)(CO)CO","InChI=1S/C4H11NO3/c5-4(1-6,2-7)3-8/h6-8H,1-3,5H2","LENZDBCJOHFCAS-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(N)C(=O)NC(C(=O)1)C(S2)N1C(C(O)=O)C(C)(C)2","InChI=1S/C16H19N3O4S/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23)/t9-,10-,11+,14-/m1/s1","AVKUERGKIZMTKX-NJBDSQKTSA-N"
"CCNc(n1)nc(Cl)nc(N)1","InChI=1S/C5H8ClN5/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H3,7,8,9,10,11)","IVENSCMCQBJAKW-UHFFFAOYSA-N"
"OCC(C)(N)CO","InChI=1S/C4H11NO2/c1-4(5,2-6)3-7/h6-7H,2-3,5H2,1H3","UXFQFBNBSPQBJW-UHFFFAOYSA-N"
"NC(=N)NC(=O)c(n1)c(N)nc(N)c(Cl)1","InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)","XSDQTOBWRPYKKA-UHFFFAOYSA-N"
"N(C(Cc(c2)cccc2)C(=O)NCCO)(C)C(=O)CNC(=O)C(C)NC(=O)C(N)Cc(c1)ccc(O)c1","InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1","HPZJMUBDEAMBFI-WTNAPCKOSA-N"
"NCCC(O)C(=O)NC(C1)C(OC(O3)C(O)C(N)C(O)C(CO)3)C(O)C(OC(O2)C(O)C(O)C(O)C(CN)2)C(N)1","InChI=1S/C22H43N5O13/c23-2-1-8(29)20(36)27-7-3-6(25)18(39-22-16(34)15(33)13(31)9(4-24)37-22)17(35)19(7)40-21-14(32)11(26)12(30)10(5-28)38-21/h6-19,21-22,28-35H,1-5,23-26H2,(H,27,36)/t6-,7+,8-,9+,10+,11-,12+,13+,14+,15-,16+,17-,18+,19-,21+,22+/m0/s1","LKCWBDHBTVXHDL-RMDFUYIESA-N"
"NC(=N)c(c1)cccc1","InChI=1S/C7H8N2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H3,8,9)","PXXJHWLDUBFPOL-UHFFFAOYSA-N"
"CCCCNC(=N)NC(N)=N","InChI=1S/C6H15N5/c1-2-3-4-10-6(9)11-5(7)8/h2-4H2,1H3,(H6,7,8,9,10,11)","XSEUMFJMFFMCIU-UHFFFAOYSA-N"
"NCC(CC(O)=O)c(c1)ccc(Cl)c1","InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)","KPYSYYIEGFHWSV-UHFFFAOYSA-N"
"COc(c5)c(OC)c(c4)c(c5)cc([n+1]34)c(c1)c(CC3)cc(O2)c(OC2)1","InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1","YBHILYKTIRIUTE-UHFFFAOYSA-N"
"CCOC(=O)C(CCCNC(N)=N)NC(=O)c(c1)cccc1","InChI=1S/C15H22N4O3/c1-2-22-14(21)12(9-6-10-18-15(16)17)19-13(20)11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,9-10H2,1H3,(H,19,20)(H4,16,17,18)","YQDHCCVUYCIGSW-UHFFFAOYSA-N"
"NCC(O1)C(O)C(O)C(N)C1OC(C(N)3)C(O)C(C(N)C3)OC([H])(O2)C(O)C(N)C(O)C(CO)2","InChI=1S/C18H37N5O10/c19-2-6-11(26)12(27)9(23)17(30-6)32-15-4(20)1-5(21)16(14(15)29)33-18-13(28)8(22)10(25)7(3-24)31-18/h4-18,24-29H,1-3,19-23H2/t4-,5+,6+,7+,8-,9+,10+,11+,12+,13+,14-,15+,16-,17+,18+/m0/s1","SKKLOUVUUNMCJE-FQSMHNGLSA-N"
"NCCCNCCCN","InChI=1S/C6H17N3/c7-3-1-5-9-6-2-4-8/h9H,1-8H2","OTBHHUPVCYLGQO-UHFFFAOYSA-N"
"O=CC[N+1](C)(C)C","InChI=1S/C5H12NO/c1-6(2,3)4-5-7/h5H,4H2,1-3H3/q+1","SXKNCCSPZDCRFD-UHFFFAOYSA-N"
"[O-1]C(=O)C[N+1](C)(C)C","InChI=1S/C5H11NO2/c1-6(2,3)4-5(7)8/h4H2,1-3H3","KWIUHFFTVRNATP-UHFFFAOYSA-N"
"O[C@H](C1)C[N+1](C)(C)[C@@H]1C([O-1])=O","InChI=1S/C7H13NO3/c1-8(2)4-5(9)3-6(8)7(10)11/h5-6,9H,3-4H2,1-2H3/t5-,6+/m1/s1","MUNWAHDYFVYIKH-RITPCOANSA-N"
"OC(=O)CN(C)C(N)=N","InChI=1S/C4H9N3O2/c1-7(4(5)6)2-3(8)9/h2H2,1H3,(H3,5,6)(H,8,9)","CVSVTCORWBXHQV-UHFFFAOYSA-N"
"[O-1]C(=O)CC(O)C[N+1](C)(C)C","InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/t6-/m1/s1","PHIQHXFUZVPYII-ZCFIWIBFSA-N"
"O[C@@H](C1)[C@@H](O)[C@H](O)[C@@H]([C@@H](O)2)N(CC2)1","InChI=1S/C8H15NO4/c10-4-1-2-9-3-5(11)7(12)8(13)6(4)9/h4-8,10-13H,1-3H2/t4-,5-,6+,7+,8+/m0/s1","JDVVGAQPNNXQDW-TVNFTVLESA-N"
"NC(=O)OCC[N+1](C)(C)C","InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1","VPJXQGSRWJZDOB-UHFFFAOYSA-O"
"OC(=O)[C@@H](N)CCSC[C@@H](N)C(O)=O","InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m0/s1","ILRYLPWNYFXEMH-WHFBIAKZSA-N"
"N#Cc(c1)nccc1","InChI=1S/C6H4N2/c7-5-6-3-1-2-4-8-6/h1-4H","FFNVQNRYTPFDDP-UHFFFAOYSA-N"
"OC(=O)C(=C1)C(=O)c(c3)c(cc(N(C4)CCNC4)c(F)3)N1C(C2)C2","InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)","MYSWGUAQZAJSOK-UHFFFAOYSA-N"
"Cc(n2)cc(nc2Nc(c3)cccc3)C(C1)C1","InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)","HAORKNGNJCEJBX-UHFFFAOYSA-N"
"Clc(c1)c(N=C(N2)NCC2)c(Cl)cc1","InChI=1S/C9H9Cl2N3/c10-6-2-1-3-7(11)8(6)14-9-12-4-5-13-9/h1-3H,4-5H2,(H2,12,13,14)","GJSURZIOUXUGAL-UHFFFAOYSA-N"
"[O-1]C(=O)CCC[N+1](C)(C)C","InChI=1S/C7H15NO2/c1-8(2,3)6-4-5-7(9)10/h4-6H2,1-3H3","JHPNVNIEXXLNTR-UHFFFAOYSA-N"
"OCCNCCO","InChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2","ZBCBWPMODOFKDW-UHFFFAOYSA-N"
"CN(C)CC(O)=O","InChI=1S/C4H9NO2/c1-5(2)3-4(6)7/h3H2,1-2H3,(H,6,7)","FFDGPVCHZBVARC-UHFFFAOYSA-N"
"NCC[C@H](N)C(O)=O","InChI=1S/C4H10N2O2/c5-2-1-3(6)4(7)8/h3H,1-2,5-6H2,(H,7,8)/t3-/m0/s1","OGNSCSPNOLGXSM-VKHMYHEASA-N"
"CCc(c1)c(N)c(CC)cc1","InChI=1S/C10H15N/c1-3-8-6-5-7-9(4-2)10(8)11/h5-7H,3-4,11H2,1-2H3","FOYHNROGBXVLLX-UHFFFAOYSA-N"
"N[C@H](C1)[C@H](O)[C@@H](O)[C@H](O)[C@@H](N)1","InChI=1S/C6H14N2O3/c7-2-1-3(8)5(10)6(11)4(2)9/h2-6,9-11H,1,7-8H2/t2-,3+,4+,5-,6-","DTFAJAKTSMLKAT-JDCCYXBGSA-N"
"CSC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1","WUUGFSXJNOTRMR-IOSLPCCCSA-N"
"OC(=O)CCCCCC(N1)C(C)NC(=O)1","InChI=1S/C10H18N2O3/c1-7-8(12-10(15)11-7)5-3-2-4-6-9(13)14/h7-8H,2-6H2,1H3,(H,13,14)(H2,11,12,15)","AUTOLBMXDDTRRT-UHFFFAOYSA-N"
"OC(=O)CCCCCC(N1)C(C)NC(=O)1","InChI=1S/C10H18N2O3/c1-7-8(12-10(15)11-7)5-3-2-4-6-9(13)14/h7-8H,2-6H2,1H3,(H,13,14)(H2,11,12,15)/t7-,8+/m0/s1","AUTOLBMXDDTRRT-JGVFFNPUSA-N"
"[H]OC([H])([H])[C@]([H])(N([H])[H])[C@]([H])(O[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H]","InChI=1S/C18H39NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)17(19)16-20/h17-18,20-21H,2-16,19H2,1H3/t17-,18+/m0/s1","OTKJDMGTUTTYMP-ZWKOTPCHSA-N"
"C[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C10H13N5O3/c1-4-6(16)7(17)10(18-4)15-3-14-5-8(11)12-2-13-9(5)15/h2-4,6-7,10,16-17H,1H3,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1","XGYIMTFOTBMPFP-KQYNXXCUSA-N"
"OC(=O)C(C)C(C)(O)C(O)=O","InChI=1S/C6H10O5/c1-3(4(7)8)6(2,11)5(9)10/h3,11H,1-2H3,(H,7,8)(H,9,10)/t3-,6-/m1/s1","WTIIULQJLZEHGZ-AWFVSMACSA-N"
"CC1=CC2=C(C=C1C)N=CN2","InChI=1S/C9H10N2/c1-6-3-8-9(4-7(6)2)11-5-10-8/h3-5H,1-2H3,(H,10,11)","LJUQGASMPRMWIW-UHFFFAOYSA-N"
"Oc(c34)c(c1c(O)c3c(c(c(OC)5)c(ccc5)c4=O)=O)C[C@](C(C)=O)(C[C@@H]1OC(C2)O[C@@H](C)[C@@H](O)[C@@H](N)2)O","InChI=1S/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3","STQGQHZAVUOBTE-UHFFFAOYSA-N"
"NC(=N)NC(C(O)1)C(O)C(NC(N)=N)C(OC(O2)C(OC(O3)C(NC)C(O)C(O)C(CO)3)C(O)(CO)C(C)2)C(O)1","InChI=1S/C21H41N7O12/c1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35/h5-18,26,29-36H,3-4H2,1-2H3,(H4,22,23,27)(H4,24,25,28)/t5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+/m0/s1","ASXBYYWOLISCLQ-HZYVHMACSA-N"
"CCN(CC)C(=O)Cc(c1)cccc1","InChI=1S/C12H17NO/c1-3-13(4-2)12(14)10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3","UXDAWVUDZLBBAM-UHFFFAOYSA-N"
"CC(NCCc(c2)cc(O)c(O)c2)CCc(c1)ccc(O)c1","InChI=1S/C18H23NO3/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15/h4-9,12-13,19-22H,2-3,10-11H2,1H3","JRWZLRBJNMZMFE-UHFFFAOYSA-N"
"CNCCc(c1)cc(O)c(O)c1","InChI=1S/C9H13NO2/c1-10-5-4-7-2-3-8(11)9(12)6-7/h2-3,6,10-12H,4-5H2,1H3","NGKZFDYBISXGGS-UHFFFAOYSA-N"
"CCN","InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3","QUSNBJAOOMFDIB-UHFFFAOYSA-N"
"CCSCC[C@H](N)C(O)=O","InChI=1S/C6H13NO2S/c1-2-10-4-3-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1","GGLZPLKKBSSKCX-YFKPBYRVSA-N"
"CCNC(C)Cc(c1)cc(cc1)C(F)(F)F","InChI=1S/C12H16F3N/c1-3-16-9(2)7-10-5-4-6-11(8-10)12(13,14)15/h4-6,8-9,16H,3,7H2,1-2H3","DBGIVFWFUFKIQN-UHFFFAOYSA-N"
"Nc(c1)ccc(F)c1","InChI=1S/C6H6FN/c7-5-1-3-6(8)4-2-5/h1-4H,8H2","KRZCOLNOCZKSDF-UHFFFAOYSA-N"
"NC(=O)CCC(N)C(O)=O","InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m1/s1","ZDXPYRJPNDTMRX-GSVOUGTGSA-N"
"OC(O1)[C@H](N)[C@@H](O)[C@H](O)[C@H]1COP(O)(O)=O","InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4-,5-,6?/m1/s1","XHMJOUIAFHJHBW-IVMDWMLBSA-N"
"NC(=N)NCCC(O)=O","InChI=1S/C4H9N3O2/c5-4(6)7-2-1-3(8)9/h1-2H2,(H,8,9)(H4,5,6,7)","KMXXSJLYVJEBHI-UHFFFAOYSA-N"
"CN(C)CC1=CNC2=CC=CC=C21","InChI=1S/C11H14N2/c1-13(2)8-9-7-12-11-6-4-3-5-10(9)11/h3-7,12H,8H2,1-2H3","OCDGBSUVYYVKQZ-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(N)C(O)1","InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1","MSWZFWKMSRAUBD-GASJEMHNSA-N"
"OCC(O)COP(O)(=O)OCC[N+1](C)(C)C","InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h8,10-11H,4-7H2,1-3H3/p+1/t8-/m1/s1","SUHOQUVVVLNYQR-MRVPVSSYSA-O"
"OC[C@@H](O)COP(O)(O)=O","InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)/t3-/m1/s1","AWUCVROLDVIAJX-GSVOUGTGSA-N"
"C1=C(NC=N1)CO","InChI=1S/C4H6N2O/c7-2-4-1-5-3-6-4/h1,3,7H,2H2,(H,5,6)","QDYTUZCWBJRHKK-UHFFFAOYSA-N"
"OC[C@@H](C(=O)O[C@@H](C2)C[C@@H](C3)N(C)[C@@H](C3)2)c(c1)cccc1","InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15-,16-/m1/s1","RKUNBYITZUJHSG-QKPAOTATSA-N"
"NCCCC(N)(C(O)=O)C(F)F","InChI=1S/C6H12F2N2O2/c7-4(8)6(10,5(11)12)2-1-3-9/h4H,1-3,9-10H2,(H,11,12)","VLCYCQAOQCDTCN-UHFFFAOYSA-N"
"NC(=O)NO","InChI=1S/CH4N2O2/c2-1(4)3-5/h5H,(H3,2,3,4)","VSNHCAURESNICA-UHFFFAOYSA-N"
"C(N23)N(C1)CN(C3)CN(C2)1","InChI=1S/C6H12N4/c1-7-2-9-4-8(1)5-10(3-7)6-9/h1-6H2","VKYKSIONXSXAKP-UHFFFAOYSA-N"
"NC[C@@H](C)O","InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3/t3-/m1/s1","HXKKHQJGJAFBHI-GSVOUGTGSA-N"
"C1=C(NC=N1)CC(=O)O","InChI=1S/C5H6N2O2/c8-5(9)1-4-2-6-3-7-4/h2-3H,1H2,(H,6,7)(H,8,9)","PRJKNHOMHKJCEJ-UHFFFAOYSA-N"
"NC(=O)c(c1)ccnc1","InChI=1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9)","VFQXVTODMYMSMJ-UHFFFAOYSA-N"
"C1=C(NC=N1)C[C@H](C(=O)O)O","InChI=1S/C6H8N2O3/c9-5(6(10)11)1-4-2-7-3-8-4/h2-3,5,9H,1H2,(H,7,8)(H,10,11)/t5-/m1/s1","ACZFBYCNAVEFLC-RXMQYKEDSA-N"
"NC(=N)NCCN(C1)CCCCCC1","InChI=1S/C10H22N4/c11-10(12)13-6-9-14-7-4-2-1-3-5-8-14/h1-9H2,(H4,11,12,13)","ACGDKVXYNVEAGU-UHFFFAOYSA-N"
"NCC(O1)C(O)C(O)C(O)C1OC(C(N)3)C(O)C(C(N)C3)OC(O2)C(O)C(N)C(O)C(CO)2","InChI=1S/C18H36N4O11/c19-2-6-10(25)12(27)13(28)18(30-6)33-16-5(21)1-4(20)15(14(16)29)32-17-11(26)8(22)9(24)7(3-23)31-17/h4-18,23-29H,1-3,19-22H2/t4-,5+,6-,7-,8+,9-,10-,11-,12+,13-,14-,15+,16-,17-,18-/m1/s1","SBUJHOSQTJFQJX-NOAMYHISSA-N"
"OC(=O)[C@@H](N)CC(=O)c(c1)c(N)ccc1","InChI=1S/C10H12N2O3/c11-7-4-2-1-3-6(7)9(13)5-8(12)10(14)15/h1-4,8H,5,11-12H2,(H,14,15)/t8-/m0/s1","YGPSJZOEDVAXAB-QMMMGPOBSA-N"
"CNC(C2)(C(=O)CCC2)c(c1)c(Cl)ccc1","InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3","YQEZLKZALYSWHR-UHFFFAOYSA-N"
"Oc(n1)nc(n2)c(ncc2)c(O)1","InChI=1S/C6H4N4O2/c11-5-3-4(8-2-1-7-3)9-6(12)10-5/h1-2H,(H2,8,9,10,11,12)","UYEUUXMDVNYCAM-UHFFFAOYSA-N"
"NCCCC[C@H](N)C(N)=O","InChI=1S/C6H15N3O/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H2,9,10)/t5-/m0/s1","HKXLAGBDJVHRQG-YFKPBYRVSA-N"
"NC(=O)CCCCC(C1)SSC1","InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10)","FCCDDURTIIUXBY-UHFFFAOYSA-N"
"CCN(CC)CC(=O)Nc(c(C)1)c(C)ccc1","InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)","NNJVILVZKWQKPM-UHFFFAOYSA-N"
"C(C3)N(CCC3(O)c(c4)ccc(c4)Cl)CCC(C(N(C)C)=O)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C29H33ClN2O2/c1-31(2)27(33)29(24-9-5-3-6-10-24,25-11-7-4-8-12-25)19-22-32-20-17-28(34,18-21-32)23-13-15-26(30)16-14-23/h3-16,34H,17-22H2,1-2H3","RDOIQAHITMMDAJ-UHFFFAOYSA-N"
"CC(C)C(N)CC(O)=O","InChI=1S/C6H13NO2/c1-4(2)5(7)3-6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m0/s1","GLUJNGJDHCTUJY-YFKPBYRVSA-N"
"OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)COP(O)(O)=O","InChI=1S/C6H15O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h3-11H,1-2H2,(H2,12,13,14)/t3-,4-,5-,6-/m1/s1","GACTWZZMVMUKNG-KVTDHHQDSA-N"
"OCC(C)(N)C(O)=O","InChI=1S/C4H9NO3/c1-4(5,2-6)3(7)8/h6H,2,5H2,1H3,(H,7,8)","CDUUKBXTEOFITR-UHFFFAOYSA-N"
"NC(=N)NC(=N)N(C)C","InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)","XZWYZXLIPXDOLR-UHFFFAOYSA-N"
"OCCn(c(C)1)c(cn1)[N+1]([O-1])=O","InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3","VAOCPAMSLUNLGC-UHFFFAOYSA-N"
"CN(C2)CC=C(C2)c(c1)cccc1","InChI=1S/C12H15N/c1-13-9-7-12(8-10-13)11-5-3-2-4-6-11/h2-7H,8-10H2,1H3","PLRACCBDVIHHLZ-UHFFFAOYSA-N"
"CNC(C)(C21)C(C)(C)C(CC2)C1","InChI=1S/C11H21N/c1-10(2)8-5-6-9(7-8)11(10,3)12-4/h8-9,12H,5-7H2,1-4H3","IMYZQPCYWPFTAG-UHFFFAOYSA-N"
"CN(C)c(c3)cc([s+1]1)c(c3)nc(c2)c(cc(N(C)C)c2)1","InChI=1S/C16H18N3S/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13/h5-10H,1-4H3/q+1","RBTBFTRPCNLSDE-UHFFFAOYSA-N"
"OC(=O)CCC(C(O)=O)NC(=O)c(c3)ccc(c3)N(C)Cc(c2)nc(c(N)1)c(n2)nc(N)n1","InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)","FBOZXECLQNJBKD-UHFFFAOYSA-N"
"OCC([H])(O1)C([H])(O)C([H])(O)C([H])1n(c3)c(N=2)c(n3)C(=N)N(C)C2","InChI=1S/C11H15N5O4/c1-15-3-14-10-6(9(15)12)13-4-16(10)11-8(19)7(18)5(2-17)20-11/h3-5,7-8,11-12,17-19H,2H2,1H3/t5-,7-,8-,11-/m1/s1","GFYLSDSUCHVORB-IOSLPCCCSA-N"
"NC(=O)c(c1)c[n+1](C)cc1","InChI=1S/C7H8N2O/c1-9-4-2-3-6(5-9)7(8)10/h2-5H,1H3,(H-,8,10)/p+1","LDHMAVIPBRSVRG-UHFFFAOYSA-O"
"C#CCN(C)Cc(c1)cccc1","InChI=1S/C11H13N/c1-3-9-12(2)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3","DPWPWRLQFGFJFI-UHFFFAOYSA-N"
"OC(=O)[C@@H](N)Cc(c1)n(C)cn1","InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m0/s1","JDHILDINMRGULE-LURJTMIESA-N"
"OC(=O)C(N)Cc(c1)n(C)cn1","InChI=1S/C7H11N3O2/c1-10-4-9-3-5(10)2-6(8)7(11)12/h3-4,6H,2,8H2,1H3,(H,11,12)/t6-/m1/s1","JDHILDINMRGULE-ZCFIWIBFSA-N"
"OCC(O1)C(O)C(O)C(N)C(O)1","InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3+,4-,5-,6?/m1/s1","MSWZFWKMSRAUBD-CBPJZXOFSA-N"
"OCC(O1)C(O)C(OC(C)C(O)=O)C(N)C(O)1","InChI=1S/C9H17NO7/c1-3(8(13)14)16-7-5(10)9(15)17-4(2-11)6(7)12/h3-7,9,11-12,15H,2,10H2,1H3,(H,13,14)/t3-,4-,5-,6-,7-,9?/m1/s1","MSFSPUZXLOGKHJ-PGYHGBPZSA-N"
"CN(C)CC([H])(C)CN(c21)c(c3)c(ccc(OC)3)Sc(cccc2)1","InChI=1S/C19H24N2OS/c1-14(12-20(2)3)13-21-16-7-5-6-8-18(16)23-19-10-9-15(22-4)11-17(19)21/h5-11,14H,12-13H2,1-4H3/t14-/m1/s1","VRQVVMDWGGWHTJ-CQSZACIVSA-N"
"CNCCC1=CNC2=CC=CC=C21","InChI=1S/C11H14N2/c1-12-7-6-9-8-13-11-5-3-2-4-10(9)11/h2-5,8,12-13H,6-7H2,1H3","NCIKQJBVUNUXLW-UHFFFAOYSA-N"
"CN(C)CCC1=CNC2=C1C=C(C=C2)OC","InChI=1S/C13H18N2O/c1-15(2)7-6-10-9-14-13-5-4-11(16-3)8-12(10)13/h4-5,8-9,14H,6-7H2,1-3H3","ZSTKHSQDNIGFLM-UHFFFAOYSA-N"
"OCC(O1)C(O)CC1n(c3)c(n2)c(n3)c(NC)nc2","InChI=1S/C11H15N5O3/c1-12-10-9-11(14-4-13-10)16(5-15-9)8-2-6(18)7(3-17)19-8/h4-8,17-18H,2-3H2,1H3,(H,12,13,14)/t6-,7+,8+/m0/s1","DYSDOYRQWBDGQQ-XLPZGREQSA-N"
"CC1=CNN=C1","InChI=1S/C4H6N2/c1-4-2-5-6-3-4/h2-3H,1H3,(H,5,6)","RIKMMFOAQPJVMX-UHFFFAOYSA-N"
"Cn(c1)c(S)nc1","InChI=1S/C4H6N2S/c1-6-3-2-5-4(6)7/h2-3H,1H3,(H,5,7)","PMRYVIKBURPHAH-UHFFFAOYSA-N"
"Nc(c2)c(Cl)cc(c2)Cc(c1)cc(Cl)c(N)c1","InChI=1S/C13H12Cl2N2/c14-10-6-8(1-3-12(10)16)5-9-2-4-13(17)11(15)7-9/h1-4,6-7H,5,16-17H2","IBOFVQJTBBUKMU-UHFFFAOYSA-N"
"CCC(CO)NC(=O)C(C4)C=C(C(N(C)4)1)c(c3)c(c(cc3)2)c(cn(C)2)C1","InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15+,19-/m1/s1","KPJZHOPZRAFDTN-ZRGWGRIASA-N"
"CC(N)C(O)c(c1)cc(O)cc1","InChI=1S/C9H13NO2/c1-6(10)9(12)7-3-2-4-8(11)5-7/h2-6,9,11-12H,10H2,1H3/t6-,9-/m0/s1","WXFIGDLSSYIKKV-RCOVLWMOSA-N"
"COc(c1)cc(C(O)C(C)N)c(OC)c1","InChI=1S/C11H17NO3/c1-7(12)11(13)9-6-8(14-2)4-5-10(9)15-3/h4-7,11,13H,12H2,1-3H3","WJAJPNHVVFWKKL-UHFFFAOYSA-N"
"c(c2)ncc(c2)C(C1)=NCC1","InChI=1S/C9H10N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7H,2,4,6H2","DPNGWXJMIILTBS-UHFFFAOYSA-N"
"CN(C2)C(CC2)c(c1)cncc1","InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1","SNICXCGAKADSCV-JTQLQIEISA-N"
"NC[C@H](O1)[C@@H](O)[C@H](O)[C@@H](N)[C@H]1O[C@H]([C@@H](CO)4)[C@@H](O)[C@@H](O4)O[C@H]([C@@H](O)3)[C@@H]([C@@H](N)C[C@@H](N)3)O[C@@H](O2)[C@H](N)[C@@H](O)[C@H](O)[C@@H](CN)2","InChI=1S/C23H46N6O13/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22/h5-23,30-36H,1-4,24-29H2","PGBHMTALBVVCIT-UHFFFAOYSA-N"
"NC[C@H](O)c(c1)cc(O)c(O)c1","InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2/t8-/m0/s1","SFLSHLFXELFNJZ-QMMMGPOBSA-N"
"CN(C)C(=O)Oc(c1)cc(cc1)[N+1](C)(C)C","InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1","ALWKGYPQUAPLQC-UHFFFAOYSA-N"
"CCN(C=1)c(n2)c(ccc(C)2)C(=O)C(C(O)=O)1","InChI=1S/C12H12N2O3/c1-3-14-6-9(12(16)17)10(15)8-5-4-7(2)13-11(8)14/h4-6H,3H2,1-2H3,(H,16,17)","MHWLWQUZZRMNGJ-UHFFFAOYSA-N"
"NCCC[C@@H](N)C(O)=O","InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m1/s1","AHLPHDHHMVZTML-SCSAIBSYSA-N"
"[C@H](C4)(N(C)C)[C@@H](C(O[C@H]4C)O[C@H]([C@@H](C)2)[C@H](C[C@](C(=O)[C@H](C)[C@@H](O)[C@H]([C@H](OC([C@H](C)[C@H]2O[C@H](O3)C[C@H](OC)[C@@H]([C@@H]3C)O)=O)C)C)(C1)O1)C)O","InChI=1S/C35H61NO12/c1-16-14-35(15-43-35)32(40)19(4)27(37)18(3)22(7)46-33(41)21(6)31(47-26-13-25(42-11)28(38)23(8)45-26)20(5)30(16)48-34-29(39)24(36(9)10)12-17(2)44-34/h16-31,34,37-39H,12-15H2,1-11H3","RZPAKFUAFGMUPI-UHFFFAOYSA-N"
"OC(COP(O)(O)=O)C(O)=O","InChI=1S/C3H7O7P/c4-2(3(5)6)1-10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)","OSJPPGNTCRNQQC-UHFFFAOYSA-N"
"Nc(c2)nc(N)c(c2)N=Nc(c1)cccc1","InChI=1S/C11H11N5/c12-10-7-6-9(11(13)14-10)16-15-8-4-2-1-3-5-8/h1-7H,(H4,12,13,14)/b16-15+","QPFYXYFORQJZEC-FOCLMDBBSA-N"
"C(C1)NCCN1","InChI=1S/C4H10N2/c1-2-6-4-3-5-1/h5-6H,1-4H2","GLUUGHFHXGJENI-UHFFFAOYSA-N"
"C1=C2C(=NC=N1)N=CN2","InChI=1S/C5H4N4/c1-4-5(8-2-6-1)9-3-7-4/h1-3H,(H,6,7,8,9)","KDCGOANMDULRCW-UHFFFAOYSA-N"
"O=C(C1)CC(C2)N(C)C(CC2)1","InChI=1S/C9H15NO/c1-10-7-3-2-4-8(10)6-9(11)5-7/h7-8H,2-6H2,1H3","RHWSKVCZXBAWLZ-UHFFFAOYSA-N"
"CN1C=CC=CC1=CN=O","InChI=1S/C7H8N2O/c1-9-5-3-2-4-7(9)6-8-10/h2-6H,1H3/b7-6+","JBKPUQTUERUYQE-VOTSOKGWSA-N"
"CN(C5)Cc(c1CC(=O)c(c3)c(C5)cc(O4)c(OC4)3)c(O2)c(OC2)cc1","InChI=1S/C20H19NO5/c1-21-5-4-13-7-18-19(25-10-24-18)8-14(13)16(22)6-12-2-3-17-20(15(12)9-21)26-11-23-17/h2-3,7-8H,4-6,9-11H2,1H3","GPTFURBXHJWNHR-UHFFFAOYSA-N"
"COc(c4)c(OC)cc(c34)c(c1)[n+1](CC3)cc(c(OC)2)c(ccc(OC)2)1","InChI=1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1","QUCQEUCGKKTEBI-UHFFFAOYSA-N"
"C[N+1](C)(C)CCOP(O)(O)=O","InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p+1","YHHSONZFOIEMCP-UHFFFAOYSA-O"
"OCc(c1)c(C(O)=O)c(O)c(C)n1","InChI=1S/C8H9NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2,10-11H,3H2,1H3,(H,12,13)","HXACOUQIXZGNBF-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c2)c(n3)c(cnc3)n2","InChI=1S/C10H12N4O4/c15-2-6-7(16)8(17)10(18-6)14-4-13-5-1-11-3-12-9(5)14/h1,3-4,6-8,10,15-17H,2H2/t6-,7-,8-,10-/m1/s1","MRWXACSTFXYYMV-FDDDBJFASA-N"
"OC(=O)CP(O)(O)=O","InChI=1S/C2H5O5P/c3-2(4)1-8(5,6)7/h1H2,(H,3,4)(H2,5,6,7)","XUYJLQHKOGNDPB-UHFFFAOYSA-N"
"OC(=O)CN(C)C(=N)NP(O)(O)=O","InChI=1S/C4H10N3O5P/c1-7(2-3(8)9)4(5)6-13(10,11)12/h2H2,1H3,(H,8,9)(H4,5,6,10,11,12)","DRBBFCLWYRJSJZ-UHFFFAOYSA-N"
"NC(=O)c(c1)nccn1","InChI=1S/C5H5N3O/c6-5(9)4-3-7-1-2-8-4/h1-3H,(H2,6,9)","IPEHBUMCGVEMRF-UHFFFAOYSA-N"
"OC(=O)[C@@H](N)CCCNC(=N)NP(O)(O)=O","InChI=1S/C6H15N4O5P/c7-4(5(11)12)2-1-3-9-6(8)10-16(13,14)15/h4H,1-3,7H2,(H,11,12)(H5,8,9,10,13,14,15)/t4-/m0/s1","CCTIOCVIZPCTGO-BYPYZUCNSA-N"
"OCC(O1)C(O)C(O)C(N)C1OC(C(N)4)C(C(O)C(N)C4)OC(O3)C(O)C(C(CO)3)OC([H])(O2)C(N)C(O)C(O)C(CN)2","InChI=1S/C23H45N5O14/c24-2-7-13(32)15(34)10(27)21(37-7)41-19-9(4-30)39-23(17(19)36)42-20-12(31)5(25)1-6(26)18(20)40-22-11(28)16(35)14(33)8(3-29)38-22/h5-23,29-36H,1-4,24-28H2/t5-,6+,7+,8-,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23-/m1/s1","UOZODPSAJZTQNH-IRIMDDDUSA-N"
"OCC(CO)CCn(c2)c(N1)c(n2)C(=O)N=C(N)1","InChI=1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)12-5-15(8)2-1-6(3-16)4-17/h5-6,16-17H,1-4H2,(H3,11,13,14,18)","JNTOCHDNEULJHD-UHFFFAOYSA-N"
"CN(C)C(=O)Oc(n1)c(C)c(C)nc(N(C)C)1","InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3","YFGYUFNIOHWBOB-UHFFFAOYSA-N"
"CCN(CC)CCOC(=O)c(c1)ccc(N)c1","InChI=1S/C13H20N2O2/c1-3-15(4-2)9-10-17-13(16)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3","MFDFERRIHVXMIY-UHFFFAOYSA-N"
"COc(c1)c(OC)cc(c(N)4)c1nc(n4)N(C3)CCN(C3)C(=O)c(c2)occ2","InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)","IENZQIKPVFGBNW-UHFFFAOYSA-N"
"CC(C)NCC(O)COc(c1)c(c2)c(ccc2)cc1","InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3","AQHHHDLHHXJYJD-UHFFFAOYSA-N"
"CC(COC1=CC=CC=C1)N(CCCl)CC2=CC=CC=C2","InChI=1S/C18H22ClNO/c1-16(15-21-18-10-6-3-7-11-18)20(13-12-19)14-17-8-4-2-5-9-17/h2-11,16H,12-15H2,1H3","QZVCTJOXCFMACW-UHFFFAOYSA-N"
"O=C(C=1)Nc(c2)c(ccc2)C1","InChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11)","LISFMEBWQUVKPJ-UHFFFAOYSA-N"
"NC(=O)NN","InChI=1S/CH5N3O/c2-1(5)4-3/h3H2,(H3,2,4,5)","DUIOPKIIICUYRZ-UHFFFAOYSA-N"
"OCC(c(c4)cccc4)C(=O)OC(C2)CC(N(C)3)C(O1)C1C23","InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11-,12-,13-,14+,15-,16+/m1/s1","STECJAGHUSJQJN-FWXGHANASA-N"
"C[n+1](c1)c(c54)c(ccc(cc(O6)c(OC6)c5)4)c(c2)c(cc(O3)c(OC3)2)1","InChI=1S/C20H14NO4/c1-21-8-12-5-17-18(24-10-23-17)6-14(12)13-3-2-11-4-16-19(25-9-22-16)7-15(11)20(13)21/h2-8H,9-10H2,1H3/q+1","IUMDBPMWPHHBDU-UHFFFAOYSA-N"
"C[n+1](c1)c(c54)c(ccc(cc(O6)c(OC6)c5)4)c(c2)c1c(O3)c(OC3)c2","InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1","INVGWHRKADIJHF-UHFFFAOYSA-N"
"CNC(C(O)3)C(O)C([H])(O1)C([H])(C(NC)3)OC(O)(C(=O)2)C([H])(OC(C)C2)1","InChI=1S/C14H24N2O7/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14/h5,7-13,15-16,18-20H,4H2,1-3H3/t5-,7-,8+,9+,10+,11-,12-,13+,14+/m1/s1","UNFWWIHTNXNPBV-WXKVUWSESA-N"
"OC(=O)CC(=C(C)1)c(c3)c(ccc(F)3)C(=Cc(c2)ccc(S(C)=O)c2)1","InChI=1S/C20H17FO3S/c1-12-17(9-13-3-6-15(7-4-13)25(2)24)16-8-5-14(21)10-19(16)18(12)11-20(22)23/h3-10H,11H2,1-2H3,(H,22,23)/b17-9-","MLKXDPUZXIRXEP-MFOYZWKCSA-N"
"CNCC(O)c(c1)ccc(O)c1","InChI=1S/C9H13NO2/c1-10-6-9(12)7-2-4-8(11)5-3-7/h2-5,9-12H,6H2,1H3/t9-/m0/s1","YRCWQPVGYLYSOX-VIFPVBQESA-N"
"O=C(OCC[N+1](C)(C)C)CCC(=O)OCC[N+1](C)(C)C","InChI=1S/C14H30N2O4/c1-15(2,3)9-11-19-13(17)7-8-14(18)20-12-10-16(4,5)6/h7-12H2,1-6H3/q+2","AXOIZCJOOAYSMI-UHFFFAOYSA-N"
"O[C@@H](C1)C[C@@H](C2)N(C)[C@@H](C2)1","InChI=1S/C8H15NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-8,10H,2-5H2,1H3/t6-,7+,8-","CYHOMWAPJJPNMW-RNLVFQAGSA-N"
"C1=CC=C2C(=C1)NC(=N2)C3=CSC=N3","InChI=1S/C10H7N3S/c1-2-4-8-7(3-1)12-10(13-8)9-5-14-6-11-9/h1-6H,(H,12,13)","WJCNZQLZVWNLKY-UHFFFAOYSA-N"
"COC(=O)C(N)Cc(c1)ccc(O)c1","InChI=1S/C10H13NO3/c1-14-10(13)9(11)6-7-2-4-8(12)5-3-7/h2-5,9,12H,6,11H2,1H3/t9-/m0/s1","MWZPENIJLUWBSY-VIFPVBQESA-N"
"COc(c4)c(OC)cc(c34)C(C1)N(CC3)Cc(c(OC)2)c(ccc(OC)2)1","InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3","AEQDJSLRWYMAQI-UHFFFAOYSA-N"
"OC(=O)Cc(c2)n(C)c(c2)C(=O)c(c1)ccc(C)c1","InChI=1S/C15H15NO3/c1-10-3-5-11(6-4-10)15(19)13-8-7-12(16(13)2)9-14(17)18/h3-8H,9H2,1-2H3,(H,17,18)","UPSPUYADGBWSHF-UHFFFAOYSA-N"
"C[N+1](C)(C)[O-1]","InChI=1S/C3H9NO/c1-4(2,3)5/h1-3H3","UYPYRKYUKCHHIB-UHFFFAOYSA-N"
"C[S+1](C)C","InChI=1S/C3H9S/c1-4(2)3/h1-3H3/q+1","NRZWQKGABZFFKE-UHFFFAOYSA-N"
"C[n+1](c1)cc(cc1)C([O-1])=O","InChI=1S/C7H7NO2/c1-8-4-2-3-6(5-8)7(9)10/h2-5H,1H3","WWNNZCOKKKDOPX-UHFFFAOYSA-N"
"O=C(C1)C[C@@H](C2)N(C)[C@@H](C2)1","InChI=1S/C8H13NO/c1-9-6-2-3-7(9)5-8(10)4-6/h6-7H,2-5H2,1H3/t6-,7+","QQXLDOJGLXJCSE-KNVOCYPGSA-N"
"OC(CNC(C)(C)C)COc(n2)c(ns2)N(C1)CCOC1","InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3/t10-/m0/s1","BLJRIMJGRPQVNF-JTQLQIEISA-N"
"CCCC(C3)OC(O3)(Cn(c2)ncn2)c(c1)c(Cl)cc(Cl)c1","InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3","STJLVHWMYQXCPB-UHFFFAOYSA-N"
"Clc(c3)cc(Cl)c(c3)C(OCc(c2)c(Cl)sc2)Cn(c1)cnc1","InChI=1S/C16H13Cl3N2OS/c17-12-1-2-13(14(18)7-12)15(8-21-5-4-20-10-21)22-9-11-3-6-23-16(11)19/h1-7,10,15H,8-9H2","QXHHHPZILQDDPS-UHFFFAOYSA-N"
"CC(C)(C)NCC(O)c(c1)cc(O)cc(O)1","InChI=1S/C12H19NO3/c1-12(2,3)13-7-11(16)8-4-9(14)6-10(15)5-8/h4-6,11,13-16H,7H2,1-3H3","XWTYSIMOBUGWOL-UHFFFAOYSA-N"
"CN(C)C(=N1)N(C)C(=O)N(C(C2)CCCC2)C(=O)1","InChI=1S/C12H20N4O2/c1-14(2)10-13-11(17)16(12(18)15(10)3)9-7-5-4-6-8-9/h9H,4-8H2,1-3H3","CAWXEEYDBZRFPE-UHFFFAOYSA-N"
"c(c2OC)(OC)ccc(c2)C(CCCN(C)CCc(c1)cc(OC)c(OC)c1)(C(C)C)C#N","InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3","SGTNSNPWRIOYBX-UHFFFAOYSA-N"
"O=C(C=2)NC(C(=O)1)=C(N2)N=C(N)N1","InChI=1S/C6H5N5O2/c7-6-10-4-3(5(13)11-6)9-2(12)1-8-4/h1H,(H,9,12)(H3,7,8,10,11,13)","VURKRJGMSKJIQX-UHFFFAOYSA-N"
"O=C(N3)Nc(n1)c(C(=O)3)nc(c2)c(cc(C)c(C)2)1","InChI=1S/C12H10N4O2/c1-5-3-7-8(4-6(5)2)14-10-9(13-7)11(17)16-12(18)15-10/h3-4H,1-2H3,(H2,14,15,16,17,18)","ZJTJUVIJVLLGSP-UHFFFAOYSA-N"
"Cc1cccc2n[nH]nc12","InChI=1S/C7H7N3/c1-5-3-2-4-6-7(5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","CMGDVUCDZOBDNL-UHFFFAOYSA-N"
"COc1ccc(C)cc1N","InChI=1S/C8H11NO/c1-6-3-4-8(10-2)7(9)5-6/h3-5H,9H2,1-2H3","WXWCDTXEKCVRRO-UHFFFAOYSA-N"
"O=C1CC2(CCCCC2)CN1","InChI=1S/C9H15NO/c11-8-6-9(7-10-8)4-2-1-3-5-9/h1-7H2,(H,10,11)","JAWPQJDOQPSNIQ-UHFFFAOYSA-N"
"Cc1ccc2cccc(O)c2n1","InChI=1S/C10H9NO/c1-7-5-6-8-3-2-4-9(12)10(8)11-7/h2-6,12H,1H3","NBYLBWHHTUWMER-UHFFFAOYSA-N"
"NCCCCCCCCCCC(O)=O","InChI=1S/C11H23NO2/c12-10-8-6-4-2-1-3-5-7-9-11(13)14/h1-10,12H2,(H,13,14)","GUOSQNAUYHMCRU-UHFFFAOYSA-N"
"N=C(Nc1ccccc1)Nc2ccccc2","InChI=1S/C13H13N3/c14-13(15-11-7-3-1-4-8-11)16-12-9-5-2-6-10-12/h1-10H,(H3,14,15,16)","OWRCNXZUPFZXOS-UHFFFAOYSA-N"
"O=S(=O)(NCCCC)c(cccc1)c1","InChI=1S/C10H15NO2S/c1-2-3-9-11-14(12,13)10-7-5-4-6-8-10/h4-8,11H,2-3,9H2,1H3","IPRJXAGUEGOFGG-UHFFFAOYSA-N"
"Nc1c(S(=O)(=O)c2ccccc2)cccc1","InChI=1S/C12H11NO2S/c13-11-8-4-5-9-12(11)16(14,15)10-6-2-1-3-7-10/h1-9H,13H2","JBCUKQQIWSWEOK-UHFFFAOYSA-N"
"CN1N(C(=O)C(=C1C)NC(C)=O)c2ccccc2","InChI=1S/C13H15N3O2/c1-9-12(14-10(2)17)13(18)16(15(9)3)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,17)","OIAGWXKSCXPNNZ-UHFFFAOYSA-N"
"CSc1nc(NC2CC2)nc(NC(C)(C)C)n1","InChI=1S/C11H19N5S/c1-11(2,3)16-9-13-8(12-7-5-6-7)14-10(15-9)17-4/h7H,5-6H2,1-4H3,(H2,12,13,14,15,16)","HDHLIWCXDDZUFH-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)N(C)CC(O)=O","InChI=1S/C15H29NO3/c1-3-4-5-6-7-8-9-10-11-12-14(17)16(2)13-15(18)19/h3-13H2,1-2H3,(H,18,19)","BACYUWVYYTXETD-UHFFFAOYSA-N"
"CC1CN(CC(C)O1)C2CCCCCCCCCCC2","InChI=1S/C18H35NO/c1-16-14-19(15-17(2)20-16)18-12-10-8-6-4-3-5-7-9-11-13-18/h16-18H,3-15H2,1-2H3","JMXKCYUTURMERF-UHFFFAOYSA-N"
"CC(C)(C)C(O)(CCc1ccc(Cl)cc1)Cn2cncn2","InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3","PXMNMQRDXWABCY-UHFFFAOYSA-N"
"CSC1=N[C@](C)(C(=O)N1Nc2ccccc2)c3ccccc3","InChI=1S/C17H17N3OS/c1-17(13-9-5-3-6-10-13)15(21)20(16(18-17)22-2)19-14-11-7-4-8-12-14/h3-12,19H,1-2H3/t17-/m0/s1","LMVPQMGRYSRMIW-KRWDZBQOSA-N"
"CC(=O)c1c(C(=O)C)cccc1","InChI=1S/C10H10O2/c1-7(11)9-5-3-4-6-10(9)8(2)12/h3-6H,1-2H3","LVQFKRXRTXCQCZ-UHFFFAOYSA-N"
"CCOc1ccc(N)cc1","InChI=1S/C8H11NO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2,9H2,1H3","IMPPGHMHELILKG-UHFFFAOYSA-N"
"Nc(c(ccc1)C(C)C)c1C(C)C","InChI=1S/C12H19N/c1-8(2)10-6-5-7-11(9(3)4)12(10)13/h5-9H,13H2,1-4H3","WKBALTUBRZPIPZ-UHFFFAOYSA-N"
"N(CCCCCCCC)CCCCCCCC","InChI=1S/C16H35N/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h17H,3-16H2,1-2H3","LAWOZCWGWDVVSG-UHFFFAOYSA-N"
"ClCCO[P](=O)(OCCCl)OCCCl","InChI=1S/C6H12Cl3O4P/c7-1-4-11-14(10,12-5-2-8)13-6-3-9/h1-6H2","HQUQLFOMPYWACS-UHFFFAOYSA-N"
"Clc1cc(C(F)(F)F)cc(Cl)c1N2C(N)=C(S(=O)C(F)(F)F)C(C#N)=N2","InChI=1S/C12H4Cl2F6N4OS/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)26(25)12(18,19)20/h1-2H,22H2","ZOCSXAVNDGMNBV-UHFFFAOYSA-N"
"CCOc1ccccc1N","InChI=1S/C8H11NO/c1-2-10-8-6-4-3-5-7(8)9/h3-6H,2,9H2,1H3","ULHFFAFDSSHFDA-UHFFFAOYSA-N"
"CCCCCCCCN1CCCC1=O","InChI=1S/C12H23NO/c1-2-3-4-5-6-7-10-13-11-8-9-12(13)14/h2-11H2,1H3","WPPOGHDFAVQKLN-UHFFFAOYSA-N"
"N(CC(CCCC)CC)CC(CCCC)CC","InChI=1S/C16H35N/c1-5-9-11-15(7-3)13-17-14-16(8-4)12-10-6-2/h15-17H,5-14H2,1-4H3","SAIKULLUBZKPDA-UHFFFAOYSA-N"
"C[C@]12CC=C3[C@@H](CCC4=C3CCC5(C4)OCCO5)[C@@H]1CCC2=O","InChI=1S/C20H26O3/c1-19-8-6-15-14-7-9-20(22-10-11-23-20)12-13(14)2-3-16(15)17(19)4-5-18(19)21/h6,16-17H,2-5,7-12H2,1H3/t16-,17+,19+/m1/s1","XUOQKQRMICQUQC-AOIWGVFYSA-N"
"CC(C)OC(=O)CCC(=O)OC(C)C","InChI=1S/C10H18O4/c1-7(2)13-9(11)5-6-10(12)14-8(3)4/h7-8H,5-6H2,1-4H3","YPLYFEUBZLLLIY-UHFFFAOYSA-N"
"CCOC(=O)C(C(=O)OCC)(CC=C)CC=C","InChI=1S/C13H20O4/c1-5-9-13(10-6-2,11(14)16-7-3)12(15)17-8-4/h5-6H,1-2,7-10H2,3-4H3","LYUUVYQGUMRKOV-UHFFFAOYSA-N"
"O=C(OCC1CCC2OC2C1)C3CCC4OC4C3","InChI=1S/C14H20O4/c15-14(9-2-4-11-13(6-9)18-11)16-7-8-1-3-10-12(5-8)17-10/h8-13H,1-7H2","YXALYBMHAYZKAP-UHFFFAOYSA-N"
"N1(C=C2)N=C(N=C1N=C2C)S(=O)(NC(=C(F)C=C1)C(F)=C1)=O","InChI=1S/C12H9F2N5O2S/c1-7-5-6-19-11(15-7)16-12(17-19)22(20,21)18-10-8(13)3-2-4-9(10)14/h2-6,18H,1H3","RXCPQSJAVKGONC-UHFFFAOYSA-N"
"S1NC(C(C1=CC1)=CC=1)=O","InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)","DMSMPAJRVJJAGA-UHFFFAOYSA-N"
"COc1cc2CC(=O)NC=Cc2cc1OC","InChI=1S/C12H13NO3/c1-15-10-5-8-3-4-13-12(14)7-9(8)6-11(10)16-2/h3-6H,7H2,1-2H3,(H,13,14)","CPNZASIAJKSBBH-UHFFFAOYSA-N"
"c1ccccc1S(=O)(=O)Nc2ccccc2","InChI=1S/C12H11NO2S/c14-16(15,12-9-5-2-6-10-12)13-11-7-3-1-4-8-11/h1-10,13H","XAUGWFWQVYXATQ-UHFFFAOYSA-N"
"CCN(C(=O)N(CC)c1ccccc1)c2ccccc2","InChI=1S/C17H20N2O/c1-3-18(15-11-7-5-8-12-15)17(20)19(4-2)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3","PZIMIYVOZBTARW-UHFFFAOYSA-N"
"COC(=O)c1ccc(C)cc1C2=NC(=O)C(C)(N2)C(C)C","InChI=1S/C16H20N2O3/c1-9(2)16(4)15(20)17-13(18-16)12-8-10(3)6-7-11(12)14(19)21-5/h6-9H,1-5H3,(H,17,18,20)","FFCCBBNQPIMUJI-UHFFFAOYSA-N"
"O=C(OC)C=Cc(cccc1)c1","InChI=1S/C10H10O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-8H,1H3","CCRCUPLGCSFEDV-UHFFFAOYSA-N"
"O=C(c(ccc(c1)Cl)c1)c(ccc(c2)Cl)c2","InChI=1S/C13H8Cl2O/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8H","OKISUZLXOYGIFP-UHFFFAOYSA-N"
"C1CC(CC=C1)C2OCC3(CO2)COC(OC3)C4CCC=CC4","InChI=1S/C19H28O4/c1-3-7-15(8-4-1)17-20-11-19(12-21-17)13-22-18(23-14-19)16-9-5-2-6-10-16/h1-3,5,15-18H,4,6-14H2","WKTJXDHLMJKSGI-UHFFFAOYSA-N"
"O=C(c(c(C(=O)c1c(Nc(ccc(c2)C)c2)ccc3Nc(ccc(c4)C)c4)ccc5)c5)c13","InChI=1S/C28H22N2O2/c1-17-7-11-19(12-8-17)29-23-15-16-24(30-20-13-9-18(2)10-14-20)26-25(23)27(31)21-5-3-4-6-22(21)28(26)32/h3-16,29-30H,1-2H3","TVRGPOFMYCMNRB-UHFFFAOYSA-N"
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"CN1C(=O)C=C(OC2=C(F)C=C(F)C=C2)C2=C1N=C(NCC(C)(C)O)N=C2","InChI=1S/C18H18F2N4O3/c1-18(2,26)9-22-17-21-8-11-14(7-15(25)24(3)16(11)23-17)27-13-5-4-10(19)6-12(13)20/h4-8,26H,9H2,1-3H3,(H,21,22,23)","KOKXXPKAPFSRCR-UHFFFAOYSA-N"
"NC1=C(Cl)C(Cl)=NC(C(O)=O)=C1Cl","InChI=1S/C6H3Cl3N2O2/c7-1-3(10)2(8)5(9)11-4(1)6(12)13/h(H2,10,11)(H,12,13)","NQQVFXUMIDALNH-UHFFFAOYSA-N"
"NC1=CC=C(C=C1)C(C1=CC=C(N)C=C1)=C1C=CC(=N)C=C1","InChI=1S/C19H17N3/c20-16-7-1-13(2-8-16)19(14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,20H,21-22H2","AFAIELJLZYUNPW-UHFFFAOYSA-N"
"CC1=C(O)C(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O","InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3","ZXVONLUNISGICL-UHFFFAOYSA-N"
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"CNP(=O)(OC)OC1=CC=C(C=C1Cl)C(C)(C)C","InChI=1S/C12H19ClNO3P/c1-12(2,3)9-6-7-11(10(13)8-9)17-18(15,14-4)16-5/h6-8H,1-5H3,(H,14,15)","BOFHKBLZOYVHSI-UHFFFAOYSA-N"
"CCOC(=O)C=CC(O)=O","InChI=1S/C6H8O4/c1-2-10-6(9)4-3-5(7)8/h3-4H,2H2,1H3,(H,7,8)","XLYMOEINVGRTEX-UHFFFAOYSA-N"
"CC(C)C1=CC=CC(C(C)C)=C1N1C(=O)C2=C(C=C(O)C=C2)C1=O","InChI=1S/C20H21NO3/c1-11(2)14-6-5-7-15(12(3)4)18(14)21-19(23)16-9-8-13(22)10-17(16)20(21)24/h5-12,22H,1-4H3","LAKWINYVWJPHQW-UHFFFAOYSA-N"
"CCOC(=O)COC1=CC2=C(CCC(C2)NCC(O)C2=CC(Cl)=CC=C2)C=C1","InChI=1S/C22H26ClNO4/c1-2-27-22(26)14-28-20-9-7-15-6-8-19(11-17(15)12-20)24-13-21(25)16-4-3-5-18(23)10-16/h3-5,7,9-10,12,19,21,24-25H,2,6,8,11,13-14H2,1H3","RDJQCOBTKKAQAH-UHFFFAOYSA-N"
"CC1=C(C2=C(O1)C(NC(=O)C1=C(Cl)C=CC=C1Cl)=CC=C2)C(C)(C)O","InChI=1S/C19H17Cl2NO3/c1-10-16(19(2,3)24)11-6-4-9-14(17(11)25-10)22-18(23)15-12(20)7-5-8-13(15)21/h4-9,24H,1-3H3,(H,22,23)","GCAOVMKRBUCSET-UHFFFAOYSA-N"
"OC(=O)C1C(C(O)=O)C2(Cl)C(Cl)=C(Cl)C1(Cl)C2(Cl)Cl","InChI=1S/C9H4Cl6O4/c10-3-4(11)8(13)2(6(18)19)1(5(16)17)7(3,12)9(8,14)15/h1-2H,(H,16,17)(H,18,19)","DJKGDNKYTKCJKD-UHFFFAOYSA-N"
"CCOP(=S)(OCC)OC1=CC2=C(C=C1)C(C)=C(Cl)C(=O)O2","InChI=1S/C14H16ClO5PS/c1-4-17-21(22,18-5-2)20-10-6-7-11-9(3)13(15)14(16)19-12(11)8-10/h6-8H,4-5H2,1-3H3","BXNANOICGRISHX-UHFFFAOYSA-N"
"CC1(C)C(=O)NC(=O)NC1=O","InChI=1S/C6H8N2O3/c1-6(2)3(9)7-5(11)8-4(6)10/h1-2H3,(H2,7,8,9,10,11)","LAOZSCRCYVBSJA-UHFFFAOYSA-N"
"NC(=O)C1=CC=CN=C1","InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)","DFPAKSUCGFBDDF-UHFFFAOYSA-N"
"C[C@]12CC[C@H]3[C@@H](CCC4=CC5=C(C[C@]34C)C=NO5)[C@@H]1CC[C@@]2(O)C#C","InChI=1S/C22H27NO2/c1-4-22(24)10-8-18-16-6-5-15-11-19-14(13-23-25-19)12-20(15,2)17(16)7-9-21(18,22)3/h1,11,13,16-18,24H,5-10,12H2,2-3H3/t16-,17+,18+,20+,21+,22+/m1/s1","POZRVZJJTULAOH-LHZXLZLDSA-N"
"CN1N=C(C)C(C=NOCC2=CC=C(C=C2)C(=O)OC(C)(C)C)=C1OC1=CC=CC=C1","InChI=1S/C24H27N3O4/c1-17-21(22(27(5)26-17)30-20-9-7-6-8-10-20)15-25-29-16-18-11-13-19(14-12-18)23(28)31-24(2,3)4/h6-15H,16H2,1-5H3","YYJNOYZRYGDPNH-UHFFFAOYSA-N"
"CC1=NNC(=O)N(C1)\N=C\C1=CC=CN=C1","InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)/b12-6+","QHMTXANCGGJZRX-WUXMJOGZSA-N"
"ClC1=CC2=C(NC(=O)O2)C=C1","InChI=1S/C7H4ClNO2/c8-4-1-2-5-6(3-4)11-7(10)9-5/h1-3H,(H,9,10)","MATCZHXABVLZIE-UHFFFAOYSA-N"
"COC1=C(C=C(C(=O)C2=CC=CC=C2)C(O)=C1)S(O)(=O)=O","InChI=1S/C14H12O6S/c1-20-12-8-11(15)10(7-13(12)21(17,18)19)14(16)9-5-3-2-4-6-9/h2-8,15H,1H3,(H,17,18,19)","CXVGEDCSTKKODG-UHFFFAOYSA-N"
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"FC1=CC=C(CC2CCN(CCS(=O)C3=CC=C4NC(=O)OC4=C3)CC2)C=C1","InChI=1S/C21H23FN2O3S/c22-17-3-1-15(2-4-17)13-16-7-9-24(10-8-16)11-12-28(26)18-5-6-19-20(14-18)27-21(25)23-19/h1-6,14,16H,7-13H2,(H,23,25)","FCBQJNCAKZSIAH-UHFFFAOYSA-N"
"CC(CC1=CC=C(OCC(O)=O)C=C1)NCC(O)C1=CSC(=N1)C(F)(F)F","InChI=1S/C17H19F3N2O4S/c1-10(6-11-2-4-12(5-3-11)26-8-15(24)25)21-7-14(23)13-9-27-16(22-13)17(18,19)20/h2-5,9-10,14,21,23H,6-8H2,1H3,(H,24,25)","YVIXXPCJZAUQHJ-UHFFFAOYSA-N"
"CC1=C(CCOC2=CC=CC3=C2C=CN3CCC(O)=O)N=C(O1)C1=CC=CC=C1","InChI=1S/C23H22N2O4/c1-16-19(24-23(29-16)17-6-3-2-4-7-17)12-15-28-21-9-5-8-20-18(21)10-13-25(20)14-11-22(26)27/h2-10,13H,11-12,14-15H2,1H3,(H,26,27)","OMSPUVWUIHNYCS-UHFFFAOYSA-N"
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"CCC1=C(N(N=C1C(=O)NN1CCCCC1)C1=CC=C(Cl)C=C1Cl)C1=CC=C(Br)C=C1","InChI=1S/C23H23BrCl2N4O/c1-2-18-21(23(31)28-29-12-4-3-5-13-29)27-30(20-11-10-17(25)14-19(20)26)22(18)15-6-8-16(24)9-7-15/h6-11,14H,2-5,12-13H2,1H3,(H,28,31)","HMXDWDSNPRNUKI-UHFFFAOYSA-N"
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"CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NN1CCCCCC1","InChI=1S/C14H21N3O3S/c1-12-6-8-13(9-7-12)21(19,20)16-14(18)15-17-10-4-2-3-5-11-17/h6-9H,2-5,10-11H2,1H3,(H2,15,16,18)","OUDSBRTVNLOZBN-UHFFFAOYSA-N"
"CC1=CC=C(C=C1)C(=O)C1=CC(O)=C(O)C(=C1)[N+]([O-])=O","InChI=1S/C14H11NO5/c1-8-2-4-9(5-3-8)13(17)10-6-11(15(19)20)14(18)12(16)7-10/h2-7,16,18H,1H3","MIQPIUSUKVNLNT-UHFFFAOYSA-N"
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"NC(=O)C1=C(Cl)C=C(C=C1)[N+]([O-])=O","InChI=1S/C7H5ClN2O3/c8-6-3-4(10(12)13)1-2-5(6)7(9)11/h1-3H,(H2,9,11)","GFGSZUNNBQXGMK-UHFFFAOYSA-N"
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"NC1=CC=C(C=C1)C(=O)OCCCOC(=O)C1=CC=C(N)C=C1","InChI=1S/C17H18N2O4/c18-14-6-2-12(3-7-14)16(20)22-10-1-11-23-17(21)13-4-8-15(19)9-5-13/h2-9H,1,10-11,18-19H2","YPACMOORZSDQDQ-UHFFFAOYSA-N"
"C[C@@H](O)C1=NC(=CC=N1)N1[C@@H](C)CN(C[C@H]1C)C1=NC(C)=NC(C)=N1","InChI=1S/C17H25N7O/c1-10-8-23(17-20-13(4)19-14(5)21-17)9-11(2)24(10)15-6-7-18-16(22-15)12(3)25/h6-7,10-12,25H,8-9H2,1-5H3/t10-,11+,12-/m1/s1","FTEQMUXMWCGJAF-GRYCIOLGSA-N"
"CC1=C(C)C(NC2=NC(SCC(O)=O)=NC(Cl)=C2)=CC=C1","InChI=1S/C14H14ClN3O2S/c1-8-4-3-5-10(9(8)2)16-12-6-11(15)17-14(18-12)21-7-13(19)20/h3-6H,7H2,1-2H3,(H,19,20)(H,16,17,18)","SZRPDCCEHVWOJX-UHFFFAOYSA-N"
"OC1=CC=C2C=CC=CC2=C1N=NC1=CC=CC=C1","InChI=1S/C16H12N2O/c19-15-11-10-12-6-4-5-9-14(12)16(15)18-17-13-7-2-1-3-8-13/h1-11,19H","MRQIXHXHHPWVIL-UHFFFAOYSA-N"
"OC1=CC2=C(C(O)=C1)C(=O)C(O)=C(O2)C1=CC(O)=C(O)C=C1","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1=COC2=C(C=CC(O)=C2)C1=O","InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3","HKQYGTCOTHHOMP-UHFFFAOYSA-N"
"OC1=C(Br)C=C(Br)C=C1C(=O)NC1=CC=C(Br)C=C1","InChI=1S/C13H8Br3NO2/c14-7-1-3-9(4-2-7)17-13(19)10-5-8(15)6-11(16)12(10)18/h1-6,18H,(H,17,19)","KVSKGMLNBAPGKH-UHFFFAOYSA-N"
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"COC1=NC(C)=NC(N)=N1","InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)","NXFQWRWXEYTOTK-UHFFFAOYSA-N"
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"OC(CCl)CS(O)(=O)=O","InChI=1S/C3H7ClO4S/c4-1-3(5)2-9(6,7)8/h3,5H,1-2H2,(H,6,7,8)","DDLBHIIDBLGOTE-UHFFFAOYSA-N"
"O[C@H]([C@H](CC1=CC=CC=C1)NC(=O)C1=CC2=CC(Cl)=CC=C2N1)C(=O)N1C[C@H](O)[C@H](O)C1","InChI=1S/C23H24ClN3O5/c24-15-6-7-16-14(9-15)10-18(25-16)22(31)26-17(8-13-4-2-1-3-5-13)21(30)23(32)27-11-19(28)20(29)12-27/h1-7,9-10,17,19-21,25,28-30H,8,11-12H2,(H,26,31)/t17-,19-,20+,21+/m0/s1","GVDRRZOORHCTAN-MJUUVYJYSA-N"
"CCCCc1ccc2c(n1)[C@@H](c1ccc(OC)cc1C[C@H](C)C(O)=O)[C@H](C(O)=O)[C@H]2c1ccc2c(c1)OCO2","InChI=1S/C31H33NO7/c1-4-5-6-20-8-10-23-26(18-7-12-24-25(15-18)39-16-38-24)28(31(35)36)27(29(23)32-20)22-11-9-21(37-3)14-19(22)13-17(2)30(33)34/h7-12,14-15,17,26-28H,4-6,13,16H2,1-3H3,(H,33,34)(H,35,36)/t17-,26-,27-,28+/m0/s1","IUHMIOAKWHUFKU-YINIXLNUSA-N"
"CC1=CC(=CC=C1NC(=O)C1=CC=CC(I)=C1C(=O)NC(C)(C)CS(C)(=O)=O)C(F)(C(F)(F)F)C(F)(F)F","InChI=1S/C23H22F7IN2O4S/c1-12-10-13(21(24,22(25,26)27)23(28,29)30)8-9-16(12)32-18(34)14-6-5-7-15(31)17(14)19(35)33-20(2,3)11-38(4,36)37/h5-10H,11H2,1-4H3,(H,32,34)(H,33,35)","ZGNITFSDLCMLGI-UHFFFAOYSA-N"
"CCC1=CC(CC2=CC(CC)=C(N)C(CC)=C2)=CC(CC)=C1N","InChI=1S/C21H30N2/c1-5-16-10-14(11-17(6-2)20(16)22)9-15-12-18(7-3)21(23)19(8-4)13-15/h10-13H,5-9,22-23H2,1-4H3","NWIVYGKSHSJHEF-UHFFFAOYSA-N"
"COC1=C(NC2=NC3=C(C=N2)N(C)C(=O)C(F)(F)CN3C2CCCC2)C=CC(=C1)C(=O)NC1CCN(C)CC1","InChI=1S/C27H35F2N7O3/c1-34-12-10-18(11-13-34)31-24(37)17-8-9-20(22(14-17)39-3)32-26-30-15-21-23(33-26)36(19-6-4-5-7-19)16-27(28,29)25(38)35(21)2/h8-9,14-15,18-19H,4-7,10-13,16H2,1-3H3,(H,31,37)(H,30,32,33)","DJNZZLZKAXGMMC-UHFFFAOYSA-N"
"CC(=O)O[C@@]1(CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)[C@@H]5C[C@@H]5[C@]4(C)[C@H]3CC[C@]12C)C(C)=O","InChI=1S/C24H29ClO4/c1-12(26)24(29-13(2)27)8-6-16-14-10-20(25)19-11-21(28)15-9-18(15)23(19,4)17(14)5-7-22(16,24)3/h10-11,14-18H,5-9H2,1-4H3/t14-,15+,16-,17-,18-,22-,23-,24-/m0/s1","UWFYSQMTEOIJJG-FDTZYFLXSA-N"
"CC1=C(N)C=CC(CC2=CC(C)=C(N)C=C2)=C1","InChI=1S/C15H18N2/c1-10-7-12(3-5-14(10)16)9-13-4-6-15(17)11(2)8-13/h3-8H,9,16-17H2,1-2H3","WECDUOXQLAIPQW-UHFFFAOYSA-N"
"CCCOC(=O)C1=CC(O)=C(O)C(O)=C1","InChI=1S/C10H12O5/c1-2-3-15-10(14)6-4-7(11)9(13)8(12)5-6/h4-5,11-13H,2-3H2,1H3","ZTHYODDOHIVTJV-UHFFFAOYSA-N"
"OC(=O)COC1=C(Cl)C=C(Cl)C(Cl)=C1","InChI=1S/C8H5Cl3O3/c9-4-1-6(11)7(2-5(4)10)14-3-8(12)13/h1-2H,3H2,(H,12,13)","SMYMJHWAQXWPDB-UHFFFAOYSA-N"
"CC1=C(C)C(NC2=C(C=CC=C2)C(O)=O)=CC=C1","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","HYYBABOKPJLUIN-UHFFFAOYSA-N"
"COC1=CC2=C(C(OC)=C1OC)C1=CC=C(OC)C(=O)C=C1[C@H](CC2)NC(C)=O","InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1","IAKHMKGGTNLKSZ-INIZCTEOSA-N"
"O=C1NSC2=C1C=CC=C2","InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)","DMSMPAJRVJJAGA-UHFFFAOYSA-N"
"FC(OC(F)(F)F)C(F)(F)OC1=C(Cl)C=C(NC(=O)NC(=O)C2=C(F)C=CC=C2F)C=C1","InChI=1S/C17H9ClF8N2O4/c18-8-6-7(4-5-11(8)31-16(22,23)14(21)32-17(24,25)26)27-15(30)28-13(29)12-9(19)2-1-3-10(12)20/h1-6,14H,(H2,27,28,29,30)","NJPPVKZQTLUDBO-UHFFFAOYSA-N"
"CC1(C)CCC(C)(C)C2=C1C=CC(=C2)C(=O)NC1=CC=C(C=C1)C(O)=O","InChI=1S/C22H25NO3/c1-21(2)11-12-22(3,4)18-13-15(7-10-17(18)21)19(24)23-16-8-5-14(6-9-16)20(25)26/h5-10,13H,11-12H2,1-4H3,(H,23,24)(H,25,26)","SZWKGOZKRMMLAJ-UHFFFAOYSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)N(C)CC(O)=O","InChI=1S/C21H39NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(23)22(2)19-21(24)25/h10-11H,3-9,12-19H2,1-2H3,(H,24,25)/b11-10-","DIOYAVUHUXAUPX-KHPPLWFESA-N"
"CS(=O)(=O)C1=C(COCC(F)(F)F)C(Cl)=C(C=C1)C(=O)C1C(=O)CCCC1=O","InChI=1S/C17H16ClF3O6S/c1-28(25,26)13-6-5-9(15(18)10(13)7-27-8-17(19,20)21)16(24)14-11(22)3-2-4-12(14)23/h5-6,14H,2-4,7-8H2,1H3","IUQAXCIUEPFPSF-UHFFFAOYSA-N"
"OCC(CO)N1C=NC(=C1C1=CC=NC(OC2=CC=CC=C2)=N1)C1=CC=C(F)C=C1","InChI=1S/C22H19FN4O3/c23-16-8-6-15(7-9-16)20-21(27(14-25-20)17(12-28)13-29)19-10-11-24-22(26-19)30-18-4-2-1-3-5-18/h1-11,14,17,28-29H,12-13H2","ZDKIAVFEUPUCMR-UHFFFAOYSA-N"
"NC(=O)C1=NC(=NN1)C1=CC=CC(=C1)C1=CC(F)=CC=C1OCC(F)(F)C(F)(F)F","InChI=1S/C18H12F6N4O2/c19-11-4-5-13(30-8-17(20,21)18(22,23)24)12(7-11)9-2-1-3-10(6-9)15-26-16(14(25)29)28-27-15/h1-7H,8H2,(H2,25,29)(H,26,27,28)","OWSLGPREZQMVQP-UHFFFAOYSA-N"
"CC(=O)O[C@]1(C(C)=O)C(=C)C[C@H]2[C@@H]3C=C(C)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C","InChI=1S/C25H32O4/c1-14-11-19-20(23(5)9-7-18(28)13-21(14)23)8-10-24(6)22(19)12-15(2)25(24,16(3)26)29-17(4)27/h11,13,19-20,22H,2,7-10,12H2,1,3-6H3/t19-,20+,22+,23-,24+,25+/m1/s1","UDKABVSQKJNZBH-DWNQPYOZSA-N"
"CN(C)P(=O)(N(C)C)N(C)C","InChI=1S/C6H18N3OP/c1-7(2)11(10,8(3)4)9(5)6/h1-6H3","GNOIPBMMFNIUFM-UHFFFAOYSA-N"
"CCOP(=S)(OCC)OC1=CC=C(C=C1)S(C)=O","InChI=1S/C11H17O4PS2/c1-4-13-16(17,14-5-2)15-10-6-8-11(9-7-10)18(3)12/h6-9H,4-5H2,1-3H3","XDNBJTQLKCIJBV-UHFFFAOYSA-N"
"CC1(C)CNC(NC1)=NN=C(\C=C\C1=CC=C(C=C1)C(F)(F)F)/C=C/C1=CC=C(C=C1)C(F)(F)F","InChI=1S/C25H24F6N4/c1-23(2)15-32-22(33-16-23)35-34-21(13-7-17-3-9-19(10-4-17)24(26,27)28)14-8-18-5-11-20(12-6-18)25(29,30)31/h3-14H,15-16H2,1-2H3,(H2,32,33,35)/b13-7+,14-8+","IQVNEKKDSLOHHK-FNCQTZNRSA-N"
"CCCC1=C(OCCCOC2=CC=C(OCC(O)=O)C=C2)C=CC(C(C)=O)=C1O","InChI=1S/C22H26O7/c1-3-5-19-20(11-10-18(15(2)23)22(19)26)28-13-4-12-27-16-6-8-17(9-7-16)29-14-21(24)25/h6-11,26H,3-5,12-14H2,1-2H3,(H,24,25)","HBBVCKCCQCQCTJ-UHFFFAOYSA-N"
"CCCCC1=C(OS(=O)(=O)N(C)C)N=C(NCC)N=C1C","InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)","DSKJPMWIHSOYEA-UHFFFAOYSA-N"
"CCCCC1=C(O)N=C(NCC)N=C1C","InChI=1S/C11H19N3O/c1-4-6-7-9-8(3)13-11(12-5-2)14-10(9)15/h4-7H2,1-3H3,(H2,12,13,14,15)","BBXXLROWFHWFQY-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C)N(C(=O)C1=CC=CC=C1)C1=CC(Cl)=C(F)C=C1","InChI=1S/C19H19ClFNO3/c1-12(2)25-19(24)13(3)22(15-9-10-17(21)16(20)11-15)18(23)14-7-5-4-6-8-14/h4-13H,1-3H3","IKVXBIIHQGXQRQ-UHFFFAOYSA-N"
"CC(C)c1c(C(=O)Nc2ccccc2)c(-c2ccccc2)c(-c2ccc(F)cc2)n1CC[C@@H](O)C[C@@H](O)CC(O)=O","InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)/t26-,27-/m1/s1","XUKUURHRXDUEBC-KAYWLYCHSA-N"
"CC(C)NC(=O)NC(C)C","InChI=1S/C7H16N2O/c1-5(2)8-7(10)9-6(3)4/h5-6H,1-4H3,(H2,8,9,10)","BGRWYRAHAFMIBJ-UHFFFAOYSA-N"
"C[C@@H](OC1=CC=C(CNC(=O)C2=CC=CN=C2OC2=CC=C3OCOC3=C2)C(F)=C1)C(O)=O","InChI=1S/C23H19FN2O7/c1-13(23(28)29)32-15-5-4-14(18(24)9-15)11-26-21(27)17-3-2-8-25-22(17)33-16-6-7-19-20(10-16)31-12-30-19/h2-10,13H,11-12H2,1H3,(H,26,27)(H,28,29)/t13-/m1/s1","CNIGFESSDPOCKS-CYBMUJFWSA-N"
"CC1=CC(C)=C(C(O)=O)C(C)=C1","InChI=1S/C10H12O2/c1-6-4-7(2)9(10(11)12)8(3)5-6/h4-5H,1-3H3,(H,11,12)","FFFIRKXTFQCCKJ-UHFFFAOYSA-N"
"CNC(=O)OC1=CC=CC=C1OC(C)C","InChI=1S/C11H15NO3/c1-8(2)14-9-6-4-5-7-10(9)15-11(13)12-3/h4-8H,1-3H3,(H,12,13)","ISRUGXGCCGIOQO-UHFFFAOYSA-N"
"CC(=O)NC1=NN=C(S1)S(N)(=O)=O","InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)","BZKPWHYZMXOIDC-UHFFFAOYSA-N"
"OC(=O)C1C2CCC(O2)C1C(O)=O","InChI=1S/C8H10O5/c9-7(10)5-3-1-2-4(13-3)6(5)8(11)12/h3-6H,1-2H2,(H,9,10)(H,11,12)","GXEKYRXVRROBEV-UHFFFAOYSA-N"
"OC1=CC2=CC=C(SSC3=CC4=CC=C(O)C=C4C=C3)C=C2C=C1","InChI=1S/C20H14O2S2/c21-17-5-1-15-11-19(7-3-13(15)9-17)23-24-20-8-4-14-10-18(22)6-2-16(14)12-20/h1-12,21-22H","AHXGXXJEEHFHDK-UHFFFAOYSA-N"
"O=C(OCCOCCOCCOC(=O)C1=CC=CC=C1)C1=CC=CC=C1","InChI=1S/C20H22O6/c21-19(17-7-3-1-4-8-17)25-15-13-23-11-12-24-14-16-26-20(22)18-9-5-2-6-10-18/h1-10H,11-16H2","AHSGHEXYEABOKT-UHFFFAOYSA-N"
"CC(C)[C@@H](NC1=C(Cl)C=C(C=C1)C(F)(F)F)C(=O)OC(C#N)C1=CC(OC2=CC=CC=C2)=CC=C1","InChI=1S/C26H22ClF3N2O3/c1-16(2)24(32-22-12-11-18(14-21(22)27)26(28,29)30)25(33)35-23(15-31)17-7-6-10-20(13-17)34-19-8-4-3-5-9-19/h3-14,16,23-24,32H,1-2H3/t23?,24-/m1/s1","INISTDXBRIBGOC-XMMISQBUSA-N"
"OC1=CC=C(C=C1)C(C1=CC=C(O)C=C1)(C(F)(F)F)C(F)(F)F","InChI=1S/C15H10F6O2/c16-14(17,18)13(15(19,20)21,9-1-5-11(22)6-2-9)10-3-7-12(23)8-4-10/h1-8,22-23H","ZFVMWEVVKGLCIJ-UHFFFAOYSA-N"
"OC(=O)CONC(=O)C1=CC=CC=C1","InChI=1S/C9H9NO4/c11-8(12)6-14-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)","WDRGQGLIUAMOOC-UHFFFAOYSA-N"
"CC(OC1=CC=C(OC2=NC=C(C=C2Cl)C(F)(F)F)C=C1)C(O)=O","InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)","GOCUAJYOYBLQRH-UHFFFAOYSA-N"
"COC1=NC=C(F)C2=NC(=NN12)S(=O)(=O)NC1=C(F)C=CC=C1F","InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3","QZXATCCPQKOEIH-UHFFFAOYSA-N"
"CC(=O)CC(=O)NC1=CC2=C(NC(=O)N2)C=C1","InChI=1S/C11H11N3O3/c1-6(15)4-10(16)12-7-2-3-8-9(5-7)14-11(17)13-8/h2-3,5H,4H2,1H3,(H,12,16)(H2,13,14,17)","VEMDQCGHZNXORX-UHFFFAOYSA-N"
"COC1=CC=C(NC(=O)CC(C)=O)C=C1","InChI=1S/C11H13NO3/c1-8(13)7-11(14)12-9-3-5-10(15-2)6-4-9/h3-6H,7H2,1-2H3,(H,12,14)","SWAJJKROCOJICG-UHFFFAOYSA-N"
"NC(=O)CC[C@H](NC1=CC=C(C=C1)[N+]([O-])=O)C(O)=O","InChI=1S/C11H13N3O5/c12-10(15)6-5-9(11(16)17)13-7-1-3-8(4-2-7)14(18)19/h1-4,9,13H,5-6H2,(H2,12,15)(H,16,17)/t9-/m0/s1","IMTMBDXEKMXETQ-VIFPVBQESA-N"
"COC1=CC(OC)=C(C=C1)S(=O)(=O)N1C(=O)[C@@](N2C[C@H](O)C[C@H]2C(=O)N(C)C)(C2=CC(Cl)=CC=C12)C1=CC=CC=C1OC","InChI=1S/C30H32ClN3O8S/c1-32(2)28(36)24-15-19(35)17-33(24)30(21-8-6-7-9-25(21)41-4)22-14-18(31)10-12-23(22)34(29(30)37)43(38,39)27-13-11-20(40-3)16-26(27)42-5/h6-14,16,19,24,35H,15,17H2,1-5H3/t19-,24+,30+/m1/s1","NJXZWIIMWNEOGJ-WEWKHQNJSA-N"
"Cc1[nH]cnc1C[C@H]1CCc2c(C)c3ccccc3n2C1=O","InChI=1S/C18H19N3O/c1-11-14-5-3-4-6-17(14)21-16(11)8-7-13(18(21)22)9-15-12(2)19-10-20-15/h3-6,10,13H,7-9H2,1-2H3,(H,19,20)/t13-/m1/s1","AEKQMJRJRAHOAP-CYBMUJFWSA-N"
"NC1=C(C=CC(=C1)[N+]([O-])=O)C(O)=O","InChI=1S/C7H6N2O4/c8-6-3-4(9(12)13)1-2-5(6)7(10)11/h1-3H,8H2,(H,10,11)","UEALKTCRMBVTFN-UHFFFAOYSA-N"
"CC1(C)O[C@@H]2CO[C@@]3(COS(N)(=O)=O)OC(C)(C)O[C@H]3[C@@H]2O1","InChI=1S/C12H21NO8S/c1-10(2)18-7-5-16-12(6-17-22(13,14)15)9(8(7)19-10)20-11(3,4)21-12/h7-9H,5-6H2,1-4H3,(H2,13,14,15)/t7-,8-,9+,12+/m1/s1","KJADKKWYZYXHBB-XBWDGYHZSA-N"
"[H][C@@]12CCC(=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C","InChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-16H,3-10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1","AEMFNILZOJDQLW-QAGGRKNESA-N"
"COCCOC(=O)C1=C(C=CC=C1)C(=O)OCCOC","InChI=1S/C14H18O6/c1-17-7-9-19-13(15)11-5-3-4-6-12(11)14(16)20-10-8-18-2/h3-6H,7-10H2,1-2H3","HSUIVCLOAAJSRE-UHFFFAOYSA-N"
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"[O-][N+](=O)C1=CC=C(NC2=CC=CC=C2)C=C1","InChI=1S/C12H10N2O2/c15-14(16)12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h1-9,13H","XXYMSQQCBUKFHE-UHFFFAOYSA-N"
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"OC1=CC(O)=C(O)C2=C1C(=O)C1=C(C=CC=C1)C2=O","InChI=1S/C14H8O5/c15-8-5-9(16)14(19)11-10(8)12(17)6-3-1-2-4-7(6)13(11)18/h1-5,15-16,19H","BBNQQADTFFCFGB-UHFFFAOYSA-N"
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"OC1=C(Cl)C=C(Cl)C=C1","InChI=1S/C6H4Cl2O/c7-4-1-2-6(9)5(8)3-4/h1-3,9H","HFZWRUODUSTPEG-UHFFFAOYSA-N"
"O=NC1=CC=C(NC2=CC=CC=C2)C=C1","InChI=1S/C12H10N2O/c15-14-12-8-6-11(7-9-12)13-10-4-2-1-3-5-10/h1-9,13H","OIJHFHYPXWSVPF-UHFFFAOYSA-N"
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"OC1=CC2=C(C(O)=C1)C(=O)C=C(O2)C1=CC=CC=C1","InChI=1S/C15H10O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-8,16-17H","RTIXKCRFFJGDFG-UHFFFAOYSA-N"
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"[O-][N+](=O)C1=CC=C(NC(=O)NCC2=CC=CN=C2)C=C1","InChI=1S/C13H12N4O3/c18-13(15-9-10-2-1-7-14-8-10)16-11-3-5-12(6-4-11)17(19)20/h1-8H,9H2,(H2,15,16,18)","CLKZWXHKFXZIMA-UHFFFAOYSA-N"
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"[O-][N+](=O)C1=CC2=C(NC=N2)C=C1","InChI=1S/C7H5N3O2/c11-10(12)5-1-2-6-7(3-5)9-4-8-6/h1-4H,(H,8,9)","XPAZGLFMMUODDK-UHFFFAOYSA-N"
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"[O-][N+](=O)C1=CC=C(Cl)C(=C1)C(=O)NC1=CC=CC=C1","InChI=1S/C13H9ClN2O3/c14-12-7-6-10(16(18)19)8-11(12)13(17)15-9-4-2-1-3-5-9/h1-8H,(H,15,17)","DNTSIBUQMRRYIU-UHFFFAOYSA-N"
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"[O-][N+](=O)C1=CC=C(C=C1)C1=CC=C(O1)C=NN1CC(=O)NC1=O","InChI=1S/C14H10N4O5/c19-13-8-17(14(20)16-13)15-7-11-5-6-12(23-11)9-1-3-10(4-2-9)18(21)22/h1-7H,8H2,(H,16,19,20)","OZOMQRBLCMDCEG-UHFFFAOYSA-N"
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"C(CC1=CC=CC=C1)CC1=CC=NC=C1","InChI=1S/C14H15N/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h1-3,5-6,9-12H,4,7-8H2","AQIIVEISJBBUCR-UHFFFAOYSA-N"
"CCNC(=O)C1CC(C)CCC1C(C)C","InChI=1S/C13H25NO/c1-5-14-13(15)12-8-10(4)6-7-11(12)9(2)3/h9-12H,5-8H2,1-4H3,(H,14,15)","VUNOFAIHSALQQH-UHFFFAOYSA-N"
"NC1=CC2=C3N(CCC3=C1)C(=O)[C@H](NC(=O)C1=CC=CN=C1)N=C2C1=CC=CC=C1","InChI=1S/C23H19N5O2/c24-17-11-15-8-10-28-20(15)18(12-17)19(14-5-2-1-3-6-14)26-21(23(28)30)27-22(29)16-7-4-9-25-13-16/h1-7,9,11-13,21H,8,10,24H2,(H,27,29)/t21-/m0/s1","XGXOSJSGDNPEEF-NRFANRHFSA-N"
"OCCOCCN1CCN(CC1)C(C1=CC=CC=C1)C1=CC=C(Cl)C=C1","InChI=1S/C21H27ClN2O2/c22-20-8-6-19(7-9-20)21(18-4-2-1-3-5-18)24-12-10-23(11-13-24)14-16-26-17-15-25/h1-9,21,25H,10-17H2","ZQDWXGKKHFNSQK-UHFFFAOYSA-N"
"C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C","InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19-,20+,21+,23+,24-/m1/s1","SMEROWZSTRWXGI-HVATVPOCSA-N"
"C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@H]2C(=O)CO","InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1","OMFXVFTZEKFJBZ-HJTSIMOOSA-N"
"CNC(=O)O\N=C\C(C)(C)S(C)(=O)=O","InChI=1S/C7H14N2O4S/c1-7(2,14(4,11)12)5-9-13-6(10)8-3/h5H,1-4H3,(H,8,10)/b9-5+","YRRKLBAKDXSTNC-WEVVVXLNSA-N"
"NC1=CC=C(C=C1)\N=N\C1=CC=CC=C1","InChI=1S/C12H11N3/c13-10-6-8-12(9-7-10)15-14-11-4-2-1-3-5-11/h1-9H,13H2","QPQKUYVSJWQSDY-UHFFFAOYSA-N"
"CCCCCCOC(=O)C1=C(C=CC=C1)C(=O)OCCCCCC","InChI=1S/C20H30O4/c1-3-5-7-11-15-23-19(21)17-13-9-10-14-18(17)20(22)24-16-12-8-6-4-2/h9-10,13-14H,3-8,11-12,15-16H2,1-2H3","KCXZNSGUUQJJTR-UHFFFAOYSA-N"
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"ClC1=CC=C(C=C1)C1=C(NC(=O)C2=C(Cl)N=CC=C2)C=CC=C1","InChI=1S/C18H12Cl2N2O/c19-13-9-7-12(8-10-13)14-4-1-2-6-16(14)22-18(23)15-5-3-11-21-17(15)20/h1-11H,(H,22,23)","WYEMLYFITZORAB-UHFFFAOYSA-N"
"CON(C)C(=O)NC1=CC(Cl)=C(Br)C=C1","InChI=1S/C9H10BrClN2O2/c1-13(15-2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","NLYNUTMZTCLNOO-UHFFFAOYSA-N"
"CCOC1=CC=C2NC(C)(C)CC(C)C2=C1","InChI=1S/C14H21NO/c1-5-16-11-6-7-13-12(8-11)10(2)9-14(3,4)15-13/h6-8,10,15H,5,9H2,1-4H3","YLDDCEXDGNXCIO-UHFFFAOYSA-N"
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"CNCC1=C(OC2=CC=C(Cl)C(Cl)=C2)C=CC(F)=C1","InChI=1S/C14H12Cl2FNO/c1-18-8-9-6-10(17)2-5-14(9)19-11-3-4-12(15)13(16)7-11/h2-7,18H,8H2,1H3","FQEBOQLYHASAOY-UHFFFAOYSA-N"
"ClC1=CC=C(OCC(=O)N2CCN(CC3=CC4=C(OCO4)C=C3)CC2)C=C1","InChI=1S/C20H21ClN2O4/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18/h1-6,11H,7-10,12-14H2","BFUJHVVEMMWLHC-UHFFFAOYSA-N"
"OC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12","InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1","YBJHBAHKTGYVGT-ZKWXMUAHSA-N"
"CC1=CC=C(N)C(=C1)S(O)(=O)=O","InChI=1S/C7H9NO3S/c1-5-2-3-6(8)7(4-5)12(9,10)11/h2-4H,8H2,1H3,(H,9,10,11)","LTPSRQRIPCVMKQ-UHFFFAOYSA-N"
"OC1=CC2=C(C=C1)C=C(C=C2)S(O)(=O)=O","InChI=1S/C10H8O4S/c11-9-3-1-8-6-10(15(12,13)14)4-2-7(8)5-9/h1-6,11H,(H,12,13,14)","VVPHSMHEYVOVLH-UHFFFAOYSA-N"
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"CCNP(=S)(OC)O\C(C)=C\C(=O)OC(C)C","InChI=1S/C10H20NO4PS/c1-6-11-16(17,13-5)15-9(4)7-10(12)14-8(2)3/h7-8H,6H2,1-5H3,(H,11,17)/b9-7+","BZNDWPRGXNILMS-VQHVLOKHSA-N"
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"CCCCNS(=O)(=O)C1=CC=C(C)C=C1","InChI=1S/C11H17NO2S/c1-3-4-9-12-15(13,14)11-7-5-10(2)6-8-11/h5-8,12H,3-4,9H2,1-2H3","RQUXYBHREKXNKT-UHFFFAOYSA-N"
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"CCCN(CCC)C1=C(C=C(C=C1[N+]([O-])=O)C(C)C)[N+]([O-])=O","InChI=1S/C15H23N3O4/c1-5-7-16(8-6-2)15-13(17(19)20)9-12(11(3)4)10-14(15)18(21)22/h9-11H,5-8H2,1-4H3","NEKOXWSIMFDGMA-UHFFFAOYSA-N"
"CC1=C(Cl)C(=O)N(C(=O)N1)C(C)(C)C","InChI=1S/C9H13ClN2O2/c1-5-6(10)7(13)12(8(14)11-5)9(2,3)4/h1-4H3,(H,11,14)","NBQCNZYJJMBDKY-UHFFFAOYSA-N"
"CCCCC(CC)C(=O)OCCOCCOCCOCCOC(=O)C(CC)CCCC","InChI=1S/C24H46O7/c1-5-9-11-21(7-3)23(25)30-19-17-28-15-13-27-14-16-29-18-20-31-24(26)22(8-4)12-10-6-2/h21-22H,5-20H2,1-4H3","GYHPTPQZVBYHLC-UHFFFAOYSA-N"
"CCCOC(=O)C1=CC=C(N=C1)C(=O)OCCC","InChI=1S/C13H17NO4/c1-3-7-17-12(15)10-5-6-11(14-9-10)13(16)18-8-4-2/h5-6,9H,3-4,7-8H2,1-2H3","IITCWRFYJWUUPC-UHFFFAOYSA-N"
"FC(F)C(F)(F)OCC(CN1C=NC=N1)C1=C(Cl)C=C(Cl)C=C1","InChI=1S/C13H11Cl2F4N3O/c14-9-1-2-10(11(15)3-9)8(4-22-7-20-6-21-22)5-23-13(18,19)12(16)17/h1-3,6-8,12H,4-5H2","LQDARGUHUSPFNL-UHFFFAOYSA-N"
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"OC1=CC=C(O)C(=C1)S(O)(=O)=O","InChI=1S/C6H6O5S/c7-4-1-2-5(8)6(3-4)12(9,10)11/h1-3,7-8H,(H,9,10,11)","IKQCSJBQLWJEPU-UHFFFAOYSA-N"
"CC1=CN(NC(=O)C2=C(C)N=C(N=C2)C2=CC=CC=N2)C2=CC=C(F)C=C12","InChI=1S/C20H16FN5O/c1-12-11-26(18-7-6-14(21)9-15(12)18)25-20(27)16-10-23-19(24-13(16)2)17-5-3-4-8-22-17/h3-11H,1-2H3,(H,25,27)","YNVKAENVJKEMOU-UHFFFAOYSA-N"
"CCC1=NC(N)=NC(N)=C1C1=CC=C(Cl)C=C1","InChI=1S/C12H13ClN4/c1-2-9-10(11(14)17-12(15)16-9)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H4,14,15,16,17)","WKSAUQYGYAYLPV-UHFFFAOYSA-N"
"OC1=C(Cl)C=C(Cl)C=C1SC1=C(O)C(Cl)=CC(Cl)=C1","InChI=1S/C12H6Cl4O2S/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18/h1-4,17-18H","JFIOVJDNOJYLKP-UHFFFAOYSA-N"
"CC1=C2C(=O)C3=C(C(O)=C(O)C([C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)=C3O)C(=O)C2=CC(O)=C1C(O)=O","InChI=1S/C22H20O13/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34)/t7-,14-,19+,20-,21+/m1/s1","DGQLVPJVXFOQEV-JNVSTXMASA-N"
"CC1=C(C=NO1)C(=O)NC1=CC=C(C=C1)C(F)(F)F","InChI=1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-6H,1H3,(H,17,18)","VHOGYURTWQBHIL-UHFFFAOYSA-N"
"COP(=O)(OC)O\C(C)=C\C(=O)N(C)C","InChI=1S/C8H16NO5P/c1-7(6-8(10)9(2)3)14-15(11,12-4)13-5/h6H,1-5H3/b7-6+","VEENJGZXVHKXNB-VOTSOKGWSA-N"
"COC1=CC2=C(C=C1)N=C(N)S2","InChI=1S/C8H8N2OS/c1-11-5-2-3-6-7(4-5)12-8(9)10-6/h2-4H,1H3,(H2,9,10)","KZHGPDSVHSDCMX-UHFFFAOYSA-N"
"OC1=C(C=C(Cl)C=C1)C(=O)NC1=CC=CC=C1","InChI=1S/C13H10ClNO2/c14-9-6-7-12(16)11(8-9)13(17)15-10-4-2-1-3-5-10/h1-8,16H,(H,15,17)","KGYNGVVNFRUOOZ-UHFFFAOYSA-N"
"CC1=C(CSC2=CC(C)=C(OCC(O)=O)C=C2)SC(=N1)C1=CC=C(C(F)=C1)C(F)(F)F","InChI=1S/C21H17F4NO3S2/c1-11-7-14(4-6-17(11)29-9-19(27)28)30-10-18-12(2)26-20(31-18)13-3-5-15(16(22)8-13)21(23,24)25/h3-8H,9-10H2,1-2H3,(H,27,28)","HWVNEWGKWRGSRK-UHFFFAOYSA-N"
"ClC1=CC2=C(CN3CCCCCC3=N2)C(Cl)=C1","InChI=1S/C13H14Cl2N2/c14-9-6-11(15)10-8-17-5-3-1-2-4-13(17)16-12(10)7-9/h6-7H,1-5,8H2","WTPSHLVHJOJDIF-UHFFFAOYSA-N"
"CC(C)OP(=S)(OC(C)C)SCCNS(=O)(=O)C1=CC=CC=C1","InChI=1S/C14H24NO4PS3/c1-12(2)18-20(21,19-13(3)4)22-11-10-15-23(16,17)14-8-6-5-7-9-14/h5-9,12-13,15H,10-11H2,1-4H3","RRNIZKPFKNDSRS-UHFFFAOYSA-N"
"CCOC1=CC=C(NC(N)=O)C=C1","InChI=1S/C9H12N2O2/c1-2-13-8-5-3-7(4-6-8)11-9(10)12/h3-6H,2H2,1H3,(H3,10,11,12)","GGLIEWRLXDLBBF-UHFFFAOYSA-N"
"CCCCCCOC(=O)C1=CC=C(O)C=C1","InChI=1S/C13H18O3/c1-2-3-4-5-10-16-13(15)11-6-8-12(14)9-7-11/h6-9,14H,2-5,10H2,1H3","ULULAZKOCFNOIM-UHFFFAOYSA-N"
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"CSC1=CC=C(C=C1)C(=O)C(C)(C)N1CCOCC1","InChI=1S/C15H21NO2S/c1-15(2,16-8-10-18-11-9-16)14(17)12-4-6-13(19-3)7-5-12/h4-7H,8-11H2,1-3H3","LWRBVKNFOYUCNP-UHFFFAOYSA-N"
"CC(C)C(OC(=O)C1=CC=CC=C1)C(C)(C)COC(=O)C1=CC=CC=C1","InChI=1S/C22H26O4/c1-16(2)19(26-21(24)18-13-9-6-10-14-18)22(3,4)15-25-20(23)17-11-7-5-8-12-17/h5-14,16,19H,15H2,1-4H3","FTSXVYQZLNPTCM-UHFFFAOYSA-N"
"CCCOC1=NN(C(=O)NS(=O)(=O)C2=C(C=CC=C2)C(=O)OC)C(=O)N1C","InChI=1S/C15H18N4O7S/c1-4-9-26-14-16-19(15(22)18(14)2)13(21)17-27(23,24)11-8-6-5-7-10(11)12(20)25-3/h5-8H,4,9H2,1-3H3,(H,17,21)","JTHMVYBOQLDDIY-UHFFFAOYSA-N"
"CCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C","InChI=1S/C22H32O3/c1-4-20(24)25-19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h13,16-19H,4-12H2,1-3H3/t16-,17-,18-,19-,21-,22-/m0/s1","PDMMFKSKQVNJMI-BLQWBTBKSA-N"
"OC1=C(C=CC=C1)C1=CC=CC=C1","InChI=1S/C12H10O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,13H","LLEMOWNGBBNAJR-UHFFFAOYSA-N"
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"OS(=O)(=O)c1ccc(cc1)C(CCC)CCCCCCCC","InChI=1S/C18H30O3S/c1-3-5-6-7-8-9-11-16(10-4-2)17-12-14-18(15-13-17)22(19,20)21/h12-16H,3-11H2,1-2H3,(H,19,20,21)","YNJLGQRDQAQAHR-UHFFFAOYSA-N"
"CCCCCCCCCc1ccc(OCCOCCO)cc1","InChI=1S/C19H32O3/c1-2-3-4-5-6-7-8-9-18-10-12-19(13-11-18)22-17-16-21-15-14-20/h10-13,20H,2-9,14-17H2,1H3","BLXVTZPGEOGTGG-UHFFFAOYSA-N"
"O=C(CCCCCCCCCCCCCCCCC)N(CCO)CCO","InChI=1S/C22H45NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22(26)23(18-20-24)19-21-25/h24-25H,2-21H2,1H3","XGZOMURMPLSSKQ-UHFFFAOYSA-N"
"O=C(CCCCCCCCCCCCCCC)N(CCO)CCO","InChI=1S/C20H41NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(24)21(16-18-22)17-19-23/h22-23H,2-19H2,1H3","VJESJEJNMGVQLZ-UHFFFAOYSA-N"
"O=C(CCCCCCCCCCCCC)N(CCO)CCO","InChI=1S/C18H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-18(22)19(14-16-20)15-17-21/h20-21H,2-17H2,1H3","SKDZEPBJPGSFHS-UHFFFAOYSA-N"
"O=C(CCCCCCCCCCC)N(CCO)CCO","InChI=1S/C16H33NO3/c1-2-3-4-5-6-7-8-9-10-11-16(20)17(12-14-18)13-15-19/h18-19H,2-15H2,1H3","AOMUHOFOVNGZAN-UHFFFAOYSA-N"
"O=C(CCCCCCCCC)N(CCO)CCO","InChI=1S/C14H29NO3/c1-2-3-4-5-6-7-8-9-14(18)15(10-12-16)11-13-17/h16-17H,2-13H2,1H3","BPXGKRUSMCVZAF-UHFFFAOYSA-N"
"O=C(CCCCCCC)N(CCO)CCO","InChI=1S/C12H25NO3/c1-2-3-4-5-6-7-12(16)13(8-10-14)9-11-15/h14-15H,2-11H2,1H3","FZQAYFWUOCXLKJ-UHFFFAOYSA-N"
"OCCOCCOCCOCCCCCCCCCCCCCCCCCC","InChI=1S/C24H50O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-26-21-23-28-24-22-27-20-18-25/h25H,2-24H2,1H3","KPRFGGDCSHOVQB-UHFFFAOYSA-N"
"OCCOCCOCCOCCCCCCCCCCCCCCCC","InChI=1S/C22H46O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-24-19-21-26-22-20-25-18-16-23/h23H,2-22H2,1H3","FSVRFCBLVIJHQY-UHFFFAOYSA-N"
"OCCOCCOCCOCCCCCCCCCCCCCC","InChI=1S/C20H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-22-17-19-24-20-18-23-16-14-21/h21H,2-20H2,1H3","NBPXCCCUFZBDQE-UHFFFAOYSA-N"
"OCCOCCOCCOCCCCCCCCCCCC","InChI=1S/C18H38O4/c1-2-3-4-5-6-7-8-9-10-11-13-20-15-17-22-18-16-21-14-12-19/h19H,2-18H2,1H3","FKMHSNTVILORFA-UHFFFAOYSA-N"
"O=S(=O)(O)OCCOCCOc1ccc(cc1)CCCCCCCCC","InChI=1S/C19H32O6S/c1-2-3-4-5-6-7-8-9-18-10-12-19(13-11-18)24-16-14-23-15-17-25-26(20,21)22/h10-13H,2-9,14-17H2,1H3,(H,20,21,22)","LTPRIPYCXJPJLM-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(C)CCCCC(=O)OC","InChI=1S/C14H20O5S/c1-11(5-3-4-6-14(15)19-2)12-7-9-13(10-8-12)20(16,17)18/h7-11H,3-6H2,1-2H3,(H,16,17,18)","CIFMNDHJUHXSFT-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CC(=O)OC)CCCCC(=O)OC","InChI=1S/C16H22O7S/c1-22-15(17)6-4-3-5-13(11-16(18)23-2)12-7-9-14(10-8-12)24(19,20)21/h7-10,13H,3-6,11H2,1-2H3,(H,19,20,21)","BAVYDCGNSNHAIZ-UHFFFAOYSA-N"
"O=S(=O)(O)c1ccc2c(c1)C(CCC2CC)CC(=O)OC","InChI=1S/C15H20O5S/c1-3-10-4-5-11(8-15(16)20-2)14-9-12(21(17,18)19)6-7-13(10)14/h6-7,9-11H,3-5,8H2,1-2H3,(H,17,18,19)","NTEVHCRIRQXHIY-UHFFFAOYSA-N"
"O=S(=O)(O)c1ccc2c(c1)C(CCC2C(=O)OC)CCC(=O)OC","InChI=1S/C16H20O7S/c1-22-15(17)8-4-10-3-6-13(16(18)23-2)12-7-5-11(9-14(10)12)24(19,20)21/h5,7,9-10,13H,3-4,6,8H2,1-2H3,(H,19,20,21)","ZTNLIVFMOYNFBS-UHFFFAOYSA-N"
"OCCOCCOCCOCC(CC(=O)O)CCCC","InChI=1S/C14H28O6/c1-2-3-4-13(11-14(16)17)12-20-10-9-19-8-7-18-6-5-15/h13,15H,2-12H2,1H3,(H,16,17)","JHOXVFIHEZNGJK-UHFFFAOYSA-N"
"O=C(O)CC(CCCC)COCCOCCO","InChI=1S/C12H24O5/c1-2-3-4-11(9-12(14)15)10-17-8-7-16-6-5-13/h11,13H,2-10H2,1H3,(H,14,15)","ZYGYNVJVDLQWDG-UHFFFAOYSA-N"
"OCCOCC(CCCC)CC(=O)O","InChI=1S/C10H20O4/c1-2-3-4-9(7-10(12)13)8-14-6-5-11/h9,11H,2-8H2,1H3,(H,12,13)","CEHZMLXJTDNURC-UHFFFAOYSA-N"
"O=C(O)CC(CCCC)COCCOCCOCC(=O)O","InChI=1S/C14H26O7/c1-2-3-4-12(9-13(15)16)10-20-7-5-19-6-8-21-11-14(17)18/h12H,2-11H2,1H3,(H,15,16)(H,17,18)","ZNWZJFNGNUAOCJ-UHFFFAOYSA-N"
"OC(=O)COCCOCC(CC(=O)O)CCCC","InChI=1S/C12H22O6/c1-2-3-4-10(7-11(13)14)8-17-5-6-18-9-12(15)16/h10H,2-9H2,1H3,(H,13,14)(H,15,16)","IOBWQNCIKXKHIW-UHFFFAOYSA-N"
"CCCCC(COCC(=O)O)CC(=O)O","InChI=1S/C10H18O5/c1-2-3-4-8(5-9(11)12)6-15-7-10(13)14/h8H,2-7H2,1H3,(H,11,12)(H,13,14)","BZWMLZQKBFATEL-UHFFFAOYSA-N"
"O=C(O)CC(COCCOCCOCCOCCO)CCCC(=O)O","InChI=1S/C16H30O9/c17-4-5-22-6-7-23-8-9-24-10-11-25-13-14(12-16(20)21)2-1-3-15(18)19/h14,17H,1-13H2,(H,18,19)(H,20,21)","LJXNKEMBFQZHEM-UHFFFAOYSA-N"
"OC(=O)COCCOCC(CC(=O)O)CC(=O)O","InChI=1S/C10H16O8/c11-8(12)3-7(4-9(13)14)5-17-1-2-18-6-10(15)16/h7H,1-6H2,(H,11,12)(H,13,14)(H,15,16)","MBNNMBGKEOZFHX-UHFFFAOYSA-N"
"OCCOCCOCCOCC(CC(=O)O)CC(=O)O","InChI=1S/C12H22O8/c13-1-2-18-3-4-19-5-6-20-9-10(7-11(14)15)8-12(16)17/h10,13H,1-9H2,(H,14,15)(H,16,17)","HRIGDWRZOSHVQG-UHFFFAOYSA-N"
"O=C(OC)COCCOc1ccc(cc1)CCCCCCCCC","InChI=1S/C20H32O4/c1-3-4-5-6-7-8-9-10-18-11-13-19(14-12-18)24-16-15-23-17-20(21)22-2/h11-14H,3-10,15-17H2,1-2H3","IKIJTQLMHCEGJB-UHFFFAOYSA-N"
"O=C(OC)CCCCCCCCc1ccc(OCCOCC(=O)OC)cc1","InChI=1S/C21H32O6/c1-24-20(22)10-8-6-4-3-5-7-9-18-11-13-19(14-12-18)27-16-15-26-17-21(23)25-2/h11-14H,3-10,15-17H2,1-2H3","RKRJIGZOXDCZOF-UHFFFAOYSA-N"
"O=C(O)CCCCCCc1ccc(OCCOCC(=O)O)cc1","InChI=1S/C17H24O6/c18-16(19)6-4-2-1-3-5-14-7-9-15(10-8-14)23-12-11-22-13-17(20)21/h7-10H,1-6,11-13H2,(H,18,19)(H,20,21)","INTYAEINDNYRNW-UHFFFAOYSA-N"
"O=C(OC)CCCCCCc1ccc(OCCOCC(=O)OC)cc1","InChI=1S/C19H28O6/c1-22-18(20)8-6-4-3-5-7-16-9-11-17(12-10-16)25-14-13-24-15-19(21)23-2/h9-12H,3-8,13-15H2,1-2H3","AWCKHGHJGUQVSR-UHFFFAOYSA-N"
"O=C(OC)CCCCCCc1ccc(OCCOCCO)cc1","InChI=1S/C18H28O5/c1-21-18(20)7-5-3-2-4-6-16-8-10-17(11-9-16)23-15-14-22-13-12-19/h8-11,19H,2-7,12-15H2,1H3","RRPVDZMCSBPRCV-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(C)CCCCCCC(=O)O","InChI=1S/C15H22O5S/c1-12(6-4-2-3-5-7-15(16)17)13-8-10-14(11-9-13)21(18,19)20/h8-12H,2-7H2,1H3,(H,16,17)(H,18,19,20)","ZXGROFOELRCPHY-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CC)CCCCCCC(C)CCC(=O)O","InChI=1S/C20H32O5S/c1-3-17(18-11-13-19(14-12-18)26(23,24)25)9-7-5-4-6-8-16(2)10-15-20(21)22/h11-14,16-17H,3-10,15H2,1-2H3,(H,21,22)(H,23,24,25)","OCCKBUPQXDPXPK-UHFFFAOYSA-N"
"OS(=O)(=O)c1ccc(cc1)C(CCC)CCC(=O)O","InChI=1S/C13H18O5S/c1-2-3-10(6-9-13(14)15)11-4-7-12(8-5-11)19(16,17)18/h4-5,7-8,10H,2-3,6,9H2,1H3,(H,14,15)(H,16,17,18)","DBANCWXFGWHFPK-UHFFFAOYSA-N"
"Cc1cc(Cl)ccc1OCC(=O)O","InChI=1S/C9H9ClO3/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)","WHKUVVPPKQRRBV-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC[C@@H](O)C(=O)O","InChI=1S/C18H36O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(19)18(20)21/h17,19H,2-16H2,1H3,(H,20,21)/t17-/m1/s1","KIHBGTRZFAVZRV-QGZVFWFLSA-N"
"NCCCCCCCCN","InChI=1S/C8H20N2/c9-7-5-3-1-2-4-6-8-10/h1-10H2","PWGJDPKCLMLPJW-UHFFFAOYSA-N"
"NC(CCCC(=O)O)C(=O)O","InChI=1S/C6H11NO4/c7-4(6(10)11)2-1-3-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11)","OYIFNHCXNCRBQI-UHFFFAOYSA-N"
"Nc1cccc(C(=O)O)c1","InChI=1S/C7H7NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H,9,10)","XFDUHJPVQKIXHO-UHFFFAOYSA-N"
"Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](OP(=O)(O)O)[C@H]1O","InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(4(1-16)21-10)22-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1","LNQVTSROQXJCDD-KQYNXXCUSA-N"
"O=C(O)C=Cc1cccc(O)c1","InChI=1S/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)","KKSDGJDHHZEWEP-UHFFFAOYSA-N"
"O=C(O)c1cccc(O)c1","InChI=1S/C7H6O3/c8-6-3-1-2-5(4-6)7(9)10/h1-4,8H,(H,9,10)","IJFXRHURBJZNAO-UHFFFAOYSA-N"
"CCC(C)C(=O)C(=O)O","InChI=1S/C6H10O3/c1-3-4(2)5(7)6(8)9/h4H,3H2,1-2H3,(H,8,9)","JVQYSWDUAOAHFM-UHFFFAOYSA-N"
"N=C(N)NCCCC(=O)O","InChI=1S/C5H11N3O2/c6-5(7)8-3-1-2-4(9)10/h1-3H2,(H,9,10)(H4,6,7,8)","TUHVEAJXIMEOSA-UHFFFAOYSA-N"
"O=Cc1ccc(O)cc1","InChI=1S/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9H","RGHHSNMVTDWUBI-UHFFFAOYSA-N"
"O=C(O)c1ccc(O)cc1","InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)","FJKROLUGYXJWQN-UHFFFAOYSA-N"
"CC(C)CC(=O)C(=O)O","InChI=1S/C6H10O3/c1-4(2)3-5(7)6(8)9/h4H,3H2,1-2H3,(H,8,9)","BKAJNAXTPSGJCU-UHFFFAOYSA-N"
"CSC[C@H]1O[C@@H](n2cnc3c2ncnc3N)[C@H](O)[C@@H]1O","InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-/m1/s1","WUUGFSXJNOTRMR-IOSLPCCCSA-N"
"COc1ccc2ncccc2c1","InChI=1S/C10H9NO/c1-12-9-4-5-10-8(7-9)3-2-6-11-10/h2-7H,1H3","HFDLDPJYCIEXJP-UHFFFAOYSA-N"
"C/C(=CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)CO","InChI=1S/C15H21N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h2,6-7,9,11-12,15,21-24H,3-5H2,1H3,(H,16,17,18)/t9-,11-,12-,15-/m1/s1","GOSWTRUMMSCNCW-SDBHATRESA-N"
"O=C(O)CCCCC(=O)O","InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)","WNLRTRBMVRJNCN-UHFFFAOYSA-N"
"N=C(O)NC1N=C(O)N=C1O","InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)","POJWUDADGALRAB-UHFFFAOYSA-N"
"O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H","KZNIFHPLKGYRTM-UHFFFAOYSA-N"
"O=C(O)CCCC[C@@H]1SC[C@@H]2N=C(O)N[C@@H]21","InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1","YBJHBAHKTGYVGT-ZKWXMUAHSA-N"
"CC(O)(CC(=O)O)C(=O)O","InChI=1S/C5H8O5/c1-5(10,4(8)9)2-3(6)7/h10H,2H2,1H3,(H,6,7)(H,8,9)","XFTRTWQBIOMVPK-UHFFFAOYSA-N"
"N=C(O)NCCCC(N)C(=O)O","InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)","RHGKLRLOHDJJDR-UHFFFAOYSA-N"
"NC(CCSCC(N)C(=O)O)C(=O)O","InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)","ILRYLPWNYFXEMH-UHFFFAOYSA-N"
"c1cn(c(=O)nc1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O","InChI=1S/C9H13N3O5/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8/h1-2,4,6-8,13-15H,3H2,(H2,10,11,16)/t4-,6-,7-,8-/m1/s1","UHDGCWIWMRVCDJ-XVFCMESISA-N"
"c1cnc(=O)[nH]c1N","InChI=1S/C4H5N3O/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8)","OPTASPLRGRRNAP-UHFFFAOYSA-N"
"O=C(COP(=O)(O)O)[C@@H](O)[C@H](O)[C@H](O)CO","InChI=1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h3,5-8,10-11H,1-2H2,(H2,12,13,14)/t3-,5-,6-/m1/s1","ZKLLSNQJRLJIGT-UYFOZJQFSA-N"
"C=C1CC[C@H]2C(=C)CC[C@H]3C(=C)C(=O)O[C@@H]3[C@@H]12","InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h11-14H,1-7H2/t11-,12-,13-,14-/m0/s1","NETSQGRTUNRXEO-XUXIUFHCSA-N"
"CC1=NCC[C@@H](C(=O)O)N1","InChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1","WQXNXVUDBPYKBA-YFKPBYRVSA-N"
"Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(O)c1C2=O","InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3","RHMXXJGYXNZAPX-UHFFFAOYSA-N"
"O=c1ccc2cc(O)c(O)cc2o1","InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H","ILEDWLMCKZNDJK-UHFFFAOYSA-N"
"O=c1ccc2cc(OC3OC(CO)C(O)C(O)C3O)c(O)cc2o1","InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2","XHCADAYNFIFUHF-UHFFFAOYSA-N"
"c1[nH]c2c(n1)nc(nc2O)N","InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)","UYTPUPDQBNUYGX-UHFFFAOYSA-N"
"O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c21","InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H","IYRMWMYZSQPJKC-UHFFFAOYSA-N"
"C[C@H](N)C(O)=N[C@@H](C)C(=O)O","InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-,4-/m0/s1","DEFJQIDDEAULHB-IMJSIDKUSA-N"
"NCCCC[C@H](N)C(=O)O","InChI=1S/C6H14N2O2/c7-4-2-1-3-5(8)6(9)10/h5H,1-4,7-8H2,(H,9,10)/t5-/m0/s1","KDXKERNSBIXSRK-YFKPBYRVSA-N"
"NCCSC[C@H](N)C(=O)O","InChI=1S/C5H12N2O2S/c6-1-2-10-3-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m0/s1","GHSJKUNUIHUPDF-BYPYZUCNSA-N"
"O=C1CC(c2ccc(O)cc2)Oc2cc(O)cc(O)c21","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2","FTVWIRXFELQLPI-UHFFFAOYSA-N"
"N=C(O)c1cccnc1","InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)","DFPAKSUCGFBDDF-UHFFFAOYSA-N"
"C[n+]1cccc(C(=O)[O-])c1","InChI=1S/C7H7NO2/c1-8-4-2-3-6(5-8)7(9)10/h2-5H,1H3","WWNNZCOKKKDOPX-UHFFFAOYSA-N"
"O=C(O)C1CCCN1","InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)","ONIBWKKTOPOVIA-UHFFFAOYSA-N"
"O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c21","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"Oc1cccc2cccnc12","InChI=1S/C9H7NO/c11-8-5-1-3-7-4-2-6-10-9(7)8/h1-6,11H","MCJGNVYPOGVAJF-UHFFFAOYSA-N"
"CC(=CCNC1=NC=NC2=C1NC=N2)CO","InChI=1S/C10H13N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h2,5-6,16H,3-4H2,1H3,(H2,11,12,13,14,15)","UZKQTCBAMSWPJD-UHFFFAOYSA-N"
"O=c1nc(O)ccn1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O","InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1","DRTQHJPVMGBUCF-XVFCMESISA-N"
"COc1cc(C(=O)O)ccc1O","InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)","WKOLLVMJNQIZCI-UHFFFAOYSA-N"
"COc1cc(C=O)ccc1O","InChI=1S/C8H8O3/c1-11-8-4-6(5-9)2-3-7(8)10/h2-5,10H,1H3","MWOOGOJBHIARFG-UHFFFAOYSA-N"
"CCCCCC=CCC=CCCCCCCCC(=O)OC(CO)CO","InChI=1S/C21H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-20(18-22)19-23/h6-7,9-10,20,22-23H,2-5,8,11-19H2,1H3/b7-6-,10-9-","IEPGNWMPIFDNSD-HZJYTTRNSA-N"
"[H]C(C)(O)C(O)=O","InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m1/s1","JVTAAEKCZFNVCJ-UWTATZPHSA-N"
"CCC=CCC=CCC=CCC=CCCCCC(O)=O","InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10,12-13H,2,5,8,11,14-17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-,13-12-","JIWBIWFOSCKQMA-LTKCOYKYSA-N"
"O=C(C(NC(=O)C(Cc(c1)cccc1)NC(=O)C(CC(O)=O)NC(CNC(C(NC(CNC(=O)C(NC(=O)C(N)CC(O)=O)CO)=O)CCC(O)=O)=O)=O)CC(C)C)NC(C(=O)NC(CCC(O)=O)C(=O)NCC(NCC(=O)NCC(=O)NC(C(C)C)C(NC(CCCNC(N)=N)C(O)=O)=O)=O)C","InChI=1S/C60H92N18O25/c1-28(2)18-36(55(98)70-30(5)50(93)73-34(14-16-46(87)88)53(96)67-23-41(81)65-22-40(80)66-24-44(84)78-49(29(3)4)58(101)74-35(59(102)103)12-9-17-64-60(62)63)75-56(99)37(19-31-10-7-6-8-11-31)76-57(100)38(21-48(91)92)72-43(83)26-68-52(95)33(13-15-45(85)86)71-42(82)25-69-54(97)39(27-79)77-51(94)32(61)20-47(89)90/h6-8,10-11,28-30,32-39,49,79H,9,12-27,61H2,1-5H3,(H,65,81)(H,66,80)(H,67,96)(H,68,95)(H,69,97)(H,70,98)(H,71,82)(H,72,83)(H,73,93)(H,74,101)(H,75,99)(H,76,100)(H,77,94)(H,78,84)(H,85,86)(H,87,88)(H,89,90)(H,91,92)(H,102,103)(H4,62,63,64)","JAMFMQAPZKXSKC-UHFFFAOYSA-N"
"OCC([H])(O1)C([H])(O)C([H])(O)C([H])(O)C1","InChI=1S/C6H12O5/c7-1-4-6(10)5(9)3(8)2-11-4/h3-10H,1-2H2/t3-,4+,5+,6+/m0/s1","MPCAJMNYNOGXPB-SLPGGIOYSA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-UZVSRGJWSA-N"
"O=C(N1)N(C)C(=O)c(n(C)2)c(nc2)1","InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)11(2)7(13)9-5/h3H,1-2H3,(H,9,13)","QUNWUDVFRNGTCO-UHFFFAOYSA-N"
"CC(C)CC(C(O)=O)NC(=O)CCC(N)C(O)=O","InChI=1S/C11H20N2O5/c1-6(2)5-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h6-8H,3-5,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)/t7-,8-/m0/s1","MYFMARDICOWMQP-YUMQZZPRSA-N"
"CCCCCC=CCC=CCC=CCC=CCCCC(=O)OC(CO)CO","InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)27-22(20-24)21-25/h6-7,9-10,12-13,15-16,22,24-25H,2-5,8,11,14,17-21H2,1H3/b7-6-,10-9-,13-12-,16-15-","RCRCTBLIHCHWDZ-DOFZRALJSA-N"
"O=C(C2)N(C)C([H])(C2)c(c1)cncc1","InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1","UIKROCXWUNQSPJ-VIFPVBQESA-N"
"CCC=CCC=CCC=CCC=CCC=CCCCCCC(O)=O","InChI=1S/C22H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16H,2,5,8,11,14,17-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-","YUFFSWGQGVEMMI-JLNKQSITSA-N"
"OC(=O)CC(C)(O)C(O)=O","InChI=1S/C5H8O5/c1-5(10,4(8)9)2-3(6)7/h10H,2H2,1H3,(H,6,7)(H,8,9)","XFTRTWQBIOMVPK-UHFFFAOYSA-N"
"CCCCCCCCCC(=O)OC(CC(O)=O)C[N+1](C)(C)C","InChI=1S/C17H33NO4/c1-5-6-7-8-9-10-11-12-17(21)22-15(13-16(19)20)14-18(2,3)4/h15H,5-14H2,1-4H3/p+1","LZOSYCMHQXPBFU-UHFFFAOYSA-O"
"OCC[N+1](C)(C)C","InChI=1S/C5H14NO/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3/q+1","OEYIOHPDSNJKLS-UHFFFAOYSA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-BSWAIDMHSA-N"
"CC(O)CC(O)=O","InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)","WHBMMWSBFZVSSR-UHFFFAOYSA-N"
"[H]C(O)(C1)CC([H])(N1)C(O)=O","InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4+/m1/s1","PMMYEEVYMWASQN-DMTCNVIQSA-N"
"CC(=O)OC([H])(CC(O)=O)C[N+1](C)(C)C","InChI=1S/C9H17NO4/c1-7(11)14-8(5-9(12)13)6-10(2,3)4/h8H,5-6H2,1-4H3/p+1/t8-/m1/s1","RDHQFKQIGNGIED-MRVPVSSYSA-O"
"NC(=O)NCCCC(N)C(O)=O","InChI=1S/C6H13N3O3/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)","RHGKLRLOHDJJDR-UHFFFAOYSA-N"
"CCC(C)C(N)C(O)=O","InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)","AGPKZVBTJJNPAG-UHFFFAOYSA-N"
"","InChI=1S/C26H43NO5/c1-15(4-9-23(30)27-14-24(31)32)19-7-8-20-18-6-5-16-12-17(28)10-11-25(16,2)21(18)13-22(29)26(19,20)3/h15-22,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16-,17-,18+,19-,20+,21+,22+,25+,26-/m1/s1","WVULKSPCQVQLCU-BUXLTGKBSA-N"
"CCCCCCCC(O)CC(O)=O","InChI=1S/C10H20O3/c1-2-3-4-5-6-7-9(11)8-10(12)13/h9,11H,2-8H2,1H3,(H,12,13)","FYSSBMZUBSBFJL-UHFFFAOYSA-N"
"NC(=N)NCCCC(N)C(O)=O","InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)","ODKSFYDXXFIFQN-UHFFFAOYSA-N"
"C(NC(=O)CNC(C(NC(C(CC(O)=O)NC(C(C)N)=O)=O)CO)=O)(CCC(O)=O)C(NCC(NC(C(NC(Cc(c1)cccc1)C(=O)NC(C(=O)NC(C)C(NC(C(=O)NCC(=O)NCC(=O)NCC(NC(C(C)C)C(NC(CCCNC(N)=N)C(O)=O)=O)=O)CCC(O)=O)=O)CC(C)C)=O)CC(O)=O)=O)=O","InChI=1S/C63H97N19O26/c1-29(2)19-37(57(102)73-32(6)53(98)76-35(15-17-48(91)92)55(100)70-24-43(85)68-23-42(84)69-25-46(88)82-51(30(3)4)61(106)77-36(62(107)108)13-10-18-67-63(65)66)79-58(103)38(20-33-11-8-7-9-12-33)80-59(104)39(21-49(93)94)75-45(87)27-71-54(99)34(14-16-47(89)90)74-44(86)26-72-56(101)41(28-83)81-60(105)40(22-50(95)96)78-52(97)31(5)64/h7-9,11-12,29-32,34-41,51,83H,10,13-28,64H2,1-6H3,(H,68,85)(H,69,84)(H,70,100)(H,71,99)(H,72,101)(H,73,102)(H,74,86)(H,75,87)(H,76,98)(H,77,106)(H,78,97)(H,79,103)(H,80,104)(H,81,105)(H,82,88)(H,89,90)(H,91,92)(H,93,94)(H,95,96)(H,107,108)(H4,65,66,67)","JWICNZAGYSIBAR-UHFFFAOYSA-N"
"CC\1=C(/C(=C/C2=C(C(=C(N2)/C=C\3/C(=C(C(=O)N3)C)C=C)C)CCC(=O)O)/N/C1=C\C4=NC(=O)C(=C4C)C=C)CCC(=O)O","InChI=1S/C33H34N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,13-15,34-35H,1-2,9-12H2,3-6H3,(H,37,42)(H,38,39)(H,40,41)/b24-13-,27-14-,28-15-","RCNSAJSGRJSBKK-NSQVQWHSSA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)[C@@H](OC[C@@H](O2)[C@@H](O)[C@H](O)[C@@H](O)[C@H]2O[C@](CO)(O3)[C@@H](O)[C@H](O)[C@@H](CO)3)1","InChI=1S/C18H32O16/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18/h5-17,19-29H,1-4H2/t5-,6-,7-,8+,9-,10-,11+,12+,13-,14-,15+,16+,17-,18+/m1/s1","MUPFEKGTMRGPLJ-ZQSKZDJDSA-N"
"OC(=O)C(N)CCC(=O)NC(C(C)O)C(O)=O","InChI=1S/C9H16N2O6/c1-4(12)7(9(16)17)11-6(13)3-2-5(10)8(14)15/h4-5,7,12H,2-3,10H2,1H3,(H,11,13)(H,14,15)(H,16,17)/t4-,5+,7+/m1/s1","GWNXFCYUJXASDX-ZDLURKLDSA-N"
"CCCCCCCCC=CCCCCCCCCC(O)=O","InChI=1S/C19H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21/h9-10H,2-8,11-18H2,1H3,(H,20,21)/b10-9-","BBOWBNGUEWHNQZ-KTKRTIGZSA-N"
"OC(=O)C([H])(N)CCC(=O)NC([H])(C(O)=O)Cc(c1)cccc1","InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)/t10-,11-/m0/s1","XHHOHZPNYFQJKL-QWRGUYRKSA-N"
"NCC(=O)NC([H])(C(O)=O)Cc(c1)cccc1","InChI=1S/C11H14N2O3/c12-7-10(14)13-9(11(15)16)6-8-4-2-1-3-5-8/h1-5,9H,6-7,12H2,(H,13,14)(H,15,16)/t9-/m0/s1","JBCLFWXMTIKCCB-VIFPVBQESA-N"
"CCCC(=O)OC([H])(CC(O)=O)C[N+1](C)(C)C","InChI=1S/C11H21NO4/c1-5-6-11(15)16-9(7-10(13)14)8-12(2,3)4/h9H,5-8H2,1-4H3/p+1/t9-/m1/s1","QWYFHHGCZUCMBN-SECBINFHSA-O"
"CC(O)C(N)C(=O)NC(C(O)=O)Cc(c1)cccc1","InChI=1S/C13H18N2O4/c1-8(16)11(14)12(17)15-10(13(18)19)7-9-5-3-2-4-6-9/h2-6,8,10-11,16H,7,14H2,1H3,(H,15,17)(H,18,19)/t8-,10+,11+/m1/s1","IQHUITKNHOKGFC-MIMYLULJSA-N"
"","InChI=1S/C26H43NO5/c1-15(4-7-22(30)27-14-23(31)32)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(28)12-16(25)13-21(24)29/h15-21,24,28-29H,4-14H2,1-3H3,(H,27,30)(H,31,32)/t15-,16+,17-,18-,19+,20+,21-,24+,25+,26-/m1/s1","GHCZAUBVMUEKKP-GYPHWSFCSA-N"
"OC(=O)C(O)Cc(c1)ccc(O)c1","InChI=1S/C9H10O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8,10-11H,5H2,(H,12,13)","JVGVDSSUAVXRDY-UHFFFAOYSA-N"
"CC(O)CCCCCC(O)=O","InChI=1S/C8H16O3/c1-7(9)5-3-2-4-6-8(10)11/h7,9H,2-6H2,1H3,(H,10,11)","OFCMTSZRXXFMBQ-UHFFFAOYSA-N"
"OC(=O)C(C1)NCC1","InChI=1S/C5H9NO2/c7-5(8)4-2-1-3-6-4/h4,6H,1-3H2,(H,7,8)","ONIBWKKTOPOVIA-UHFFFAOYSA-N"
"CCC1=C(C(=O)NC1CC2=C(C(=C(N2)CC3=C(C(=C(N3)CC4C(=C(C(=O)N4)CC)C)C)CCC(=O)O)CCC(=O)O)C)C","InChI=1S/C33H44N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h26-27,34-35H,7-15H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)","OBHRVMZSZIDDEK-UHFFFAOYSA-N"
"OCC([H])(O1)C([H])(O)C([H])(O)C([H])1C(=C2)C(=O)NC(=O)N2","InChI=1S/C9H12N2O6/c12-2-4-5(13)6(14)7(17-4)3-1-10-9(16)11-8(3)15/h1,4-7,12-14H,2H2,(H2,10,11,15,16)/t4-,5-,6-,7+/m1/s1","PTJWIQPHWPFNBW-GBNDHIKLSA-N"
"C(C(C([H])(C41C)CCC1(C(C(CC(O)4)([H])2)([H])CCC([H])(C3)C2(C)CCC3O)[H])C)CC(=O)NCCS(O)(=O)=O","InChI=1S/C26H45NO6S/c1-16(4-9-24(30)27-12-13-34(31,32)33)20-7-8-21-19-6-5-17-14-18(28)10-11-25(17,2)22(19)15-23(29)26(20,21)3/h16-23,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-/m1/s1","AWDRATDZQPNJFN-VAYUFCLWSA-N"
"CCCCCCCCCCCCCCCCC(O)=O","InChI=1S/C17H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19/h2-16H2,1H3,(H,18,19)","KEMQGTRYUADPNZ-UHFFFAOYSA-N"
"CC(C)C(N)C(O)=O","InChI=1S/C5H11NO2/c1-3(2)4(6)5(7)8/h3-4H,6H2,1-2H3,(H,7,8)/t4-/m0/s1","KZSNJWFQEVHDMF-BYPYZUCNSA-N"
"OC(=O)C([H])(N)CCC(=O)NC([H])(C(C)C)C(O)=O","InChI=1S/C10H18N2O5/c1-5(2)8(10(16)17)12-7(13)4-3-6(11)9(14)15/h5-6,8H,3-4,11H2,1-2H3,(H,12,13)(H,14,15)(H,16,17)/t6-,8-/m0/s1","AQAKHZVPOOGUCK-XPUUQOCRSA-N"
"CC(C)C(O)C(O)=O","InChI=1S/C5H10O3/c1-3(2)4(6)5(7)8/h3-4,6H,1-2H3,(H,7,8)","NGEWQZIDQIYUNV-UHFFFAOYSA-N"
"O=C(N1)NC(N2)=C(NC(=O)2)C(=O)1","InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)","LEHOTFFKMJEONL-UHFFFAOYSA-N"
"CCCCCCC=CCCCC(O)=O","InChI=1S/C12H22O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14/h7-8H,2-6,9-11H2,1H3,(H,13,14)/b8-7-","IJBFSOLHRKELLR-FPLPWBNLSA-N"
"CCC=CCC=CCC=CCCCCCCCCCC(O)=O","InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h3-4,6-7,9-10H,2,5,8,11-19H2,1H3,(H,21,22)/b4-3-,7-6-,10-9-","AHANXAKGNAKFSK-PDBXOOCHSA-N"
"P(O)(=O)(OCC[N+1](C)(C)C)OCC([H])(O)COC(=O)CCCCCCCC=CCCCCCCCC","InChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/p+1/b13-12-/t25-/m1/s1","YAMUFBLWGFFICM-PTGWMXDISA-O"
"NCC(=O)NC([H])(C(C)C)C(O)=O","InChI=1S/C7H14N2O3/c1-4(2)6(7(11)12)9-5(10)3-8/h4,6H,3,8H2,1-2H3,(H,9,10)(H,11,12)/t6-/m0/s1","STKYPAFSDFAEPH-LURJTMIESA-N"
"O=C(NC(C(=O)NCC(=O)NC(C(=O)NCC(=O)NC(CC(O)=O)C(=O)NC(C(NC(CC(C)C)C(NC(C(NC(C(=O)NCC(=O)NCC(=O)NCC(NC(C(C)C)C(NC(CCCNC(N)=N)C(O)=O)=O)=O)CCC(O)=O)=O)C)=O)=O)Cc(c1)cccc1)CCC(O)=O)COP(O)(O)=O)C(NC(=O)C(C)N)CC(O)=O","InChI=1S/C63H98N19O29P/c1-29(2)19-37(57(101)73-32(6)53(97)76-35(15-17-48(90)91)55(99)70-24-43(84)68-23-42(83)69-25-46(87)82-51(30(3)4)61(105)77-36(62(106)107)13-10-18-67-63(65)66)79-58(102)38(20-33-11-8-7-9-12-33)80-59(103)39(21-49(92)93)75-45(86)27-71-54(98)34(14-16-47(88)89)74-44(85)26-72-56(100)41(28-111-112(108,109)110)81-60(104)40(22-50(94)95)78-52(96)31(5)64/h7-9,11-12,29-32,34-41,51H,10,13-28,64H2,1-6H3,(H,68,84)(H,69,83)(H,70,99)(H,71,98)(H,72,100)(H,73,101)(H,74,85)(H,75,86)(H,76,97)(H,77,105)(H,78,96)(H,79,102)(H,80,103)(H,81,104)(H,82,87)(H,88,89)(H,90,91)(H,92,93)(H,94,95)(H,106,107)(H4,65,66,67)(H2,108,109,110)","DROFZMGQYLJNLQ-UHFFFAOYSA-N"
"CC(C)C[C@@H](C(=O)NC(C)C(=O)O)NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)C(Cc1c[nH]cn1)N","InChI=1S/C23H39N7O6/c1-12(2)6-17(30-20(32)16(24)8-15-9-25-11-27-15)21(33)26-10-19(31)29-18(7-13(3)4)22(34)28-14(5)23(35)36/h9,11-14,16-18H,6-8,10,24H2,1-5H3,(H,25,27)(H,26,33)(H,28,34)(H,29,31)(H,30,32)(H,35,36)","WXNAHZWQHGJJCT-UHFFFAOYSA-N"
"CCCc(o1)c(C)c(C(O)=O)c(CCC(O)=O)1","InChI=1S/C12H16O5/c1-3-4-8-7(2)11(12(15)16)9(17-8)5-6-10(13)14/h3-6H2,1-2H3,(H,13,14)(H,15,16)","WMCQWXZMVIETAO-UHFFFAOYSA-N"
"","InChI=1S/C26H45NO6S/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-/m1/s1","BHTRKEVKTKCXOH-BJLOMENOSA-N"
"C=CCCCCCCCCC(=O)O[H]","InChI=1S/C11H20O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2H,1,3-10H2,(H,12,13)","FRPZMMHWLSIFAZ-UHFFFAOYSA-N"
"CCCCCCCC(=O)OC(CC(O)=O)C[N+1](C)(C)C","InChI=1S/C15H29NO4/c1-5-6-7-8-9-10-15(19)20-13(11-14(17)18)12-16(2,3)4/h13H,5-12H2,1-4H3/p+1","CXTATJFJDMJMIY-UHFFFAOYSA-O"
"CCCCCCCCCCCCCCCC(=O)OCC(O)COP(O)(=O)OCC[N+1](C)(C)C","InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/p+1","ASWBNKHCZGQVJV-UHFFFAOYSA-O"
"C1=NC2=C(N1)C(=O)NC(=O)N2","InChI=1S/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)","LRFVTYWOQMYALW-UHFFFAOYSA-N"
"C[C@@H](C(=O)N[C@@H](CO)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(=O)O)NC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](Cc3c[nH]cn3)N","InChI=1S/C43H63N11O13/c1-21(2)12-30(39(62)52-32(43(66)67)13-22(3)4)51-42(65)34(19-56)53-36(59)23(5)48-41(64)33(18-55)54-38(61)29(10-11-35(57)58)49-40(63)31(14-24-16-46-28-9-7-6-8-26(24)28)50-37(60)27(44)15-25-17-45-20-47-25/h6-9,16-17,20-23,27,29-34,46,55-56H,10-15,18-19,44H2,1-5H3,(H,45,47)(H,48,64)(H,49,63)(H,50,60)(H,51,65)(H,52,62)(H,53,59)(H,54,61)(H,57,58)(H,66,67)","KUZSCKDYVGVVKC-UHFFFAOYSA-N"
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"NC(=O)CCC([H])(N)C(O)=O","InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1","ZDXPYRJPNDTMRX-VKHMYHEASA-N"
"OC(=O)CNC(=O)C([H])(C1)NC(=O)C1","InChI=1S/C7H10N2O4/c10-5-2-1-4(9-5)7(13)8-3-6(11)12/h4H,1-3H2,(H,8,13)(H,9,10)(H,11,12)/t4-/m0/s1","HLPLTUJPJMFPMP-BYPYZUCNSA-N"
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"CSCCC([H])(C(O)=O)NC(=O)CCC([H])(N)C(O)=O","InChI=1S/C10H18N2O5S/c1-18-5-4-7(10(16)17)12-8(13)3-2-6(11)9(14)15/h6-7H,2-5,11H2,1H3,(H,12,13)(H,14,15)(H,16,17)/t6-,7-/m0/s1","RQNSKRXMANOPQY-BQBZGAKWSA-N"
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"O=C(C=CC=Cc(c2)cc(O3)c(OC3)c2)N(C1)CCCC1","InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+","MXXWOMGUGJBKIW-YPCIICBESA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m1/s1","DGABKXLVXPYZII-SIBKNCMHSA-N"
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"NC(=O)CCC([H])(C(O)=O)NC(=O)CCC([H])(N)C(O)=O","InChI=1S/C10H17N3O6/c11-5(9(16)17)1-4-8(15)13-6(10(18)19)2-3-7(12)14/h5-6H,1-4,11H2,(H2,12,14)(H,13,15)(H,16,17)(H,18,19)/t5-,6-/m0/s1","JBFYFLXEJFQWMU-WDSKDSINSA-N"
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"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1","KXGVEGMKQFWNSR-LLQZFEROSA-N"
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"OC(=O)CC([H])(N)C(=O)NC([H])(C(O)=O)Cc(c1)cccc1","InChI=1S/C13H16N2O5/c14-9(7-11(16)17)12(18)15-10(13(19)20)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)/t9-,10-/m0/s1","YZQCXOFQZKCETR-UWVGGRQHSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@H]([C@@H](CO)4)[C@H](O)[C@@H](O)[C@H](O4)O[C@H]([C@@H](CO)3)[C@H](O)[C@@H](O)[C@H](O3)O[C@H]([C@@H](CO)2)[C@H](O)[C@@H](O)C(O)O2","InChI=1S/C24H42O21/c25-1-5-9(29)10(30)15(35)22(40-5)44-19-7(3-27)42-24(17(37)12(19)32)45-20-8(4-28)41-23(16(36)13(20)33)43-18-6(2-26)39-21(38)14(34)11(18)31/h5-38H,1-4H2/t5-,6-,7-,8-,9-,10+,11-,12-,13-,14-,15-,16-,17-,18-,19-,20-,21?,22-,23-,24-/m1/s1","LUEWUZLMQUOBSB-AYQJAVFRSA-N"
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"C=CC1CN2CCC1CC2[C@H](C3=CC=NC4=CC=CC=C34)O","InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13?,14?,18?,19-/m0/s1","KMPWYEUPVWOPIM-QHQSXHFQSA-N"
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"[H]OC([H])([H])C(C([H])([H])[H])=C([H])C([H])([H])N([H])c(n3)c(n2)c(nc([H])3)n(c([H])2)[C@]([H])(O1)[C@]([H])(O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]([H])(C([H])([H])O[H])1","InChI=1S/C16H23N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)21(7-20-10)16-13(26)12(25)11(24)9(5-23)27-16/h2,6-7,9,11-13,16,22-26H,3-5H2,1H3,(H,17,18,19)/b8-2+/t9-,11-,12+,13-,16-/m1/s1","VYRAJOITMBSQSE-HNVSNYHQSA-N"
"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(SC(=NOS(O)(=O)=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])SC([H])([H])[H])1","InChI=1S/C16H31NO9S3/c1-27-9-7-5-3-2-4-6-8-12(17-26-29(22,23)24)28-16-15(21)14(20)13(19)11(10-18)25-16/h11,13-16,18-21H,2-10H2,1H3,(H,22,23,24)/b17-12+/t11-,13-,14+,15-,16+/m1/s1","CWOJBEDMJKZKAB-STPBKMPXSA-N"
"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(SC(=NOS(O)(=O)=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])S(=O)C([H])([H])[H])1","InChI=1S/C12H23NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21)/b13-8+/t7-,9-,10+,11-,12+,25?/m1/s1","GMMLNKINDDUDCF-RFOBZYEESA-N"
"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(SC(=NOS(O)(=O)=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])SC([H])([H])[H])1","InChI=1S/C15H29NO9S3/c1-26-8-6-4-2-3-5-7-11(16-25-28(21,22)23)27-15-14(20)13(19)12(18)10(9-17)24-15/h10,12-15,17-20H,2-9H2,1H3,(H,21,22,23)/b16-11+/t10-,12-,13+,14-,15+/m1/s1","SJHVRBSHKTUXLG-MFIRQCQASA-N"
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"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(SC(=NOS(O)(=O)=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])SC([H])([H])[H])1","InChI=1S/C12H23NO9S3/c1-23-5-3-2-4-8(13-22-25(18,19)20)24-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)/t7-,9-,10+,11-,12+/m1/s1","GKUMMDFLKGFCKH-URYVQPGZSA-N"
"[H]OC([H])([H])C([H])([H])C([H])([H])C(=NOS(O)(=O)=O)SC([H])(O1)C([H])(O)C([H])(O[H])C([H])(O[H])C([H])(CO)1","InChI=1S/C10H19NO10S2/c12-3-1-2-6(11-21-23(17,18)19)22-10-9(16)8(15)7(14)5(4-13)20-10/h5,7-10,12-16H,1-4H2,(H,17,18,19)/b11-6+","WIGYSAIZPJAWDF-IZZDOVSWSA-N"
"[H]OC([H])([H])C(C([H])([H])[H])=C([H])C([H])([H])N([H])c(n3)c(c(nc([H])3)2)n(c([H])n2)C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(C([H])([H])O[H])1","InChI=1S/C16H23N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)20-7-21(10)16-13(26)12(25)11(24)9(5-23)27-16/h2,6-7,9,11-13,16,22-26H,3-5H2,1H3,(H,17,18,19)/b8-2+/t9-,11-,12+,13-,16-/m1/s1","HTDHRCLVWUEXIS-HNVSNYHQSA-N"
"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(SC(=NOS(O)(=O)=O)C([H])([H])c(c([H])2)c(c(OC([H])([H])[H])3)c(c([H])c([H])c([H])3)n([H])2)1","InChI=1S/C17H22N2O10S2/c1-27-10-4-2-3-9-13(10)8(6-18-9)5-12(19-29-31(24,25)26)30-17-16(23)15(22)14(21)11(7-20)28-17/h2-4,6,11,14-18,20-23H,5,7H2,1H3,(H,24,25,26)/t11-,14-,15+,16-,17+/m1/s1","IIAGSABLXRZUSE-UFRBAHOGSA-N"
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"[H]OC([H])(C([H])(CO)1)C([H])(O[H])C([H])(O)C([H])(SC(=NOS(O)(=O)=O)C([H])([H])C([H])([H])C([H])([H])SC([H])([H])[H])O1","InChI=1S/C11H21NO9S3/c1-22-4-2-3-7(12-21-24(17,18)19)23-11-10(16)9(15)8(14)6(5-13)20-11/h6,8-11,13-16H,2-5H2,1H3,(H,17,18,19)/b12-7+","ZCZCVJVUJGULMO-KPKJPENVSA-N"
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"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])1n(c([H])3)c(c2n3)c(nc([H])n2)N([H])C([H])([H])C([H])=C(C([H])([H])[H])C([H])([H])[H]","InChI=1S/C16H23N5O5/c1-8(2)3-4-17-14-10-15(19-6-18-14)20-7-21(10)16-13(25)12(24)11(23)9(5-22)26-16/h3,6-7,9,11-13,16,22-25H,4-5H2,1-2H3,(H,17,18,19)/t9-,11-,12+,13-,16-/m1/s1","ORUWKZNXHJIZKV-HDNYONAXSA-N"
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"[H]C(O4)(C([H])(O)C([H])(OC(C([H])(O)5)([H])OC(C([H])(O)C5([H])O)([H])CO)C([H])(O)C4([H])CO)OC(C([H])(O)3)(C([H])(O)C([H])(OC3([H])CO)OC(C([H])(O)1)(C(C(OC(C([H])(O)2)([H])C([H])(O)C(OC2([H])O)([H])CO)([H])OC1([H])CO)([H])O)[H])[H]","InChI=1S/C30H52O26/c31-1-6-11(36)16(41)17(42)27(49-6)54-23-13(38)8(3-33)51-29(19(23)44)56-25-15(40)10(5-35)52-30(21(25)46)55-24-14(39)9(4-34)50-28(20(24)45)53-22-12(37)7(2-32)48-26(47)18(22)43/h6-47H,1-5H2/t6?,7?,8?,9?,10?,11-,12-,13-,14-,15-,16-,17?,18?,19?,20?,21?,22+,23+,24+,25+,26-,27+,28+,29+,30+/m1/s1","UUQINGLDFWYORW-WYJXGQBFSA-N"
"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])1n(c([H])3)c(n2)c(n3)c(nc([H])2)N([H])C([H])([H])C([H])=C(C)C([H])([H])O","InChI=1S/C16H23N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)21(7-20-10)16-13(26)12(25)11(24)9(5-23)27-16/h2,6-7,9,11-13,16,22-26H,3-5H2,1H3,(H,17,18,19)/b8-2-/t9-,11-,12+,13-,16-/m1/s1","VYRAJOITMBSQSE-MTQUCLQASA-N"
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"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(SC(=NOS(O)(=O)=O)C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])S(=O)C([H])([H])[H])1","InChI=1S/C16H31NO10S3/c1-29(22)9-7-5-3-2-4-6-8-12(17-27-30(23,24)25)28-16-15(21)14(20)13(19)11(10-18)26-16/h11,13-16,18-21H,2-10H2,1H3,(H,23,24,25)/b17-12+/t11-,13-,14+,15-,16+,29?/m1/s1","GPMDJOOLATZDQL-SGBLMZTFSA-N"
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"[H]OC([H])([H])C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(OC([H])([H])C(C([H])([H])[H])=CC([H])([H])N([H])c(n3)c(n([H])2)c(nc([H])3)nc([H])2)1","InChI=1S/C16H23N5O6/c1-8(2-3-17-14-10-15(19-6-18-10)21-7-20-14)5-26-16-13(25)12(24)11(23)9(4-22)27-16/h2,6-7,9,11-13,16,22-25H,3-5H2,1H3,(H2,17,18,19,20,21)/b8-2-/t9-,11-,12+,13-,16-/m1/s1","UUPDCCPAOMDMPT-MTQUCLQASA-N"
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"C1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C(=C3O)O)O","InChI=1S/C15H10O5/c16-9-6-11(8-4-2-1-3-5-8)20-12-7-10(17)14(18)15(19)13(9)12/h1-7,17-19H","FXNFHKRTJBSTCS-UHFFFAOYSA-N"
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"C[C@H]1[C@@H]2CN3CCC4=C([C@@H]3C[C@@H]2C(=CO1)C(=O)OC)NC5=CC=CC=C45","InChI=1S/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t12-,15-,16-,19-/m0/s1","GRTOGORTSDXSFK-DLLGKBFGSA-N"
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"[H]Oc(c([H])4)c(O[H])c([H])c(c([H])4)C(O1)=C(O[C@]([H])(O3)[C@]([H])(O[H])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]([H])(C(=O)O[H])3)C(=O)c(c(O[H])2)c(c([H])c(O[H])c([H])2)1","InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1","DUBCCGAQYVUYEU-ZUGPOPFOSA-N"
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"[2H]/C(=C(\[2H])/C/C(=C(/[2H])\C/C(=C(/[2H])\C/C(=C(/[2H])\CCCC(=O)O)/[2H])/[2H])/[2H])/CCCCC","InChI=1S/C20H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-,16-15-/i6D,7D,9D,10D,12D,13D,15D,16D","YZXBAPSDXZZRGB-FBFLGLDDSA-N"
"[2H]C([2H])([2H])C([2H])([2H])CCC[C@@H](\C=C\C=C/C=C/C=C/[C@H]([C@H](CCCC(=O)O)O)O)O","InChI=1S/C20H32O5/c1-2-3-8-12-17(21)13-9-6-4-5-7-10-14-18(22)19(23)15-11-16-20(24)25/h4-7,9-10,13-14,17-19,21-23H,2-3,8,11-12,15-16H2,1H3,(H,24,25)/b6-4-,7-5+,13-9+,14-10+/t17-,18+,19-/m0/s1/i1D3,2D2","IXAQOQZEOGMIQS-YUMLLTTFSA-N"
"[2H]C([2H])(CC(=O)O)C([2H])([2H])/C=C\C[C@@H]1[C@H]([C@@H](CC1=O)O)/C=C/[C@H](CCCCC)O","InChI=1S/C20H32O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-17,19,21,23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,19+/m0/s1/i5D2,8D2","XEYBRNLFEZDVAW-YOLMOHOWSA-N"
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"O=C(N[C@@H](CSC(C)CCO)C(=O)NCC(=O)O)CC[C@H](N)C(=O)O","InChI=1S/C14H25N3O7S/c1-8(4-5-18)25-7-10(13(22)16-6-12(20)21)17-11(19)3-2-9(15)14(23)24/h8-10,18H,2-7,15H2,1H3,(H,16,22)(H,17,19)(H,20,21)(H,23,24)/t8?,9-,10-/m0/s1","SLDQURKLQRTWJV-AGROOBSYSA-N"
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"C[C@@H]1C[C@@H](O[C@@]1(C)CC(=O)/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C#CC2=C(C[C@H](CC2(C)C)O)C)/C)/C)CC(=O)C","InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-37-32(5)23-35(42)26-39(37,8)9)15-11-12-16-29(2)19-14-20-31(4)38(43)27-40(10)33(6)24-36(44-40)25-34(7)41/h11-20,33,35-36,42H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+/t33-,35-,36-,40+/m1/s1","KFNGKYUGHHQDEE-AXWOCEAUSA-N"
"CC1=C(C(C[C@@H](C1)O)(C)C)C#C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C(=O)C/C(=C(\C)/C[C@@H](CC(=O)C)O)/C)/C)/C","InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-38-34(7)24-37(43)27-40(38,9)10)15-11-12-16-29(2)19-14-20-31(4)39(44)25-33(6)32(5)23-36(42)26-35(8)41/h11-20,36-37,42-43H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+,33-32+/t36-,37+/m0/s1","LGLPDUBVWXHHHU-ZCJJJFIZSA-N"
"CC1=C(C(C[C@@H](C1)O)(C)C)C#C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C2=C(C(=O)[C@H](CC2(C)C)O)C)/C)/C","InChI=1S/C40H52O3/c1-28(17-13-19-30(3)21-23-35-32(5)25-34(41)26-39(35,7)8)15-11-12-16-29(2)18-14-20-31(4)22-24-36-33(6)38(43)37(42)27-40(36,9)10/h11-20,22,24,34,37,41-42H,25-27H2,1-10H3/b12-11+,17-13+,18-14+,24-22+,28-15+,29-16+,30-19+,31-20+/t34-,37+/m1/s1","ANEICJWUPVGZBQ-HEBVJZCOSA-N"
"","InChI=1S/C37H48O6/c1-25(15-16-31-33(3,4)21-28(38)23-35(31,7)41)13-11-9-10-12-14-26(2)19-30-20-27(32(40)42-30)17-18-37-34(5,6)22-29(39)24-36(37,8)43-37/h9-15,17-20,28-29,38-39,41H,21-24H2,1-8H3/b11-9+,12-10+,18-17+,25-13+,26-14+,30-19-/t16?,28-,29-,35+,36+,37-/m0/s1","GWNBJBMUGIZCIP-VWLXYMLYSA-N"
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"CN(C)C[C@H](C)NC(=O)CCNC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)NC(=O)[C@@H](NC(=O)[C@H](C[C@H](C)C[C@@H](O)CC(=O)CC)NC(=O)[C@@H]1C[C@H](C)CN1C(=O)/C=C/[C@@H](C)CC)[C@H](O)C(C)C","InChI=1S/C62H111N11O13/c1-21-38(9)23-24-49(77)73-33-40(11)31-47(73)55(82)66-46(30-39(10)29-43(75)32-42(74)22-2)53(80)68-50(51(78)37(7)8)56(83)70-61(15,16)58(85)67-44(27-35(3)4)52(79)65-45(28-36(5)6)54(81)69-62(17,18)59(86)71-60(13,14)57(84)63-26-25-48(76)64-41(12)34-72(19)20/h23-24,35-41,43-47,50-51,75,78H,21-22,25-34H2,1-20H3,(H,63,84)(H,64,76)(H,65,79)(H,66,82)(H,67,85)(H,68,80)(H,69,81)(H,70,83)(H,71,86)/b24-23+/t38-,39+,40-,41-,43+,44-,45-,46-,47-,50-,51+/m0/s1","FOAIGCPESMNWQP-FGFJWYLSSA-N"
"O=C(O)C(C)NC(=O)CCNC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)CC(O)CC(=O)CC)NC(=O)[C@@H]1C[C@H](C)CN1C(=O)/C=C/C(C)CC)C(O)C(C)C","InChI=1S/C60H104N10O15/c1-19-35(9)21-22-46(74)70-31-37(11)29-44(70)52(79)64-43(28-36(10)27-40(72)30-39(71)20-2)50(77)66-47(48(75)34(7)8)53(80)68-59(15,16)56(84)65-41(25-32(3)4)49(76)63-42(26-33(5)6)51(78)67-60(17,18)57(85)69-58(13,14)55(83)61-24-23-45(73)62-38(12)54(81)82/h21-22,32-38,40-44,47-48,72,75H,19-20,23-31H2,1-18H3,(H,61,83)(H,62,73)(H,63,76)(H,64,79)(H,65,84)(H,66,77)(H,67,78)(H,68,80)(H,69,85)(H,81,82)/b22-21+/t35?,36?,37-,38?,40?,41-,42-,43-,44-,47-,48?/m0/s1","RNNIWZPLXMQCIS-RSHGAMSMSA-N"
"CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O","InChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3/b13-12-/t25-/m1/s1","YAMUFBLWGFFICM-PTGWMXDISA-N"
"CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC","InChI=1S/C44H86NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h21,23,42H,6-20,22,24-41H2,1-5H3/b23-21-/t42-/m1/s1","ATHVAWFAEPLPPQ-VRDBWYNSSA-N"
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"C1CCC(CC1)NC(=O)NC2CCCCC2","InChI=1S/C13H24N2O/c16-13(14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h11-12H,1-10H2,(H2,14,15,16)","ADFXKUOMJKEIND-UHFFFAOYSA-N"
"C1=CC(=CC=C1C(=O)OCCO)C(=O)OCCOC(=O)C2=CC=C(C=C2)C(=O)OCCO","InChI=1S/C22H22O10/c23-9-11-29-19(25)15-1-5-17(6-2-15)21(27)31-13-14-32-22(28)18-7-3-16(4-8-18)20(26)30-12-10-24/h1-8,23-24H,9-14H2","SMNDVBDBKRCKDY-UHFFFAOYSA-N"
"CN(CC#C)C1=C(C=NN1C2=NN3CCCCC3=C2Cl)C#N","InChI=1S/C15H15ClN6/c1-3-7-20(2)15-11(9-17)10-18-22(15)14-13(16)12-6-4-5-8-21(12)19-14/h1,10H,4-8H2,2H3","IHHMUBRVTJMLQO-UHFFFAOYSA-N"
"CC1=C(C(C[C@@H](C1)O)(C)C)C#C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/[C@@H]2C=C3[C@](O2)(C[C@H](CC3(C)C)O)C)/C)/C","InChI=1S/C40H54O3/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)25-38(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36-24-37-39(8,9)26-34(42)27-40(37,10)43-36/h11-20,24,33-34,36,41-42H,23,25-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+/t33-,34+,36+,40-/m1/s1","USOIUYXBYYVLLZ-PMBXBIOBSA-N"
"CC1=C(C(C[C@@H](C1)O)(C)C)C#C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C(=O)C[C@]23[C@](O2)(C[C@H](CC3(C)C)O)C)/C)/C","InChI=1S/C40H54O4/c1-28(17-13-18-30(3)21-22-35-32(5)23-33(41)24-37(35,6)7)15-11-12-16-29(2)19-14-20-31(4)36(43)27-40-38(8,9)25-34(42)26-39(40,10)44-40/h11-20,33-34,41-42H,23-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+/t33-,34+,39-,40+/m1/s1","CNOIXMULOQWVGR-ABUIXNMTSA-N"
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"COc1cc(nc(n1)NC(=O)NS(=O)(=O)Cc2ccccc2C(=O)OC)OC","InChI=1S/C16H18N4O7S/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)20-28(23,24)9-10-6-4-5-7-11(10)14(21)27-3/h4-8H,9H2,1-3H3,(H2,17,18,19,20,22)","XMQFTWRPUQYINF-UHFFFAOYSA-N"
"COc1cc(nc(n1)NC(=O)NS(=O)(=O)c2c(nc3n2cccc3)Cl)OC","InChI=1S/C14H13ClN6O5S/c1-25-9-7-10(26-2)18-13(17-9)19-14(22)20-27(23,24)12-11(15)16-8-5-3-4-6-21(8)12/h3-7H,1-2H3,(H2,17,18,19,20,22)","NAGRVUXEKKZNHT-UHFFFAOYSA-N"
"c1ccc2c(c1)C(=O)C(=C(C2=O)Cl)N","InChI=1S/C10H6ClNO2/c11-7-8(12)10(14)6-4-2-1-3-5(6)9(7)13/h1-4H,12H2","OBLNWSCLAYSJJR-UHFFFAOYSA-N"
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"CC(=C1C(=O)N(C(=O)O1)c2cc(c(cc2F)Cl)OC3CCCC3)C","InChI=1S/C17H17ClFNO4/c1-9(2)15-16(21)20(17(22)24-15)13-8-14(11(18)7-12(13)19)23-10-5-3-4-6-10/h7-8,10H,3-6H2,1-2H3","JZPKLLLUDLHCEL-UHFFFAOYSA-N"
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"C1=CC(=CC=C1N)OC2=C(C=C(C=C2Cl)Cl)Cl","InChI=1S/C12H8Cl3NO/c13-7-5-10(14)12(11(15)6-7)17-9-3-1-8(16)2-4-9/h1-6H,16H2","YDIXMXKRLYKJJM-UHFFFAOYSA-N"
"CCOP(=S)(C1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]","InChI=1S/C14H14NO4PS/c1-2-18-20(21,14-6-4-3-5-7-14)19-13-10-8-12(9-11-13)15(16)17/h3-11H,2H2,1H3","AIGRXSNSLVJMEA-UHFFFAOYSA-N"
"CCOP(=O)(C1=CC=CC=C1)OC2=CC=C(C=C2)[N+](=O)[O-]","InChI=1S/C14H14NO5P/c1-2-19-21(18,14-6-4-3-5-7-14)20-13-10-8-12(9-11-13)15(16)17/h3-11H,2H2,1H3","PDABPGQGULTJFY-UHFFFAOYSA-N"
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"CC1=C(C=C(C=C1)OC(=O)NC)C","InChI=1S/C10H13NO2/c1-7-4-5-9(6-8(7)2)13-10(12)11-3/h4-6H,1-3H3,(H,11,12)","WCJYTPVNMWIZCG-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C(C2=CC=C(C=C2)Cl)C(Cl)Cl)Cl","InChI=1S/C14H10Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8,13-14H","JWBOIMRXGHLCPP-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C(C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl)Cl","InChI=1S/C14H9Cl5/c15-10-7-5-9(6-8-10)13(14(17,18)19)11-3-1-2-4-12(11)16/h1-8,13H","CVUGPAFCQJIYDT-UHFFFAOYSA-N"
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"C1=CC(=CC=C1C(=C(Cl)Cl)C2=CC=C(C=C2)Cl)Cl","InChI=1S/C14H8Cl4/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8H","UCNVFOCBFJOQAL-UHFFFAOYSA-N"
"C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl)Cl","InChI=1S/C14H9Cl5/c15-11-5-1-9(2-6-11)13(14(17,18)19)10-3-7-12(16)8-4-10/h1-8,13H","YVGGHNCTFXOJCH-UHFFFAOYSA-N"
"Cl[C@H]1[C@H](Cl)[C@@H](Cl)[C@H](Cl)[C@H](Cl)[C@@H]1Cl","InChI=1S/C6H6Cl6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-6H/t1-,2-,3-,4+,5-,6-","JLYXXMFPNIAWKQ-GPIVLXJGSA-N"
"CCOP(=O)(OCC)O/C(=C/Cl)/C1=C(C=C(C=C1)Cl)Cl","InChI=1S/C12H14Cl3O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3/b12-8+","FSAVDKDHPDSCTO-XYOKQWHBSA-N"
"CC1(C)C(C1/C=C/C(=O)OC(C(F)(F)F)C(F)(F)F)C(=O)O[C@H](C#N)c3cccc(Oc2ccccc2)c3","InChI=1S/C26H21F6NO5/c1-24(2)18(11-12-20(34)38-23(25(27,28)29)26(30,31)32)21(24)22(35)37-19(14-33)15-7-6-10-17(13-15)36-16-8-4-3-5-9-16/h3-13,18-19,21,23H,1-2H3/b12-11+/t18?,19-,21?/m1/s1","YLFSVIMMRPNPFK-PYWOBYHFSA-N"
"Clc(c3)cc(Cl)c(c3)C(O2)(OCC2)Cn(c1)ncn1","InChI=1S/C12H11Cl2N3O2/c13-9-1-2-10(11(14)5-9)12(18-3-4-19-12)6-17-8-15-7-16-17/h1-2,5,7-8H,3-4,6H2","AKNQMEBLVAMSNZ-UHFFFAOYSA-N"
"[H]c(c([H])2)c([H])c(N=1)c(c([H])2)C(=O)N(N1)C([H])([H])SP(=S)(OC([H])([H])[H])OC([H])([H])[H]","InChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3","CJJOSEISRRTUQB-UHFFFAOYSA-N"
"N#CN=C(C)N(C)Cc(c1)cnc(Cl)c1","InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3","WCXDHFDTOYPNIE-UHFFFAOYSA-N"
"CC(C)N(C(=O)CSP(=S)(OC)OC)c(c1)ccc(Cl)c1","InChI=1S/C13H19ClNO3PS2/c1-10(2)15(12-7-5-11(14)6-8-12)13(16)9-21-19(20,17-3)18-4/h5-8,10H,9H2,1-4H3","NXQDBZGWYSEGFL-UHFFFAOYSA-N"
"COCN(C(=O)CCl)c(c(CC)1)c(CC)ccc1","InChI=1S/C14H20ClNO2/c1-4-11-7-6-8-12(5-2)14(11)16(10-18-3)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3","XCSGPAVHZFQHGE-UHFFFAOYSA-N"
"C=CCN(CC=C)C(=O)CCl","InChI=1S/C8H12ClNO/c1-3-5-10(6-4-2)8(11)7-9/h3-4H,1-2,5-7H2","MDBGGTQNNUOQRC-UHFFFAOYSA-N"
"C1[C@@H]2C=C[C@H]1[C@H]3[C@@H]2[C@]4(C(=C([C@@]3(C4(Cl)Cl)Cl)Cl)Cl)Cl","InChI=1S/C12H8Cl6/c13-8-9(14)11(16)7-5-2-1-4(3-5)6(7)10(8,15)12(11,17)18/h1-2,4-7H,3H2/t4-,5+,6+,7-,10+,11-","QBYJBZPUGVGKQQ-SJJAEHHWSA-N"
"C=CCC(C(=O)2)=C(C)C(C2)OC(=O)C(C(C=C(C)C)1)C(C)(C)1","InChI=1S/C19H26O3/c1-7-8-13-12(4)16(10-15(13)20)22-18(21)17-14(9-11(2)3)19(17,5)6/h7,9,14,16-17H,1,8,10H2,2-6H3","ZCVAOQKBXKSDMS-UHFFFAOYSA-N"
"CC1=C(C(=O)CC1OC(=O)C2C(C2(C)C)/C=C(\C)/C(=O)OC)CC=C","InChI=1S/C20H26O5/c1-7-8-13-12(3)16(10-15(13)21)25-19(23)17-14(20(17,4)5)9-11(2)18(22)24-6/h7,9,14,16-17H,1,8,10H2,2-6H3/b11-9+","WZRUHNUBXOTVHG-PKNBQFBNSA-N"
"CCOP(=S)(OCC)Oc(n1)nn(C(C)C)c(Cl)1","InChI=1S/C9H17ClN3O3PS/c1-5-14-17(18,15-6-2)16-9-11-8(10)13(12-9)7(3)4/h7H,5-6H2,1-4H3","XRHGWAGWAHHFLF-UHFFFAOYSA-N"
"[H]C([H])([H])C([H])([H])OP(=O)(OC([H])([H])C([H])([H])[H])Oc(n2)c([H])c(o2)c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C13H16NO5P/c1-3-16-20(15,17-4-2)19-13-10-12(18-14-13)11-8-6-5-7-9-11/h5-10H,3-4H2,1-2H3","VLBRWDJSOHOVGF-UHFFFAOYSA-N"
"FC(F)(F)c(c3)cc(S(C)(=O)=O)c(c3)C(=O)c(c2)c(on2)C(C1)C1","InChI=1S/C15H12F3NO4S/c1-24(21,22)12-6-9(15(16,17)18)4-5-10(12)13(20)11-7-19-23-14(11)8-2-3-8/h4-8H,2-3H2,1H3","OYIKARCXOQLFHF-UHFFFAOYSA-N"
"CC(C)OC(=O)c(c1)c(ccc1)OP(=S)(OCC)NC(C)C","InChI=1S/C15H24NO4PS/c1-6-18-21(22,16-11(2)3)20-14-10-8-7-9-13(14)15(17)19-12(4)5/h7-12H,6H2,1-5H3,(H,16,22)","HOQADATXFBOEGG-UHFFFAOYSA-N"
"CNC(=O)Oc(c1)c(ccc1)C(C)C","InChI=1S/C11H15NO2/c1-8(2)9-6-4-5-7-10(9)14-11(13)12-3/h4-8H,1-3H3,(H,12,13)","QBSJMKIUCUGGNG-UHFFFAOYSA-N"
"CN(C)C(=O)Nc(c1)ccc(C(C)C)c1","InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)","PUIYMUZLKQOUOZ-UHFFFAOYSA-N"
"Clc(c2)cc(C(O)c(c3)cccc3)c(c2)NC(=O)c(c1)ccnc1","InChI=1S/C19H15ClN2O2/c20-15-6-7-17(22-19(24)14-8-10-21-11-9-14)16(12-15)18(23)13-4-2-1-3-5-13/h1-12,18,23H,(H,22,24)","PFDCOZXELJAUTR-UHFFFAOYSA-N"
"Clc2ccc(C(OCC=C)Cn1ccnc1)c(Cl)c2","InChI=1S/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2","PZBPKYOVPCNPJY-UHFFFAOYSA-N"
"SCC[C@H](N)C(O)=O","InChI=1S/C4H9NO2S/c5-3(1-2-8)4(6)7/h3,8H,1-2,5H2,(H,6,7)/t3-/m0/s1","FFFHZYDWPBMWHY-VKHMYHEASA-N"
"Nc(n4)c(n3)c(nc4)n(c3)[C@H](O1)[C@H](O)[C@H](O2)[C@@H](COP(O)(=O)2)1","InChI=1S/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1","IVOMOUWHDPKRLL-KQYNXXCUSA-N"
"Nc(n3)c(n2)c(nc3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1","UDMBCSSLTHHNCD-KQYNXXCUSA-N"
"NC(=O)c(c5)c[n+1](cc5)C(O1)C(O)C(O)C(COP(O)(=O)OP(O)(=O)OCC(O2)C(O)C(O)C2n(c4)c(n3)c(n4)c(N)nc3)1","InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1","BAWFJGJZGIEFAR-NNYOXOHSSA-O"
"CC(=O)SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC(O1)C(OP(O)(O)=O)C(O)C1n(c2)c(n3)c(c(N)nc3)n2","InChI=1S/C23H38N7O17P3S/c1-12(31)51-7-6-25-14(32)4-5-26-21(35)18(34)23(2,3)9-44-50(41,42)47-49(39,40)43-8-13-17(46-48(36,37)38)16(33)22(45-13)30-11-29-15-19(24)27-10-28-20(15)30/h10-11,13,16-18,22,33-34H,4-9H2,1-3H3,(H,25,32)(H,26,35)(H,39,40)(H,41,42)(H2,24,27,28)(H2,36,37,38)/t13-,16-,17-,18+,22-/m1/s1","ZSLZBFCDCINBPY-ZSJPKINUSA-N"
"NC(=O)c(c5)c[n+1](cc5)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OC[C@@H](O2)[C@@H](O)[C@@H](OP(O)(O)=O)[C@@H]2n(c3)c(n4)c(c(N)nc4)n3)1","InChI=1S/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/p+1/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1","XJLXINKUBYWONI-NNYOXOHSSA-O"
"NC(C=2)=NC(=O)N(C2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(O)=O)1","InChI=1S/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1","ZWIADYZPOWUWEW-XVFCMESISA-N"
"C(C(CN(c54)C(=N6)C(C(=O)NC6=O)=Nc(cc(c(c5)C)C)4)O)(O)C(O)COP(OP(OCC(O1)C(C(C1n(c2)c(n3)c(c(N)nc3)n2)O)O)(O)=O)(O)=O","InChI=1S/C27H33N9O15P2/c1-10-3-12-13(4-11(10)2)35(24-18(32-12)25(42)34-27(43)33-24)5-14(37)19(39)15(38)6-48-52(44,45)51-53(46,47)49-7-16-20(40)21(41)26(50-16)36-9-31-17-22(28)29-8-30-23(17)36/h3-4,8-9,14-16,19-21,26,37-41H,5-7H2,1-2H3,(H,44,45)(H,46,47)(H2,28,29,30)(H,34,42,43)/t14-,15+,16+,19-,20+,21+,26+/m0/s1","VWWQXMAJTJZDQX-UYBVJOGSSA-N"
"OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1N(C=2)C(=O)N=C(N)C2","InChI=1S/C9H13N3O5/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8/h1-2,4,6-8,13-15H,3H2,(H2,10,11,16)/t4-,6-,7-,8-/m1/s1","UHDGCWIWMRVCDJ-XVFCMESISA-N"
"OC(=O)[C@@H](N)CCSC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)/t6-,7+,9+,10+,13+/m0/s1","ZJUKTBDSGOFHSH-WFMPWKQPSA-N"
"NC(=O)C(C5)=CN(C=C5)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OC[C@@H](O2)[C@@H](O)[C@@H](O)[C@@H]2n(c4)c(n3)c(n4)c(N)nc3)1","InChI=1S/C21H29N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1,3-4,7-8,10-11,13-16,20-21,29-32H,2,5-6H2,(H2,23,33)(H,34,35)(H,36,37)(H2,22,24,25)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1","BOPGDPNILDQYTO-NNYOXOHSSA-N"
"O[C@@H](O1)[C@H](O)[C@@H](O)[C@H](O)[C@H]1COP(O)(O)=O","InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6+/m1/s1","NBSCHQHZLSJFNQ-DVKNGEFBSA-N"
"OCC(O)C(O)C(O)C(O)C(O)=O","InChI=1S/C6H12O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-5,7-11H,1H2,(H,12,13)","RGHNJXZEOKUKBD-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)C1OP(O)(O)=O","InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1","HXXFSFRBOHSIMQ-VFUOTHLCSA-N"
"OC[C@@](O)(O1)[C@@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6-/m1/s1","BGWGXPAPYGQALX-ARQDHWQXSA-N"
"O[C@H](COP(O)(O)=O)C(O)=O","InChI=1S/C3H7O7P/c4-2(3(5)6)1-10-11(7,8)9/h2,4H,1H2,(H,5,6)(H2,7,8,9)/t2-/m1/s1","OSJPPGNTCRNQQC-UWTATZPHSA-N"
"Nc(n3)c(n2)c(nc3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(O)=O)1","InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1","XTWYTFMLZFPYCI-KQYNXXCUSA-N"
"C1CCN2C[C@@H]3C[C@@H](CN4CCCC[C@H]34)[C@@H]2C1","InChI=1S/C15H26N2/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17/h12-15H,1-11H2/t12-,13-,14-,15+/m0/s1","SLRCCWJSBJZJBV-ZQDZILKHSA-N"
"C=CC[C@@H]1NCC2CC1CN1[C@@H]2CCCC1=O","InChI=1S/C14H22N2O/c1-2-4-12-11-7-10(8-15-12)13-5-3-6-14(17)16(13)9-11/h2,10-13,15H,1,3-9H2/t10?,11?,12-,13+/m0/s1","VTIPIBIDDZPDAV-IFWUJCSASA-N"
"OC[C@@H]1CCCN2CCCC[C@H]12","InChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10+/m0/s1","HDVAWXXJVMJBAR-VHSXEESVSA-N"
"C1CCN2CC3CC(C2C1)CN4C3CCCC4=O","InChI=1S/C15H24N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h11-14H,1-10H2","JYIJIIVLEOETIQ-UHFFFAOYSA-N"
"C1C[C@@H]2[C@H]3C[C@@H](CN2C(=O)C1)[C@@H]4C[C@H](CCN4C3)O","InChI=1S/C15H24N2O2/c18-12-4-5-16-8-10-6-11(14(16)7-12)9-17-13(10)2-1-3-15(17)19/h10-14,18H,1-9H2/t10-,11-,12-,13+,14-/m0/s1","JVYKIBAJVKEZSQ-YHQUGGNUSA-N"
"CN(C)CC1=CNC2=CC=CC=C12","InChI=1S/C11H14N2/c1-13(2)8-9-7-12-11-6-4-3-5-10(9)11/h3-7,12H,8H2,1-2H3","OCDGBSUVYYVKQZ-UHFFFAOYSA-N"
"CO[C@H](C)[C@@](O)(C(C)C)C(=O)OCC1=CCN2CC[C@H](O)[C@@H]12","InChI=1S/C16H27NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11-,13+,14-,16+/m1/s1","LMFKRLGHEKVMNT-UJDVCPFMSA-N"
"C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23","InChI=1S/C16H23NO6/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3/t9-,11+,12+,15+,16-/m0/s1","QVCMHGGNRFRMAD-XFGHUUIASA-N"
"C\C=C1\C[C@@H](C)[C@@](C)(O)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23","InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-/m1/s1","HKODIGSRFALUTA-JTLQZVBZSA-N"
"C[C@H]1C(=O)O[C@@H]2CCN3(=O)CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23","InChI=1S/C16H23NO7/c1-9-13(18)24-11-5-7-17(22)6-4-10(12(11)17)8-23-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3/t9-,11+,12+,15+,16-,17?/m0/s1","LHVAZUAALQTANZ-ANYXPJNNSA-N"
"CC=C1CC2(C(O2)(C(=O)OCC3=CCN4C3C(CC4)OC1=O)C)CO","InChI=1S/C18H23NO6/c1-3-11-8-18(10-20)17(2,25-18)16(22)23-9-12-4-6-19-7-5-13(14(12)19)24-15(11)21/h3-4,13-14,20H,5-10H2,1-2H3","NOQVBHHOUTTZGE-UHFFFAOYSA-N"
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"CC(=O)N[C@H]1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC","InChI=1S/C22H25NO6/c1-12(24)23-16-8-6-13-10-19(27-3)21(28-4)22(29-5)20(13)14-7-9-18(26-2)17(25)11-15(14)16/h7,9-11,16H,6,8H2,1-5H3,(H,23,24)/t16-/m0/s1","IAKHMKGGTNLKSZ-INIZCTEOSA-N"
"C/C=C(/C)\C(=O)O[C@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)OC)(C(C)(C)O)O","InChI=1S/C21H33NO7/c1-7-13(2)18(23)29-16-9-11-22-10-8-15(17(16)22)12-28-19(24)21(26,14(3)27-6)20(4,5)25/h7-8,14,16-17,25-26H,9-12H2,1-6H3/b13-7-/t14-,16-,17+,21-/m0/s1","QHOZSLCIKHUPSU-LPLKQDONSA-N"
"C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C)OC1","InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1","WQLVFSAGQJTQCK-VKROHFNGSA-N"
"CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O","InChI=1S/C29H36O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,17-19,21-22,24,31-33,36H,11-13H2,1-5H3/t17-,18-,19+,21+,22-,24-,27+,28-,29+/m0/s1","YWLXLRUDGLRYDR-ZHPRIASZSA-N"
"C[C@H]1[C@@H]([C@H](C[C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]4[C@@H]3CC[C@]5([C@@]4(C[C@@H]([C@@H]5C6=CC(=O)OC6)OC(=O)C)O)C)C)OC)O","InChI=1S/C32H48O9/c1-17-29(35)24(37-5)14-27(39-17)41-21-8-10-30(3)20(13-21)6-7-23-22(30)9-11-31(4)28(19-12-26(34)38-16-19)25(40-18(2)33)15-32(23,31)36/h12,17,20-25,27-29,35-36H,6-11,13-16H2,1-5H3/t17-,20+,21-,22-,23+,24-,25-,27-,28-,29-,30-,31+,32-/m0/s1","JLPDBLFIVFSOCC-XYXFTTADSA-N"
"COc1ccc2c(c1)[nH]c3c2CCN4[C@@H]3C[C@H]5[C@@H](C4)C[C@H]([C@@H]([C@H]5C(=O)OC)OC)OC(=O)c6cc(c(c(c6)OC)OC)OC","InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1","QEVHRUUCFGRFIF-MDEJGZGSSA-N"
"CN1CCC[C@H]1c2cccnc2","InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1","SNICXCGAKADSCV-JTQLQIEISA-N"
"C/C/1=C\CC/C(=C/[C@@H]2[C@@H](CC1)C(=C)C(=O)O2)/C","InChI=1S/C15H20O2/c1-10-5-4-6-11(2)9-14-13(8-7-10)12(3)15(16)17-14/h5,9,13-14H,3-4,6-8H2,1-2H3/b10-5+,11-9+/t13-,14+/m0/s1","HRYLQFBHBWLLLL-AHNJNIBGSA-N"
"C[C@H]1[C@@H]2CC[C@]3(C=CC(=O)C(=C3[C@H]2OC1=O)C)C","InChI=1S/C15H18O3/c1-8-10-4-6-15(3)7-5-11(16)9(2)12(15)13(10)18-14(8)17/h5,7-8,10,13H,4,6H2,1-3H3/t8-,10-,13-,15-/m0/s1","XJHDMGJURBVLLE-BOCCBSBMSA-N"
"C1C[C@@H]2[C@H]3CCCN4[C@H]3[C@@H](CCC4)CN2C(=O)C1","InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-/m0/s1","ZSBXGIUJOOQZMP-JLNYLFASSA-N"
"CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)[C@H](CO)c3ccccc3","InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16-/m1/s1","RKUNBYITZUJHSG-FXUDXRNXSA-N"
"C[C@@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@@H](CC2)O)O)O","InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12+,13+,15-/m0/s1","SFVVQRJOGUKCEG-ZGFBFQLVSA-N"
"C[C@H]([C@@](C(C)C)(C(=O)OCC1=CC[N+]2([C@H]1[C@@H](CC2)O)[O-])O)O","InChI=1S/C15H25NO6/c1-9(2)15(20,10(3)17)14(19)22-8-11-4-6-16(21)7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12-,13-,15+,16?/m1/s1","DNAWGBOKUFFVMB-JXSDSIQZSA-N"
"C[C@H]([C@@](C(C)C)(C(=O)OCC1=CC[N+]2([C@H]1[C@H](CC2)O)[O-])O)OC","InChI=1S/C16H27NO6/c1-10(2)16(20,11(3)22-4)15(19)23-9-12-5-7-17(21)8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11-,13+,14-,16+,17?/m1/s1","QSTHEUSPIBEICI-MCAMCBDESA-N"
"C[C@@H]1[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC(=O)C1=C)(C)O)C","InChI=1S/C18H25NO5/c1-10-11(2)16(20)24-14-6-8-19-7-5-13(15(14)19)9-23-17(21)18(4,22)12(10)3/h5,10,12,14-15,22H,2,6-9H2,1,3-4H3/t10-,12+,14+,15+,18+/m0/s1","FLUOSFVUPTUYEX-QHOAOGIMSA-N"
"C[C@@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@@H](CC2)OC(=O)C)O)O","InChI=1S/C17H27NO6/c1-10(2)17(22,11(3)19)16(21)23-9-13-5-7-18-8-6-14(15(13)18)24-12(4)20/h5,10-11,14-15,19,22H,6-9H2,1-4H3/t11-,14+,15+,17-/m0/s1","RKDOFSJTBIDAHX-OFSOMGBPSA-N"
"C/C=C/1\CC(=C)[C@@](C(=O)OCC2=CC[N+]3([C@H]2[C@@H](CC3)OC1=O)[O-])(C)O","InChI=1S/C18H23NO6/c1-4-12-9-11(2)18(3,22)17(21)24-10-13-5-7-19(23)8-6-14(15(13)19)25-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4+/t14-,15-,18-,19?/m1/s1","COHUFMBRBUPZPA-HPHFTHPTSA-N"
"CC1C(C(C(=O)OCC2=CC[N+]3(C2C(CC3)OC(=O)C1=C)[O-])(C)O)C","InChI=1S/C18H25NO6/c1-10-11(2)16(20)25-14-6-8-19(23)7-5-13(15(14)19)9-24-17(21)18(4,22)12(10)3/h5,10,12,14-15,22H,2,6-9H2,1,3-4H3","GDDNFNQRHNCJAZ-UHFFFAOYSA-N"
"COC(=O)[C@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3c4c(c5ccccc5[nH]4)CCN3C2)O","InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15-,17-,18-,19+/m0/s1","BLGXFZZNTVWLAY-SCYLSFHTSA-N"
"C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CC[N@@+]3([C@H]2[C@@H](CC3)OC1=O)[O-])(CO)O)C","InChI=1S/C18H25NO7/c1-3-12-8-11(2)18(23,10-20)17(22)25-9-13-4-6-19(24)7-5-14(15(13)19)26-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14-,15-,18-,19-/m1/s1","IDIMIWQPUHURPV-BJODLBMNSA-N"
"C[C@@H]1CC[C@@]2([C@H]([C@H]3[C@@H](O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC=C6[C@@]5(CC[C@@H](C6)O)C)C)C)NC1","InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1","KWVISVAMQJWJSZ-VKROHFNGSA-N"
"CC(C)(CCC[C@@](CC(=O)OC)(C(=O)O[C@H]1[C@H]2c3cc4c(cc3CCN5[C@@]2(CCC5)C=C1OC)OCO4)O)O","InChI=1S/C29H39NO9/c1-27(2,33)8-5-10-29(34,16-23(31)36-4)26(32)39-25-22(35-3)15-28-9-6-11-30(28)12-7-18-13-20-21(38-17-37-20)14-19(18)24(25)28/h13-15,24-25,33-34H,5-12,16-17H2,1-4H3/t24-,25-,28+,29-/m1/s1","HYFHYPWGAURHIV-JFIAXGOJSA-N"
"CN(C)CCc1ccc(cc1)O","InChI=1S/C10H15NO/c1-11(2)8-7-9-3-5-10(12)6-4-9/h3-6,12H,7-8H2,1-2H3","KUBCEEMXQZUPDQ-UHFFFAOYSA-N"
"C1C[C@H]2CN3[C@H](CC=CC3=O)[C@@H]4[C@H]2N(C1)CCC4","InChI=1S/C15H22N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h1,7,11-13,15H,2-6,8-10H2/t11-,12+,13+,15-/m0/s1","AAGFPTSOPGCENQ-JLNYLFASSA-N"
"COc1ccc(cc1)c2coc3cc(ccc3c2=O)O","InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3","HKQYGTCOTHHOMP-UHFFFAOYSA-N"
"CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)C(CO)c3ccccc3","InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16?","RKUNBYITZUJHSG-SPUOUPEWSA-N"
"C[C@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@@H](CC2)O)O)O","InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12-,13-,15+/m1/s1","SFVVQRJOGUKCEG-OPQSFPLASA-N"
"C[C@@H]([C@@](C(C)C)(C(=O)OCC1=CC[N+]2([C@H]1[C@@H](CC2)O)[O-])O)O","InChI=1S/C15H25NO6/c1-9(2)15(20,10(3)17)14(19)22-8-11-4-6-16(21)7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10-,12+,13+,15-,16?/m0/s1","DNAWGBOKUFFVMB-FVZLBROTSA-N"
"CN1C[C@@]2([C@@H]3[C@H]1[C@@H]4C2CC([C@@]35c6ccccc6NC5=O)OC4)C=C","InChI=1S/C20H22N2O2/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23)/t11-,13?,15?,16+,17-,19-,20-/m0/s1","NFYYATWFXNPTRM-XXVYUQGQSA-N"
"C/C=C\1/CC(=C)[C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(C)O","InChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3/b12-4-/t14-,15-,18-/m1/s1","FCEVNJIUIMLVML-QPSVUOIXSA-N"
"CC(=CCC1=C(C=C(C2=C1O[C@@H](CC2=O)C3=CC=C(C=C3)O)O)O)C","InChI=1S/C20H20O5/c1-11(2)3-8-14-15(22)9-16(23)19-17(24)10-18(25-20(14)19)12-4-6-13(21)7-5-12/h3-7,9,18,21-23H,8,10H2,1-2H3/t18-/m0/s1","LPEPZZAVFJPLNZ-SFHVURJKSA-N"
"C/C=C\1/C[C@@]2([C@@](O2)(C(=O)OCC3=CCN4[C@H]3[C@@H](CC4)OC1=O)C)CO","InChI=1S/C18H23NO6/c1-3-11-8-18(10-20)17(2,25-18)16(22)23-9-12-4-6-19-7-5-13(14(12)19)24-15(11)21/h3-4,13-14,20H,5-10H2,1-2H3/b11-3-/t13-,14-,17+,18+/m1/s1","NOQVBHHOUTTZGE-LUZNJDLOSA-N"
"C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CC[N+]3([C@H]2[C@@H](CC3)OC1=O)[O-])(C)O)C","InChI=1S/C18H25NO6/c1-4-12-9-11(2)18(3,22)17(21)24-10-13-5-7-19(23)8-6-14(15(13)19)25-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-,19?/m1/s1","PLGBHVNNYDZWGZ-GPUZEBNTSA-N"
"COC1=C(C2=C(C[C@@H]3C4=CC(=C(C=C4CCN3C2)OC)OC)C=C1)OC","InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3/t17-/m1/s1","AEQDJSLRWYMAQI-QGZVFWFLSA-N"
"C/C=C(/C)\C(=O)O[C@@H]1CCN2[C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)O)(C(C)(C)O)O","InChI=1S/C20H31NO7/c1-6-12(2)17(23)28-15-8-10-21-9-7-14(16(15)21)11-27-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13-,15+,16+,20-/m0/s1","HRSGCYGUWHGOPY-LYHHMGRNSA-N"
"C/C=C(/C)\C(=O)O[C@@H]1CC[N+]2([C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)O)(C(C)(C)O)O)[O-]","InChI=1S/C20H31NO8/c1-6-12(2)17(23)29-15-8-10-21(27)9-7-14(16(15)21)11-28-18(24)20(26,13(3)22)19(4,5)25/h6-7,13,15-16,22,25-26H,8-11H2,1-5H3/b12-6-/t13-,15+,16+,20-,21?/m0/s1","KDJGEXAPDZNXSD-KCFAIRMISA-N"
"C/C=C(/C)\C(=O)O[C@H]1CC[N+]2([C@@H]1C(=CC2)COC(=O)[C@@]([C@H](C)OC)(C(C)(C)O)O)[O-]","InChI=1S/C21H33NO8/c1-7-13(2)18(23)30-16-9-11-22(27)10-8-15(17(16)22)12-29-19(24)21(26,14(3)28-6)20(4,5)25/h7-8,14,16-17,25-26H,9-12H2,1-6H3/b13-7-/t14-,16-,17+,21-,22?/m0/s1","AABILZKQMVKFHP-LRBDFNDQSA-N"
"CCN1C[C@@]2([C@@H](C[C@@H]([C@@]34[C@@H]2[C@H]([C@@H](C31)[C@@]5([C@@H]6[C@H]4C[C@@]([C@@H]6OC(=O)C7=CC=CC=C7)([C@H]([C@@H]5O)OC)O)OC(=O)C)OC)OC)O)COC","InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26?,27+,28-,29+,31+,32-,33+,34-/m1/s1","XFSBVAOIAHNAPC-XTHSEXKGSA-N"
"CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1OC(=O)[C@@H]([C@H](C5=CC=CC=C5)NC(=O)C6=CC=CC=C6)O)O)OC(=O)C7=CC=CC=C7)(CO4)OC(=O)C)O)C)OC(=O)C","InChI=1S/C47H51NO14/c1-25-31(60-43(56)36(52)35(28-16-10-7-11-17-28)48-41(54)29-18-12-8-13-19-29)23-47(57)40(61-42(55)30-20-14-9-15-21-30)38-45(6,32(51)22-33-46(38,24-58-33)62-27(3)50)39(53)37(59-26(2)49)34(25)44(47,4)5/h7-21,31-33,35-38,40,51-52,57H,22-24H2,1-6H3,(H,48,54)/t31-,32-,33+,35-,36+,37+,38-,40-,45+,46-,47+/m0/s1","RCINICONZNJXQF-MZXODVADSA-N"
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"CCCCCC1=CC(=O)C=C(C1=O)OC","InChI=1S/C12H16O3/c1-3-4-5-6-9-7-10(13)8-11(15-2)12(9)14/h7-8H,3-6H2,1-2H3","WLWIMKWZMGJRBS-UHFFFAOYSA-N"
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"C1CN2CC3=CC4=C(C=C3[C@H]5[C@H]2C1=C[C@@H]([C@H]5O)O)OCO4","InChI=1S/C16H17NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h3-5,11,14-16,18-19H,1-2,6-7H2/t11-,14-,15+,16+/m0/s1","XGVJWXAYKUHDOO-DANNLKNASA-N"
"CN1CCc2cc(c(c-3c2[C@H]1Cc4c3cccc4)OC)OC","InChI=1S/C19H21NO2/c1-20-9-8-13-11-16(21-2)19(22-3)18-14-7-5-4-6-12(14)10-15(20)17(13)18/h4-7,11,15H,8-10H2,1-3H3/t15-/m1/s1","ORJVQPIHKOARKV-OAHLLOKOSA-N"
"CN1[C@@H]2C[C@H](C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)c4ccccc4","InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11-,12-,13-,14+,15-,16+/m1/s1","STECJAGHUSJQJN-FWXGHANASA-N"
"C[C@H]([C@@](C(C)C)(C(=O)OCC1=CCN2[C@H]1[C@H](CC2)O)O)OC","InChI=1S/C16H27NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11-,13+,14-,16+/m1/s1","LMFKRLGHEKVMNT-UJDVCPFMSA-N"
"COc1cc2c(c3c1c(=O)c4c(cccc4o3)O)[C@@H]5C=CO[C@@H]5O2","InChI=1S/C18H12O6/c1-21-11-7-12-13(8-5-6-22-18(8)24-12)17-15(11)16(20)14-9(19)3-2-4-10(14)23-17/h2-8,18-19H,1H3/t8-,18+/m0/s1","UTSVPXMQSFGQTM-DCXZOGHSSA-N"
"C[C@@H]([C@](C(=O)OCC1=CCN2[C@H]1[C@H](CC2)O)(C(C)(C)O)O)OC","InChI=1S/C16H27NO6/c1-10(22-4)16(21,15(2,3)20)14(19)23-9-11-5-7-17-8-6-12(18)13(11)17/h5,10,12-13,18,20-21H,6-9H2,1-4H3/t10-,12-,13+,16-/m0/s1","ZNEMYFCJOCCUJN-VFFTVRQLSA-N"
"c1ccc2c(c1)[C@]34CCN5[C@H]3C[C@@H]6[C@@H]7[C@@H]4N2C(=O)C[C@@H]7OCC=C6C5","InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1","QMGVPVSNSZLJIA-FVWCLLPLSA-N"
"CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=C3C(=C(C=C4)OC)O)OC)OC","InChI=1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3/t13-/m0/s1","QELDJEKNFOQJOY-ZDUSSCGKSA-N"
"C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H](CC3)OC1=O)(CO)O)C","InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14-,15-,18-/m1/s1","BCJMNZRQJAVDLD-CQRYIUNCSA-N"
"C[C@H]1[C@H]2CN3CCc4c5ccccc5[nH]c4[C@@H]3C[C@@H]2C(=CO1)C(=O)OC","InChI=1S/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3/t12-,15-,16+,19-/m0/s1","GRTOGORTSDXSFK-XJTZBENFSA-N"
"CC[C@@]12CCCN3[C@@H]1C4=C(CC3)C5=CC=CC=C5N4[C@](C2)(C(=O)OC)O","InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3/t18-,20+,21+/m1/s1","RXPRRQLKFXBCSJ-GIVPXCGWSA-N"
"COc1cc2c(cc1OC)N3C4[C@]25CCN6[C@H]5C[C@@H]7[C@H]4C(CC3=O)OCC=C7C6","InChI=1S/C23H26N2O4/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3/t13-,18?,19-,21-,22?,23+/m0/s1","RRKTZKIUPZVBMF-PLNGPGDESA-N"
"C[C@H]1C[C@@H]2[C@H]([C@H]([C@]3(O2)CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@@]6([C@H]5C(=O)C4=C3C)C)O)C)NC1","InChI=1S/C27H39NO3/c1-14-11-21-24(28-13-14)16(3)27(31-21)10-8-19-20-6-5-17-12-18(29)7-9-26(17,4)23(20)25(30)22(19)15(27)2/h5,14,16,18-21,23-24,28-29H,6-13H2,1-4H3/t14-,16+,18-,19-,20-,21+,23+,24-,26-,27-/m0/s1","CLEXYFLHGFJONT-DNMILWOZSA-N"
"C/C=C(/C)\C(=O)O[C@H]1CC[C@]2([C@H]3[C@@]1(O[C@@]24C[C@]5([C@@H]6CN7C[C@H](CC[C@H]7[C@@]([C@]6([C@H](C[C@]5([C@@H]4CC3)O)O)O)(C)O)C)O)O)C","InChI=1S/C32H49NO9/c1-6-18(3)25(35)41-24-11-12-26(4)19-8-9-20-28(37)13-23(34)31(39)21(29(28,38)16-30(20,26)42-32(19,24)40)15-33-14-17(2)7-10-22(33)27(31,5)36/h6,17,19-24,34,36-40H,7-16H2,1-5H3/b18-6-/t17-,19-,20-,21-,22-,23-,24-,26-,27+,28+,29+,30+,31-,32-/m0/s1","DBUCFOVFALNEOO-HWBIYQLFSA-N"
"CC(C)[C@@H]1C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N([C@H](C(=O)O1)Cc2ccccc2)C)C(C)C)Cc3ccccc3)C)C(C)C)Cc4ccccc4)C","InChI=1S/C45H57N3O9/c1-28(2)37-40(49)46(7)35(26-32-21-15-11-16-22-32)44(53)56-39(30(5)6)42(51)48(9)36(27-33-23-17-12-18-24-33)45(54)57-38(29(3)4)41(50)47(8)34(43(52)55-37)25-31-19-13-10-14-20-31/h10-24,28-30,34-39H,25-27H2,1-9H3/t34-,35-,36-,37+,38+,39+/m0/s1","GYSCAQFHASJXRS-FFCOJMSVSA-N"
"C=CC1CNC(=S)O1","InChI=1S/C5H7NOS/c1-2-4-3-6-5(8)7-4/h2,4H,1,3H2,(H,6,8)","UZQVYLOFLQICCT-UHFFFAOYSA-N"
"OC1=CC(=O)C2=CC=CC=C2O1","InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,11H","OWBBAPRUYLEWRR-UHFFFAOYSA-N"
"COC1=C(OC)C(O)=C2OC(=O)C=CC2=C1","InChI=1S/C11H10O5/c1-14-7-5-6-3-4-8(12)16-10(6)9(13)11(7)15-2/h3-5,13H,1-2H3","QNFBKOHHLAWWTC-UHFFFAOYSA-N"
"OC1=CC(O)=C2C(OC(=O)C=C2C2=CC=CC=C2)=C1","InChI=1S/C15H10O4/c16-10-6-12(17)15-11(9-4-2-1-3-5-9)8-14(18)19-13(15)7-10/h1-8,16-17H","HUQKUJNSVHEHIH-UHFFFAOYSA-N"
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"OC[C@H]1O[C@@H](OC2=CC(O)=C3C(=O)C=C(OC3=C2)C2=CC=C(O)C=C2)[C@H](O[C@@H]2OC[C@](O)(CO)[C@H]2O)[C@@H](O)[C@@H]1O","InChI=1S/C26H28O14/c27-8-18-20(32)21(33)22(40-25-23(34)26(35,9-28)10-36-25)24(39-18)37-13-5-14(30)19-15(31)7-16(38-17(19)6-13)11-1-3-12(29)4-2-11/h1-7,18,20-25,27-30,32-35H,8-10H2/t18-,20-,21+,22-,23+,24-,25+,26-/m1/s1","NTDLXWMIWOECHG-YRCFQSNFSA-N"
"CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C(O)=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3","IKGXIBQEEMLURG-UHFFFAOYSA-N"
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"NC1=C2N=CNC2=NC=N1","InChI=1S/C5H5N5/c6-4-3-5(9-1-7-3)10-2-8-4/h1-2H,(H3,6,7,8,9,10)","GFFGJBXGBJISGV-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)C1=C(O)C(=O)C2=C(O)C=C(O)C=C2O1","InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H","IYRMWMYZSQPJKC-UHFFFAOYSA-N"
"C1[C@H]2CNC[C@@H]1C3=CC=CC(=O)N3C2","InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2/t8-,9+/m0/s1","ANJTVLIZGCUXLD-DTWKUNHWSA-N"
"CC[C@H]1[C@H](COC1=O)Cc2cncn2C","InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8-,10-/m0/s1","QCHFTSOMWOSFHM-WPRPVWTQSA-N"
"CC1O[C@@H](OC2=CC(O)=C3C(=O)C(O[C@@H]4OC(C)[C@H](O)C(O)[C@@H]4O)=C(OC3=C2)C2=CC=C(O)C=C2)C(O)[C@@H](O)[C@H]1O","InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3/t9?,10?,17-,18-,20-,21?,22?,23-,26-,27-/m0/s1","PUPKKEQDLNREIM-YMCFDUETSA-N"
"","InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18-,19+,20-,21+,22+,24+,25-/m1/s1","YXZVCZUDUJEPPK-IZZHPKMPSA-N"
"","InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18+,19+,20-,21+,22+,24+,25-/m1/s1","YXZVCZUDUJEPPK-NLCUXKGASA-N"
"","InChI=1S/C25H42O3/c1-16(8-11-22(27)28-4)18-9-10-19-23-20(12-14-25(18,19)3)24(2)13-6-5-7-17(24)15-21(23)26/h16-21,23,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20+,21-,23+,24+,25-/m1/s1","SLMFZEZJHJUPDN-DZRFFRGESA-N"
"","InChI=1S/C25H42O3/c1-16(8-11-22(27)28-4)18-9-10-19-23-20(12-14-25(18,19)3)24(2)13-6-5-7-17(24)15-21(23)26/h16-21,23,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20+,21+,23+,24+,25-/m1/s1","SLMFZEZJHJUPDN-LILYDYCDSA-N"
"","InChI=1S/C25H42O3/c1-16(8-13-23(27)28-4)19-11-12-20-18-10-9-17-7-5-6-14-24(17,2)21(18)15-22(26)25(19,20)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18+,19-,20+,21+,22+,24+,25-/m1/s1","FKEDTKXWEOKYFM-JMJUXQCLSA-N"
"","InChI=1S/C25H42O3/c1-16(8-13-23(27)28-4)19-11-12-20-18-10-9-17-7-5-6-14-24(17,2)21(18)15-22(26)25(19,20)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18+,19-,20+,21+,22-,24+,25-/m1/s1","FKEDTKXWEOKYFM-OCZXYDQXSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17-,18-,19+,20+,21-,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-WKMGUUQUSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17+,18-,19+,20+,21-,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-FSRREMSASA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17-,18-,19+,20+,21+,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-SWRVAOPOSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17+,18-,19+,20+,21+,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-OYXAOJMWSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16+,17-,18+,19-,20+,21+,22+,24+,25-/m1/s1","ZHUOOEGSSFNTNP-YUOXLNDWSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16+,17+,18+,19-,20+,21+,22+,24+,25-/m1/s1","ZHUOOEGSSFNTNP-YAAGUFSRSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16+,17-,18+,19-,20+,21+,22-,24+,25-/m1/s1","ZHUOOEGSSFNTNP-HUNMOIQUSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16+,17+,18+,19-,20+,21+,22-,24+,25-/m1/s1","ZHUOOEGSSFNTNP-WUSWSPBQSA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-GIYPMICSSA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19+,20+,21+,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-UKBQWIIISA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19+,20-,21-,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-ULLNIBHSSA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19+,20+,21-,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-KSDNDYNGSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-ALWRDVSSSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16-,17-,18+,19+,20-,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-VTZVKVOJSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16-,17-,18+,19+,20+,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-NBGUEMFKSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16+,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-SIIRNWGXSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16-,17-,18+,19+,20+,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-NAWWTTLBSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16+,17-,18+,19+,20-,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-POLYPNRQSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16+,17-,18+,19+,20+,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-VGYPDWFLSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15-,16+,17-,18+,19+,20+,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-FBNWQFKWSA-N"
"","InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18-,19+,20-,21+,22+,24+,25-/m1/s1","YXZVCZUDUJEPPK-ULCLHEGSSA-N"
"","InChI=1S/C25H42O3/c1-16(5-10-23(27)28-4)20-8-9-21-19-7-6-17-15-18(26)11-13-24(17,2)22(19)12-14-25(20,21)3/h16-22,26H,5-15H2,1-4H3/t16-,17-,18+,19+,20-,21+,22+,24+,25-/m1/s1","YXZVCZUDUJEPPK-ARCWCCGYSA-N"
"","InChI=1S/C25H42O3/c1-16(8-13-23(27)28-4)19-11-12-20-18-10-9-17-7-5-6-14-24(17,2)21(18)15-22(26)25(19,20)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18+,19-,20+,21+,22+,24+,25-/m1/s1","FKEDTKXWEOKYFM-HFCBJCDPSA-N"
"","InChI=1S/C25H42O3/c1-16(8-13-23(27)28-4)19-11-12-20-18-10-9-17-7-5-6-14-24(17,2)21(18)15-22(26)25(19,20)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18+,19-,20+,21+,22-,24+,25-/m1/s1","FKEDTKXWEOKYFM-VPXJZYEMSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20+,21+,22+,24+,25-/m1/s1","ZHUOOEGSSFNTNP-JMKDMENQSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17+,18+,19-,20+,21+,22+,24+,25-/m1/s1","ZHUOOEGSSFNTNP-WIQCXVCASA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17-,18+,19-,20+,21+,22-,24+,25-/m1/s1","ZHUOOEGSSFNTNP-QFSGMOSZSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-23(28)29-4)19-8-9-20-18-7-6-16-13-17(26)11-12-24(16,2)21(18)14-22(27)25(19,20)3/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17+,18+,19-,20+,21+,22-,24+,25-/m1/s1","ZHUOOEGSSFNTNP-PLQQDRFXSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21-,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-IFJDUOSNSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-AMRVJQGXSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21+,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-ZQMFMVRBSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21+,23+,24+,25-/m1/s1","GRQROVWZGGDYSW-LWNNJCQBSA-N"
"","InChI=1S/C25H42O3/c1-16(8-11-22(27)28-4)18-9-10-19-23-20(12-14-25(18,19)3)24(2)13-6-5-7-17(24)15-21(23)26/h16-21,23,26H,5-15H2,1-4H3/t16-,17+,18-,19+,20+,21-,23+,24+,25-/m1/s1","SLMFZEZJHJUPDN-IGANSQQNSA-N"
"","InChI=1S/C25H42O3/c1-16(8-11-22(27)28-4)18-9-10-19-23-20(12-14-25(18,19)3)24(2)13-6-5-7-17(24)15-21(23)26/h16-21,23,26H,5-15H2,1-4H3/t16-,17+,18-,19+,20+,21+,23+,24+,25-/m1/s1","SLMFZEZJHJUPDN-VKFOQVEHSA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-KGFCUSQPSA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18+,19+,20+,21+,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-UGBWVQFXSA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18+,19+,20-,21-,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-KKXJSBRXSA-N"
"","InChI=1S/C25H42O4/c1-15(8-11-22(28)29-4)17-9-10-18-23-19(14-21(27)25(17,18)3)24(2)12-6-5-7-16(24)13-20(23)26/h15-21,23,26-27H,5-14H2,1-4H3/t15-,16+,17-,18+,19+,20+,21-,23+,24+,25-/m1/s1","XPMSMFOWYBQWHS-KQLZVSNCSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-SRNOMOOLSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20-,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-IORFIOCPSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20+,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-GVFWELEYSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16+,17-,18+,19+,20-,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-RMPHWFMRSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16-,17-,18+,19+,20+,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-MEAQBNKYSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16+,17-,18+,19+,20-,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-HLFBMUMPSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16+,17-,18+,19+,20+,21+,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-JNCYXBDVSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-22(29)30-4)17-6-7-18-23-19(13-21(28)25(17,18)3)24(2)10-9-16(26)11-15(24)12-20(23)27/h14-21,23,26-28H,5-13H2,1-4H3/t14-,15+,16+,17-,18+,19+,20+,21-,23+,24+,25-/m1/s1","DLYVTEULDNMQAR-AAXWLKRGSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-23(28)29-4)18-6-7-19-17-14-22(27)21-13-16(26)9-11-25(21,3)20(17)10-12-24(18,19)2/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17+,18-,19+,20+,21-,22+,24-,25-/m1/s1","BWDRDVHYVJQWBO-FUWIEVQRSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-23(28)29-4)18-6-7-19-17-14-22(27)21-13-16(26)9-11-25(21,3)20(17)10-12-24(18,19)2/h15-22,26-27H,5-14H2,1-4H3/t15-,16-,17+,18-,19+,20+,21-,22-,24-,25-/m1/s1","BWDRDVHYVJQWBO-MDNFQYQZSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-23(28)29-4)18-6-7-19-17-14-22(27)21-13-16(26)9-11-25(21,3)20(17)10-12-24(18,19)2/h15-22,26-27H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,22+,24-,25-/m1/s1","BWDRDVHYVJQWBO-JKZXFRSXSA-N"
"","InChI=1S/C25H42O4/c1-15(5-8-23(28)29-4)18-6-7-19-17-14-22(27)21-13-16(26)9-11-25(21,3)20(17)10-12-24(18,19)2/h15-22,26-27H,5-14H2,1-4H3/t15-,16+,17+,18-,19+,20+,21-,22-,24-,25-/m1/s1","BWDRDVHYVJQWBO-MGUHFAAZSA-N"
"","InChI=1S/C25H42O3/c1-16(8-11-23(27)28-4)18-9-10-19-17-15-22(26)21-7-5-6-13-24(21,2)20(17)12-14-25(18,19)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18-,19+,20+,21-,22+,24-,25-/m1/s1","MOPCJIIMYLCQCF-IFIJBTQOSA-N"
"","InChI=1S/C25H42O3/c1-16(8-11-23(27)28-4)18-9-10-19-17-15-22(26)21-7-5-6-13-24(21,2)20(17)12-14-25(18,19)3/h16-22,26H,5-15H2,1-4H3/t16-,17+,18-,19+,20+,21-,22-,24-,25-/m1/s1","MOPCJIIMYLCQCF-UETNCTRESA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15-,16-,17+,18+,19+,21+,22-,23+,24-,25-/m1/s1","ZODJZVRYUQWYON-QFFHYBKKSA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15-,16-,17+,18+,19+,21+,22-,23-,24-,25-/m1/s1","ZODJZVRYUQWYON-OAQHTDLISA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15-,16-,17+,18+,19+,21+,22+,23+,24-,25-/m1/s1","ZODJZVRYUQWYON-BGUMXIOESA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15-,16-,17+,18+,19+,21+,22+,23-,24-,25-/m1/s1","ZODJZVRYUQWYON-OPKNLNMWSA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15+,16-,17+,18+,19+,21+,22-,23+,24-,25-/m1/s1","ZODJZVRYUQWYON-MJCINFFDSA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15+,16-,17+,18+,19+,21+,22-,23-,24-,25-/m1/s1","ZODJZVRYUQWYON-IFWOPCKJSA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15+,16-,17+,18+,19+,21+,22+,23+,24-,25-/m1/s1","ZODJZVRYUQWYON-ZFSISXKUSA-N"
"C(C32[H])(O)C(C(C(C2([H])CCC(C([H])(C(C)CCC(=O)OC)4)(C3([H])CC4)C)(C)1)([H])CC(O)CC1)O","InChI=1S/C25H42O5/c1-14(5-8-20(27)30-4)16-6-7-17-21-18(10-12-24(16,17)2)25(3)11-9-15(26)13-19(25)22(28)23(21)29/h14-19,21-23,26,28-29H,5-13H2,1-4H3/t14-,15+,16-,17+,18+,19+,21+,22+,23-,24-,25-/m1/s1","ZODJZVRYUQWYON-GBIHIIGWSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-22(27)29-4)17-8-9-18-16-6-7-20-23(28)21(26)12-14-25(20,3)19(16)11-13-24(17,18)2/h15-21,23,26,28H,5-14H2,1-4H3/t15-,16+,17-,18+,19+,20-,21-,23-,24-,25-/m1/s1","BJTZAKSSYSISDQ-NTMHHKLKSA-N"
"","InChI=1S/C25H42O5/c1-14(5-10-22(28)30-4)16-8-9-17-15-6-7-18-23(29)20(26)11-12-24(18,2)19(15)13-21(27)25(16,17)3/h14-21,23,26-27,29H,5-13H2,1-4H3/t14-,15+,16-,17+,18-,19+,20-,21+,23-,24+,25-/m1/s1","MTRCPXDXXWWCKT-MQGFRRQESA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-21(28)30-4)15-6-7-16-22-17(9-11-24(15,16)2)25(3)12-10-19(26)23(29)18(25)13-20(22)27/h14-20,22-23,26-27,29H,5-13H2,1-4H3/t14-,15-,16+,17+,18-,19-,20-,22+,23-,24-,25-/m1/s1","BPLRQLCQZUEYNH-WHUWPRSFSA-N"
"","InChI=1S/C25H42O6/c1-13(5-8-21(29)31-4)14-6-7-15-22-16(12-20(28)25(14,15)3)24(2)10-9-18(26)23(30)17(24)11-19(22)27/h13-20,22-23,26-28,30H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18-,19-,20+,22+,23-,24-,25-/m1/s1","SIAXNMMFZGXYTK-AHTUSHBZSA-N"
"","InChI=1S/C25H42O4/c1-15(5-10-22(27)29-4)17-8-9-18-16-6-7-20-23(28)21(26)12-14-25(20,3)19(16)11-13-24(17,18)2/h15-21,23,26,28H,5-14H2,1-4H3/t15-,16+,17-,18+,19+,20-,21+,23-,24-,25-/m1/s1","BJTZAKSSYSISDQ-UGYUPSKXSA-N"
"","InChI=1S/C25H42O5/c1-14(5-10-22(28)30-4)16-8-9-17-15-6-7-18-23(29)20(26)11-12-24(18,2)19(15)13-21(27)25(16,17)3/h14-21,23,26-27,29H,5-13H2,1-4H3/t14-,15+,16-,17+,18-,19+,20+,21+,23-,24+,25-/m1/s1","MTRCPXDXXWWCKT-MLUDQODMSA-N"
"","InChI=1S/C25H42O5/c1-14(5-8-21(28)30-4)15-6-7-16-22-17(9-11-24(15,16)2)25(3)12-10-19(26)23(29)18(25)13-20(22)27/h14-20,22-23,26-27,29H,5-13H2,1-4H3/t14-,15-,16+,17+,18-,19+,20-,22+,23-,24-,25-/m1/s1","BPLRQLCQZUEYNH-HSPVUHCXSA-N"
"","InChI=1S/C25H42O6/c1-13(5-8-21(29)31-4)14-6-7-15-22-16(12-20(28)25(14,15)3)24(2)10-9-18(26)23(30)17(24)11-19(22)27/h13-20,22-23,26-28,30H,5-12H2,1-4H3/t13-,14-,15+,16+,17-,18+,19-,20+,22+,23-,24-,25-/m1/s1","SIAXNMMFZGXYTK-HRCKCGQDSA-N"
"","InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19-,20+,21+,23+,24-/m1/s1","SMEROWZSTRWXGI-HVATVPOCSA-N"
"","InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17+,18+,19-,20+,21+,23+,24-/m1/s1","SMEROWZSTRWXGI-WFVDQZAMSA-N"
"","InChI=1S/C24H40O3/c1-15(7-10-21(26)27)17-8-9-18-22-19(11-13-24(17,18)3)23(2)12-5-4-6-16(23)14-20(22)25/h15-20,22,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17-,18+,19+,20-,22+,23+,24-/m1/s1","JVMCMMXFADJQKU-MMSVWBHPSA-N"
"","InChI=1S/C24H40O3/c1-15(7-10-21(26)27)17-8-9-18-22-19(11-13-24(17,18)3)23(2)12-5-4-6-16(23)14-20(22)25/h15-20,22,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17-,18+,19+,20+,22+,23+,24-/m1/s1","JVMCMMXFADJQKU-KEUPPCRPSA-N"
"","InChI=1S/C24H40O3/c1-15(7-12-22(26)27)18-10-11-19-17-9-8-16-6-4-5-13-23(16,2)20(17)14-21(25)24(18,19)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17+,18-,19+,20+,21+,23+,24-/m1/s1","OBUOWZOYJNAMCZ-VSRDABHLSA-N"
"","InChI=1S/C24H40O3/c1-15(7-12-22(26)27)18-10-11-19-17-9-8-16-6-4-5-13-23(16,2)20(17)14-21(25)24(18,19)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17+,18-,19+,20+,21-,23+,24-/m1/s1","OBUOWZOYJNAMCZ-ORVKXXEISA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-BSWAIDMHSA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-UZVSRGJWSA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16+,17-,18+,19+,20-,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-JGFDLHJZSA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16+,17-,18+,19+,20+,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-DNMBCGTGSA-N"
"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1","KXGVEGMKQFWNSR-LLQZFEROSA-N"
"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18-,19+,20+,21-,23+,24-/m1/s1","KXGVEGMKQFWNSR-MFSKYVBHSA-N"
"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17+,18-,19+,20+,21+,23+,24-/m1/s1","KXGVEGMKQFWNSR-OFYXWCICSA-N"
"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17+,18-,19+,20+,21-,23+,24-/m1/s1","KXGVEGMKQFWNSR-BYGCHKRWSA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-QLEQUTGBSA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18+,19-,20-,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-CIKBIKKZSA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18+,19+,20+,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-BJMHMCHXSA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18+,19+,20-,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-RTHCORENSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-OELDTZBJSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19+,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-UTLSPDKDSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15+,16+,17-,18-,19+,20+,22-,23-,24+/m0/s1","BHQCQFFYRZLCQQ-IDIMTOGTSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19+,20-,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-BJOVICNYSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15+,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-UXWVVXDJSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15+,16-,17+,18+,19+,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-NSYKHXCCSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15+,16-,17+,18+,19-,20-,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-WZNOYYHXSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15+,16-,17+,18+,19+,20-,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-SHFFZNEJSA-N"
"","InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17-,18+,19-,20+,21+,23+,24-/m1/s1","SMEROWZSTRWXGI-NWFSOSCSSA-N"
"","InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17+,18+,19-,20+,21+,23+,24-/m1/s1","SMEROWZSTRWXGI-XBESLWPFSA-N"
"","InChI=1S/C24H40O3/c1-15(7-10-21(26)27)17-8-9-18-22-19(11-13-24(17,18)3)23(2)12-5-4-6-16(23)14-20(22)25/h15-20,22,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1","JVMCMMXFADJQKU-HELGRDCBSA-N"
"","InChI=1S/C24H40O3/c1-15(7-10-21(26)27)17-8-9-18-22-19(11-13-24(17,18)3)23(2)12-5-4-6-16(23)14-20(22)25/h15-20,22,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1","JVMCMMXFADJQKU-IOYWVCIASA-N"
"","InChI=1S/C24H40O3/c1-15(7-12-22(26)27)18-10-11-19-17-9-8-16-6-4-5-13-23(16,2)20(17)14-21(25)24(18,19)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1","OBUOWZOYJNAMCZ-SFDBLMKMSA-N"
"","InChI=1S/C24H40O3/c1-15(7-12-22(26)27)18-10-11-19-17-9-8-16-6-4-5-13-23(16,2)20(17)14-21(25)24(18,19)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17+,18-,19+,20+,21-,23+,24-/m1/s1","OBUOWZOYJNAMCZ-CRUIVANASA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-IKAPKQLESA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17-,18+,19+,20+,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-SHOXBNBYSA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20-,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-ZOMDUIRWSA-N"
"","InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,22+,23+,24-/m1/s1","RUDATBOHQWOJDD-IMRDPUKRSA-N"
"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18-,19+,20+,21+,23+,24-/m1/s1","KXGVEGMKQFWNSR-WFTUMUMQSA-N"
"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16+,17+,18-,19+,20+,21+,23+,24-/m1/s1","KXGVEGMKQFWNSR-UPSXFCICSA-N"
"","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16+,17+,18-,19+,20+,21-,23+,24-/m1/s1","KXGVEGMKQFWNSR-QVJCARKASA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-VKOHPBAUSA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18+,19-,20-,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-YYPSVLEDSA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18+,19+,20+,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-NGPAMCMXSA-N"
"","InChI=1S/C24H40O4/c1-14(7-10-21(27)28)16-8-9-17-22-18(13-20(26)24(16,17)3)23(2)11-5-4-6-15(23)12-19(22)25/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17+,18+,19+,20-,22+,23+,24-/m1/s1","ZHCAAZIHTDCFJX-JLXCKZAHSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-PGHAKIONSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15-,16-,17+,18+,19+,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-PWNRUWOFSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15-,16-,17+,18+,19-,20-,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-OFYMMLAUSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15-,16-,17+,18+,19+,20-,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-JWQTVRMOSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15+,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-OJGXVJBCSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15+,16-,17+,18+,19+,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-UEXPSFCYSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15+,16-,17+,18+,19-,20-,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-HZYSRDACSA-N"
"","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15+,16-,17+,18+,19+,20-,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-ODBXGGFUSA-N"
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"","InChI=1S/C24H40O5/c1-14(4-5-20(27)28)17-8-11-24(29)21-18(7-10-23(17,24)3)22(2)9-6-16(25)12-15(22)13-19(21)26/h14-19,21,25-26,29H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19-,21+,22+,23-,24-/m1/s1","OGSDYCPNYNWUNN-XJKBFLKTSA-N"
"","InChI=1S/C24H40O5/c1-14(4-5-20(27)28)17-8-11-24(29)21-18(7-10-23(17,24)3)22(2)9-6-16(25)12-15(22)13-19(21)26/h14-19,21,25-26,29H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,21+,22+,23-,24-/m1/s1","OGSDYCPNYNWUNN-QGGGRKECSA-N"
"","InChI=1S/C24H40O5/c1-13(4-5-20(28)29)17-12-19(27)22-21-16(7-9-24(17,22)3)23(2)8-6-15(25)10-14(23)11-18(21)26/h13-19,21-22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16+,17-,18-,19+,21+,22+,23+,24-/m1/s1","KAOKDEFHEADBNL-BLLLHDCFSA-N"
"","InChI=1S/C24H40O5/c1-13(4-5-20(28)29)17-12-19(27)22-21-16(7-9-24(17,22)3)23(2)8-6-15(25)10-14(23)11-18(21)26/h13-19,21-22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16+,17-,18-,19-,21+,22+,23+,24-/m1/s1","KAOKDEFHEADBNL-XCCGACRLSA-N"
"","InChI=1S/C24H40O5/c1-13(4-5-20(28)29)17-12-19(27)22-21-16(7-9-24(17,22)3)23(2)8-6-15(25)10-14(23)11-18(21)26/h13-19,21-22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16+,17-,18+,19-,21+,22+,23+,24-/m1/s1","KAOKDEFHEADBNL-IXFPQTCNSA-N"
"","InChI=1S/C24H40O5/c1-13(4-5-20(28)29)22-19(27)12-17-21-16(7-9-24(17,22)3)23(2)8-6-15(25)10-14(23)11-18(21)26/h13-19,21-22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16+,17+,18-,19-,21-,22+,23+,24+/m1/s1","PFMAXGIVRQIQPX-JSFQCDATSA-N"
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"","InChI=1S/C24H40O5/c1-14(4-5-20(27)28)24(29)11-8-18-21-17(7-10-23(18,24)3)22(2)9-6-16(25)12-15(22)13-19(21)26/h14-19,21,25-26,29H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17+,18+,19-,21-,22+,23+,24+/m1/s1","JSIQROACCRQDKK-GUDITCNYSA-N"
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"O=C(O)CNC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@]12C)[C@@]4(C)CC[C@@H](OS(=O)(=O)O)C[C@H]4C[C@@H]3O","InChI=1S/C26H43NO8S/c1-15(4-7-22(29)27-14-23(30)31)18-5-6-19-24-20(9-11-26(18,19)3)25(2)10-8-17(35-36(32,33)34)12-16(25)13-21(24)28/h15-21,24,28H,4-14H2,1-3H3,(H,27,29)(H,30,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20+,21+,24+,25+,26-/m1/s1","DKXXSIJHWWVNMO-XROMFQGDSA-N"
"C1C[C@@H](OS(=O)(=O)O)C[C@@]2([H])CC[C@@]3([H])[C@]4([H])CC[C@]([H])([C@H](C)CCC(=O)NCC(=O)O)[C@@]4(C)[C@@H](O)C[C@]3([H])[C@@]12C","InChI=1S/C26H43NO8S/c1-15(4-9-23(29)27-14-24(30)31)19-7-8-20-18-6-5-16-12-17(35-36(32,33)34)10-11-25(16,2)21(18)13-22(28)26(19,20)3/h15-22,28H,4-14H2,1-3H3,(H,27,29)(H,30,31)(H,32,33,34)/t15-,16-,17-,18+,19-,20+,21+,22+,25+,26-/m1/s1","QJZCNFGUZPMYAX-BUXLTGKBSA-N"
"C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)OS(=O)(=O)O)C)O)O)C","InChI=1S/C26H43NO9S/c1-14(4-7-22(30)27-13-23(31)32)17-5-6-18-24-19(12-21(29)26(17,18)3)25(2)9-8-16(36-37(33,34)35)10-15(25)11-20(24)28/h14-21,24,28-29H,4-13H2,1-3H3,(H,27,30)(H,31,32)(H,33,34,35)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1","ZXUWKFXQTSOVDY-FRVQLJSFSA-N"
"O=S(=O)(O)CCNC(=O)CC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC[C@@H]4C[C@@H](CC[C@]4(C)[C@H]3CC[C@]12C)OS(=O)(=O)O","InChI=1S/C26H45NO8S2/c1-17(4-9-24(28)27-14-15-36(29,30)31)21-7-8-22-20-6-5-18-16-19(35-37(32,33)34)10-12-25(18,2)23(20)11-13-26(21,22)3/h17-23H,4-16H2,1-3H3,(H,27,28)(H,29,30,31)(H,32,33,34)/t17-,18-,19-,20+,21-,22+,23+,25+,26-/m1/s1","HSNPMXROZIQAQD-GBURMNQMSA-N"
"C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2[C@H](C[C@H]4[C@@]3(CC[C@H](C4)OS(=O)(=O)O)C)O)C","InChI=1S/C26H45NO9S2/c1-16(4-7-23(29)27-12-13-37(30,31)32)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(36-38(33,34)35)14-17(25)15-22(24)28/h16-22,24,28H,4-15H2,1-3H3,(H,27,29)(H,30,31,32)(H,33,34,35)/t16-,17+,18-,19-,20+,21+,22+,24+,25+,26-/m1/s1","GLVWZDCWCRWVFM-LBSADWJPSA-N"
"C[C@H](CCC(=O)NCCS(=O)(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)OS(=O)(=O)O)C)O)C","InChI=1S/C26H45NO9S2/c1-16(4-9-24(29)27-12-13-37(30,31)32)20-7-8-21-19-6-5-17-14-18(36-38(33,34)35)10-11-25(17,2)22(19)15-23(28)26(20,21)3/h16-23,28H,4-15H2,1-3H3,(H,27,29)(H,30,31,32)(H,33,34,35)/t16-,17-,18-,19+,20-,21+,22+,23+,25+,26-/m1/s1","UCVGCHGIKFWAGH-VAYUFCLWSA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)CO)O)O[C@H]4[C@@H]([C@H]([C@H]([C@H](O4)CO)O)O[C@@]5(C[C@@H]([C@H]([C@@H](O5)C([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)NC(=O)C)O[C@@]6(C[C@@H]([C@H]([C@@H](O6)C([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)O)[C@@H](/C=C/CCCCCCCCCCCCC)O","InChI=1S/C86H152N4O39/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-60(105)90-50(51(100)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2)46-118-80-69(111)68(110)72(58(44-95)121-80)123-82-71(113)78(129-86(84(116)117)39-53(102)62(88-48(4)98)76(127-86)65(107)55(104)41-92)73(59(45-96)122-82)124-79-63(89-49(5)99)74(66(108)56(42-93)119-79)125-81-70(112)77(67(109)57(43-94)120-81)128-85(83(114)115)38-52(101)61(87-47(3)97)75(126-85)64(106)54(103)40-91/h34,36,50-59,61-82,91-96,100-104,106-113H,6-33,35,37-46H2,1-5H3,(H,87,97)(H,88,98)(H,89,99)(H,90,105)(H,114,115)(H,116,117)/b36-34+/t50-,51+,52-,53-,54+,55+,56+,57+,58+,59+,61+,62+,63+,64?,65?,66-,67-,68+,69+,70+,71+,72+,73-,74+,75+,76+,77-,78+,79-,80+,81-,82-,85-,86-/m0/s1","UPMLUBZFFWELOX-IOFMCULOSA-N"
"Nc(c21)c(c3)c(ccc3)nc(cccc2)1","InChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)","XJGFWWJLMVZSIG-UHFFFAOYSA-N"
"COc(c1)cc(C(O)=O)c(O)c1","InChI=1S/C8H8O4/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11)","IZZIWIAOVZOBLF-UHFFFAOYSA-N"
"OC(=O)c(n1)c(O)ccc1","InChI=1S/C6H5NO3/c8-4-2-1-3-7-5(4)6(9)10/h1-3,8H,(H,9,10)","BRARRAHGNDUELT-UHFFFAOYSA-N"
"CC(=O)c(c(O)1)c(O)cc(O)c1","InChI=1S/C8H8O4/c1-4(9)8-6(11)2-5(10)3-7(8)12/h2-3,10-12H,1H3","XLEYFDVVXLMULC-UHFFFAOYSA-N"
"Nc(n3)c(n2)c(nc3)n(c2)[C@]([H])(O1)[C@]([H])(O)[C@]([H])(O)[C@@]([H])(COP(O)(=O)OP(O)(=O)OP(O)(O)=O)1","InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1","ZKHQWZAMYRWXGA-KQYNXXCUSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(COOC(CC)(O3)C(O)C(O)C(CO)3)(O2)C(O)C(O)C(CO)2","InChI=1S/C19H34O16/c1-2-18(15(28)11(24)8(4-21)32-18)35-30-6-19(16(29)12(25)9(5-22)33-19)34-17-14(27)13(26)10(23)7(3-20)31-17/h7-17,20-29H,2-6H2,1H3/t7-,8-,9-,10-,11-,12-,13+,14-,15+,16+,17-,18+,19+/m1/s1","XMQMBYAYWCCFHQ-DPVQPYEZSA-N"
"OC(=O)c(n1)c(C(O)=O)n(C)c1","InChI=1S/C6H6N2O4/c1-8-2-7-3(5(9)10)4(8)6(11)12/h2H,1H3,(H,9,10)(H,11,12)","YARDQACXPOQDMO-UHFFFAOYSA-N"
"OC(=O)C(COP(O)(O)=O)OP(O)(O)=O","InChI=1S/C3H8O10P2/c4-3(5)2(13-15(9,10)11)1-12-14(6,7)8/h2H,1H2,(H,4,5)(H2,6,7,8)(H2,9,10,11)","XOHUEYCVLUUEJJ-UHFFFAOYSA-N"
"OC(=O)c(c1)c(O)c(O)cc1","InChI=1S/C7H6O4/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3,8-9H,(H,10,11)","GLDQAMYCGOIJDV-UHFFFAOYSA-N"
"C1=NC2=C(N1)C(=NC(=N2)N)N","InChI=1S/C5H6N6/c6-3-2-4(9-1-8-2)11-5(7)10-3/h1H,(H5,6,7,8,9,10,11)","MSSXOMSJDRHRMC-UHFFFAOYSA-N"
"OCC(O)C(O)C(O)C(=O)C(O)=O","InChI=1S/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-4,7-10H,1H2,(H,12,13)/t2-,3-,4+/m1/s1","VBUYCZFBVCCYFD-JJYYJPOSSA-N"
"OCC(O1)C(O)CC1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)/t5-,6-,7-/m1/s1","OLXZPDWKRNYJJZ-FSDSQADBSA-N"
"OCC(O1)C(O)C(O)CC(O)1","InChI=1S/C6H12O5/c7-2-4-6(10)3(8)1-5(9)11-4/h3-10H,1-2H2","PMMURAAUARKVCB-UHFFFAOYSA-N"
"OCC(O1)C(O)CC1n(c3)c(N=2)c(n3)C(=O)NC2","InChI=1S/C10H12N4O4/c15-2-6-5(16)1-7(18-6)14-4-13-8-9(14)11-3-12-10(8)17/h3-7,15-16H,1-2H2,(H,11,12,17)/t5-,6+,7+/m0/s1","VGONTNSXDCQUGY-RRKCRQDMSA-N"
"OC[C@@H](O1)[C@@H](O)C[C@@H]1N(C=2)C(=O)NC(=O)C2","InChI=1S/C9H12N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h1-2,5-6,8,12-13H,3-4H2,(H,10,14,15)/t5-,6+,8+/m0/s1","MXHRCPNRJAMMIM-SHYZEUOFSA-N"
"OC(=O)CCC(C)C(O)=O","InChI=1S/C6H10O4/c1-4(6(9)10)2-3-5(7)8/h4H,2-3H2,1H3,(H,7,8)(H,9,10)","AQYCMVICBNBXNA-UHFFFAOYSA-N"
"c(c2)ccc(c2)C(O)c(c1)ccc(Br)c1","InChI=1S/C13H11BrO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,13,15H","WTIWDBNPPSHSCB-UHFFFAOYSA-N"
"O=C(C=1)NC(=S)NC1","InChI=1S/C4H4N2OS/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)","ZEMGGZBWXRYJHK-UHFFFAOYSA-N"
"NC(C=1)CC(=CC1)C(O)=O","InChI=1S/C7H9NO2/c8-6-3-1-2-5(4-6)7(9)10/h1-3,6H,4,8H2,(H,9,10)","KFNRJXCQEJIBER-UHFFFAOYSA-N"
"NC(=O)NCCCCC(N)C(O)=O","InChI=1S/C7H15N3O3/c8-5(6(11)12)3-1-2-4-10-7(9)13/h5H,1-4,8H2,(H,11,12)(H3,9,10,13)/t5-/m0/s1","XIGSAGMEBXLVJJ-YFKPBYRVSA-N"
"Nc(c1)ncc(c1)C(O)=O","InChI=1S/C6H6N2O2/c7-5-2-1-4(3-8-5)6(9)10/h1-3H,(H2,7,8)(H,9,10)","ZCIFWRHIEBXBOY-UHFFFAOYSA-N"
"OC(=O)CC(C)(C)O","InChI=1S/C5H10O3/c1-5(2,8)3-4(6)7/h8H,3H2,1-2H3,(H,6,7)","AXFYFNCPONWUHW-UHFFFAOYSA-N"
"CCOC(=O)C(O)c(c1)ccc(O)c1","InChI=1S/C10H12O4/c1-2-14-10(13)9(12)7-3-5-8(11)6-4-7/h3-6,9,11-12H,2H2,1H3","VLOUFSKXRCPIQR-UHFFFAOYSA-N"
"Oc(c1)ccnc1","InChI=1S/C5H5NO/c7-5-1-3-6-4-2-5/h1-4H,(H,6,7)","GCNTZFIIOFTKIY-UHFFFAOYSA-N"
"OC(=O)C(O)(C1)CC(=O)C(O)C(O)1","InChI=1S/C7H10O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3,5,8,10,13H,1-2H2,(H,11,12)/t3-,5+,7-/m1/s1","WVMWZWGZRAXUBK-SYTVJDICSA-N"
"Oc(c1)cc(C(O)=O)c(N)c1","InChI=1S/C7H7NO3/c8-6-2-1-4(9)3-5(6)7(10)11/h1-3,9H,8H2,(H,10,11)","HYNQTSZBTIOFKH-UHFFFAOYSA-N"
"C1=CC2=C(C=C1O)C(=CN2)C[C@@H](C(=O)O)N","InChI=1S/C11H12N2O3/c12-9(11(15)16)3-6-5-13-10-2-1-7(14)4-8(6)10/h1-2,4-5,9,13-14H,3,12H2,(H,15,16)/t9-/m0/s1","LDCYZAJDBXYCGN-VIFPVBQESA-N"
"OCc(c1)c(O)nc(O)n1","InChI=1S/C5H6N2O3/c8-2-3-1-6-5(10)7-4(3)9/h1,8H,2H2,(H2,6,7,9,10)","JDBGXEHEIRGOBU-UHFFFAOYSA-N"
"OCC(O)C(O)C(O)C(=O)C(O)=O","InChI=1S/C6H10O7/c7-1-2(8)3(9)4(10)5(11)6(12)13/h2-4,7-10H,1H2,(H,12,13)/t2-,3+,4-/m1/s1","VBUYCZFBVCCYFD-FLRLBIABSA-N"
"Nc(s3)nc(c13)c(c2)c(ccc2)cc1","InChI=1S/C11H8N2S/c12-11-13-10-8-4-2-1-3-7(8)5-6-9(10)14-11/h1-6H,(H2,12,13)","FECQXVPRUCCUIL-UHFFFAOYSA-N"
"O=C(C=1)NC(=O)N(C)C(N)1","InChI=1S/C5H7N3O2/c1-8-3(6)2-4(9)7-5(8)10/h2H,6H2,1H3,(H,7,9,10)","GZLZRPNUDBIQBM-UHFFFAOYSA-N"
"CC(=O)Nc(c2)ccc(c2)OC(O1)C(O)C(O)C(O)C(C(O)=O)1","InChI=1S/C14H17NO8/c1-6(16)15-7-2-4-8(5-3-7)22-14-11(19)9(17)10(18)12(23-14)13(20)21/h2-5,9-12,14,17-19H,1H3,(H,15,16)(H,20,21)/t9-,10-,11+,12-,14+/m0/s1","IPROLSVTVHAQLE-BYNIDDHOSA-N"
"CC(=O)CC(O)=O","InChI=1S/C4H6O3/c1-3(5)2-4(6)7/h2H2,1H3,(H,6,7)","WDJHALXBUFZDSR-UHFFFAOYSA-N"
"OC(=O)CC(=CC(O)=O)C(O)=O","InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1-","GTZCVFVGUGFEME-IWQZZHSRSA-N"
"C[C@]12C[C@H]([C@@H]3C[C@]1([C@@]3(C(=O)O2)COC(=O)C4=CC=CC=C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O","InChI=1S/C23H28O11/c1-21-8-13(25)12-7-23(21,33-19-17(28)16(27)15(26)14(9-24)32-19)22(12,20(30)34-21)10-31-18(29)11-5-3-2-4-6-11/h2-6,12-17,19,24-28H,7-10H2,1H3/t12-,13+,14+,15+,16-,17+,19-,21-,22-,23-/m0/s1","QQUHMASGPODSIW-ICECTASOSA-N"
"OCC([H])(O)C(O1)C(O)=C(O)C(=O)1","InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1","CIWBSHSKHKDKBQ-JLAZNSOCSA-N"
"CC(O)C(O)c(c2)nc(C(=O)1)c(n2)N=C(N)N1","InChI=1S/C9H11N5O3/c1-3(15)6(16)4-2-11-7-5(12-4)8(17)14-9(10)13-7/h2-3,6,15-16H,1H3,(H3,10,11,13,14,17)/t3-,6-/m0/s1","LHQIJBMDNUYRAM-DZSWIPIPSA-N"
"OCC=Cc(c1)cc(OC)c(O)c1","InChI=1S/C10H12O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-5,7,11-12H,6H2,1H3/b3-2+","JMFRWRFFLBVWSI-NSCUHMNNSA-N"
"[H]C(=O)C=Cc(c1)cc(OC)c(O)c1","InChI=1S/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3/b3-2+","DKZBBWMURDFHNE-NSCUHMNNSA-N"
"c(c14)cccc1c(cc[n+1]4CCC(C)C)C=C(C=3)c(c2)c(N(C3)CCC(C)C)ccc2","InChI=1S/C29H35N2/c1-22(2)13-17-30-19-15-24(26-9-5-7-11-28(26)30)21-25-16-20-31(18-14-23(3)4)29-12-8-6-10-27(25)29/h5-12,15-16,19-23H,13-14,17-18H2,1-4H3/q+1","OPYVFVSPWOXGSM-UHFFFAOYSA-N"
"OC(=O)[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)C(O)1","InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)/t1-,2+,3+,4-,6?/m0/s1","AEMOLEFTQBMNLQ-YMDCURPLSA-N"
"Oc(c3)ccc(c3)C(=C1)C(=O)c(c2)c(cc(O)c2)O1","InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H","ZQSIJRDFPHDXIC-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)C(O)1","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4-,5-,6?/m1/s1","WQZGKKKJIJFFOK-IVMDWMLBSA-N"
"OS(=O)(=O)OC(C4)CC(=C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H28O5S/c1-18-9-7-13(24-25(21,22)23)11-12(18)3-4-14-15-5-6-17(20)19(15,2)10-8-16(14)18/h3,13-16H,4-11H2,1-2H3,(H,21,22,23)","CZWCKYRVOZZJNM-UHFFFAOYSA-N"
"O=C(N1)CC(NC(=O)1)C(O)=O","InChI=1S/C5H6N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h2H,1H2,(H,9,10)(H2,6,7,8,11)/t2-/m0/s1","UFIVEPVSAGBUSI-REOHCLBHSA-N"
"C1=CC=C2C(=C1)C=C(N2)CN","InChI=1S/C9H10N2/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-5,11H,6,10H2","RNAODKZCUVVPEN-UHFFFAOYSA-N"
"CCSCCC(N)C(O)=O","InChI=1S/C6H13NO2S/c1-2-10-4-3-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)","GGLZPLKKBSSKCX-UHFFFAOYSA-N"
"NC(CCS(O)(=O)=O)C(O)=O","InChI=1S/C4H9NO5S/c5-3(4(6)7)1-2-11(8,9)10/h3H,1-2,5H2,(H,6,7)(H,8,9,10)","VBOQYPQEPHKASR-UHFFFAOYSA-N"
"OC(=O)C(N)C(O)C(O)=O","InChI=1S/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)/t1-,2-/m1/s1","YYLQUHNPNCGKJQ-JCYAYHJZSA-N"
"OC(C1)C(O)C(O)C(O)O1","InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4+,5?/m0/s1","SRBFZHDQGSBBOR-AEQNFAKKSA-N"
"OC(=O)C(N)CCCC(N)C(O)=O","InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5+","GMKMEZVLHJARHF-SYDPRGILSA-N"
"O=CC(O)C(O)C([H])(C(O)CO)OC(O1)C(O)C(O)C(O)C(COC(O2)C(O)C(O)C(O)C(CO)2)1","InChI=1S/C18H32O16/c19-1-5(22)9(24)16(6(23)2-20)34-18-15(30)13(28)11(26)8(33-18)4-31-17-14(29)12(27)10(25)7(3-21)32-17/h1,5-18,20-30H,2-4H2/t5-,6+,7+,8+,9+,10+,11+,12-,13-,14+,15+,16+,17-,18+/m0/s1","ZCLAHGAZPPEVDX-MQHGYYCBSA-N"
"OCC(O)(O1)C(O)C(O)C1","InChI=1S/C5H10O5/c6-2-5(9)4(8)3(7)1-10-5/h3-4,6-9H,1-2H2/t3-,4-,5?/m1/s1","LQXVFWRQNMEDEE-ZZKAVYKESA-N"
"OCC(=O)C(O)C(O)COP(O)(O)=O","InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h4-6,8-9H,1-2H2,(H2,10,11,12)/t4-,5+/m1/s1","FNZLKVNUWIIPSJ-UHNVWZDZSA-N"
"OCC([H])(O)C([H])(O)C([H])(O)C([H])(O)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6-/m1/s1","FBPFZTCFMRRESA-JGWLITMVSA-N"
"OCC(O)C(O)C(O)C(=O)CO","InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5+,6-/m1/s1","BJHIKXHVCXFQLS-PQLUHFTBSA-N"
"OCC(O1)C(O)C(O)C(O)C([H])1OC(C(O)2)C(O)(CO)OCC(O)2","InChI=1S/C12H22O11/c13-1-5-7(17)8(18)9(19)11(22-5)23-10-6(16)4(15)2-21-12(10,20)3-14/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11-,12?/m1/s1","SEWFWJUQVJHATO-PUVWEJBASA-N"
"OCC(O)C(O)C(=O)CO","InChI=1S/C5H10O5/c6-1-3(8)5(10)4(9)2-7/h3,5-8,10H,1-2H2/t3-,5+/m1/s1","ZAQJHHRNXZUBTE-WUJLRWPWSA-N"
"Cc(c2)ccc(c2)NS(=O)(=O)c(c1)cc(cc1)N(=O)=O","InChI=1S/C13H12N2O4S/c1-10-5-7-11(8-6-10)14-20(18,19)13-4-2-3-12(9-13)15(16)17/h2-9,14H,1H3","ORIAXWVUHQXKKI-UHFFFAOYSA-N"
"CCc(c1)c(c2)c(ccc2)cc1","InChI=1S/C12H12/c1-2-10-7-5-8-11-6-3-4-9-12(10)11/h3-9H,2H2,1H3","ZMXIYERNXPIYFR-UHFFFAOYSA-N"
"Oc(c3)c(O)cc(c3)C([H])(O1)C([H])(O)Cc(c(O)2)c(cc(O)c2)1","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1","PFTAWBLQPZVEMU-UKRRQHHQSA-N"
"C[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)C(O)1","InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m1/s1","SHZGCJCMOBCMKK-SVZMEOIVSA-N"
"OCC([H])(O)C([H])(O)C([H])(O)C([H])(O)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5+,6-","FBPFZTCFMRRESA-GUCUJZIJSA-N"
"Oc(c3)ccc(c3)C(=C1)C(=O)c(c(O)2)c(cc(O)c2)O1","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H","TZBJGXHYKVUXJN-UHFFFAOYSA-N"
"OCC(O)C(O)C(O)C(O)C=O","InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4+,5+,6+/m1/s1","GZCGUPFRVQAUEE-VANKVMQKSA-N"
"[H]C([H])(O)C([H])(O)C=O","InChI=1S/C3H6O3/c4-1-3(6)2-5/h1,3,5-6H,2H2","MNQZXJOMYWMBOU-UHFFFAOYSA-N"
"OCC(CO)OP(O)(O)=O","InChI=1S/C3H9O6P/c4-1-3(2-5)9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)","DHCLVCXQIBBOPH-UHFFFAOYSA-N"
"ON=CCOC(C)=O","InChI=1S/C4H7NO3/c1-4(6)8-3-2-5-7/h2,7H,3H2,1H3/b5-2+","GFLRGQMBJYFKBZ-GORDUTHDSA-N"
"C1=C(NC=N1)C[C@@H](C(=O)O)O","InChI=1S/C6H8N2O3/c9-5(6(10)11)1-4-2-7-3-8-4/h2-3,5,9H,1H2,(H,7,8)(H,10,11)/t5-/m0/s1","ACZFBYCNAVEFLC-YFKPBYRVSA-N"
"C1=CC=C2C(=C1)C(=CN2)CC(O)S(=O)(=O)O","InChI=1S/C10H11NO4S/c12-10(16(13,14)15)5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,10-12H,5H2,(H,13,14,15)","AGASQWULIFZUOK-UHFFFAOYSA-N"
"OCC(O)C(O)C(C(O)CO)OC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8-,9-,10+,11+,12-/m0/s1","VQHSOMBJVWLPSR-JVCRWLNRSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(CO)2)C(O)C(O)C(O)O2","InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10-,11-,12+/m1/s1","GUBGYTABKSRVRQ-DCSYEGIMSA-N"
"NC(C(O)=O)CS(O)(=O)=O","InChI=1S/C3H7NO5S/c4-2(3(5)6)1-10(7,8)9/h2H,1,4H2,(H,5,6)(H,7,8,9)/t2-/m0/s1","XVOYSCVBGLVSOL-REOHCLBHSA-N"
"OCC(O)C(O1)C(O)C(O)C(=O)1","InChI=1S/C6H10O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2-5,7-10H,1H2","SXZYCXMUPBBULW-UHFFFAOYSA-N"
"[H]C(C)(O)C(O)=O","InChI=1S/C3H6O3/c1-2(4)3(5)6/h2,4H,1H3,(H,5,6)/t2-/m0/s1","JVTAAEKCZFNVCJ-REOHCLBHSA-N"
"CN(C4)CCN(C4)C(=C1)n(c32)c(nc(cccc3)2)C(C#N)=C(C)1","InChI=1S/C18H19N5/c1-13-11-17(22-9-7-21(2)8-10-22)23-16-6-4-3-5-15(16)20-18(23)14(13)12-19/h3-6,11H,7-10H2,1-2H3","VNYWJJHYUBPQIA-UHFFFAOYSA-N"
"OC(=O)CCC(NCCCCC(N)C(O)=O)C(O)=O","InChI=1S/C11H20N2O6/c12-7(10(16)17)3-1-2-6-13-8(11(18)19)4-5-9(14)15/h7-8,13H,1-6,12H2,(H,14,15)(H,16,17)(H,18,19)/t7-,8-/m0/s1","ZDGJAHTZVHVLOT-YUMQZZPRSA-N"
"OCC(O)C(O)C(O)C(=O)CO","InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5+,6+/m0/s1","BJHIKXHVCXFQLS-OTWZMJIISA-N"
"C(C2)CN(C2)CCSc(c1)cccc1","InChI=1S/C12H17NS/c1-2-6-12(7-3-1)14-11-10-13-8-4-5-9-13/h1-3,6-7H,4-5,8-11H2","MRRDGEBLFSXZBU-UHFFFAOYSA-N"
"OCC(O)C(O)C([H])(C(O)CO)OC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C12H24O11/c13-1-4(16)7(18)11(5(17)2-14)23-12-10(21)9(20)8(19)6(3-15)22-12/h4-21H,1-3H2/t4-,5+,6+,7+,8+,9-,10+,11+,12+/m0/s1","VQHSOMBJVWLPSR-WUJBLJFYSA-N"
"OCC(O)C(O)C(O)C(O)C=O","InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2/t3-,4-,5-,6-/m1/s1","GZCGUPFRVQAUEE-KVTDHHQDSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@@H]([C@H](O)3)[C@@](CO)(O[C@H](CO)3)O[C@@H](O2)[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)2","InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-15-10(25)7(3-21)33-18(15,4-22)34-17-14(29)12(27)9(24)6(2-20)31-17/h5-17,19-29H,1-4H2/t5-,6-,7-,8-,9-,10-,11+,12+,13-,14-,15+,16-,17-,18+/m1/s1","QWIZNVHXZXRPDR-WSCXOGSTSA-N"
"OC(=O)C(C)(N)Cc(c1)cc(O)c(O)c1","InChI=1S/C10H13NO4/c1-10(11,9(14)15)5-6-2-3-7(12)8(13)4-6/h2-4,12-13H,5,11H2,1H3,(H,14,15)/t10-/m0/s1","CJCSPKMFHVPWAR-JTQLQIEISA-N"
"CCC=CCC(C(=O)1)C(CC1)CC(=O)OC","InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4+/t10-,11+/m0/s1","GEWDNTWNSAZUDX-BXXZLRJFSA-N"
"NC(=O)NC(CC(O)=O)C(O)=O","InChI=1S/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)","HLKXYZVTANABHZ-UHFFFAOYSA-N"
"O=CNCC(O)=O","InChI=1S/C3H5NO3/c5-2-4-1-3(6)7/h2H,1H2,(H,4,5)(H,6,7)","UGJBHEZMOKVTIM-UHFFFAOYSA-N"
"CNCCO","InChI=1S/C3H9NO/c1-4-2-3-5/h4-5H,2-3H2,1H3","OPKOKAMJFNKNAS-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCCCCC(O)=O","InChI=1S/C28H56O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h2-27H2,1H3,(H,29,30)","UTOPWMOLSKOLTQ-UHFFFAOYSA-N"
"O=C(N1)C=C(NC(=O)1)C(O)=O","InChI=1S/C5H4N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11)","PXQPEWDEAKTCGB-UHFFFAOYSA-N"
"OC(=O)CCC(=O)OCCC(N)C(O)=O","InChI=1S/C8H13NO6/c9-5(8(13)14)3-4-15-7(12)2-1-6(10)11/h5H,1-4,9H2,(H,10,11)(H,13,14)/t5-/m0/s1","GNISQJGXJIDKDJ-YFKPBYRVSA-N"
"NC(=O)C(N)=O","InChI=1S/C2H4N2O2/c3-1(5)2(4)6/h(H2,3,5)(H2,4,6)","YIKSCQDJHCMVMK-UHFFFAOYSA-N"
"[H]C(=O)c(c1)ccc(O)c1","InChI=1S/C7H6O2/c8-5-6-1-3-7(9)4-2-6/h1-5,9H","RGHHSNMVTDWUBI-UHFFFAOYSA-N"
"COc(c(OC)5)cc(cc(OC)5)C(c21)C([H])(C(=O)4)C([H])(CO4)C(O)c(cc(O3)c(OC3)c2)1","InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13-,18+,19-,20-/m0/s1","YJGVMLPVUAXIQN-XVVDYKMHSA-N"
"OC(C=1)C=CC(C1)(C(O)=O)CC(=O)C(O)=O","InChI=1S/C10H10O6/c11-6-1-3-10(4-2-6,9(15)16)5-7(12)8(13)14/h1-4,6,11H,5H2,(H,13,14)(H,15,16)","FPWMCUPFBRFMLH-UHFFFAOYSA-N"
"OCC(O)C(O)C(O)C(=O)CO","InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5-9,11-12H,1-2H2/t3-,5-,6+/m1/s1","BJHIKXHVCXFQLS-PUFIMZNGSA-N"
"OP(O)(=O)OP(O)(O)=O","InChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)","XPPKVPWEQAFLFU-UHFFFAOYSA-N"
"OC(COP(O)(O)=O)C(O)C(=O)COP(O)(O)=O","InChI=1S/C5H12O11P2/c6-3(1-15-17(9,10)11)5(8)4(7)2-16-18(12,13)14/h3,5-6,8H,1-2H2,(H2,9,10,11)(H2,12,13,14)","YAHZABJORDUQGO-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c(O)3)C(=O)CC1c(c2)ccc(O)c2","InChI=1S/C16H14O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-7,14,17-18H,8H2,1H3/t14-/m0/s1","DJOJDHGQRNZXQQ-AWEZNQCLSA-N"
"OCc(c2)c(ccc2)OC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C13H18O7/c14-5-7-3-1-2-4-8(7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1","NGFMICBWJRZIBI-UJPOAAIJSA-N"
"OC(=O)C(N)CSCc(c1)cccc1","InChI=1S/C10H13NO2S/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)","GHBAYRBVXCRIHT-UHFFFAOYSA-N"
"[H]C(=O)C=Cc(c1)cc(OC)c(O)c(OC)1","InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3/b4-3+","CDICDSOGTRCHMG-ONEGZZNKSA-N"
"C=CCC(=NOS(O)(=O)=O)SC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C10H17NO9S2/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18)/t5-,7-,8+,9-,10+/m1/s1","PHZOWSSBXJXFOR-HOQQJHGQSA-N"
"OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(N2)c(n3)C(=O)NC(=O)2","InChI=1S/C10H12N4O6/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19)/t3-,5-,6-,9-/m1/s1","UBORTCNDUKBEOP-UUOKFMHZSA-N"
"OC(C1)C(O)C(O)C(O)O1","InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2/t2-,3+,4-,5+/m1/s1","SRBFZHDQGSBBOR-LECHCGJUSA-N"
"CNCC([H])(N)C(O)=O","InChI=1S/C4H10N2O2/c1-6-2-3(5)4(7)8/h3,6H,2,5H2,1H3,(H,7,8)/t3-/m0/s1","UJVHVMNGOZXSOZ-VKHMYHEASA-N"
"SC[C@@H](C(O)=O)NC(=O)CC[C@H](N)C(O)=O","InChI=1S/C8H14N2O5S/c9-4(7(12)13)1-2-6(11)10-5(3-16)8(14)15/h4-5,16H,1-3,9H2,(H,10,11)(H,12,13)(H,14,15)/t4-,5-/m0/s1","RITKHVBHSGLULN-WHFBIAKZSA-N"
"CC(C4)(C(CC(O)C4)=3)C(C2)C(CC3)C(C1)C(C)(C2)C(C(C)CCCC(C)C)C1","InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19?,21-,22?,23?,24?,25?,26?,27?/m0/s1","HVYWMOMLDIMFJA-LBHVWCRMSA-N"
"C(C)(C1)(C(C(C)CCCC(C)C)4)C(CC4)C(C2)C(C(C)(C3)C([H])(CC(C3)O)C2)C1","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19?,20-,21+,22?,23?,24?,25?,26?,27?/m1/s1","QYIXCDOBOSTCEI-WXXXDBQUSA-N"
"CC(C4)(C(CC(O)C4)3)C(C2)C(CC3)C(C1)C(C)(C2)C(C(C)CCCC(C)C)C1","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3","QYIXCDOBOSTCEI-UHFFFAOYSA-N"
"C(C)(C1)(C(C(C)CCCC(C)C)4)C(CC4)C(C2)C(C(C)(C3)C([H])(CC(C3)=O)C2)C1","InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-20,22-25H,6-17H2,1-5H3/t19?,20-,22?,23?,24?,25?,26?,27?/m1/s1","PESKGJQREUXSRR-JAGYRSRJSA-N"
"C(C)(C1)(C(C(C)CCCC(C)C)4)C(CC4)C(C2)C(C(C)(C3)C([H])(CC(C3)O)C2)C1","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19?,20-,21-,22?,23?,24?,25?,26?,27?/m0/s1","QYIXCDOBOSTCEI-JKUMBUQESA-N"
"[H]C(C([H])23)(CCC(C)(C4C(C)CCC(C(C)C)CC)C(CC4)3[H])C(C(CC2)1[H])(CCC(O)C1)C","InChI=1S/C29H52O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-27,30H,7-18H2,1-6H3/t20-,21+,22-,23-,24+,25?,26+,27+,28+,29-/m1/s1","LGJMUZUPVCAVPU-RFCGSYLUSA-N"
"O=C(C=4)C=C(C3)C(C)(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H24O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h7,9,11,14-16H,3-6,8,10H2,1-2H3/t14-,15-,16-,18-,19-/m0/s1","LUJVUUWNAPIQQI-QAGGRKNESA-N"
"C(C4)C(C(CC4O)=3)(C(C(CC3)2)CCC(C21)(C(CC1)C(C)CCC(C(C)C)CC)C)C","InChI=1S/C29H50O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-21,23-27,30H,7-9,11-18H2,1-6H3/t20?,21?,23-,24?,25?,26?,27?,28?,29?/m0/s1","KZJWDPNRJALLNS-GDQWMHGZSA-N"
"C(C4)C(C(CC4O)3)(C(C(CC3)2)CCC(C21)(C(CC1)C(C)CCC(C(C)C)CC)C)C","InChI=1S/C29H52O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-27,30H,7-18H2,1-6H3/t20?,21?,22?,23-,24?,25?,26?,27?,28?,29?/m0/s1","LGJMUZUPVCAVPU-BYKIICAPSA-N"
"OC(C4)CC(=C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3/t13-,14?,15?,16?,18?,19?/m0/s1","FMGSKLZLMKYGDP-IHFGAHDLSA-N"
"C(C34[H])(CCC(O)C4)(C([H])(C([H])2CC3)CCC(C([H])12)(C)C(CC1)([H])C(CCC(C(C)C)CC)C)C","InChI=1S/C29H52O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h19-27,30H,7-18H2,1-6H3/t20-,21+,22-,23+,24+,25-,26+,27+,28+,29-/m1/s1","LGJMUZUPVCAVPU-RMEUMSAISA-N"
"O=C(C4)C=C(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C1","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14?,15?,16?,17-,18?,19?/m0/s1","MUMGGOZAMZWBJJ-YDJBNQETSA-N"
"Oc(c4)cc(C3)c(c4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C1","InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14?,15?,16?,17-,18?/m1/s1","VOXZDWNPVJITMN-AWDGRILASA-N"
"C(C(C=CC(C)C(C4)C(C3C4)(C)CCC(C13)C(C2)(C(CC(C2)O)=CC1)C)C)(C)C","InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22-26,29H,10-17H2,1-6H3/b8-7+/t19?,20?,22-,23?,24?,25?,26?,27?,28?/m0/s1","OILXMJHPFNGGTO-FQRXBOAXSA-N"
"Oc(c4)cc(C3)c(c4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C(O)1","InChI=1S/C18H24O3/c1-18-7-6-13-12-5-3-11(19)8-10(12)2-4-14(13)15(18)9-16(20)17(18)21/h3,5,8,13-17,19-21H,2,4,6-7,9H2,1H3/t13?,14?,15?,16-,17+,18?/m1/s1","PROQIPRRNZUXQM-SBZGPEHISA-N"
"O=C(C4)CC([H])(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C1","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14?,15?,16?,17+,18?,19?/m1/s1","NVKAWKQGWWIWPM-NOLKSFPRSA-N"
"OC(C4)CC([H])(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C1","InChI=1S/C19H32O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-17,20-21H,3-11H2,1-2H3/t12-,13-,14?,15?,16?,17+,18?,19?/m1/s1","CBMYJHIOYJEBSB-GCFMDFLISA-N"
"C(C)(C1)(C(C(C)CCCC(C)C)4)C(CC4)C(C2)C(C(C)(C3)C([H])(CC(C3)O)C2)C1","InChI=1S/C27H48O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-25,28H,6-17H2,1-5H3/t19?,20-,21+,22?,23?,24?,25?,26?,27?/m0/s1","QYIXCDOBOSTCEI-LNXFVTSZSA-N"
"C(C(CCC(C)C(C4)C(C3C4)(C)CCC(C13)C(C2)(C(CC(C2)O)=CC1)C)C)(C)C","InChI=1S/C28H48O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h9,18-20,22-26,29H,7-8,10-17H2,1-6H3/t19?,20?,22-,23?,24?,25?,26?,27?,28?/m0/s1","SGNBVLSWZMBQTH-FEGPEKPQSA-N"
"Oc(c4)cc(C3)c(c4)C(C2)C(C3)C(C1)C(C)(C2)C(O)(C#C)C1","InChI=1S/C20H24O2/c1-3-20(22)11-9-18-17-6-4-13-12-14(21)5-7-15(13)16(17)8-10-19(18,20)2/h1,5,7,12,16-18,21-22H,4,6,8-11H2,2H3","BFPYWIDHMRZLRN-UHFFFAOYSA-N"
"C(C(C=CC(C)C(C4)C(C3C4)(C)CCC(C=13)C(C2)(C(CC(C2)O)=CC1)C)C)(C)C","InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-10,18-20,22,24-26,29H,11-17H2,1-6H3/b8-7+/t19?,20?,22-,24?,25?,26?,27?,28?/m0/s1","DNVPQKQSNYMLRS-CTZLKQLBSA-N"
"OC(C4)CC([H])(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14?,15?,16?,18?,19?/m0/s1","QGXBDMJGAMFCBF-CYFBJHQBSA-N"
"O=C(C4)C=C(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(C(C)=O)C1","InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3","RJKFOVLPORLFTN-UHFFFAOYSA-N"
"O=C(C4)CC([H])(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C1","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12,14-17,21H,3-11H2,1-2H3/t12-,14?,15?,16?,17-,18?,19?/m0/s1","NVKAWKQGWWIWPM-FMFZMMAASA-N"
"Oc(c4)cc(C3)c(c4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1","InChI=1S/C18H22O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-16,19H,2,4,6-9H2,1H3","DNXHEGUUPJUMQT-UHFFFAOYSA-N"
"OC(C4)CC([H])(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13+,14?,15?,16?,18?,19?/m0/s1","QGXBDMJGAMFCBF-LISVHTKMSA-N"
"O=C(C4)C=C(C3)C(C)(C4)C(C2)C(C3)C(C1)C(C)(C2)C(=O)C1","InChI=1S/C19H26O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-16H,3-10H2,1-2H3/t14?,15?,16?,18-,19-/m0/s1","AEMFNILZOJDQLW-WFZCBACDSA-N"
"C(C4)C(C(CC4O)=3)(C(C(CC3)2)CCC(C21)(C(CC1)C(C)C=CC(C(C)C)CC)C)C","InChI=1S/C29H48O/c1-7-21(19(2)3)9-8-20(4)25-12-13-26-24-11-10-22-18-23(30)14-16-28(22,5)27(24)15-17-29(25,26)6/h8-10,19-21,23-27,30H,7,11-18H2,1-6H3/b9-8+/t20?,21?,23-,24?,25?,26?,27?,28?,29?/m0/s1","HCXVJBMSMIARIN-WWUFFIEYSA-N"
"Oc(c4)cc(C3)c(c4)C(C2)C(C3)C(C1)C(C)(C2)C(O)C1","InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14?,15?,16?,17-,18?/m0/s1","VOXZDWNPVJITMN-LESVLKBLSA-N"
"CCOC(=O)C(C1)=CC(OC(CC)CC)C(NC(C)=O)C(N)1","InChI=1S/C16H28N2O4/c1-5-12(6-2)22-14-9-11(16(20)21-7-3)8-13(17)15(14)18-10(4)19/h9,12-15H,5-8,17H2,1-4H3,(H,18,19)/t13-,14+,15+/m0/s1","VSZGPKBBMSAYNT-RRFJBIMHSA-N"
"CCC(CC)OC(C=1)C(NC(C)=O)C(N)CC(C(O)=O)1","InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19)/t11-,12+,13+/m0/s1","NENPYTRHICXVCS-YNEHKIRRSA-N"
"FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-1(10,3(13,14)5(17,18)7(21,22)23)2(11,12)4(15,16)6(19,20)8(24,25)29(26,27)28/h(H,26,27,28)","YFSUTJLHUFNCNZ-UHFFFAOYSA-N"
"FC(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-1(6(18,19)20,7(21,22)23)2(10,11)3(12,13)4(14,15)5(16,17)8(24,25)29(26,27)28/h(H,26,27,28)","NIKYAXWJPSOKTP-UHFFFAOYSA-N"
"FC(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-1(6(18,19)20,3(12,13)7(21,22)23)2(10,11)4(14,15)5(16,17)8(24,25)29(26,27)28/h(H,26,27,28)","MLMPJIZPFXGYRO-UHFFFAOYSA-N"
"FC(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-1(6(18,19)20,2(10,11)4(14,15)7(21,22)23)3(12,13)5(16,17)8(24,25)29(26,27)28/h(H,26,27,28)","MDEVHGNTMAPDQA-UHFFFAOYSA-N"
"FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-1(6(18,19)20,3(12,13)8(24,25)29(26,27)28)2(10,11)4(14,15)5(16,17)7(21,22)23/h(H,26,27,28)","CCEVPOURSCMDRL-UHFFFAOYSA-N"
"FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-1(6(18,19)20,8(24,25)29(26,27)28)2(10,11)3(12,13)4(14,15)5(16,17)7(21,22)23/h(H,26,27,28)","QNLVHHDMJVQEDV-UHFFFAOYSA-N"
"FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-1(10,3(13,14)5(17,18)7(20,21)22)2(11,12)4(15,16)6(19,8(23,24)25)29(26,27)28/h(H,26,27,28)","LYZNUCXUQHMFTA-UHFFFAOYSA-N"
"FC(F)(F)C(F)(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)S(O)(=O)=O","InChI=1S/C8HF17O3S/c9-2(10,4(13,14)8(24,25)29(26,27)28)1(5(15,16)17,6(18,19)20)3(11,12)7(21,22)23/h(H,26,27,28)","SIBWNSUYVDSFHF-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)4(12,13)6(16,17)5(14,15)3(11,7(18,19)20)8(21,22)23/h(H,24,25)","KPBOPOXIOBBZTR-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)4(12,13)5(14,15)3(11,7(18,19)20)6(16,17)8(21,22)23/h(H,24,25)","HDWNCRCOUUAYQG-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)4(12,13)3(11,7(18,19)20)5(14,15)6(16,17)8(21,22)23/h(H,24,25)","RGXLMLZPWKONOH-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)3(11,7(18,19)20)4(12,13)5(14,15)6(16,17)8(21,22)23/h(H,24,25)","FUGOJSZHPNUCLK-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)4(11,12)3(6(15,16)17,7(18,19)20)5(13,14)8(21,22)23/h(H,24,25)","UDFRHYDOIIBODA-UHFFFAOYSA-N"
"OC(=O)C(F)(F)C(F)(F)C(F)(F)C(C(F)(F)F)(C(F)(F)F)C(F)(F)F","InChI=1S/C8HF15O2/c9-2(10,1(24)25)4(11,12)5(13,14)3(6(15,16)17,7(18,19)20)8(21,22)23/h(H,24,25)","GTHPUDUCLLCPLT-UHFFFAOYSA-N"
"OC(=O)CCC(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C6H5F7O2/c7-4(8,2-1-3(14)15)5(9,10)6(11,12)13/h1-2H2,(H,14,15)","ISFKSWMQWIRDNC-UHFFFAOYSA-N"
"OC(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8H5F11O2/c9-4(10,2-1-3(20)21)5(11,12)6(13,14)7(15,16)8(17,18)19/h1-2H2,(H,20,21)","ABFCFCPCGMHSRX-UHFFFAOYSA-N"
"OC(=O)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C10H5F15O2/c11-4(12,2-1-3(26)27)5(13,14)6(15,16)7(17,18)8(19,20)9(21,22)10(23,24)25/h1-2H2,(H,26,27)","HLBRGVKRZQSQHB-UHFFFAOYSA-N"
"OC(=O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C8H3F13O2/c9-3(10,1-2(22)23)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1H2,(H,22,23)","LRWIIEJPCFNNCZ-UHFFFAOYSA-N"
"OC(=O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C10H3F17O2/c11-3(12,1-2(28)29)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1H2,(H,28,29)","XTBXSCIWOVSSGB-UHFFFAOYSA-N"
"OC(=O)CC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F","InChI=1S/C12H3F21O2/c13-3(14,1-2(34)35)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)11(29,30)12(31,32)33/h1H2,(H,34,35)","IKHNVATUHWDNGI-UHFFFAOYSA-N"
"OCC(O)(C1)OCC(O)(CO)O1","InChI=1S/C6H12O6/c7-1-5(9)3-12-6(10,2-8)4-11-5/h7-10H,1-4H2","KEQUNHIAUQQPAC-UHFFFAOYSA-N"
"CC(C)(CO)[C@H](C(=O)NCCC(=O)O)O","InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)/t7-/m0/s1","GHOKWGTUZJEAQD-ZETCQYMHSA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](N)C(O)1","InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1","MSWZFWKMSRAUBD-GASJEMHNSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)C(O)(CO)1","InChI=1S/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2/t3-,4-,5+,6?/m1/s1","RFSUNEUAIZKAJO-VRPWFDPXSA-N"
"OCC(O1)C(O)C(O)C(O)C(O)1","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3-,4+,5-,6-/m1/s1","WQZGKKKJIJFFOK-VFUOTHLCSA-N"
"CC(C)=CCNC(=N2)C(N=1)C(N=C2)=NC1","InChI=1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6,8H,4H2,1-2H3,(H,11,12,13,14,15)","XVVUABVHOSCDJP-UHFFFAOYSA-N"
"OCC=C(C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C","InChI=1S/C20H40O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h15,17-19,21H,6-14,16H2,1-5H3/b20-15+/t18-,19-/m1/s1","BOTWFXYSPFMFNR-PYDDKJGSSA-N"
"OCC(NC(C)=O)C(O)=O","InChI=1S/C5H9NO4/c1-3(8)6-4(2-7)5(9)10/h4,7H,2H2,1H3,(H,6,8)(H,9,10)","JJIHLJJYMXLCOY-UHFFFAOYSA-N"
"OC(=O)CNC(=O)C(N)CS","InChI=1S/C5H10N2O3S/c6-3(2-11)5(10)7-1-4(8)9/h3,11H,1-2,6H2,(H,7,10)(H,8,9)/t3-/m0/s1","ZUKPVRWZDMRIEO-VKHMYHEASA-N"
"OC(=O)C(N)CCSSCCC(N)C(O)=O","InChI=1S/C8H16N2O4S2/c9-5(7(11)12)1-3-15-16-4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)/t5-,6-/m0/s1","ZTVZLYBCZNMWCF-WDSKDSINSA-N"
"CC(N)P(O)(O)=O","InChI=1S/C2H8NO3P/c1-2(3)7(4,5)6/h2H,3H2,1H3,(H2,4,5,6)/t2-/m0/s1","UIQSKEDQPSEGAU-REOHCLBHSA-N"
"O[C@@H](C1)[C@@H](COP(O)(O)=O)O[C@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C10H14N5O6P/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(21-7)2-20-22(17,18)19/h3-7,16H,1-2H2,(H2,11,12,13)(H2,17,18,19)/t5-,6+,7+/m0/s1","KHWCHTKSEGGWEX-RRKCRQDMSA-N"
"NC(=O)N[C@H](N1)C(=O)NC(=O)1","InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)/t1-/m1/s1","POJWUDADGALRAB-PVQJCKRUSA-N"
"OC(=O)C(N)CCCC(N)C(O)=O","InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5-/m1/s1","GMKMEZVLHJARHF-RFZPGFLSSA-N"
"O=C(C1)NC(=O)NC1","InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-2H2,(H2,5,6,7,8)","OIVLITBTBDPEFK-UHFFFAOYSA-N"
"OC(=O)C(C)C(N)C(O)=O","InChI=1S/C5H9NO4/c1-2(4(7)8)3(6)5(9)10/h2-3H,6H2,1H3,(H,7,8)(H,9,10)","LXRUAYBIUSUULX-UHFFFAOYSA-N"
"NO","InChI=1S/H3NO/c1-2/h2H,1H2","AVXURJPOCDRRFD-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CC=O","InChI=1S/C10H9NO/c12-6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,6-7,11H,5H2","WHOOUMGHGSPMGR-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(CO)2)C(O)C(O)C(O)O2","InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2/t3-,4-,5-,6+,7-,8-,9-,10-,11-,12-/m1/s1","GUBGYTABKSRVRQ-QUYVBRFLSA-N"
"OC(C1)C(COP(O)(O)=O)OC1n(c3)c(N2)c(n3)C(=O)N=C2","InChI=1S/C10H13N4O7P/c15-5-1-7(21-6(5)2-20-22(17,18)19)14-4-13-8-9(14)11-3-12-10(8)16/h3-7,15H,1-2H2,(H,11,12,16)(H2,17,18,19)/t5-,6+,7+/m0/s1","PHNGFPPXDJJADG-RRKCRQDMSA-N"
"CCCCCC=CCC=CCC=CCCCCC(O)=O","InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-","VZCCETWTMQHEPK-QNEBEIHSSA-N"
"OC[C@H](O)[C@@H](O1)C(O)=C(O)C(=O)1","InChI=1S/C6H8O6/c7-1-2(8)5-3(9)4(10)6(11)12-5/h2,5,7-10H,1H2/t2-,5+/m0/s1","CIWBSHSKHKDKBQ-JLAZNSOCSA-N"
"OC(=O)CCC(=O)CC(O)=O","InChI=1S/C6H8O5/c7-4(3-6(10)11)1-2-5(8)9/h1-3H2,(H,8,9)(H,10,11)","RTGHRDFWYQHVFW-UHFFFAOYSA-N"
"c(c2)ccc(c2)NCC(C1)NCC1","InChI=1S/C11H16N2/c1-2-5-10(6-3-1)13-9-11-7-4-8-12-11/h1-3,5-6,11-13H,4,7-9H2","MCHWKJRTMPIHRA-UHFFFAOYSA-N"
"NCC(C)O","InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3/t3-/m1/s1","HXKKHQJGJAFBHI-GSVOUGTGSA-N"
"OCC(O1)C(O)C(O)C(NC(C)=O)C1OP(O)(=O)OP(O)(=O)OCC(O2)C(O)C(O)C2N(C=3)C(=O)NC(=O)C3","InChI=1S/C17H27N3O17P2/c1-6(22)18-10-13(26)11(24)7(4-21)35-16(10)36-39(31,32)37-38(29,30)33-5-8-12(25)14(27)15(34-8)20-3-2-9(23)19-17(20)28/h2-3,7-8,10-16,21,24-27H,4-5H2,1H3,(H,18,22)(H,29,30)(H,31,32)(H,19,23,28)/t7-,8-,10-,11-,12-,13-,14-,15-,16-/m1/s1","LFTYTUAZOPRMMI-CFRASDGPSA-N"
"Oc(c3)c(O)cc(c3)[C@H](O1)[C@@H](O)Cc(c(O)2)c(cc(O)c2)1","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m0/s1","PFTAWBLQPZVEMU-ZFWWWQNUSA-N"
"C(O4)(C(O)C(O)C(O)C(C)4)OC(C(O)3)C(OC(CO)C3O)Oc(c1)cc(O)c(C(=O)C=Cc(c2)ccc(c2)OC)c1O","InChI=1S/C28H34O14/c1-12-21(33)23(35)25(37)27(39-12)42-26-24(36)22(34)19(11-29)41-28(26)40-15-9-17(31)20(18(32)10-15)16(30)8-5-13-3-6-14(38-2)7-4-13/h3-10,12,19,21-29,31-37H,11H2,1-2H3/b8-5+/t12-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1","HWRDCYOHJBCWGW-UKZYJBATSA-N"
"Oc(c3)c(O)cc(c3)c([o+1]1)c(O)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C15H10O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-6H,(H4-,16,17,18,19,20)/p+1","VEVZSMAEJFVWIL-UHFFFAOYSA-O"
"COc(c3)cc(O1)c(c(O)3)C(=O)C(O)=C1c(c2)cc(O)c(O)c2","InChI=1S/C16H12O7/c1-22-8-5-11(19)13-12(6-8)23-16(15(21)14(13)20)7-2-3-9(17)10(18)4-7/h2-6,17-19,21H,1H3","JGUZGNYPMHHYRK-UHFFFAOYSA-N"
"COc(c1)c(O)c(OC)cc1c([o+1]2)c(O)cc(c(O)3)c(cc(O)c3)2","InChI=1S/C17H14O7/c1-22-14-3-8(4-15(23-2)16(14)21)17-12(20)7-10-11(19)5-9(18)6-13(10)24-17/h3-7H,1-2H3,(H3-,18,19,20,21)/p+1","KZMACGJDUUWFCH-UHFFFAOYSA-O"
"COc(c3)ccc(c3)C(O1)=C(O)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C16H12O6/c1-21-10-4-2-8(3-5-10)16-15(20)14(19)13-11(18)6-9(17)7-12(13)22-16/h2-7,17-18,20H,1H3","SQFSKOYWJBQGKQ-UHFFFAOYSA-N"
"Oc(c3)c(O)cc(c3)[C@H](C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2/t13-/m0/s1","SBHXYTNGIZCORC-ZDUSSCGKSA-N"
"Oc(c3)c(O)cc(c3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H","IQPNAANSBPBGFQ-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c2)c(C(=O)CCc(c3)cccc3)c(O)cc(O)2","InChI=1S/C21H24O9/c22-10-16-18(26)19(27)20(28)21(30-16)29-15-9-12(23)8-14(25)17(15)13(24)7-6-11-4-2-1-3-5-11/h1-5,8-9,16,18-23,25-28H,6-7,10H2/t16-,18-,19+,20-,21-/m1/s1","NLGUKXQDDTZCDG-QNDFHXLGSA-N"
"OCC(O1)C(O)C(O)C(O)C1SC(CCCCS(C)=O)=NOS(O)(=O)=O","InChI=1S/C12H23NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21)/t7-,9-,10+,11-,12+,25?/m1/s1","GMMLNKINDDUDCF-SISVVIKZSA-N"
"CSCCCCC(=NOS(O)(=O)=O)SC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C12H23NO9S3/c1-23-5-3-2-4-8(13-22-25(18,19)20)24-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)/b13-8-","GKUMMDFLKGFCKH-JYRVWZFOSA-N"
"C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H]([C@H](O[C@H]2OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)OC)O)CO)O)O)O)O)O","InChI=1S/C28H32O14/c1-11-21(32)23(34)25(36)27(38-11)42-26-24(35)22(33)19(10-29)41-28(26)39-14-7-15(30)20-16(31)9-17(40-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-30,32-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1","MLWDGPFGTFOLRJ-CUVHLRMHSA-N"
"c(O)(c3)c(C(=O)2)c(cc3OC(O4)C(O)C(O)C(O)C(COC(O5)C(O)C(C(C5C)O)O)4)OC(=C2)c(c1)ccc(OC)c1","InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1","YFVGIJBUXMQFOF-PJOVQGMDSA-N"
"COc(c3)ccc(c3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3","DANYIYRPLHHOCZ-UHFFFAOYSA-N"
"OC[C@H]([C@@H](O)4)O[C@H]([C@H](O)[C@@H](O)4)c(c(O)3)c(O1)c(c(O)c3)C(=O)C=C(c(c2)ccc(O)c2)1","InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1","SGEWCQFRYRRZDC-VPRICQMDSA-N"
"O([C@@H]5CO)[C@H]([C@@H]([C@H]([C@@H]5O)O)O)Oc(c1)c([C@H](O4)[C@@H]([C@H]([C@@H]([C@H]4CO)O)O)O)c(c(C2=O)c(OC(c(c3)ccc(O)c3)=C2)1)O","InChI=1S/C27H30O15/c28-7-15-19(32)22(35)24(37)26(40-15)18-14(41-27-25(38)23(36)20(33)16(8-29)42-27)6-13-17(21(18)34)11(31)5-12(39-13)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2/t15-,16-,19-,20-,22+,23+,24-,25-,26+,27-/m1/s1","HGUVPEBGCAVWID-KETMJRJWSA-N"
"OC(=O)[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc(c2)c(O)c(O)c(C(=O)3)c(OC(c(c4)cccc4)=C3)2","InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1","IKIIZLYTISPENI-ZFORQUDYSA-N"
"OCC(O1)C(O)C(O)C(O)C1SC(Cc(c2)cccc2)=NOS(O)(=O)=O","InChI=1S/C14H19NO9S2/c16-7-9-11(17)12(18)13(19)14(23-9)25-10(15-24-26(20,21)22)6-8-4-2-1-3-5-8/h1-5,9,11-14,16-19H,6-7H2,(H,20,21,22)/t9-,11-,12+,13-,14+/m1/s1","QQGLQYQXUKHWPX-LPUQOGTASA-N"
"c(c(c([o+1]2)c(OC(O5)C(C(C(C5CO)O)O)O)cc(c3OC(O4)C(C(C(C4CO)O)O)O)c(cc(c3)O)2)1)c(O)c(O)cc1","InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1","RDFLLVCQYHQOBU-ZOTFFYTFSA-O"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc(c3)c([o+1]c(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17-,18+,19-,21-/m1/s1","RKWHWFONKJEUEF-GQUPQBGVSA-O"
"OC[C@H]([C@@H](O)4)O[C@H]([C@H](O)[C@@H](O)4)c(c(O)3)c(O2)c(cc3)C(=O)C(=C2)c(c1)ccc(O)c1","InChI=1S/C21H20O9/c22-7-14-17(26)18(27)19(28)21(30-14)15-13(24)6-5-11-16(25)12(8-29-20(11)15)9-1-3-10(23)4-2-9/h1-6,8,14,17-19,21-24,26-28H,7H2/t14-,17-,18+,19-,21+/m1/s1","HKEAFJYKMMKDOR-VPRICQMDSA-N"
"c(c5)(O)cc(c(c52)C(C(OC(O3)C(C(C(C3COC(C4O)OC(C(C4O)O)C)O)O)O)=C(O2)c(c(O)1)cccc1)=O)O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-10(28)7-14(16)40-24(25)11-4-2-3-5-12(11)29/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","BJJCTXDEJUWVIC-QHWHWDPRSA-N"
"[H]C([H])([H])Oc(c([H])1)c(c(c(C(C([H])([H])C(c(c4O[H])c(c([H])c(c4[H])O[C@](O2)([C@]([H])(O[C@@](O3)([H])[C@@]([H])([C@]([C@@]([H])(O[H])[C@@]([H])3C([H])([H])[H])([H])O[H])O[H])[C@]([C@@](O[H])([H])[C@@]([H])(C([H])([H])O[H])2)(O[H])[H])[H])O[H])=O)([H])[H])c1[H])[H])O[H]","InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1","ITVGXXMINPYUHD-CUVHLRMHSA-N"
"C(C(O)4)(OC([H])(C(O)5)OC(C)C(O)C(O)5)C(OC(CO)C4O)Oc(c3)cc(c(c(O)3)2)OC(=CC(=O)2)c(c1)ccc(c1O)OC","InChI=1S/C28H32O15/c1-10-21(33)23(35)25(37)27(39-10)43-26-24(36)22(34)19(9-29)42-28(26)40-12-6-14(31)20-15(32)8-17(41-18(20)7-12)11-3-4-16(38-2)13(30)5-11/h3-8,10,19,21-31,33-37H,9H2,1-2H3/t10-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1","VCCNKWWXYVWTLT-CYZBKYQRSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c4)cc(O2)c(c(O)4)C(=O)CC2c(c3)cc(O)c(O)c3","InChI=1S/C21H22O11/c22-7-16-18(27)19(28)20(29)21(32-16)30-9-4-12(25)17-13(26)6-14(31-15(17)5-9)8-1-2-10(23)11(24)3-8/h1-5,14,16,18-25,27-29H,6-7H2/t14-,16+,18+,19-,20+,21+/m0/s1","RAFHNDRXYHOLSH-SFTVRKLSSA-N"
"O([C@H]5C)[C@H]([C@@H]([C@@H]([C@H]5O)O)O)O[C@H]([C@H]4O)[C@@H](O[C@@H]([C@H]4O)CO)Oc(c3)cc(O1)c(c3O)C(C[C@@H](c(c2)cc(O)c(O)c2)1)=O","InChI=1S/C27H32O15/c1-9-20(33)22(35)24(37)26(38-9)42-25-23(36)21(34)18(8-28)41-27(25)39-11-5-14(31)19-15(32)7-16(40-17(19)6-11)10-2-3-12(29)13(30)4-10/h2-6,9,16,18,20-31,33-37H,7-8H2,1H3/t9-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1","OBKKEZLIABHSGY-DOYQYKRZSA-N"
"COc(c4)ccc(c4)C(=C3)C(=O)c(c2)c(O3)cc(c2)O[C@H](O1)[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)1","InChI=1S/C22H22O9/c1-28-12-4-2-11(3-5-12)15-10-29-16-8-13(6-7-14(16)18(15)24)30-22-21(27)20(26)19(25)17(9-23)31-22/h2-8,10,17,19-23,25-27H,9H2,1H3/t17-,19-,20+,21-,22-/m1/s1","MGJLSBDCWOSMHL-MIUGBVLSSA-N"
"c(O)(c3)c(C(=O)2)c(cc3O[C@H](O5)[C@@H]([C@@H](O)[C@H](O)[C@@H](CO)5)O[C@H](O4)[C@H](O)[C@H](O)[C@@H](O)[C@H](C)4)O[C@@H](C2)c(c1)ccc(c1O)OC","InChI=1S/C28H34O15/c1-10-21(33)23(35)25(37)27(39-10)43-26-24(36)22(34)19(9-29)42-28(26)40-12-6-14(31)20-15(32)8-17(41-18(20)7-12)11-3-4-16(38-2)13(30)5-11/h3-7,10,17,19,21-31,33-37H,8-9H2,1-2H3/t10-,17-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1","ARGKVCXINMKCAZ-UZRWAPQLSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c3)c([o+1]c(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17+,18+,19-,21-/m1/s1","RKWHWFONKJEUEF-WVXKDWSHSA-O"
"OCC(O1)C(O)C(O)C(O)C1Oc(c4)c(O)c(O2)c(c4)C(=O)CC2c(c3)cc(O)c(O)c3","InChI=1S/C21H22O11/c22-7-15-16(26)18(28)19(29)21(32-15)31-13-4-2-9-11(24)6-14(30-20(9)17(13)27)8-1-3-10(23)12(25)5-8/h1-5,14-16,18-19,21-23,25-29H,6-7H2/t14-,15+,16+,18-,19+,21+/m0/s1","DGGOLFCPSUVVHX-RTHJTPBESA-N"
"COc(c(O)4)cc(cc4)C(O1)=C(OC(O3)C(O)C(O)C(O)C(CO)3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C22H22O12/c1-31-12-4-8(2-3-10(12)25)20-21(17(28)15-11(26)5-9(24)6-13(15)32-20)34-22-19(30)18(29)16(27)14(7-23)33-22/h2-6,14,16,18-19,22-27,29-30H,7H2,1H3/t14-,16-,18+,19-,22+/m1/s1","CQLRUIIRRZYHHS-LFXZADKFSA-N"
"O(CC(O2)C(O)C(O)C(C(OC(C5=O)=C(Oc(c45)cc(O)cc4O)c(c3)cc(c(O)c3)OC)2)O)C(O1)C(O)C(C(C1C)O)O","InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(41-9)40-8-16-19(33)22(36)24(38)28(43-16)44-26-20(34)17-13(31)6-11(29)7-15(17)42-25(26)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,24+,27+,28-/m0/s1","UIDGLYUNOUKLBM-GEBJFKNCSA-N"
"c(O)(c3)c(C(=O)2)c(cc3O[C@H](O5)[C@@H]([C@@H](O)[C@H](O)[C@@H](CO)5)O[C@H](O4)[C@H](O)[C@H](O)[C@@H](O)[C@H](C)4)O[C@@H](C2)c(c1)ccc(OC)c1","InChI=1S/C28H34O14/c1-11-21(32)23(34)25(36)27(38-11)42-26-24(35)22(33)19(10-29)41-28(26)39-14-7-15(30)20-16(31)9-17(40-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-8,11,17,19,21-30,32-36H,9-10H2,1-2H3/t11-,17-,19+,21-,22+,23+,24-,25+,26+,27-,28+/m0/s1","NLAWPKPYBMEWIR-SKYQDXIQSA-N"
"COc(c3)ccc(c3)[C@H](C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-7,14,17-18H,8H2,1H3/t14-/m0/s1","HMUJXQRRKBLVOO-AWEZNQCLSA-N"
"Oc(c1)cc(O2)c(C(C(OC(C5O)OC(C(C5O)O)COC(=O)C=Cc(c4)ccc(O)c4)=C2c(c3)ccc(c3)O)=O)c(O)1","InChI=1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2/b10-3+/t21-,24-,26+,27-,30+/m1/s1","DVGGLGXQSFURLP-VWMSDXGPSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1OC(C(=O)2)=C(c(c4)ccc(O)c4)Oc(c3)c(c(O)cc(O)3)2","InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1","JPUKWEQWGBDDQB-QSOFNFLRSA-N"
"[C@@H]([C@@H](O)5)(O)[C@@H](O[C@H](CO[C@@H]([C@H](O)6)O[C@H]([C@H](O)[C@H]6O)C)[C@@H]5O)OC(=C3c(c4)ccc(O)c4)C(c(c(O3)1)c(O)cc(O[C@H](O2)[C@@H]([C@H](O)[C@H]([C@@H]2C)O)O)c1)=O","InChI=1S/C33H40O19/c1-10-19(36)23(40)26(43)31(47-10)46-9-17-21(38)25(42)28(45)33(51-17)52-30-22(39)18-15(35)7-14(49-32-27(44)24(41)20(37)11(2)48-32)8-16(18)50-29(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-28,31-38,40-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24+,25-,26+,27+,28+,31+,32-,33-/m0/s1","PEFASEPMJYRQBW-HKWQTAEVSA-N"
"c(c5)(O)cc(c(c51)C(C(OC(O3)C(C(C(C3COC(C4O)OC(C(C4O)O)C)O)O)O)=C(c(c2)ccc(O)c2)O1)=O)O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","RTATXGUCZHCSNG-QHWHWDPRSA-N"
"O(C5C)C(C(C(C5O)O)O)OC(C4O)C(OC(C4O)CO)Oc(c3)cc(O1)c(c3O)C(C(=C(c(c2)ccc(O)c2)1)O)=O","InChI=1S/C27H30O15/c1-9-17(31)20(34)23(37)26(38-9)42-25-21(35)18(32)15(8-28)41-27(25)39-12-6-13(30)16-14(7-12)40-24(22(36)19(16)33)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-21,23,25-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,23+,25+,26-,27+/m0/s1","ZEJXENDZTYVXDP-CSJHBIPPSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c4)c(O)cc(c4)C(=C2)Oc(c3)c(c(O)cc(O)3)C(=O)2","InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)31-13-2-1-8(3-10(13)24)14-6-12(26)17-11(25)4-9(23)5-15(17)30-14/h1-6,16,18-25,27-29H,7H2/t16-,18-,19+,20-,21-/m1/s1","UHNXUSWGOJMEFO-QNDFHXLGSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc(c4)cc(O2)c(c(O)4)C(=O)C=C2c(c3)cc(O)c(O)c3","InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)30-9-4-12(25)17-13(26)6-14(31-15(17)5-9)8-1-2-10(23)11(24)3-8/h1-6,16,18-25,27-29H,7H2/t16-,18-,19+,20-,21-/m1/s1","PEFNSGRTCBGNAN-QNDFHXLGSA-N"
"c(c41)([o+1]c(c(OC(O5)C(O)C(O)C(O)C5CO)c4)c(c3)cc(OC)c(O)c(OC)3)cc(O)cc1OC(O2)C(O)C(O)C(O)C2CO","InChI=1S/C29H34O17/c1-40-15-3-10(4-16(41-2)20(15)33)27-17(44-29-26(39)24(37)22(35)19(9-31)46-29)7-12-13(42-27)5-11(32)6-14(12)43-28-25(38)23(36)21(34)18(8-30)45-28/h3-7,18-19,21-26,28-31,34-39H,8-9H2,1-2H3,(H-,32,33)/p+1/t18-,19-,21-,22-,23+,24+,25-,26-,28-,29-/m1/s1","CILLXFBAACIQNS-BTXJZROQSA-O"
"OCC(O1)C(O)C(O)C(O)C1Oc(c3)c([o+1]c(c4)c(c(O)cc(O)4)3)c(c2)cc(OC)c(O)c(OC)2","InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1/t17-,19+,20+,21-,23-/m1/s1","PXUQTDZNOHRWLI-XSEKTIEYSA-O"
"OCC(O1)C(O)C(O)C(O)C1Oc(c3)c([o+1]c(c4)c(c(O)cc(O)4)3)c(c2)cc(OC)c(O)c(OC)2","InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1/t17-,19-,20+,21-,23-/m1/s1","PXUQTDZNOHRWLI-OXUVVOBNSA-O"
"OCC(O1)C(O)C(O)C(O)C1Oc(c4)c(O)c(o2)c(c4)c(=O)c(=Cc(c3)cc(O)c(O)c3)2","InChI=1S/C21H20O11/c22-7-14-16(26)18(28)19(29)21(32-14)31-12-4-2-9-15(25)13(30-20(9)17(12)27)6-8-1-3-10(23)11(24)5-8/h1-6,14,16,18-19,21-24,26-29H,7H2/b13-6-/t14-,16-,18+,19-,21-/m1/s1","SYRURBPRFQUYQS-RHEJLWEFSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c4)cc(O2)c(c(O)4)C(=O)CC(c(c3)ccc(O)c3)2","InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2/t14-,16+,18+,19-,20+,21+/m0/s1","DLIKSSGEMUFQOK-SFTVRKLSSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c3)c(O)c(O)c(c3)C(=O)C=Cc(c2)cc(O)c(O)c2","InChI=1S/C21H22O11/c22-8-15-18(28)19(29)20(30)21(32-15)31-14-6-3-10(16(26)17(14)27)11(23)4-1-9-2-5-12(24)13(25)7-9/h1-7,15,18-22,24-30H,8H2/b4-1+/t15-,18-,19+,20-,21-/m1/s1","XGEYXJDOVMEJNG-HTFDPZBKSA-N"
"Oc(c3)ccc(c3)c([o+1]1)c(O)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-7H,(H3-,16,17,18,19)/p+1","XVFMGWDSJLBXDZ-UHFFFAOYSA-O"
"COc(c(O)4)cc(cc4)c([o+1]1)c(OC(O3)C(O)C(O)C(O)C(CO)3)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1/t17-,18-,19+,20-,22-/m1/s1","ZZWPMFROUHHAKY-OUUKCGNVSA-O"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc(c2)c(C(=O)CCc(c3)ccc(O)c3)c(O)cc(O)2","InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16-,18-,19+,20-,21-/m1/s1","IOUVKUPGCMBWBT-QNDFHXLGSA-N"
"c(c5)(O)cc(c(c52)C(C(OC(O3)C(C(C(C3COC(C(O)4)OCC(O)C4O)O)O)O)=C(O2)c(c1)ccc(O)c1O)=O)O","InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15+,17-,18+,20-,21+,22+,25-,26-/m0/s1","YNMFDPCLPIMRFD-KSPKLRDJSA-N"
"CC(=O)OCC(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3/t15-,17-,19+,20-,23+/m1/s1","IGLUNMMNDNWZOA-LNNZMUSMSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1","OVSQVDMCBVZWGM-QSOFNFLRSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c4)c(O)cc(c4)C(O2)=C(O)C(=O)c(c(O)3)c(cc(O)c3)2","InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)32-11-2-1-7(3-9(11)24)20-18(29)16(27)14-10(25)4-8(23)5-12(14)31-20/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1","OIUBYZLTFSLSBY-HMGRVEAOSA-N"
"C=C[C@H](O)CC(=NOS(O)(=O)=O)S[C@H](O1)[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)1","InChI=1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)/t5-,6+,8+,9-,10+,11-/m0/s1","MYHSVHWQEVDFQT-ILPXZUKPSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(OC)c(O)c(OC)2","InChI=1S/C23H24O13/c1-32-12-3-8(4-13(33-2)16(12)27)21-22(18(29)15-10(26)5-9(25)6-11(15)34-21)36-23-20(31)19(30)17(28)14(7-24)35-23/h3-6,14,17,19-20,23-28,30-31H,7H2,1-2H3/t14-,17+,19+,20-,23+/m1/s1","JMFWYRWPJVEZPV-UOCKATJYSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(OC)c(O)c(OC)2","InChI=1S/C23H24O13/c1-32-12-3-8(4-13(33-2)16(12)27)21-22(18(29)15-10(26)5-9(25)6-11(15)34-21)36-23-20(31)19(30)17(28)14(7-24)35-23/h3-6,14,17,19-20,23-28,30-31H,7H2,1-2H3/t14-,17-,19+,20-,23+/m1/s1","JMFWYRWPJVEZPV-AVGVHVDKSA-N"
"[C@H](O1)([C@@H]([C@H]([C@H]([C@@H]1O[C@H]([C@H]5O)[C@@H](O[C@@H]([C@H]5O)CO)c(c2O)c(O3)c(C(C=C(c(c4)ccc(O)c4)3)=O)c(c2)O)O)O)O)C","InChI=1S/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3/t9-,16+,19-,20+,21+,22-,23+,25-,26+,27-/m0/s1","LYGPBZVKGHHTIE-HUBYJIGHSA-N"
"C/C(=C/CNC1=NC=NC2=C1NC=N2)/CO","InChI=1S/C10H13N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h2,5-6,16H,3-4H2,1H3,(H2,11,12,13,14,15)/b7-2-","UZKQTCBAMSWPJD-UQCOIBPSSA-N"
"OCC(C)=CCNc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(CO)1","InChI=1S/C15H21N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h2,6-7,9,11-12,15,21-24H,3-5H2,1H3,(H,16,17,18)/b8-2+/t9-,11-,12-,15-/m1/s1","GOSWTRUMMSCNCW-HNNGNKQASA-N"
"OCC(C)=CCNc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(CO)1","InChI=1S/C15H21N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h2,6-7,9,11-12,15,21-24H,3-5H2,1H3,(H,16,17,18)/b8-2-/t9-,11-,12-,15-/m1/s1","GOSWTRUMMSCNCW-BAJUWZQUSA-N"
"CC(CCNC1=NC=NC2=C1NC=N2)CO","InChI=1S/C10H15N5O/c1-7(4-16)2-3-11-9-8-10(13-5-12-8)15-6-14-9/h5-7,16H,2-4H2,1H3,(H2,11,12,13,14,15)","XXFACTAYGKKOQB-UHFFFAOYSA-N"
"OCC(C)CCNc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(CO)1","InChI=1S/C15H23N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h6-9,11-12,15,21-24H,2-5H2,1H3,(H,16,17,18)/t8?,9-,11-,12-,15-/m1/s1","DBVVQDGIJAUEAZ-YXYADJKSSA-N"
"CC(C)=CCNC(=N2)C(N=1)C(N=C2)NC1","InChI=1S/C10H15N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6,8,10H,4H2,1-2H3,(H,12,13)(H,11,14,15)","DIMSEFDETYWFFK-UHFFFAOYSA-N"
"CC(=CCNC1=NC=NC2=C1NC=N2)C","InChI=1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6H,4H2,1-2H3,(H2,11,12,13,14,15)","HYVABZIGRDEKCD-UHFFFAOYSA-N"
"OCC(C)=CCNc(n3)c(c(nc3)2)n(cn2)C(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C16H23N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)20-7-21(10)16-13(26)12(25)11(24)9(5-23)27-16/h2,6-7,9,11-13,16,22-26H,3-5H2,1H3,(H,17,18,19)/b8-2+/t9-,11-,12+,13-,16-/m1/s1","HTDHRCLVWUEXIS-HNVSNYHQSA-N"
"OCC(C)=CCNc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C16H23N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)21(7-20-10)16-13(26)12(25)11(24)9(5-23)27-16/h2,6-7,9,11-13,16,22-26H,3-5H2,1H3,(H,17,18,19)/b8-2+/t9-,11-,12+,13-,16-/m1/s1","VYRAJOITMBSQSE-HNVSNYHQSA-N"
"C/C(=C\CNC1=NC=NC2=C1NC=N2)/CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O","InChI=1S/C16H23N5O6/c1-8(2-3-17-14-10-15(19-6-18-10)21-7-20-14)5-26-16-13(25)12(24)11(23)9(4-22)27-16/h2,6-7,9,11-13,16,22-25H,3-5H2,1H3,(H2,17,18,19,20,21)/b8-2+/t9-,11-,12+,13-,16-/m1/s1","UUPDCCPAOMDMPT-HNVSNYHQSA-N"
"OCC(C)CCNc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C16H25N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)21(7-20-10)16-13(26)12(25)11(24)9(5-23)27-16/h6-9,11-13,16,22-26H,2-5H2,1H3,(H,17,18,19)/t8?,9-,11-,12+,13-,16-/m1/s1","DRPMMLWYLAPTPK-UFZVAZPKSA-N"
"CC(C)=CCNc(n3)c(c(nc3)2)n(cn2)C(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C16H23N5O5/c1-8(2)3-4-17-14-10-15(19-6-18-14)20-7-21(10)16-13(25)12(24)11(23)9(5-22)26-16/h3,6-7,9,11-13,16,22-25H,4-5H2,1-2H3,(H,17,18,19)/t9-,11-,12+,13-,16-/m1/s1","ORUWKZNXHJIZKV-HDNYONAXSA-N"
"CC(C)=CCNc(n3)c(n2)c(nc3)n(c2)C(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C16H23N5O5/c1-8(2)3-4-17-14-10-15(19-6-18-14)21(7-20-10)16-13(25)12(24)11(23)9(5-22)26-16/h3,6-7,9,11-13,16,22-25H,4-5H2,1-2H3,(H,17,18,19)/t9-,11-,12+,13-,16-/m1/s1","XEHLLUQVSRLWMH-HDNYONAXSA-N"
"OCC(O1)C(O)C(O)C(O)C(OCC(C)=CCNc(n4)c(n3)c(nc4)n(c3)C(O2)C(O)C(O)C(CO)2)1","InChI=1S/C21H31N5O10/c1-9(6-34-21-17(33)15(31)13(29)11(5-28)36-21)2-3-22-18-12-19(24-7-23-18)26(8-25-12)20-16(32)14(30)10(4-27)35-20/h2,7-8,10-11,13-17,20-21,27-33H,3-6H2,1H3,(H,22,23,24)/b9-2+/t10-,11-,13-,14-,15+,16-,17-,20-,21-/m1/s1","MVMBTNNVZQRZQT-BPDSZQNASA-N"
"CC(C(=O)O)NC(=O)CC1=CNC2=CC=CC=C21","InChI=1S/C13H14N2O3/c1-8(13(17)18)15-12(16)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7-8,14H,6H2,1H3,(H,15,16)(H,17,18)","FBDCJLXTUCMFLF-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CC(=O)NC(CC(=O)O)C(=O)O","InChI=1S/C14H14N2O5/c17-12(16-11(14(20)21)6-13(18)19)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)","VAFNMNRKDDAKRM-UHFFFAOYSA-N"
"CC[C@H](C)[C@@H](C(=O)O)NC(=O)CC1=CNC2=CC=CC=C21","InChI=1S/C16H20N2O3/c1-3-10(2)15(16(20)21)18-14(19)8-11-9-17-13-7-5-4-6-12(11)13/h4-7,9-10,15,17H,3,8H2,1-2H3,(H,18,19)(H,20,21)","WPTUQMUCTTVOFW-UHFFFAOYSA-N"
"CC(C)C[C@@H](C(=O)O)NC(=O)CC1=CNC2=CC=CC=C21","InChI=1S/C16H20N2O3/c1-10(2)7-14(16(20)21)18-15(19)8-11-9-17-13-6-4-3-5-12(11)13/h3-6,9-10,14,17H,7-8H2,1-2H3,(H,18,19)(H,20,21)/t14-/m0/s1","HCZNPUHZYPPINM-AWEZNQCLSA-N"
"C1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)CC2=CNC3=CC=CC=C32","InChI=1S/C19H18N2O3/c22-18(11-14-12-20-16-9-5-4-8-15(14)16)21-17(19(23)24)10-13-6-2-1-3-7-13/h1-9,12,17,20H,10-11H2,(H,21,22)(H,23,24)","BUGQHORRADGONS-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)CC3=CNC4=CC=CC=C43","InChI=1S/C21H19N3O3/c25-20(10-14-12-23-18-8-4-2-6-16(14)18)24-19(21(26)27)9-13-11-22-17-7-3-1-5-15(13)17/h1-8,11-12,19,22-23H,9-10H2,(H,24,25)(H,26,27)","FOSPCYZZRVNHJS-UHFFFAOYSA-N"
"OC(=O)C(C321)C([H])(C(C)54)C(CCC(O)5)(OC(=O)4)C([H])(CCC(O)(C(=C)C3)C2)1","InChI=1S/C19H24O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h10-13,20,24H,1,3-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1","JLJLRLWOEMWYQK-OBDJNFEBSA-N"
"OC(=O)[C@H]([C@@]321)[C@]([H])([C@@](C)54)[C@](C=C[C@H](O)5)(OC(=O)4)[C@]([H])(CC[C@@](O)(C(=C)C3)C2)1","InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1","IXORZMNAPKEEDV-OBDJNFEBSA-N"
"C=C([C@H]45)C[C@@](C5)([C@@H](C(O)=O)1)[C@@]([H])(CC4)[C@@](C3)(O2)[C@]([H])([C@@](C)([C@@H](O)C3)C(=O)2)1","InChI=1S/C19H24O5/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12+,13-,14-,17-,18+,19-/m1/s1","RSQSQJNRHICNNH-NFMPGMCNSA-N"
"OC(=O)C(C321)C([H])(C(C)54)C(CC=C5)(OC(=O)4)C([H])(CCC(O)(C(=C)C3)C2)1","InChI=1S/C19H22O5/c1-10-8-17-9-18(10,23)7-4-11(17)19-6-3-5-16(2,15(22)24-19)13(19)12(17)14(20)21/h3,5,11-13,23H,1,4,6-9H2,2H3,(H,20,21)/t11-,12-,13-,16-,17+,18+,19-/m1/s1","ZOWHLBOPCIHIHW-KQBHUUJHSA-N"
"C=C([C@H]45)C[C@@](C5)([C@@H](C(O)=O)1)[C@@]([H])(CC4)[C@@](C=3)(O2)[C@]([H])([C@@](C)([C@@H](O)C3)C(=O)2)1","InChI=1S/C19H22O5/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h5-6,10-14,20H,1,3-4,7-8H2,2H3,(H,21,22)/t10-,11-,12+,13-,14-,17-,18+,19-/m1/s1","SEEGHKWOBVVBTQ-NFMPGMCNSA-N"
"OC(=O)C(C321)C([H])(C(C)54)C(CC(O)C(O)5)(OC(=O)4)C([H])(CCC(O)(C(=C)C3)C2)1","InChI=1S/C19H24O7/c1-8-5-17-7-18(8,25)4-3-10(17)19-6-9(20)13(21)16(2,15(24)26-19)12(19)11(17)14(22)23/h9-13,20-21,25H,1,3-7H2,2H3,(H,22,23)/t9-,10+,11+,12+,13-,16-,17-,18-,19+/m0/s1","WZRRJZYYGOOHRC-UQJCXHNCSA-N"
"C=C([C@H]45)C[C@@](C5)([C@@H](C(O)=O)1)[C@@]([H])(CC4)[C@@](C3)(O2)[C@]([H])([C@@](C)(CC3)C(=O)2)1","InChI=1S/C19H24O4/c1-10-8-18-9-11(10)4-5-12(18)19-7-3-6-17(2,16(22)23-19)14(19)13(18)15(20)21/h11-14H,1,3-9H2,2H3,(H,20,21)/t11-,12-,13-,14-,17-,18+,19-/m1/s1","MHVYWTXXZIFXDT-YGNOGLJPSA-N"
"OC(=O)C(C)(C4)C([H])(C(C(O)=O)1)C(C=O)(CC4)C([H])(C3)C(C2)(CC(O)(C3)C(=C)2)1","InChI=1S/C20H26O6/c1-11-8-19-9-20(11,26)7-4-12(19)18(10-21)6-3-5-17(2,16(24)25)14(18)13(19)15(22)23/h10,12-14,26H,1,3-9H2,2H3,(H,22,23)(H,24,25)/t12-,13+,14+,17+,18+,19-,20-/m0/s1","VNCQCPQAMDQEBY-YTJHIPEWSA-N"
"OC(=O)C(C321)C([H])(C(C)54)C(CCC5)(OC(=O)4)C([H])(CCC(O)(C(=C)C3)C2)1","InChI=1S/C19H24O5/c1-10-8-17-9-18(10,23)7-4-11(17)19-6-3-5-16(2,15(22)24-19)13(19)12(17)14(20)21/h11-13,23H,1,3-9H2,2H3,(H,20,21)/t11-,12-,13-,16-,17+,18+,19-/m1/s1","OXFPYCSNYOFUCH-KQBHUUJHSA-N"
"OC(=O)[C@](C)(C4)[C@@]([H])([C@H](C(O)=O)1)[C@@](C=O)(CC4)[C@]([H])(C3)[C@](C2)(C[C@@H](C3)C(=C)2)1","InChI=1S/C20H26O5/c1-11-8-20-9-12(11)4-5-13(20)19(10-21)7-3-6-18(2,17(24)25)15(19)14(20)16(22)23/h10,12-15H,1,3-9H2,2H3,(H,22,23)(H,24,25)/t12-,13+,14-,15-,18-,19-,20+/m1/s1","QQRSSHFHXYSOMF-CXXOJBQZSA-N"
"OC(C4)CC(O5)(C([H])31)C([H])(C(C)4C(=O)5)C(C(O)=O)C(C2)(CC(O)(CC3)C(=C)2)1","InChI=1S/C19H24O6/c1-9-5-17-8-18(9,24)4-3-11(17)19-7-10(20)6-16(2,15(23)25-19)13(19)12(17)14(21)22/h10-13,20,24H,1,3-8H2,2H3,(H,21,22)/t10-,11-,12-,13-,16-,17+,18+,19-/m1/s1","BKBYHSYZKIAJDA-WWSAFQOPSA-N"
"OC(=O)C(C321)C([H])(C(C)54)C(CCC5)(COC(=O)4)C([H])(CCC(O)(C(=C)C3)C2)1","InChI=1S/C20H26O5/c1-11-8-19-9-20(11,24)7-4-12(19)18-6-3-5-17(2,16(23)25-10-18)14(18)13(19)15(21)22/h12-14,24H,1,3-10H2,2H3,(H,21,22)/t12-,13+,14+,17+,18+,19-,20-/m0/s1","KSBJAONOPKRVRR-YTJHIPEWSA-N"
"OC(=O)C(C)(C4)C([H])(C(C(O)=O)1)C(C)(CC4)C([H])(C3)C(C2)(CC(O)(C3)C(=C)2)1","InChI=1S/C20H28O5/c1-11-9-19-10-20(11,25)8-5-12(19)17(2)6-4-7-18(3,16(23)24)14(17)13(19)15(21)22/h12-14,25H,1,4-10H2,2-3H3,(H,21,22)(H,23,24)/t12-,13+,14-,17-,18+,19-,20-/m0/s1","CZEMYYICWZPENF-VOLTXKGXSA-N"
"OC(=O)C=C(C)C=CC(O)(C(C)=1)C(C)(C)CC(=O)C1","InChI=1S/C15H20O4/c1-10(7-13(17)18)5-6-15(19)11(2)8-12(16)9-14(15,3)4/h5-8,19H,9H2,1-4H3,(H,17,18)/b6-5+,10-7-/t15-/m1/s1","JLIDBLDQVAYHNE-YKALOCIXSA-N"
"O(C5CO)C(C(C(C5O)O)O)Oc(c4)c(c1)c(cc4O)[o+1]c(c(c3)ccc(O)c3)c(OC(O2)C(C(C(C2CO)O)O)O)1","InChI=1S/C27H30O15/c28-8-17-19(32)21(34)23(36)26(41-17)39-15-6-12(31)5-14-13(15)7-16(25(38-14)10-1-3-11(30)4-2-10)40-27-24(37)22(35)20(33)18(9-29)42-27/h1-7,17-24,26-29,32-37H,8-9H2,(H-,30,31)/p+1/t17-,18-,19-,20-,21+,22+,23-,24-,26-,27-/m1/s1","SLCKJKWFULXZBD-ZOTFFYTFSA-O"
"c(c(c([o+1]2)c(O[C@H](O4)[C@@H]([C@H]([C@@H]([C@H]4CO[C@@H]([C@@H]5O)O[C@H]([C@@H]([C@H]5O)O)C)O)O)O)cc(c(O)3)c(cc(O)c3)2)1)c(O)c(O)cc1","InChI=1S/C27H30O15/c1-9-19(32)21(34)23(36)26(39-9)38-8-18-20(33)22(35)24(37)27(42-18)41-17-7-12-14(30)5-11(28)6-16(12)40-25(17)10-2-3-13(29)15(31)4-10/h2-7,9,18-24,26-27,32-37H,8H2,1H3,(H3-,28,29,30,31)/p+1/t9-,18+,19-,20+,21+,22-,23+,24+,26+,27+/m0/s1","USNPULRDBDVJAO-FXCAAIILSA-O"
"OCC(O1)C(O)C(O)C(O)C1Oc(c3)c([o+1]c(c4)c(c(O)cc(O)4)3)c(c2)ccc(O)c2","InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9/h1-7,16-19,21-22,26-28H,8H2,(H2-,23,24,25)/p+1/t16-,17-,18+,19-,21-/m1/s1","ABVCUBUIXWJYSE-GQUPQBGVSA-O"
"OC(=O)C(OC(=O)C=Cc(c2)cc(O)c(O)c2)Cc(c1)cc(O)c(O)c1","InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m1/s1","DOUMFZQKYFQNTF-WUTVXBCWSA-N"
"COc(c1)cc(cc1)C=CC(O)=O","InChI=1S/C10H10O3/c1-13-9-4-2-3-8(7-9)5-6-10(11)12/h2-7H,1H3,(H,11,12)/b6-5+","LZPNXAULYJPXEH-AATRIKPKSA-N"
"[H]C(=O)C=Cc(c1)cccc1","InChI=1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+","KJPRLNWUNMBNBZ-QPJJXVBHSA-N"
"O[C@@H](O1)[C@H](N)[C@@H](O)[C@H](O)[C@H]1COP(O)(O)=O","InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)/t2-,3-,4-,5-,6+/m1/s1","XHMJOUIAFHJHBW-UKFBFLRUSA-N"
"NC(=N)NCCCC(C=O)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(C)=O","InChI=1S/C20H38N6O4/c1-12(2)9-16(24-14(5)28)19(30)26-17(10-13(3)4)18(29)25-15(11-27)7-6-8-23-20(21)22/h11-13,15-17H,6-10H2,1-5H3,(H,24,28)(H,25,29)(H,26,30)(H4,21,22,23)/t15-,16+,17+/m1/s1","GDBQQVLCIARPGH-IKGGRYGDSA-N"
"NC(C=2)=NC(=O)N(C2)[C@@H](C1)O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)1","InChI=1S/C9H15N3O10P2/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(21-8)4-20-24(18,19)22-23(15,16)17/h1-2,5-6,8,13H,3-4H2,(H,18,19)(H2,10,11,14)(H2,15,16,17)/t5-,6+,8+/m0/s1","FTDHDKPUHBLBTL-SHYZEUOFSA-N"
"SCCNC(=O)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@@H](O1)[C@@H](O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C21H35N7O13P2S/c1-21(2,16(32)19(33)24-4-3-12(29)23-5-6-44)8-39-43(36,37)41-42(34,35)38-7-11-14(30)15(31)20(40-11)28-10-27-13-17(22)25-9-26-18(13)28/h9-11,14-16,20,30-32,44H,3-8H2,1-2H3,(H,23,29)(H,24,33)(H,34,35)(H,36,37)(H2,22,25,26)/t11-,14-,15-,16+,20-/m1/s1","KDTSHFARGAKYJN-IBOSZNHHSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1OP(O)(=O)OP(O)(=O)OC[C@@H](O2)[C@@H](O)[C@@H](O)[C@@H]2n(c4)c(n3)c(n4)c(N)nc3","InChI=1S/C16H25N5O15P2/c17-13-7-14(19-3-18-13)21(4-20-7)15-11(26)9(24)6(33-15)2-32-37(28,29)36-38(30,31)35-16-12(27)10(25)8(23)5(1-22)34-16/h3-6,8-12,15-16,22-27H,1-2H2,(H,28,29)(H,30,31)(H2,17,18,19)/t5-,6-,8-,9-,10+,11-,12-,15-,16-/m1/s1","WFPZSXYXPSUOPY-ROYWQJLOSA-N"
"NC(C=3)=NC(=O)N(C3)[C@H](O1)[C@H](O)[C@H](O2)[C@@H](COP(O)(=O)2)1","InChI=1S/C9H12N3O7P/c10-5-1-2-12(9(14)11-5)8-6(13)7-4(18-8)3-17-20(15,16)19-7/h1-2,4,6-8,13H,3H2,(H,15,16)(H2,10,11,14)/t4-,6-,7-,8-/m1/s1","WCPTXJJVVDAEMW-XVFCMESISA-N"
"NC(C=2)=NC(=O)N(C2)C(O1)C(O)C(O)C(COP(O)(=O)OP([O-1])(=O)OCC[N+1](C)(C)C)1","InChI=1S/C14H26N4O11P2/c1-18(2,3)6-7-26-30(22,23)29-31(24,25)27-8-9-11(19)12(20)13(28-9)17-5-4-10(15)16-14(17)21/h4-5,9,11-13,19-20H,6-8H2,1-3H3,(H3-,15,16,21,22,23,24,25)/t9-,11-,12-,13-/m1/s1","RZZPDXZPRHQOCG-OJAKKHQRSA-N"
"NC(C=2)=NC(=O)N(C2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1","IERHLVCPSMICTF-XVFCMESISA-N"
"OC(=O)C(N)CCCC(N)C(O)=O","InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)","GMKMEZVLHJARHF-UHFFFAOYSA-N"
"[O-1]C(=O)C[C@H](O)C[N+1](C)(C)C","InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/t6-/m0/s1","PHIQHXFUZVPYII-LURJTMIESA-N"
"NC(N4)=Nc(c3C(=O)4)n(cn3)[C@H](O1)[C@H](O)[C@H](O2)[C@@H](COP(O)(=O)2)1","InChI=1S/C10H12N5O7P/c11-10-13-7-4(8(17)14-10)12-2-15(7)9-5(16)6-3(21-9)1-20-23(18,19)22-6/h2-3,5-6,9,16H,1H2,(H,18,19)(H3,11,13,14,17)/t3-,5-,6-,9-/m1/s1","ZOOGRGPOEVQQDX-UUOKFMHZSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@H](O)[C@H]1OP(O)(=O)OP(O)(=O)OC[C@@H](O2)[C@@H](O)[C@@H](O)[C@@H]2n(c4)c(N=3)c(n4)C(=O)NC(N)3","InChI=1S/C16H25N5O16P2/c17-16-19-12-6(13(28)20-16)18-3-21(12)14-10(26)8(24)5(34-14)2-33-38(29,30)37-39(31,32)36-15-11(27)9(25)7(23)4(1-22)35-15/h3-5,7-11,14-15,22-27H,1-2H2,(H,29,30)(H,31,32)(H3,17,19,20,28)/t4-,5-,7-,8-,9+,10-,11+,14-,15-/m1/s1","MVMSCBBUIHUTGJ-GDJBGNAASA-N"
"OCC(O1)C(O)C(O)C(O)C1OP(O)(=O)OP(O)(=O)OCC(O2)C(O)C(O)C2n(c4)c(N=3)c(n4)C(=O)NC(N)3","InChI=1S/C16H25N5O16P2/c17-16-19-12-6(13(28)20-16)18-3-21(12)14-10(26)8(24)5(34-14)2-33-38(29,30)37-39(31,32)36-15-11(27)9(25)7(23)4(1-22)35-15/h3-5,7-11,14-15,22-27H,1-2H2,(H,29,30)(H,31,32)(H3,17,19,20,28)/t4-,5-,7-,8-,9+,10-,11-,14-,15-/m1/s1","MVMSCBBUIHUTGJ-LRJDVEEWSA-N"
"NC(N3)=Nc(c2C(=O)3)n(cn2)C(O1)C(O)C(O)C(COP(O)(O)=O)1","InChI=1S/C10H14N5O8P/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1","RQFCJASXJCIDSX-UUOKFMHZSA-N"
"C1=NC2=C(C(=O)N1)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O","InChI=1S/C10H13N4O8P/c15-6-4(1-21-23(18,19)20)22-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,11,12,17)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1","GRSZFWQUAKGDAV-KQYNXXCUSA-N"
"O=C(NCCSC(=O)C(C)C)CCNC(=O)C(O)C(C)(C)COP(O)(=O)OP(O)(=O)OCC(O1)C(OP(O)(O)=O)C(O)C1n(c2)c(n3)c(c(N)nc3)n2","InChI=1S/C25H42N7O17P3S/c1-13(2)24(37)53-8-7-27-15(33)5-6-28-22(36)19(35)25(3,4)10-46-52(43,44)49-51(41,42)45-9-14-18(48-50(38,39)40)17(34)23(47-14)32-12-31-16-20(26)29-11-30-21(16)32/h11-14,17-19,23,34-35H,5-10H2,1-4H3,(H,27,33)(H,28,36)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)/t14-,17-,18-,19+,23-/m1/s1","AEWHYWSPVRZHCT-NDZSKPAWSA-N"
"[O-1]C(=O)C[C@H](O)C[N+1](C)(C)C","InChI=1S/C7H15NO3/c1-8(2,3)5-6(9)4-7(10)11/h6,9H,4-5H2,1-3H3/t6-/m1/s1","PHIQHXFUZVPYII-ZCFIWIBFSA-N"
"[O-1]C(=O)c(c2)c[n+1](cc2)C(O1)C(O)C(O)C(COP(O)(O)=O)1","InChI=1S/C11H14NO9P/c13-8-7(5-20-22(17,18)19)21-10(9(8)14)12-3-1-2-6(4-12)11(15)16/h1-4,7-10,13-14H,5H2,(H2-,15,16,17,18,19)/t7-,8-,9-,10-/m1/s1","JOUIQRNQJGXQDC-ZYUZMQFOSA-N"
"OS(=O)(=O)CCN(C1)CCN(C1)CCS(O)(=O)=O","InChI=1S/C8H18N2O6S2/c11-17(12,13)7-5-9-1-2-10(4-3-9)6-8-18(14,15)16/h1-8H2,(H,11,12,13)(H,14,15,16)","IHPYMWDTONKSCO-UHFFFAOYSA-N"
"ON=Cc(c1)[n+1](C)ccc1","InChI=1S/C7H8N2O/c1-9-5-3-2-4-7(9)6-8-10/h2-6H,1H3/p+1","JBKPUQTUERUYQE-UHFFFAOYSA-O"
"O=C(N3)C(C)=CN(C(=O)3)C(O1)CC([H])(O2)C([H])(COP(O)(=O)2)1","InChI=1S/C10H13N2O7P/c1-5-3-12(10(14)11-9(5)13)8-2-6-7(18-8)4-17-20(15,16)19-6/h3,6-8H,2,4H2,1H3,(H,15,16)(H,11,13,14)/t6-,7+,8+/m0/s1","QSJFDOVQWZVUQG-XLPZGREQSA-N"
"OCC(O1)C(O)C(O)C(NC(C)=O)C1OP(O)(=O)OP(O)(=O)OCC(O2)C(O)C(O)C2N(C=3)C(=O)NC(=O)C3","InChI=1S/C17H27N3O17P2/c1-6(22)18-10-13(26)11(24)7(4-21)35-16(10)36-39(31,32)37-38(29,30)33-5-8-12(25)14(27)15(34-8)20-3-2-9(23)19-17(20)28/h2-3,7-8,10-16,21,24-27H,4-5H2,1H3,(H,18,22)(H,29,30)(H,31,32)(H,19,23,28)/t7-,8-,10-,11+,12-,13-,14-,15-,16-/m1/s1","LFTYTUAZOPRMMI-NESSUJCYSA-N"
"O=C(N3)Nc(c2C(=O)3)n(cn2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C10H13N4O9P/c15-5-3(1-22-24(19,20)21)23-9(6(5)16)14-2-11-4-7(14)12-10(18)13-8(4)17/h2-3,5-6,9,15-16H,1H2,(H2,19,20,21)(H2,12,13,17,18)/t3-,5-,6-,9-/m1/s1","DCTLYFZHFGENCW-UUOKFMHZSA-N"
"NC(=O)c(c5)c[n+1](cc5)C(O1)C(O)C(O)C(COP([O-1])(=O)OP(O)(=O)OCC(O2)C(O)C(O)C2n(c4)c(n3)c(n4)c(N)nc3)1","InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1","BAWFJGJZGIEFAR-NNYOXOHSSA-N"
"NC(=O)c(c2)c[n+1](cc2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)([O-1])=O)1","InChI=1S/C11H15N2O8P/c12-10(16)6-2-1-3-13(4-6)11-9(15)8(14)7(21-11)5-20-22(17,18)19/h1-4,7-9,11,14-15H,5H2,(H3-,12,16,17,18,19)/t7-,8-,9-,11-/m1/s1","DAYLJWODMCOQEW-TURQNECASA-N"
"CC(C)/C=C/CCCCC(=O)NCC1=CC(=C(C=C1)O)OC","InChI=1S/C18H27NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h6,8,10-12,14,20H,4-5,7,9,13H2,1-3H3,(H,19,21)/b8-6+","YKPUWZUDDOIDPM-SOFGYWHQSA-N"
"CC(C)CCCCCCC(=O)NCc(c1)cc(OC)c(O)c1","InChI=1S/C18H29NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h10-12,14,20H,4-9,13H2,1-3H3,(H,19,21)","XJQPQKLURWNAAH-UHFFFAOYSA-N"
"Oc(c3)c(O)cc(c3)[C@@H](O1)[C@@H](O)Cc(c(O)2)c(cc(O)c2)1","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1","PFTAWBLQPZVEMU-DZGCQCFKSA-N"
"NC(N3)=Nc(c2C(=O)3)n(cn2)[C@@H](C1)O[C@H](COP(O)(O)=O)[C@@H](O)1","InChI=1S/C10H14N5O7P/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(22-6)2-21-23(18,19)20/h3-6,16H,1-2H2,(H2,18,19,20)(H3,11,13,14,17)/t4-,5+,6+/m0/s1","LTFMZDNNPPEQNG-KVQBGUIXSA-N"
"OCC(O)C(O)C(O)C(O)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4+,5-,6+","FBPFZTCFMRRESA-FBXFSONDSA-N"
"CC(C)CC(N)CC(O)=O","InChI=1S/C7H15NO2/c1-5(2)3-6(8)4-7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)/t6-/m0/s1","MLYMSIKVLAPCAK-LURJTMIESA-N"
"NCCCCC(N)CC(O)=O","InChI=1S/C7H16N2O2/c8-4-2-1-3-6(9)5-7(10)11/h6H,1-5,8-9H2,(H,10,11)/t6-/m0/s1","PJDINCOFOROBQW-LURJTMIESA-N"
"CSCCC(N)CC(O)=O","InChI=1S/C6H13NO2S/c1-10-3-2-5(7)4-6(8)9/h5H,2-4,7H2,1H3,(H,8,9)/t5-/m0/s1","QWVNCDVONVDGDV-YFKPBYRVSA-N"
"OC(=O)CC(N)Cc(c1)cccc1","InChI=1S/C10H13NO2/c11-9(7-10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m1/s1","OFVBLKINTLPEGH-SECBINFHSA-N"
"OC(=O)CC(C1)NCC1","InChI=1S/C6H11NO2/c8-6(9)4-5-2-1-3-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1","ADSALMJPJUKESW-YFKPBYRVSA-N"
"OCC(N)CC(O)=O","InChI=1S/C4H9NO3/c5-3(2-6)1-4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m1/s1","BUZICZZQJDLXJN-GSVOUGTGSA-N"
"OCC(N)CC(O)=O","InChI=1S/C4H9NO3/c5-3(2-6)1-4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1","BUZICZZQJDLXJN-VKHMYHEASA-N"
"C1=CC=C2C(=C1)C(=CN2)C[C@@H](CC(=O)O)N","InChI=1S/C12H14N2O2/c13-9(6-12(15)16)5-8-7-14-11-4-2-1-3-10(8)11/h1-4,7,9,14H,5-6,13H2,(H,15,16)/t9-/m0/s1","DUVVFMLAHWNDJD-VIFPVBQESA-N"
"OC(=O)CC(N)Cc(c1)ccc(O)c1","InChI=1S/C10H13NO3/c11-8(6-10(13)14)5-7-1-3-9(12)4-2-7/h1-4,8,12H,5-6,11H2,(H,13,14)/t8-/m1/s1","VUNPIAMEJXBAFP-MRVPVSSYSA-N"
"CC(C)[C@@H](N)CC(O)=O","InChI=1S/C6H13NO2/c1-4(2)5(7)3-6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t5-/m1/s1","GLUJNGJDHCTUJY-RXMQYKEDSA-N"
"CC(O)C(N)CC(O)=O","InChI=1S/C5H11NO3/c1-3(7)4(6)2-5(8)9/h3-4,7H,2,6H2,1H3,(H,8,9)/t3-,4-/m1/s1","NIVRJEWVLMOZNV-QWWZWVQMSA-N"
"CC(=O)OCC[C@H](N)C(O)=O","InChI=1S/C6H11NO4/c1-4(8)11-3-2-5(7)6(9)10/h5H,2-3,7H2,1H3,(H,9,10)/t5-/m0/s1","FCXZBWSIAGGPCB-YFKPBYRVSA-N"
"C[C@@H](N)C(=O)N[C@H](C)C(O)=O","InChI=1S/C6H12N2O3/c1-3(7)5(9)8-4(2)6(10)11/h3-4H,7H2,1-2H3,(H,8,9)(H,10,11)/t3-,4-/m1/s1","DEFJQIDDEAULHB-QWWZWVQMSA-N"
"COc(c3)ccc(c3)C(=C1)C(=O)c(c2)c(cc(O)c2)O1","InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3","HKQYGTCOTHHOMP-UHFFFAOYSA-N"
"CC(O)C(N)C(O)=O","InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m0/s1","AYFVYJQAPQTCCC-HRFVKAFMSA-N"
"CCC(N)C(O)=O","InChI=1S/C4H9NO2/c1-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)","QWCKQJZIFLGMSD-UHFFFAOYSA-N"
"COc(c1)cc(C=CC(O)=O)cc(OC)1","InChI=1S/C11H12O4/c1-14-9-5-8(3-4-11(12)13)6-10(7-9)15-2/h3-7H,1-2H3,(H,12,13)","VLSRUFWCGBMYDJ-UHFFFAOYSA-N"
"CC(N)CC(O)=O","InChI=1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)","OQEBBZSWEGYTPG-UHFFFAOYSA-N"
"Oc(c1)cncc1","InChI=1S/C5H5NO/c7-5-2-1-3-6-4-5/h1-4,7H","GRFNBEZIAWKNCO-UHFFFAOYSA-N"
"O[C@H](C1)[C@@H](O)C(O)O1","InChI=1S/C4H8O4/c5-2-1-8-4(7)3(2)6/h2-7H,1H2/t2-,3-,4?/m1/s1","FMAORJIQYMIRHF-HERZVMAMSA-N"
"CCC(C)C(N)CC(O)=O","InChI=1S/C7H15NO2/c1-3-5(2)6(8)4-7(9)10/h5-6H,3-4,8H2,1-2H3,(H,9,10)/t5-,6+/m0/s1","JHEDYGILOIBOTL-NTSWFWBYSA-N"
"OC(=O)CC(N)Cc(c1)cccc1","InChI=1S/C10H13NO2/c11-9(7-10(12)13)6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/t9-/m0/s1","OFVBLKINTLPEGH-VIFPVBQESA-N"
"CCCCCCCCCCCC(=O)OCC(O)COP([O-1])(=O)OCC[N+1](C)(C)C","InChI=1S/C20H42NO7P/c1-5-6-7-8-9-10-11-12-13-14-20(23)26-17-19(22)18-28-29(24,25)27-16-15-21(2,3)4/h19,22H,5-18H2,1-4H3/t19-/m1/s1","BWKILASWCLJPBO-LJQANCHMSA-N"
"CCCCCCCCCC(=O)OCC(O)COP(O)(=O)OCC[N+1](C)(C)C","InChI=1S/C18H38NO7P/c1-5-6-7-8-9-10-11-12-18(21)24-15-17(20)16-26-27(22,23)25-14-13-19(2,3)4/h17,20H,5-16H2,1-4H3/p+1/t17-/m1/s1","SECPDKKEUKDCPG-QGZVFWFLSA-O"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc(c(O)4)c(O2)c(c(O)c4)C(=O)C(O)=C(c(c3)cc(O)c(O)c3)2","InChI=1S/C21H20O13/c22-5-11-13(27)15(29)17(31)21(32-11)34-19-10(26)4-9(25)12-14(28)16(30)18(33-20(12)19)6-1-2-7(23)8(24)3-6/h1-4,11,13,15,17,21-27,29-31H,5H2/t11-,13-,15+,17-,21+/m1/s1","SJRXVLUZMMDCNG-KKPQBLLMSA-N"
"COc(c4)ccc(c4)C(=C3)C(=O)c(c(O)2)c(O3)cc(c2)O[C@H](O1)[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)1","InChI=1S/C22H22O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3/t16-,19-,20+,21-,22-/m1/s1","LFEUICHQZGNOHD-RECXWPGBSA-N"
"","InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3/t16-,17+,19+,20-,21+,22+,23+,24+,25+,26+,27-/m1/s1","KWVISVAMQJWJSZ-VKROHFNGSA-N"
"CC(C)=CCCC(C)=CCCC(C)(O)C=C","InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11-","FQTLCLSUCSAZDY-KAMYIIQDSA-N"
"CC(C)C(=C1)C=C(O)C(=O)C=C1","InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)","FUWUEFKEXZQKKA-UHFFFAOYSA-N"
"OCC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3","CRDAMVZIKSXKFV-UHFFFAOYSA-N"
"CC(C)[C@@](C2)(C1)[C@@H]([C@@](=C)C2)1","InChI=1S/C10H16/c1-7(2)10-5-4-8(3)9(10)6-10/h7,9H,3-6H2,1-2H3","NDVASEGYNIMXJL-UHFFFAOYSA-N"
"CC(CC1=CN=CN1)(C(=O)O)N","InChI=1S/C7H11N3O2/c1-7(8,6(11)12)2-5-3-9-4-10-5/h3-4H,2,8H2,1H3,(H,9,10)(H,11,12)","HRRYYCWYCMJNGA-UHFFFAOYSA-N"
"NCC(O)CCC(N)C(O)=O","InChI=1S/C6H14N2O3/c7-3-4(9)1-2-5(8)6(10)11/h4-5,9H,1-3,7-8H2,(H,10,11)","YSMODUONRAFBET-UHFFFAOYSA-N"
"NCC(C)C(O)=O","InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)","QCHPKSFMDHPSNR-UHFFFAOYSA-N"
"CC[C@H](C)[C@@H](N)C(O)=O","InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5+/m0/s1","AGPKZVBTJJNPAG-CRCLSJGQSA-N"
"OC(=O)CCCC(N)C(O)=O","InChI=1S/C6H11NO4/c7-4(6(10)11)2-1-3-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11)/t4-/m1/s1","OYIFNHCXNCRBQI-SCSAIBSYSA-N"
"CC(=O)NC(CC(O)=O)C(O)=O","InChI=1S/C6H9NO5/c1-3(8)7-4(6(11)12)2-5(9)10/h4H,2H2,1H3,(H,7,8)(H,9,10)(H,11,12)","OTCCIMWXFLJLIA-UHFFFAOYSA-N"
"CC(=O)O[C@H](CC(O)=O)C[N+1](C)(C)C","InChI=1S/C9H17NO4/c1-7(11)14-8(5-9(12)13)6-10(2,3)4/h8H,5-6H2,1-4H3/p+1/t8-/m1/s1","RDHQFKQIGNGIED-MRVPVSSYSA-O"
"NCC(=O)N(C1)C(CC1)C(O)=O","InChI=1S/C7H12N2O3/c8-4-6(10)9-3-1-2-5(9)7(11)12/h5H,1-4,8H2,(H,11,12)/t5-/m0/s1","KZNQNBZMBZJQJO-YFKPBYRVSA-N"
"CC=C(C)C(=O)NCC(O)=O","InChI=1S/C7H11NO3/c1-3-5(2)7(11)8-4-6(9)10/h3H,4H2,1-2H3,(H,8,11)(H,9,10)/b5-3+","WRUSVQOKJIDBLP-HWKANZROSA-N"
"OCC(O)C(O)C(O)CN(c21)C(=N3)C(C(=O)NC(=O)3)=Nc(cc(C)c(C)c2)1","InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m0/s1","AUNGANRZJHBGPY-SCRDCRAPSA-N"
"C1=C2C(=NC(=O)NC2=O)NN1","InChI=1S/C5H4N4O2/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)","HXNFUBHNUDHIGC-UHFFFAOYSA-N"
"NC(=N)NCC(O)=O","InChI=1S/C3H7N3O2/c4-3(5)6-1-2(7)8/h1H2,(H,7,8)(H4,4,5,6)","BPMFZUMJYQTVII-UHFFFAOYSA-N"
"O=C(N1)NC(N(C)2)=C1C(=O)N(C)C(=O)2","InChI=1S/C7H8N4O3/c1-10-4-3(8-6(13)9-4)5(12)11(2)7(10)14/h1-2H3,(H2,8,9,13)","OTSBKHHWSQYEHK-UHFFFAOYSA-N"
"CN1C2=C(C(=O)NC1=O)NC=N2","InChI=1S/C6H6N4O2/c1-10-4-3(7-2-8-4)5(11)9-6(10)12/h2H,1H3,(H,7,8)(H,9,11,12)","GMSNIKWWOQHZGF-UHFFFAOYSA-N"
"CC(=O)NC(CCC(O)=O)C(O)=O","InChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)","RFMMMVDNIPUKGG-UHFFFAOYSA-N"
"OC(=O)[C@@H](N)Cc(c1)cc(Br)c(O)c(Br)1","InChI=1S/C9H9Br2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)/t7-/m0/s1","COESHZUDRKCEPA-ZETCQYMHSA-N"
"OC(=O)C(N)Cc(c1)cc(Cl)c(O)c1","InChI=1S/C9H10ClNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)/t7-/m0/s1","ACWBBAGYTKWBCD-ZETCQYMHSA-N"
"[H]C(=O)N(C)C","InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3","ZMXDDKWLCZADIW-UHFFFAOYSA-N"
"S=C=NCCC=CS(C)=O","InChI=1S/C6H9NOS2/c1-10(8)5-3-2-4-7-6-9/h3,5H,2,4H2,1H3/b5-3+","QKGJFQMGPDVOQE-HWKANZROSA-N"
"C=CCCC(=NOS(O)(=O)=O)SC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C11H19NO9S2/c1-2-3-4-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(5-13)20-11/h2,6,8-11,13-16H,1,3-5H2,(H,17,18,19)/b12-7+/t6-,8-,9+,10-,11+/m1/s1","PLYQBXHVYUJNQB-BZVDQRPCSA-N"
"C=CC(O)CC(=NOS(O)(=O)=O)SC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)/b12-7-/t5-,6-,8-,9+,10-,11+/m1/s1","MYHSVHWQEVDFQT-KBHNZSCUSA-N"
"C=CC(O)CC(=NOS(O)(=O)=O)SC(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)/b12-7+/t5-,6-,8-,9+,10-,11+/m1/s1","MYHSVHWQEVDFQT-QSKOKFRPSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1SC(CCCS(C)=O)=NOS(O)(=O)=O","InChI=1S/C11H21NO10S3/c1-24(17)4-2-3-7(12-22-25(18,19)20)23-11-10(16)9(15)8(14)6(5-13)21-11/h6,8-11,13-16H,2-5H2,1H3,(H,18,19,20)/t6-,8-,9+,10-,11+,24?/m1/s1","PHYYADMVYQURSX-GEINXPCQSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1SC(CCC=CS(C)=O)=NOS(O)(=O)=O","InChI=1S/C12H21NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h3,5,7,9-12,14-17H,2,4,6H2,1H3,(H,19,20,21)/b5-3+,13-8?/t7-,9-,10+,11-,12+,25?/m1/s1","ZFLXCZJBYSPSKU-HFUPMICZSA-N"
"OCC(O1)C(O)C(O)C(O)C1SC(Cc(c2)cccc2)=NOS(O)(=O)=O","InChI=1S/C14H19NO9S2/c16-7-9-11(17)12(18)13(19)14(23-9)25-10(15-24-26(20,21)22)6-8-4-2-1-3-5-8/h1-5,9,11-14,16-19H,6-7H2,(H,20,21,22)/b15-10+/t9-,11-,12+,13-,14+/m1/s1","QQGLQYQXUKHWPX-BXLHIMNRSA-N"
"OCC(O1)C(O)C(O)C(O)C1SC(CCc(c2)cccc2)=NOS(O)(=O)=O","InChI=1S/C15H21NO9S2/c17-8-10-12(18)13(19)14(20)15(24-10)26-11(16-25-27(21,22)23)7-6-9-4-2-1-3-5-9/h1-5,10,12-15,17-20H,6-8H2,(H,21,22,23)/b16-11+/t10-,12-,13+,14-,15+/m1/s1","CKIJIGYDFNXSET-MFIRQCQASA-N"
"OCC(O1)C(O)C(O)C(O)C1SC(=NOS(O)(=O)=O)CC(O)c(c2)cccc2","InChI=1S/C15H21NO10S2/c17-7-10-12(19)13(20)14(21)15(25-10)27-11(16-26-28(22,23)24)6-9(18)8-4-2-1-3-5-8/h1-5,9-10,12-15,17-21H,6-7H2,(H,22,23,24)/b16-11+/t9-,10-,12-,13+,14-,15+/m1/s1","GAPDDBFHNYHZIS-LXFDRBQGSA-N"
"OC(=O)C(C1)NCCC1","InChI=1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)","HXEACLLIILLPRG-UHFFFAOYSA-N"
"Oc(c4)c(O)cc(c4)c([o+1]1)c(OC(O3)C(O)C(O)C(O)C(C)3)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C21H20O10/c1-8-17(26)18(27)19(28)21(29-8)31-16-7-11-13(24)5-10(22)6-15(11)30-20(16)9-2-3-12(23)14(25)4-9/h2-8,17-19,21,26-28H,1H3,(H3-,22,23,24,25)/p+1/t8-,17-,18+,19+,21-/m0/s1","USWXMMRFOWNEOR-VWLKIGRWSA-O"
"CC=CCC=CCCC(=O)[C@@H](O1)[C@H](C(N)=O)1","InChI=1S/C12H17NO3/c1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)/b3-2+,6-5+/t10-,11-/m1/s1","GVEZIHKRYBHEFX-NQQPLRFYSA-N"
"O=C(C2)CCC[C@H](C)OC(=O)c(c(O)1)c(C=CCC2)cc(O)c1","InChI=1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1","MBMQEIFVQACCCH-QBODLPLBSA-N"
"S=C=NCCCCS(C)=O","InChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3","SUVMJBTUFCVSAD-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H]1n(c3)c(n2)c(n3)c(N)nc2","InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(4(1-16)21-10)22-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1","LNQVTSROQXJCDD-KQYNXXCUSA-N"
"Oc(c4)c(O)cc(c4)C(O1)=C(OC(O3)C(O)C(O)C(O)C3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2/t12-,15+,17-,20+/m1/s1","PZZRDJXEMZMZFD-BWYUNELBSA-N"
"O[C@H](C1)[C@H](O)C(O)O1","InChI=1S/C4H8O4/c5-2-1-8-4(7)3(2)6/h2-7H,1H2/t2-,3+,4?/m1/s1","FMAORJIQYMIRHF-BCDHYOAOSA-N"
"COc(c1)c(O)c(O)cc1c([o+1]2)c(O)cc(c(O)3)c(cc(O)c3)2","InChI=1S/C16H12O7/c1-22-14-3-7(2-11(19)15(14)21)16-12(20)6-9-10(18)4-8(17)5-13(9)23-16/h2-6H,1H3,(H4-,17,18,19,20,21)/p+1","AFOLOMGWVXKIQL-UHFFFAOYSA-O"
"Oc(c4)c(O)cc(c4)c([o+1]1)c(OC(O3)C(O)C(O)C(O)C3)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C20H18O10/c21-9-4-12(23)10-6-16(30-20-18(27)17(26)14(25)7-28-20)19(29-15(10)5-9)8-1-2-11(22)13(24)3-8/h1-6,14,17-18,20,25-27H,7H2,(H3-,21,22,23,24)/p+1/t14-,17-,18+,20-/m0/s1","KUCVMQMKRICXJC-DEYWJSPQSA-O"
"COc(c(O)4)cc(cc4)c([o+1]1)c(OC(O3)C(O)C(O)C(O)C(CO)3)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1/t17-,18+,19+,20-,22-/m1/s1","ZZWPMFROUHHAKY-VRRLNDPFSA-O"
"COc(c(O)4)cc(cc4)c([o+1]1)c(OC(O3)C(O)C(O)C(O)C3)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C21H20O10/c1-28-16-4-9(2-3-12(16)23)20-17(31-21-19(27)18(26)14(25)8-29-21)7-11-13(24)5-10(22)6-15(11)30-20/h2-7,14,18-19,21,25-27H,8H2,1H3,(H2-,22,23,24)/p+1","KRUPPTWQKIEURV-UHFFFAOYSA-O"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1Oc(c3)c([o+1]c(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c(O)2","InChI=1S/C21H20O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-22,28-30H,6H2,(H4-,23,24,25,26,27)/p+1/t15-,17-,18+,19-,21-/m1/s1","XENHPQQLDPAYIJ-PEVLUNPASA-O"
"OCC(O1)C(O)C(O)C(O)C1Oc(c3)c([o+1]c(c4)c(c(O)cc(O)4)3)c(c2)cc(OC)c(O)c(O)2","InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27)/p+1/t16-,18-,19+,20-,22-/m1/s1","CCQDWIRWKWIUKK-QKYBYQKWSA-O"
"c(c5)(O)cc(c(c53)C(C(OC(O4)C(C(C(C4CO)O)O)O)=C(O3)c(c1)cc(c(OC(O2)C(C(C(C2CO)O)O)O)c1)O)=O)O","InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)41-12-2-1-8(3-10(12)31)24-25(19(35)16-11(32)4-9(30)5-13(16)40-24)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2/t14-,15-,17-,18-,20+,21+,22-,23-,26-,27+/m1/s1","RPVIQWDFJPYNJM-DEFKTLOSSA-N"
"C(C5O)(O)COC(C5O)(OC(C4O)C(OC(C4O)CO)Oc(c2)c([o+1]c(c3)c(c(O)cc3O)2)c(c1)ccc(O)c1O)[H]","InChI=1S/C26H28O15/c27-7-18-20(34)21(35)24(41-25-22(36)19(33)15(32)8-37-25)26(40-18)39-17-6-11-13(30)4-10(28)5-16(11)38-23(17)9-1-2-12(29)14(31)3-9/h1-6,15,18-22,24-27,32-36H,7-8H2,(H3-,28,29,30,31)/p+1/t15-,18-,19+,20-,21+,22-,24-,25+,26-/m1/s1","ZPPQIOUITZSYAO-AOBOYTTNSA-O"
"c(c(c([o+1]4)c(cc(c(O)5)c(cc(O)c5)4)OC(O2)C(OC(O3)C(C(C(C3CO)O)O)O)C(C(C2CO)O)O)1)c(O)c(O)cc1","InChI=1S/C27H30O16/c28-7-17-19(34)21(36)23(38)26(41-17)43-25-22(37)20(35)18(8-29)42-27(25)40-16-6-11-13(32)4-10(30)5-15(11)39-24(16)9-1-2-12(31)14(33)3-9/h1-6,17-23,25-29,34-38H,7-8H2,(H3-,30,31,32,33)/p+1/t17-,18-,19-,20-,21+,22+,23-,25-,26+,27-/m1/s1","SXYMMDGPXYVCER-WGNLCONDSA-O"
"c(O)(c(OC)1)ccc(c(c(OC(O5)C(O)C(O)C(O)C5CO)4)[o+1]c(c(c4)2)cc(O)cc2OC(O3)C(O)C(O)C(O)C3CO)c1","InChI=1S/C28H32O16/c1-39-16-4-10(2-3-13(16)32)26-17(42-28-25(38)23(36)21(34)19(9-30)44-28)7-12-14(40-26)5-11(31)6-15(12)41-27-24(37)22(35)20(33)18(8-29)43-27/h2-7,18-25,27-30,33-38H,8-9H2,1H3,(H-,31,32)/p+1/t18-,19-,20-,21-,22+,23+,24-,25-,27-,28-/m1/s1","IPVSUYLZIAYTOK-DPOJTEBASA-O"
"C(C5O)(O)C(C)OC(C5O)OCC(O1)C(C(C(C1Oc(c3)c([o+1]c(c4)c(c(O)cc4O)3)c(c2)cc(c(c2O)O)O)O)O)O","InChI=1S/C27H30O16/c1-8-18(32)21(35)23(37)26(40-8)39-7-17-20(34)22(36)24(38)27(43-17)42-16-6-11-12(29)4-10(28)5-15(11)41-25(16)9-2-13(30)19(33)14(31)3-9/h2-6,8,17-18,20-24,26-27,32,34-38H,7H2,1H3,(H4-,28,29,30,31,33)/p+1/t8-,17+,18-,20+,21+,22-,23+,24+,26+,27+/m0/s1","PLKUTZNSKRWCCA-LTSKFBHWSA-O"
"C(C5O)(O)COC(C5O)(OC(C4O)C(OC(C4O)CO)Oc(c2)c([o+1]c(c3)c(c(O)cc3O)2)c(c1)cc(c(c1O)O)O)[H]","InChI=1S/C26H28O16/c27-6-17-20(35)21(36)24(42-25-22(37)19(34)14(32)7-38-25)26(41-17)40-16-5-10-11(29)3-9(28)4-15(10)39-23(16)8-1-12(30)18(33)13(31)2-8/h1-5,14,17,19-22,24-27,32,34-37H,6-7H2,(H4-,28,29,30,31,33)/p+1/t14-,17-,19+,20-,21+,22-,24-,25+,26-/m1/s1","TWYYVOVDSNRIJM-AFAGGVQESA-O"
"c(c1)(O)c(O)ccc1c(c4OC(C5OC([H])(O6)C(C(C(C6)O)O)O)OC(C(O)C5O)CO)[o+1]c(c2c4)cc(O)cc2OC(O3)C(C(C(C3CO)O)O)O","InChI=1S/C32H38O20/c33-7-19-22(40)24(42)27(45)31(50-19)48-17-5-11(35)4-16-12(17)6-18(28(47-16)10-1-2-13(36)14(37)3-10)49-32-29(25(43)23(41)20(8-34)51-32)52-30-26(44)21(39)15(38)9-46-30/h1-6,15,19-27,29-34,38-45H,7-9H2,(H2-,35,36,37)/p+1/t15-,19-,20-,21+,22-,23-,24+,25+,26-,27-,29-,30+,31-,32-/m1/s1","OLBLWNPOURNBCY-MRBLLYQQSA-O"
"C(C1O)(OC(Oc(c23)cc(cc2[o+1]c(c(c7)cc(c(O)c7)O)c(OC(O5)C(C(C(C(COC(C=Cc(c6)ccc(O)c6)=O)5)O)O)OC(O4)C(C(C(O)C4)O)O)c3)O)C(O)C1O)CO","InChI=1S/C41H44O22/c42-13-27-31(50)33(52)36(55)40(61-27)59-25-11-19(44)10-24-20(25)12-26(37(58-24)17-4-7-21(45)22(46)9-17)60-41-38(63-39-35(54)30(49)23(47)14-57-39)34(53)32(51)28(62-41)15-56-29(48)8-3-16-1-5-18(43)6-2-16/h1-12,23,27-28,30-36,38-42,47,49-55H,13-15H2,(H3-,43,44,45,46,48)/p+1/t23-,27-,28-,30+,31-,32-,33+,34+,35-,36-,38-,39+,40-,41-/m1/s1","JSYDBTWJIIAZPU-NEVABJEQSA-O"
"OC(C(O)5)C(OC(COC(O7)C(O)C(C(C7C)OC(=O)C=Cc(c6)ccc(c6)O)O)C(O)5)Oc(c(c(c4)cc(c(O)c(OC)4)O)3)cc(c([o+1]3)1)c(OC(C(O)2)OC(CO)C(C2O)O)cc(c1)O","InChI=1S/C43H48O23/c1-16-39(66-29(48)8-5-17-3-6-19(45)7-4-17)35(54)38(57)41(60-16)59-15-28-32(51)34(53)37(56)43(65-28)63-26-13-21-23(61-40(26)18-9-22(47)30(49)25(10-18)58-2)11-20(46)12-24(21)62-42-36(55)33(52)31(50)27(14-44)64-42/h3-13,16,27-28,31-39,41-44,50-57H,14-15H2,1-2H3,(H3-,45,46,47,48,49)/p+1/t16-,27+,28+,31+,32+,33-,34-,35-,36+,37+,38+,39-,41+,42+,43+/m0/s1","BXEZTCOKOLHMKY-PJUZUSDESA-O"
"c(c4)ccc(c4)[n+1](c21)c(c3)c(cc(C)c(N)3)nc(cc(C)c(N)c2)1","InChI=1S/C20H18N4/c1-12-8-17-19(10-15(12)21)24(14-6-4-3-5-7-14)20-11-16(22)13(2)9-18(20)23-17/h3-11H,1-2H3,(H3,21,22)/p+1","WULISCVZERSMML-UHFFFAOYSA-O"
"OC(=O)C=C(C)C=CC=C(C)C=CC(=C(C)1)C(C)(C)CCC1","InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)/b9-6+,12-11+,15-8+,16-14+","SHGAZHPCJJPHSC-YCNIQYBTSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H](OC[C@@H](O2)[C@@H](O)[C@H](O)C(O)(CO)2)1","InChI=1S/C12H22O11/c13-1-4-6(15)8(17)9(18)11(22-4)21-2-5-7(16)10(19)12(20,3-14)23-5/h4-11,13-20H,1-3H2/t4-,5-,6-,7-,8+,9-,10+,11+,12?/m1/s1","PVXPPJIGRGXGCY-TZLCEDOOSA-N"
"COc(c1)c(O)cc(O2)c(C=CC(=O)2)1","InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3","RODXRVNMMDRFIK-UHFFFAOYSA-N"
"O=C(C=2)Oc(c(O)1)c(C2)ccc(O)1","InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H","ATEFPOUAMCWAQS-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c2)c(O)cc(O3)c(C=CC(=O)3)2","InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1","XHCADAYNFIFUHF-TVKJYDDYSA-N"
"C=C(C1=CC=C(C2)[C@](C3)([C@@](C)([C@@](C3)([H])[C@@H](C=C[C@@H](C(C)C)C)C)CC2)[H])CCC(C1)O","InChI=1S/C28H44O/c1-19(2)20(3)9-10-22(5)26-15-16-27-23(8-7-17-28(26,27)6)12-13-24-18-25(29)14-11-21(24)4/h9-10,12-13,19-20,22,25-27,29H,4,7-8,11,14-18H2,1-3,5-6H3/b10-9+,23-12+,24-13-/t20-,22+,25-,26+,27-,28+/m0/s1","MECHNRXZTMCUDQ-RKHKHRCZSA-N"
"O([C@](CCC=[C@](C)CCC=[C@](C)CCC=C(C)C)1C)c(c(C)2)c(c(C)c(O)c2C)CC1","InChI=1S/C29H44O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h12,14,16,30H,9-11,13,15,17-19H2,1-8H3/b21-14+,22-16+/t29-/m1/s1","RZFHLOLGZPDCHJ-XZXLULOTSA-N"
"C([C@@]2(C)CCC=[C@](C)CCC=[C@](C)CCC=C(C)C)Cc(c1O2)cc(O)cc1C","InChI=1S/C27H40O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h10,12,14,18-19,28H,7-9,11,13,15-17H2,1-6H3/b21-12+,22-14+/t27-/m1/s1","ODADKLYLWWCHNB-LDYBVBFYSA-N"
"O=C(C=2)NC(=O)N(C2)[C@@H](C1)O[C@H](COP(O)(O)=O)[C@@H](O)1","InChI=1S/C9H13N2O8P/c12-5-3-8(11-2-1-7(13)10-9(11)14)19-6(5)4-18-20(15,16)17/h1-2,5-6,8,12H,3-4H2,(H,10,13,14)(H2,15,16,17)/t5-,6+,8+/m0/s1","JSRLJPSBLDHEIO-SHYZEUOFSA-N"
"[H]C(=O)C(O)C(O)COP(O)(O)=O","InChI=1S/C4H9O7P/c5-1-3(6)4(7)2-11-12(8,9)10/h1,3-4,6-7H,2H2,(H2,8,9,10)/t3-,4+/m0/s1","NGHMDNPXVRFFGS-IUYQGCFVSA-N"
"OCC(O)(O1)[C@@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)/t3-,4-,5+,6?/m1/s1","BGWGXPAPYGQALX-VRPWFDPXSA-N"
"OCC(=O)[C@H](O)[C@H](O)COP(O)(O)=O","InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h4-6,8-9H,1-2H2,(H2,10,11,12)/t4-,5+/m1/s1","FNZLKVNUWIIPSJ-UHNVWZDZSA-N"
"O=C(N3)N=C(C(C(=O)3)=1)N(CC(O)C(O)C(O)COP(O)(O)=O)c(c2)c(cc(C)c(C)2)N1","InChI=1S/C17H21N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29)/t11-,12+,14-/m0/s1","FVTCRASFADXXNN-SCRDCRAPSA-N"
"NC(N4)=Nc(c3C(=O)4)n(cn3)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)OC(O2)[C@@H](O)[C@H](O)[C@H](O)[C@H](C)2)1","InChI=1S/C16H25N5O15P2/c1-4-7(22)9(24)11(26)15(33-4)35-38(30,31)36-37(28,29)32-2-5-8(23)10(25)14(34-5)21-3-18-6-12(21)19-16(17)20-13(6)27/h3-5,7-11,14-15,22-26H,2H2,1H3,(H,28,29)(H,30,31)(H3,17,19,20,27)/t4-,5+,7+,8+,9+,10+,11-,14+,15+/m0/s1","LQEBEXMHBLQMDB-JGQUBWHWSA-N"
"O=C(N3)c(n2)c(N=C3)n(c2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(O)=O)1","InChI=1S/C10H14N4O11P2/c15-6-4(1-23-27(21,22)25-26(18,19)20)24-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,21,22)(H,11,12,17)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1","JPXZQMKKFWMMGK-KQYNXXCUSA-N"
"O=C(N2)C(C)=CN(C(=O)2)[C@@H](C1)O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)1","InChI=1S/C10H16N2O11P2/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(22-8)4-21-25(19,20)23-24(16,17)18/h3,6-8,13H,2,4H2,1H3,(H,19,20)(H,11,14,15)(H2,16,17,18)/t6-,7+,8+/m0/s1","UJLXYODCHAELLY-XLPZGREQSA-N"
"O=C(N2)C(C)=CN(C(=O)2)[C@@H](C1)O[C@H](COP(O)(O)=O)[C@@H](O)1","InChI=1S/C10H15N2O8P/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(20-8)4-19-21(16,17)18/h3,6-8,13H,2,4H2,1H3,(H,11,14,15)(H2,16,17,18)/t6-,7+,8+/m0/s1","GYOZYWVXFNDGLU-XLPZGREQSA-N"
"O=C(C=2)NC(=O)N(C2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(O)=O)1","InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1","XCCTYIAWTASOJW-XVFCMESISA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)C1OP(O)(=O)OP(O)(=O)OC[C@@H](O2)[C@@H](O)[C@@H](O)[C@@H]2N(C=3)C(=O)NC(=O)C3","InChI=1S/C15H24N2O17P2/c18-3-5-8(20)10(22)12(24)14(32-5)33-36(28,29)34-35(26,27)30-4-6-9(21)11(23)13(31-6)17-2-1-7(19)16-15(17)25/h1-2,5-6,8-14,18,20-24H,3-4H2,(H,26,27)(H,28,29)(H,16,19,25)/t5-,6-,8-,9-,10+,11-,12-,13-,14-/m1/s1","HSCJRCZFDFQWRP-JZMIEXBBSA-N"
"O=C(C=3)NC(=O)N(C3)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(=O)OP(O)(=O)O[C@@H](O2)[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)2)1","InChI=1S/C15H22N2O18P2/c18-5-1-2-17(15(26)16-5)12-9(22)6(19)4(32-12)3-31-36(27,28)35-37(29,30)34-14-10(23)7(20)8(21)11(33-14)13(24)25/h1-2,4,6-12,14,19-23H,3H2,(H,24,25)(H,27,28)(H,29,30)(H,16,18,26)/t4-,6-,7+,8+,9-,10-,11+,12-,14-/m1/s1","HDYANYHVCAPMJV-LXQIFKJMSA-N"
"O=C(C=2)NC(=O)N(C2)[C@H](O1)[C@H](O)[C@H](O)[C@@H](COP(O)(O)=O)1","InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1","DJJCXFVJDGTHFX-XVFCMESISA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)[C@H]1OP(O)(O)=O","InChI=1S/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3+,4+,5-,6-/m1/s1","HXXFSFRBOHSIMQ-FPRJBGLDSA-N"
"O[C@@H]([C@H](O)1)[C@@H](COP(O)(O)=O)O[C@@H]([C@H](O)1)OP(O)(O)=O","InChI=1S/C6H14O12P2/c7-3-2(1-16-19(10,11)12)17-6(5(9)4(3)8)18-20(13,14)15/h2-9H,1H2,(H2,10,11,12)(H2,13,14,15)/t2-,3-,4+,5-,6-/m1/s1","RWHOZGRAXYWRNX-VFUOTHLCSA-N"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O[C@H]([C@@H](CO)3)[C@H](O)[C@@H](O)[C@@H](O3)O[C@H]([C@@H](CO)2)[C@H](O)[C@@H](O)[C@H](O)O2","InChI=1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2/t4-,5-,6-,7-,8+,9-,10-,11-,12-,13-,14-,15-,16-,17+,18+/m1/s1","FYGDTMLNYKFZSV-CSHPIKHBSA-N"
"OCC(O)C(O)C(O)C(O)CO","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2","FBPFZTCFMRRESA-UHFFFAOYSA-N"
"O=CC([H])(O)COP(O)(O)=O","InChI=1S/C3H7O6P/c4-1-3(5)2-9-10(6,7)8/h1,3,5H,2H2,(H2,6,7,8)","LXJXRIRHZLFYRP-UHFFFAOYSA-N"
"O=C(C=3)NC(=O)N(C3)C(O1)C(O)C(O)C(COP(O)(=O)OP(O)(=O)OC(O2)C(O)C(O)C(O)C(C)2)1","InChI=1S/C15H24N2O16P2/c1-5-8(19)10(21)12(23)14(30-5)32-35(27,28)33-34(25,26)29-4-6-9(20)11(22)13(31-6)17-3-2-7(18)16-15(17)24/h2-3,5-6,8-14,19-23H,4H2,1H3,(H,25,26)(H,27,28)(H,16,18,24)/t5-,6+,8-,9+,10+,11+,12+,13+,14+/m0/s1","DRDCJEIZVLVWNC-SLBWPEPYSA-N"
"O=C(C=3)NC(=O)N(C3)C(O1)C(O)C(O)C(COP(O)(=O)OP(O)(=O)OC(O2)C(O)C(O)C(O)C2)1","InChI=1S/C14H22N2O16P2/c17-5-3-28-13(11(22)8(5)19)31-34(26,27)32-33(24,25)29-4-6-9(20)10(21)12(30-6)16-2-1-7(18)15-14(16)23/h1-2,5-6,8-13,17,19-22H,3-4H2,(H,24,25)(H,26,27)(H,15,18,23)/t5-,6-,8+,9-,10-,11-,12-,13-/m1/s1","DQQDLYVHOTZLOR-OCIMBMBZSA-N"
"OC(=O)[C@@](O)(C1)C[C@@H](O)[C@@H](O)[C@H](O)1","InChI=1S/C7H12O6/c8-3-1-7(13,6(11)12)2-4(9)5(3)10/h3-5,8-10,13H,1-2H2,(H,11,12)/t3-,4-,5-,7+/m1/s1","AAWZDTNXLSGCEK-WYWMIBKRSA-N"
"OC[C@@H](O1)[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H]1N(C=2)C(=O)N=C(N)C2","InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-6(14)7(4(3-13)19-8)20-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1","UOOOPKANIPLQPU-XVFCMESISA-N"
"NC(N3)=Nc(c2C(=O)3)n(cn2)[C@@H](C1)O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)1","InChI=1S/C10H15N5O10P2/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(24-6)2-23-27(21,22)25-26(18,19)20/h3-6,16H,1-2H2,(H,21,22)(H2,18,19,20)(H3,11,13,14,17)/t4-,5+,6+/m0/s1","CIKGWCTVFSRMJU-KVQBGUIXSA-N"
"CCC=CC[C@@H](C(=O)1)[C@H](CC1)CC(=O)OC","InChI=1S/C13H20O3/c1-3-4-5-6-11-10(7-8-12(11)14)9-13(15)16-2/h4-5,10-11H,3,6-9H2,1-2H3/b5-4-/t10-,11-/m1/s1","GEWDNTWNSAZUDX-WQMVXFAESA-N"
"SCCS(O)(=O)=O","InChI=1S/C2H6O3S2/c3-7(4,5)2-1-6/h6H,1-2H2,(H,3,4,5)","ZNEWHQLOPFWXOF-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(O)C1OP(O)(=O)OP(O)(=O)OCC(O2)C(O)C(O)C2N(C=3)C(=O)NC(=O)C3","InChI=1S/C15H24N2O17P2/c18-3-5-8(20)10(22)12(24)14(32-5)33-36(28,29)34-35(26,27)30-4-6-9(21)11(23)13(31-6)17-2-1-7(19)16-15(17)25/h1-2,5-6,8-14,18,20-24H,3-4H2,(H,26,27)(H,28,29)(H,16,19,25)/t5-,6-,8+,9-,10+,11-,12-,13-,14-/m1/s1","HSCJRCZFDFQWRP-ABVWGUQPSA-N"
"OC(=O)C(O)C(O)C(O)=O","InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)","FEWJPZIEWOKRBE-UHFFFAOYSA-N"
"OC(=O)C=Cc(c1)cc(O)cc1","InChI=1S/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)/b5-4+","KKSDGJDHHZEWEP-SNAWJCMRSA-N"
"C[C@H](O1)[C@H](O)[C@@H](O)[C@@H](O)C(O)1","InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3-,4+,5+,6?/m0/s1","SHZGCJCMOBCMKK-JFNONXLTSA-N"
"CCCCCCCCCCCC(=O)OCC(OC(=O)CCCCCCCCCCC)COP(O)(O)=O","InChI=1S/C27H53O8P/c1-3-5-7-9-11-13-15-17-19-21-26(28)33-23-25(24-34-36(30,31)32)35-27(29)22-20-18-16-14-12-10-8-6-4-2/h25H,3-24H2,1-2H3,(H2,30,31,32)/t25-/m1/s1","OKLASJZQBDJAPH-RUZDIDTESA-N"
"CCCCCCCCCCCCCC(=O)OCC(O)COP(O)(O)=O","InChI=1S/C17H35O7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-17(19)23-14-16(18)15-24-25(20,21)22/h16,18H,2-15H2,1H3,(H2,20,21,22)/t16-/m1/s1","FAZBDRGXCKPVJU-MRXNPFEDSA-N"
"CC(C)CC(O)C(O)=O","InChI=1S/C6H12O3/c1-4(2)3-5(7)6(8)9/h4-5,7H,3H2,1-2H3,(H,8,9)","LVRFTAZAXQPQHI-UHFFFAOYSA-N"
"COC(=O)CCCC(=O)Cl","InChI=1S/C6H9ClO3/c1-10-6(9)4-2-3-5(7)8/h2-4H2,1H3","JCAZSWWHFJVFPP-UHFFFAOYSA-N"
"CCCC(O)C(O)=O","InChI=1S/C5H10O3/c1-2-3-4(6)5(7)8/h4,6H,2-3H2,1H3,(H,7,8)","JRHWHSJDIILJAT-UHFFFAOYSA-N"
"CCCC(=O)C(O)=O","InChI=1S/C5H8O3/c1-2-3-4(6)5(7)8/h2-3H2,1H3,(H,7,8)","KDVFRMMRZOCFLS-UHFFFAOYSA-N"
"OC(=O)C(O)c(c1)cc(O)cc1","InChI=1S/C8H8O4/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)","OLSDAJRAVOVKLG-UHFFFAOYSA-N"
"OC(=O)[C@@H](O)[C@H](O)C(O)=O","InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m0/s1","FEWJPZIEWOKRBE-LWMBPPNESA-N"
"OCC(O)C(O)=O","InChI=1S/C3H6O4/c4-1-2(5)3(6)7/h2,4-5H,1H2,(H,6,7)","RBNPOMFGQQGHHO-UHFFFAOYSA-N"
"OC[C@@H](O1)[C@H](O)[C@H](O)[C@@H](O)[C@H]1O[C@@H]([C@H](O)2)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)2","InChI=1S/C12H22O11/c13-1-2-3(14)4(15)10(21)12(22-2)23-11-8(19)6(17)5(16)7(18)9(11)20/h2-21H,1H2/t2-,3+,4+,5-,6-,7+,8+,9+,10-,11-,12-/m1/s1","VCWMRQDBPZKXKG-DXNLKLAMSA-N"
"COc(c(O)3)cc(cc3)c([o+1]1)c(O)cc(c(O)2)c(cc(O)c2)1","InChI=1S/C16H12O6/c1-21-15-4-8(2-3-11(15)18)16-13(20)7-10-12(19)5-9(17)6-14(10)22-16/h2-7H,1H3,(H3-,17,18,19,20)/p+1","XFDQJKDGGOEYPI-UHFFFAOYSA-O"
"Oc(c1)cc([o+1]2)c(cc(O)c2c(c3)cc(O)c(O)c(O)3)c(O)1","InChI=1S/C15H10O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-5H,(H5-,16,17,18,19,20,21)/p+1","JKHRCGUTYDNCLE-UHFFFAOYSA-O"
"OC[C@@H](O1)[C@@H](O)[C@H](O)[C@@H](O)[C@H](Oc(c2)cc(C=Cc(c3)cc(O)c(O)c3)cc(O)2)1","InChI=1S/C20H22O9/c21-9-16-17(25)18(26)19(27)20(29-16)28-13-6-11(5-12(22)8-13)2-1-10-3-4-14(23)15(24)7-10/h1-8,16-27H,9H2/b2-1+/t16-,17-,18+,19-,20-/m1/s1","PERPNFLGJXUDDW-CUYWLFDKSA-N"
"Oc(c4)ccc(c4)C(O1)=C(O)C(=O)c(c(O)2)c(cc(OC(O3)C(O)C(O)C(O)C(C)3)c2)1","InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3/t8-,15-,17+,19+,21-/m0/s1","HQNOUCSPWAGQND-GKLNBGJFSA-N"
"C(C1O)(C)OC(Oc(c5)cc(O2)c(c5O)C(C(OC(O4)C(C(C(C4CO)O)O)O)=C(c(c3)ccc(O)c3)2)=O)C(C1O)O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(38-9)39-12-6-13(30)16-14(7-12)40-24(10-2-4-11(29)5-3-10)25(19(16)33)42-27-23(37)21(35)18(32)15(8-28)41-27/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26-,27-/m0/s1","JYXSWDCPHRTYGU-RVCYDTIBSA-N"
"C(C1O)(C)OC(Oc(c5)cc(O2)c(c5O)C(C(OC(O4)C(C(C(C4CO)O)O)O)=C(c(c3)ccc(O)c3)2)=O)C(C1O)O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(38-9)39-12-6-13(30)16-14(7-12)40-24(10-2-4-11(29)5-3-10)25(19(16)33)42-27-23(37)21(35)18(32)15(8-28)41-27/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18-,20+,21-,22+,23+,26-,27-/m0/s1","JYXSWDCPHRTYGU-VYARGGPUSA-N"
"O(CC(O2)C(O)C(O)C(C(OC(C5=O)=C(Oc(c45)cc(O)cc4O)c(c3)cc(c(O)c3)OC)2)O)C(O1)C(O)C(C(C1C)O)O","InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(41-9)40-8-16-19(33)22(36)24(38)28(43-16)44-26-20(34)17-13(31)6-11(29)7-15(17)42-25(26)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19-,21+,22-,23+,24+,27+,28-/m0/s1","UIDGLYUNOUKLBM-ZLADREHTSA-N"
"c(c1)(c(C4=O)c(OC(=C4OC(O5)C(O)C(O)C(O)C5CO)c(c3)cc(OC)c(c3)OC(O2)C(O)C(O)C(O)C2CO)cc(O)1)O","InChI=1S/C28H32O17/c1-40-13-4-9(2-3-12(13)42-27-23(38)21(36)18(33)15(7-29)43-27)25-26(20(35)17-11(32)5-10(31)6-14(17)41-25)45-28-24(39)22(37)19(34)16(8-30)44-28/h2-6,15-16,18-19,21-24,27-34,36-39H,7-8H2,1H3/t15-,16-,18-,19-,21+,22+,23-,24-,27-,28+/m1/s1","VKVBSQRURLRCHO-QDYVESOYSA-N"
"C(C(COC(C5O)OC(C(C5OC([H])(O6)C(C(C(C(C)6)O)O)O)O)C)1)(C(O)C(C(OC(=C(c(c4)ccc(O)c4)3)C(=O)c(c2O3)c(cc(c2)O)O)O1)O)O","InChI=1S/C33H40O19/c1-10-19(37)23(41)25(43)32(48-10)51-29-20(38)11(2)47-31(27(29)45)46-9-17-21(39)24(42)26(44)33(50-17)52-30-22(40)18-15(36)7-14(35)8-16(18)49-28(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,29,31-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21-,23+,24-,25+,26+,27+,29+,31+,32-,33-/m0/s1","UYVBMGULWGRDQT-KABOUGNXSA-N"
"OC(C1O)C(O)C(Oc(c6)cc(c5c(O)6)OC(=C(C(=O)5)OC(C(OC(O4)(C(O)C(C(O)C(C)4)O)[H])3)OC(CO)C(C3O)O)c(c2)ccc(O)c2)OC1C","InChI=1S/C33H40O19/c1-10-19(37)23(41)26(44)31(46-10)48-14-7-15(36)18-16(8-14)49-28(12-3-5-13(35)6-4-12)29(22(18)40)51-33-30(25(43)21(39)17(9-34)50-33)52-32-27(45)24(42)20(38)11(2)47-32/h3-8,10-11,17,19-21,23-27,30-39,41-45H,9H2,1-2H3/t10-,11-,17+,19-,20-,21+,23+,24+,25-,26+,27+,30+,31-,32-,33-/m0/s1","DDELFAUOHDSZJL-CPGGTDLHSA-N"
"Oc(c1)cc(O2)c(C(=O)C(OC(O5)C(C(O)C(C5CO)O)OC(=O)C=Cc(c4)ccc(O)c4)=C2c(c3)ccc(c3)O)c(O)1","InChI=1S/C30H26O13/c31-13-21-24(37)26(39)29(42-22(36)10-3-14-1-6-16(32)7-2-14)30(41-21)43-28-25(38)23-19(35)11-18(34)12-20(23)40-27(28)15-4-8-17(33)9-5-15/h1-12,21,24,26,29-35,37,39H,13H2/b10-3+/t21-,24-,26+,29-,30+/m1/s1","IKONEAPXVKTZFF-NLGJGAJZSA-N"
"c(c5)(O)cc(c(c51)C(C(OC(O4)C(C(C(C4CO)O)OC(O3)(C(C(C(C3C)O)O)O)[H])O)=C(c(c2)ccc(O)c2)O1)=O)O","InChI=1S/C27H30O15/c1-9-17(32)20(35)21(36)26(38-9)41-24-18(33)15(8-28)40-27(22(24)37)42-25-19(34)16-13(31)6-12(30)7-14(16)39-23(25)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,24,26-33,35-37H,8H2,1H3/t9-,15+,17-,18+,20+,21+,22+,24-,26-,27-/m0/s1","YFPYXTNSQOUHPS-NIILUQFKSA-N"
"OC(C1O)C(O)C(Oc(c6)cc(c5c(O)6)OC(=C(C5=O)OC(C(O)3)OC(C)C(OC(O4)C(C(O)C(C4C)O)O)C3O)c(c2)ccc(O)c2)OC1C","InChI=1S/C33H40O18/c1-10-19(36)22(39)25(42)31(45-10)48-15-8-16(35)18-17(9-15)49-29(13-4-6-14(34)7-5-13)30(21(18)38)51-33-27(44)24(41)28(12(3)47-33)50-32-26(43)23(40)20(37)11(2)46-32/h4-12,19-20,22-28,31-37,39-44H,1-3H3","NLJNYZLJCNVCNR-UHFFFAOYSA-N"
"Oc(c4)ccc(c4)C(O1)=C(OC(O3)C(O)C(O)C(O)C3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C20H18O10/c21-9-3-1-8(2-4-9)18-19(30-20-17(27)15(25)12(24)7-28-20)16(26)14-11(23)5-10(22)6-13(14)29-18/h1-6,12,15,17,20-25,27H,7H2/t12-,15+,17-,20+/m1/s1","RNVUDWOQYYWXBJ-BWYUNELBSA-N"
"Oc(c4)ccc(c4)C(O1)=C(OC(O3)C(O)C(O)C(O)C(C(O)=O)3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)17-18(13(25)12-10(24)5-9(23)6-11(12)31-17)32-21-16(28)14(26)15(27)19(33-21)20(29)30/h1-6,14-16,19,21-24,26-28H,(H,29,30)/t14-,15-,16+,19-,21+/m0/s1","FNTJVYCFNVUBOL-ZUGPOPFOSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c(O)2","InChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2/t12-,15-,17+,18-,21+/m1/s1","FOHXFLPXBUAOJM-LIBJPBHASA-N"
"OC(C4)C(O)C(O)C(O4)OC(C(=O)2)=C(Oc(c3)c(c(O)cc(O)3)2)c(c1)cc(O)c(O)c(O)1","InChI=1S/C20H18O12/c21-7-3-8(22)13-12(4-7)31-18(6-1-9(23)14(26)10(24)2-6)19(16(13)28)32-20-17(29)15(27)11(25)5-30-20/h1-4,11,15,17,20-27,29H,5H2/t11-,15+,17-,20+/m1/s1","SBEOEJNITMVWLK-CFSKSFDZSA-N"
"O(C(OCC(C(O)6)OC(C(O)C(O)6)OC(C(=O)3)=C(c(c5)cc(c(c5)O)O)Oc(c4)c3c(O)cc(OC)4)1)C(C)C(O)C(OC(C2O)OC(C)C(C2O)O)C1O","InChI=1S/C34H42O20/c1-10-20(38)24(42)26(44)33(50-10)53-30-21(39)11(2)49-32(28(30)46)48-9-18-22(40)25(43)27(45)34(52-18)54-31-23(41)19-16(37)7-13(47-3)8-17(19)51-29(31)12-4-5-14(35)15(36)6-12/h4-8,10-11,18,20-22,24-28,30,32-40,42-46H,9H2,1-3H3/t10-,11-,18+,20-,21-,22-,24+,25-,26+,27+,28+,30+,32+,33-,34-/m0/s1","NMGVHLDIHNFGQB-OTCPXFHUSA-N"
"Oc(c4)c(O)cc(c4)C(O1)=C(OC(O3)C(O)C(O)C(O)C3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2/t12-,15-,17+,20-/m0/s1","PZZRDJXEMZMZFD-IEGSVRCHSA-N"
"OC(=O)C(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)/t14-,15-,16+,19-,21+/m0/s1","DUBCCGAQYVUYEU-ZUGPOPFOSA-N"
"OC(=O)CC(=O)OCC(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)/t14-,18-,20+,21-,24+/m1/s1","NBQPHANHNTWDML-UJKBSQBPSA-N"
"O=Cc(c1)cc(OC)c(O)c(OC)1","InChI=1S/C9H10O4/c1-12-7-3-6(5-10)4-8(13-2)9(7)11/h3-5,11H,1-2H3","KCDXJAYRVLXPFO-UHFFFAOYSA-N"
"O=Cc(c1)c(c2)c(ccc2)n(OC)1","InChI=1S/C10H9NO2/c1-13-11-6-8(7-12)9-4-2-3-5-10(9)11/h2-7H,1H3","NFGIENSPALNOON-UHFFFAOYSA-N"
"C(C1O)(C)OC(Oc(c5)cc(O2)c(c5O)C(C(OC(O4)C(C(C(C4C)O)O)O)=C(c(c3)ccc(O)c3O)2)=O)C(C1O)O","InChI=1S/C27H30O15/c1-8-17(31)20(34)22(36)26(38-8)40-11-6-14(30)16-15(7-11)41-24(10-3-4-12(28)13(29)5-10)25(19(16)33)42-27-23(37)21(35)18(32)9(2)39-27/h3-9,17-18,20-23,26-32,34-37H,1-2H3/t8-,9-,17-,18-,20+,21+,22+,23+,26-,27-/m0/s1","GXLQUHPXGLZNGE-BJBZVNFPSA-N"
"Oc(c4)c(O)cc(c4)C(O1)=C(O)C(=O)c(c(O)2)c(cc(OC(O3)C(O)C(O)C(O)C(C)3)c2)1","InChI=1S/C21H20O11/c1-7-15(25)17(27)19(29)21(30-7)31-9-5-12(24)14-13(6-9)32-20(18(28)16(14)26)8-2-3-10(22)11(23)4-8/h2-7,15,17,19,21-25,27-29H,1H3/t7-,15-,17+,19+,21-/m0/s1","QPHXPNUXTNHJOF-XNFUJFQVSA-N"
"OC(C1O)C(O)C(Oc(c6)cc(c(c62)C(C(OC(C(OC(O5)(C(O)C(C(O)C(C)5)O)[H])4)OC(CO)C(C4O)O)=C(c(c3)cc(c(O)c3)O)O2)=O)O)OC1C","InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(47-9)49-12-6-15(37)18-16(7-12)50-28(11-3-4-13(35)14(36)5-11)29(22(18)41)52-33-30(25(44)21(40)17(8-34)51-33)53-32-27(46)24(43)20(39)10(2)48-32/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3/t9-,10-,17+,19-,20-,21+,23+,24+,25-,26+,27+,30+,31-,32-,33-/m0/s1","WLPJMCCYDZFCBL-HTMUFORZSA-N"
"C(C1O)(C)OC(Oc(c5)cc(O2)c(c5O)C(C(OC(O4)C(C(C(C4CO)O)O)O)=C(c(c3)ccc(O)c3O)2)=O)C(C1O)O","InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(39-8)40-10-5-13(31)16-14(6-10)41-24(9-2-3-11(29)12(30)4-9)25(19(16)34)43-27-23(38)21(36)18(33)15(7-28)42-27/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26-,27-/m0/s1","OTUCXMIQUNROBJ-JFNZIVIESA-N"
"OC(=O)CC(C(O)=O)OC(=O)C=Cc(c1)cc(OC)c(O)c(OC)1","InChI=1S/C15H16O9/c1-22-9-5-8(6-10(23-2)14(9)19)3-4-13(18)24-11(15(20)21)7-12(16)17/h3-6,11,19H,7H2,1-2H3,(H,16,17)(H,20,21)/b4-3+/t11-/m0/s1","DUDGAPSRYCQPBG-UFFNRZRYSA-N"
"OCC(O1)C(O)C(O)C(O)C(OC(=O)C=Cc(c2)cc(OC)c(O)c(OC)2)1","InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3/b4-3+/t11-,14-,15+,16-,17+/m1/s1","XRKBRPFTFKKHEF-DGDBGZAXSA-N"
"c(c1)(C(O2)C(O)Cc(c(O)3)c2c(C(c54)C(C(c(c9)cc(O)c(c9)O)Oc4c(C(c76)C(C(c(c8)cc(O)c(c8)O)Oc6cc(O)cc7O)O)c(cc(O)5)O)O)c(O)c3)ccc(c(O)1)O","InChI=1S/C45H38O18/c46-18-10-27(54)33-32(11-18)61-42(16-2-5-21(48)25(52)8-16)39(59)37(33)35-29(56)14-30(57)36-38(40(60)43(63-45(35)36)17-3-6-22(49)26(53)9-17)34-28(55)13-23(50)19-12-31(58)41(62-44(19)34)15-1-4-20(47)24(51)7-15/h1-11,13-14,31,37-43,46-60H,12H2/t31-,37-,38+,39-,40-,41-,42-,43-/m1/s1","MOJZMWJRUKIQGL-XILRTYJMSA-N"
"CCCCC[C@H](O)C=C[C@@H]([C@H](O)1)[C@@H](CCCCCCC(O)=O)C(=O)C1","InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16+,17+,19+/m0/s1","GMVPRGQOIOIIMI-DWKJAMRDSA-N"
"S=C=NCCCCCCCS(C)=O","InChI=1S/C9H17NOS2/c1-13(11)8-6-4-2-3-5-7-10-9-12/h2-8H2,1H3","OGYHCBGORZWBPH-UHFFFAOYSA-N"
"S=C=NCCCCCCS(C)=O","InChI=1S/C8H15NOS2/c1-12(10)7-5-3-2-4-6-9-8-11/h2-7H2,1H3","XQZVZULJKVALRI-UHFFFAOYSA-N"
"S=C=NCCCCCCCCCS(C)=O","InChI=1S/C11H21NOS2/c1-15(13)10-8-6-4-2-3-5-7-9-12-11-14/h2-10H2,1H3","MQFLXLMNOHHPTC-UHFFFAOYSA-N"
"S=C=NCCCCCCCCS(C)=O","InChI=1S/C10H19NOS2/c1-14(12)9-7-5-3-2-4-6-8-11-10-13/h2-9H2,1H3","BCRXKWOQVFKZAG-UHFFFAOYSA-N"
"S=C=NCCCCCCS(C)(=O)=O","InChI=1S/C8H15NO2S2/c1-13(10,11)7-5-3-2-4-6-9-8-12/h2-7H2,1H3","CLJXLUXFLFBKAS-UHFFFAOYSA-N"
"CCC1=N[C@H]2C[C@]3([C@H]4C[C@@H]1[C@@H]2CO4)C(=O)N(OC)C1=CC=CC=C31","InChI=1S/C19H22N2O3/c1-3-14-11-8-17-19(9-15(20-14)12(11)10-24-17)13-6-4-5-7-16(13)21(23-2)18(19)22/h4-7,11-12,15,17H,3,8-10H2,1-2H3/t11-,12+,15+,17-,19+/m1/s1","BIGABVPVCRHEES-NWPJSNQLSA-N"
"COC(=O)C1=CO[C@H](C)[C@H]2CN3CC[C@]4([C@@H]3C[C@H]12)C(O)=NC1=CC=CC=C41","InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13+,14-,18+,21+/m1/s1","JMIAZDVHNCCPDM-DQDWJNSRSA-N"
"CO[C@H](C)C1[C@H]2N3CC[C@@]22C(NC4=CC=CC=C24)=C([C@H]1CC3)C(=O)OC","InChI=1S/C21H26N2O3/c1-12(25-2)16-13-8-10-23-11-9-21(19(16)23)14-6-4-5-7-15(14)22-18(21)17(13)20(24)26-3/h4-7,12-13,16,19,22H,8-11H2,1-3H3/t12-,13+,16?,19-,21-/m1/s1","LTOOPESWVADEAE-JHOCLNBPSA-N"
"COC(=O)[C@@]12C[C@H]3C[C@H]([C@H](C)O)[C@@H]1N(C3)CCC1=C2NC2=C1C=C(OC)C=C2","InChI=1S/C22H28N2O4/c1-12(25)16-8-13-10-22(21(26)28-3)19-15(6-7-24(11-13)20(16)22)17-9-14(27-2)4-5-18(17)23-19/h4-5,9,12-13,16,20,23,25H,6-8,10-11H2,1-3H3/t12-,13+,16+,20-,22+/m0/s1","OYMQKBZMKFJPMH-VJMPXSKLSA-N"
"C1CCC2=CC3=C4N=C5C=CC=CC5=C4C=CN3C=C2C1","InChI=1S/C19H16N2/c1-2-6-14-12-21-10-9-16-15-7-3-4-8-17(15)20-19(16)18(21)11-13(14)5-1/h3-4,7-12H,1-2,5-6H2","UQVUEULZDJRMJR-UHFFFAOYSA-N"
"C\C=C1/CN2[C@H]3CC4=C(NC5=CC=CC=C45)[C@@H]2C[C@H]1[C@@H]3CO","InChI=1S/C19H22N2O/c1-2-11-9-21-17-8-14-12-5-3-4-6-16(12)20-19(14)18(21)7-13(11)15(17)10-22/h2-6,13,15,17-18,20,22H,7-10H2,1H3/b11-2+/t13-,15+,17+,18+/m1/s1","VXTDUGOBAOLMED-CPEJFPLXSA-N"
"COC(=O)[C@]1(O)C[C@]23CCCN4CC[C@]5([C@H]24)C2=C(N[C@]15CC3)C1=C(OCO1)C=C2","InChI=1S/C22H26N2O5/c1-27-18(25)21(26)11-19-5-2-9-24-10-8-20(17(19)24)13-3-4-14-16(29-12-28-14)15(13)23-22(20,21)7-6-19/h3-4,17,23,26H,2,5-12H2,1H3/t17-,19+,20+,21+,22-/m0/s1","JVIKUDVTJCANPX-NBYDKTAJSA-N"
"COC(=O)[C@@H]1C[C@@]23CCC[N@@]4(=O)CC[C@@]5([C@@H]24)C2=CC=CC=C2N[C@@]15CC3","InChI=1S/C21H26N2O3/c1-26-17(24)15-13-19-7-4-11-23(25)12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15-,18+,19-,20-,21-,23+/m0/s1","KWXHCCIXBUPHTG-ICLMVOIRSA-N"
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"OCC1OC(C(O)C(O)C1O)C1=C(O)C2=C(OC(=CC2=O)C2=CC(O)=C(O)C=C2)C=C1O","InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2","ODBRNZZJSYPIDI-UHFFFAOYSA-N"
"OC(=O)C=CC1=CC=C(O)C=C1","InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)","NGSWKAQJJWESNS-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1O)C1=C(OC2OC(CO)C(O)C(O)C2O)C=C2C(O)=CC(O)=CC2=[O+]1","InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1","PXUQTDZNOHRWLI-UHFFFAOYSA-O"
"CC1OC(OCC2OC(OC3=C(OC4=CC(OC5OC(C)C(O)C(O)C5O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C33H40O19/c1-10-19(36)23(40)26(43)31(47-10)46-9-17-21(38)25(42)28(45)33(51-17)52-30-22(39)18-15(35)7-14(49-32-27(44)24(41)20(37)11(2)48-32)8-16(18)50-29(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-28,31-38,40-45H,9H2,1-2H3","PEFASEPMJYRQBW-UHFFFAOYSA-N"
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"OC(=O)C=CC1=CC(O)=CC=C1","InChI=1S/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)","KKSDGJDHHZEWEP-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2","FTVWIRXFELQLPI-UHFFFAOYSA-N"
"CC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3","OXGUCUVFOIWWQJ-UHFFFAOYSA-N"
"CC(=O)OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3","IGLUNMMNDNWZOA-UHFFFAOYSA-N"
"COC1=CC=C(C=CC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O)C=C1","InChI=1S/C28H34O14/c1-12-21(33)23(35)25(37)27(39-12)42-26-24(36)22(34)19(11-29)41-28(26)40-15-9-17(31)20(18(32)10-15)16(30)8-5-13-3-6-14(38-2)7-4-13/h3-10,12,19,21-29,31-37H,11H2,1-2H3","HWRDCYOHJBCWGW-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1O)C1=C(OC2OC(CO)C(O)C(O)C2O)C(=O)C2=C(O)C=C(O)C=C2O1","InChI=1S/C23H24O13/c1-32-12-3-8(4-13(33-2)16(12)27)21-22(18(29)15-10(26)5-9(25)6-11(15)34-21)36-23-20(31)19(30)17(28)14(7-24)35-23/h3-6,14,17,19-20,23-28,30-31H,7H2,1-2H3","JMFWYRWPJVEZPV-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O","InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)31-13-2-1-8(3-10(13)24)14-6-12(26)17-11(25)4-9(23)5-15(17)30-14/h1-6,16,18-25,27-29H,7H2","UHNXUSWGOJMEFO-UHFFFAOYSA-N"
"OC(=O)C(CC1=CC(O)=C(O)C=C1)OC(=O)C=CC1=CC(O)=C(O)C=C1","InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)","DOUMFZQKYFQNTF-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1CC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O1","InChI=1S/C28H34O14/c1-11-21(32)23(34)25(36)27(38-11)42-26-24(35)22(33)19(10-29)41-28(26)39-14-7-15(30)20-16(31)9-17(40-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-8,11,17,19,21-30,32-36H,9-10H2,1-2H3","NLAWPKPYBMEWIR-UHFFFAOYSA-N"
"COC1=CC=C(C=CC(O)=O)C=C1","InChI=1S/C10H10O3/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)","AFDXODALSZRGIH-UHFFFAOYSA-N"
"OCC1OC(C(O)C(O)C1O)C1=C(O)C=CC2=C1OC=C(C2=O)C1=CC=C(O)C=C1","InChI=1S/C21H20O9/c22-7-14-17(26)18(27)19(28)21(30-14)15-13(24)6-5-11-16(25)12(8-29-20(11)15)9-1-3-10(23)4-2-9/h1-6,8,14,17-19,21-24,26-28H,7H2","HKEAFJYKMMKDOR-UHFFFAOYSA-N"
"OCC1OC(C(O)C(O)C1O)C1=C(O)C=C(O)C2=C1OC(=CC2=O)C1=CC(O)=C(O)C=C1","InChI=1S/C21H20O11/c22-6-14-17(28)18(29)19(30)21(32-14)16-11(26)4-10(25)15-12(27)5-13(31-20(15)16)7-1-2-8(23)9(24)3-7/h1-5,14,17-19,21-26,28-30H,6H2","PLAPMLGJVGLZOV-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1CC(=O)C2=C(O)C=C(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)C=C2O1","InChI=1S/C28H34O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-8,11,17,19,21-29,31-36H,9-10H2,1-2H3","RMCRQBAILCLJGU-UHFFFAOYSA-N"
"COC1=CC=CC=C1C=CC(O)=O","InChI=1S/C10H10O3/c1-13-9-5-3-2-4-8(9)6-7-10(11)12/h2-7H,1H3,(H,11,12)","FEGVSPGUHMGGBO-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=CC3=C2C=C(OC2OC(CO)C(O)C(O)C2O)C(=[O+]3)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C27H30O15/c28-8-17-19(32)21(34)23(36)26(41-17)39-15-6-12(31)5-14-13(15)7-16(25(38-14)10-1-3-11(30)4-2-10)40-27-24(37)22(35)20(33)18(9-29)42-27/h1-7,17-24,26-29,32-37H,8-9H2,(H-,30,31)/p+1","SLCKJKWFULXZBD-UHFFFAOYSA-O"
"OCC1OC(OC2=C([O+]=C3C=C(O)C=C(O)C3=C2)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1","RKWHWFONKJEUEF-UHFFFAOYSA-O"
"CC1OC(OC2C(O)C(O)C(CO)OC2OC2=CC(O)=C3C(=O)C=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C27H30O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-8,10,18,20-30,32-36H,9H2,1H3","RPMNUQRUHXIGHK-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=CC(O)=C2C(=O)CCC2=CC=CC=C2)C(O)C(O)C1O","InChI=1S/C21H24O9/c22-10-16-18(26)19(27)20(28)21(30-16)29-15-9-12(23)8-14(25)17(15)13(24)7-6-11-4-2-1-3-5-11/h1-5,8-9,16,18-23,25-28H,6-7,10H2","NLGUKXQDDTZCDG-UHFFFAOYSA-N"
"COC1=CC=CC(C=CC(O)=O)=C1","InChI=1S/C10H10O3/c1-13-9-4-2-3-8(7-9)5-6-10(11)12/h2-7H,1H3,(H,11,12)","LZPNXAULYJPXEH-UHFFFAOYSA-N"
"CC1OC(OCC2OC(OC3=C([O+]=C4C=C(O)C=C(O)C4=C3)C3=CC(O)=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H30O15/c1-9-19(32)21(34)23(36)26(39-9)38-8-18-20(33)22(35)24(37)27(42-18)41-17-7-12-14(30)5-11(28)6-16(12)40-25(17)10-2-3-13(29)15(31)4-10/h2-7,9,18-24,26-27,32-37H,8H2,1H3,(H3-,28,29,30,31)/p+1","USNPULRDBDVJAO-UHFFFAOYSA-O"
"COC1=CC(C=CC=O)=CC(OC)=C1O","InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3","CDICDSOGTRCHMG-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1=COC2=C(C=CC(OC3OC(CO)C(O)C(O)C3O)=C2)C1=O","InChI=1S/C22H22O9/c1-28-12-4-2-11(3-5-12)15-10-29-16-8-13(6-7-14(16)18(15)24)30-22-21(27)20(26)19(25)17(9-23)31-22/h2-8,10,17,19-23,25-27H,9H2,1H3","MGJLSBDCWOSMHL-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1","InChI=1S/C16H14O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-7,14,17-18H,8H2,1H3","HMUJXQRRKBLVOO-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C3=C(C=C2)C(=O)CC(O3)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H22O11/c22-7-15-16(26)18(28)19(29)21(32-15)31-13-4-2-9-11(24)6-14(30-20(9)17(13)27)8-1-3-10(23)12(25)5-8/h1-5,14-16,18-19,21-23,25-29H,6-7H2","DGGOLFCPSUVVHX-UHFFFAOYSA-N"
"OC1COC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)C(O)C(O)C2O)C(O)C1O","InChI=1S/C26H28O16/c27-9-4-12(30)16-14(5-9)40-23(8-1-2-10(28)11(29)3-8)24(19(16)34)42-26-22(37)20(35)18(33)15(41-26)7-39-25-21(36)17(32)13(31)6-38-25/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2","YNMFDPCLPIMRFD-UHFFFAOYSA-N"
"COC1=C(OC)C=C(C=CC(O)=O)C=C1","InChI=1S/C11H12O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H,12,13)","HJBWJAPEBGSQPR-UHFFFAOYSA-N"
"COC1=CC(O)=C2C(=O)CC(OC2=C1)C1=CC=C(O)C=C1","InChI=1S/C16H14O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-7,14,17-18H,8H2,1H3","DJOJDHGQRNZXQQ-UHFFFAOYSA-N"
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"OCC1OC(OC2=C(O)C(O)=C(C=C2)C(=O)C=CC2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H22O11/c22-8-15-18(28)19(29)20(30)21(32-15)31-14-6-3-10(16(26)17(14)27)11(23)4-1-9-2-5-12(24)13(25)7-9/h1-7,15,18-22,24-30H,8H2","XGEYXJDOVMEJNG-UHFFFAOYSA-N"
"CC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3","SOSLMHZOJATCCP-UHFFFAOYSA-N"
"COC1=CC(C=CC(O)=O)=CC(OC)=C1","InChI=1S/C11H12O4/c1-14-9-5-8(3-4-11(12)13)6-10(7-9)15-2/h3-7H,1-2H3,(H,12,13)","VLSRUFWCGBMYDJ-UHFFFAOYSA-N"
"CC1OC(OC2C(O)C(O)C(CO)OC2C2=C(O)C=C(O)C3=C2OC(=CC3=O)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3","LYGPBZVKGHHTIE-UHFFFAOYSA-N"
"CC1OC(OCC2OC(OC3=CC(O)=C4C(=O)CC(OC4=C3)C3=CC(O)=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H32O15/c1-9-20(32)22(34)24(36)26(39-9)38-8-18-21(33)23(35)25(37)27(42-18)40-11-5-14(30)19-15(31)7-16(41-17(19)6-11)10-2-3-12(28)13(29)4-10/h2-6,9,16,18,20-30,32-37H,7-8H2,1H3","OMQADRGFMLGFJF-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=C3C(=O)CC(OC3=C2)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H22O11/c22-7-16-18(27)19(28)20(29)21(32-16)30-9-4-12(25)17-13(26)6-14(31-15(17)5-9)8-1-2-10(23)11(24)3-8/h1-5,14,16,18-25,27-29H,6-7H2","RAFHNDRXYHOLSH-UHFFFAOYSA-N"
"CC1OC(OC2=CC(O)=C3C(=O)C(O)=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3","HQNOUCSPWAGQND-UHFFFAOYSA-N"
"OC1=CC(O)=C2C(=O)CC(OC2=C1)C1=CC(O)=C(O)C=C1","InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2","SBHXYTNGIZCORC-UHFFFAOYSA-N"
"OC1CC2=C(O)C=C(O)C=C2OC1C1=CC(O)=C(O)C=C1","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2","PFTAWBLQPZVEMU-UHFFFAOYSA-N"
"OCC1OC(C(O)C(O)C1O)C1=C(O)C=C(O)C2=C1OC(=CC2=O)C1=CC=C(O)C=C1","InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2","SGEWCQFRYRRZDC-UHFFFAOYSA-N"
"CC1OC(OCC2OC(OC3=CC(O)=C4C(=O)CC(OC4=C3)C3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H32O14/c1-10-20(31)22(33)24(35)26(38-10)37-9-18-21(32)23(34)25(36)27(41-18)39-13-6-14(29)19-15(30)8-16(40-17(19)7-13)11-2-4-12(28)5-3-11/h2-7,10,16,18,20-29,31-36H,8-9H2,1H3","HXTFHSYLYXVTHC-UHFFFAOYSA-N"
"COC1=C(O)C=C(C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)C=C2O1","InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3","GZSOSUNBTXMUFQ-UHFFFAOYSA-N"
"OC1=CC=C(C=CC2=CC(O)=CC(O)=C2)C=C1","InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H","LUKBXSAWLPMMSZ-UHFFFAOYSA-N"
"OCC1OC(OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9/h1-7,16-19,21-22,26-28H,8H2,(H2-,23,24,25)/p+1","ABVCUBUIXWJYSE-UHFFFAOYSA-O"
"COC1=C(O)C=CC(=C1)C1=C(OC2OC(CO)C(O)C(O)C2O)C=C2C(O)=CC(O)=CC2=[O+]1","InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1","ZZWPMFROUHHAKY-UHFFFAOYSA-O"
"COC1=C(O)C=C(C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O1","InChI=1S/C28H32O15/c1-10-21(33)23(35)25(37)27(39-10)43-26-24(36)22(34)19(9-29)42-28(26)40-12-6-14(31)20-15(32)8-17(41-18(20)7-12)11-3-4-16(38-2)13(30)5-11/h3-8,10,19,21-31,33-37H,9H2,1-2H3","VCCNKWWXYVWTLT-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(COC4OC(C)C(O)C(O)C4O)C(O)C(O)C3O)C=C2O1","InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3","YFVGIJBUXMQFOF-UHFFFAOYSA-N"
"CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC(O)=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3","IKGXIBQEEMLURG-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=C3C(=O)CC(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2","DLIKSSGEMUFQOK-UHFFFAOYSA-N"
"OC1=CC=C(C=CC(=O)C2=C(O)C=C(O)C=C2)C=C1","InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H","DXDRHHKMWQZJHT-UHFFFAOYSA-N"
"OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2","OVSQVDMCBVZWGM-UHFFFAOYSA-N"
"COC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O1","InChI=1S/C28H34O15/c1-10-21(33)23(35)25(37)27(39-10)43-26-24(36)22(34)19(9-29)42-28(26)40-12-6-14(31)20-15(32)8-17(41-18(20)7-12)11-3-4-16(38-2)13(30)5-11/h3-7,10,17,19,21-31,33-37H,8-9H2,1-2H3","ARGKVCXINMKCAZ-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=CC(O)=C2C(=O)CCC2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2","IOUVKUPGCMBWBT-UHFFFAOYSA-N"
"OCC1OC(OC2=C(C3OC(CO)C(O)C(O)C3O)C(O)=C3C(=O)C=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C27H30O15/c28-7-15-19(32)22(35)24(37)26(40-15)18-14(41-27-25(38)23(36)20(33)16(8-29)42-27)6-13-17(21(18)34)11(31)5-12(39-13)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2","HGUVPEBGCAVWID-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C=C(C=C2)C2=C(O)C(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O","InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)32-11-2-1-7(3-9(11)24)20-18(29)16(27)14-10(25)4-8(23)5-12(14)31-20/h1-5,13,15,17,19,21-26,28-30H,6H2","OIUBYZLTFSLSBY-UHFFFAOYSA-N"
"OC1C(COC(=O)C=CC2=CC=C(O)C=C2)OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(O)C1O","InChI=1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2","DVGGLGXQSFURLP-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1=COC2=CC(OC3OC(CO)C(O)C(O)C3O)=CC(O)=C2C1=O","InChI=1S/C22H22O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3","LFEUICHQZGNOHD-UHFFFAOYSA-N"
"COC1=C(O)C=C(C=C1)C1CC(=O)C2=C(O)C=C(O)C=C2O1","InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3","AIONOLUJZLIMTK-UHFFFAOYSA-N"
"CC1OC(OCC2OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3","RTATXGUCZHCSNG-UHFFFAOYSA-N"
"COC1=C(O)C=CC(=C1)C1=C(OC2OC(CO)C(O)C(O)C2O)C(=O)C2=C(O)C=C(O)C=C2O1","InChI=1S/C22H22O12/c1-31-12-4-8(2-3-10(12)25)20-21(17(28)15-11(26)5-9(24)6-13(15)32-20)34-22-19(30)18(29)16(27)14(7-23)33-22/h2-6,14,16,18-19,22-27,29-30H,7H2,1H3","CQLRUIIRRZYHHS-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C3=C(C=C2)C(=O)C(O3)=CC2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O11/c22-7-14-16(26)18(28)19(29)21(32-14)31-12-4-2-9-15(25)13(30-20(9)17(12)27)6-8-1-3-10(23)11(24)5-8/h1-6,14,16,18-19,21-24,26-29H,7H2","SYRURBPRFQUYQS-UHFFFAOYSA-N"
"COC1=C(O)C=C(CCC(=O)C2=C(O)C=C(OC3OC(CO)C(O)C(O)C3OC3OC(C)C(O)C(O)C3O)C=C2O)C=C1","InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3","ITVGXXMINPYUHD-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C=C(C=C2)C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O","InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)41-12-2-1-8(3-10(12)31)24-25(19(35)16-11(32)4-9(30)5-13(16)40-24)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2","RPVIQWDFJPYNJM-UHFFFAOYSA-N"
"OC1C(O)C(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)OC(C1O)C(O)=O","InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)","DUBCCGAQYVUYEU-UHFFFAOYSA-N"
"CC1OC(OC2C(O)C(CO)OC(OC3=C(OC4=CC(O)=CC(O)=C4C3=O)C3=CC=C(O)C=C3)C2O)C(O)C(O)C1O","InChI=1S/C27H30O15/c1-9-17(32)20(35)21(36)26(38-9)41-24-18(33)15(8-28)40-27(22(24)37)42-25-19(34)16-13(31)6-12(30)7-14(16)39-23(25)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,24,26-33,35-37H,8H2,1H3","YFPYXTNSQOUHPS-UHFFFAOYSA-N"
"OCC1OC(OC2=C([O+]=C3C=C(O)C=C(O)C3=C2)C2=CC(O)=C(O)C(O)=C2)C(OC2OCC(O)C(O)C2O)C(O)C1O","InChI=1S/C26H28O16/c27-6-17-20(35)21(36)24(42-25-22(37)19(34)14(32)7-38-25)26(41-17)40-16-5-10-11(29)3-9(28)4-15(10)39-23(16)8-1-12(30)18(33)13(31)2-8/h1-5,14,17,19-22,24-27,32,34-37H,6-7H2,(H4-,28,29,30,31,33)/p+1","TWYYVOVDSNRIJM-UHFFFAOYSA-O"
"COC1=C(OC2OC(CO)C(O)C(O)C2O)C=CC(=C1)C1=C(OC2OC(CO)C(O)C(O)C2O)C(=O)C2=C(O)C=C(O)C=C2O1","InChI=1S/C28H32O17/c1-40-13-4-9(2-3-12(13)42-27-23(38)21(36)18(33)15(7-29)43-27)25-26(20(35)17-11(32)5-10(31)6-14(17)41-25)45-28-24(39)22(37)19(34)16(8-30)44-28/h2-6,15-16,18-19,21-24,27-34,36-39H,7-8H2,1H3","VKVBSQRURLRCHO-UHFFFAOYSA-N"
"OC1CC2=C(OC1C1=CC(O)=C(O)C=C1)C(C1C(O)C(OC3=C(C4C(O)C(OC5=CC(O)=CC(O)=C45)C4=CC(O)=C(O)C=C4)C(O)=CC(O)=C13)C1=CC(O)=C(O)C=C1)=C(O)C=C2O","InChI=1S/C45H38O18/c46-18-10-27(54)33-32(11-18)61-42(16-2-5-21(48)25(52)8-16)39(59)37(33)35-29(56)14-30(57)36-38(40(60)43(63-45(35)36)17-3-6-22(49)26(53)9-17)34-28(55)13-23(50)19-12-31(58)41(62-44(19)34)15-1-4-20(47)24(51)7-15/h1-11,13-14,31,37-43,46-60H,12H2","MOJZMWJRUKIQGL-UHFFFAOYSA-N"
"OC1COC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C1O","InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2","PZZRDJXEMZMZFD-UHFFFAOYSA-N"
"OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O","InChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2","FOHXFLPXBUAOJM-UHFFFAOYSA-N"
"OCC1OC(OC2C(OC3=C([O+]=C4C=C(O)C=C(O)C4=C3)C3=CC(O)=C(O)C=C3)OC(CO)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H30O16/c28-7-17-19(34)21(36)23(38)26(41-17)43-25-22(37)20(35)18(8-29)42-27(25)40-16-6-11-13(32)4-10(30)5-15(11)39-24(16)9-1-2-12(31)14(33)3-9/h1-6,17-23,25-29,34-38H,7-8H2,(H3-,30,31,32,33)/p+1","SXYMMDGPXYVCER-UHFFFAOYSA-O"
"OCC1OC(OC2=C(O)C=C3OC(=O)C=CC3=C2)C(O)C(O)C1O","InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2","XHCADAYNFIFUHF-UHFFFAOYSA-N"
"OC1COC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O","InChI=1S/C20H18O12/c21-7-3-8(22)13-12(4-7)31-18(6-1-9(23)14(26)10(24)2-6)19(16(13)28)32-20-17(29)15(27)11(25)5-30-20/h1-4,11,15,17,20-27,29H,5H2","SBEOEJNITMVWLK-UHFFFAOYSA-N"
"CC1OC(OC2C(O)C(C)OC(OCC3OC(OC4=C(OC5=CC(O)=CC(O)=C5C4=O)C4=CC=C(O)C=C4)C(O)C(O)C3O)C2O)C(O)C(O)C1O","InChI=1S/C33H40O19/c1-10-19(37)23(41)25(43)32(48-10)51-29-20(38)11(2)47-31(27(29)45)46-9-17-21(39)24(42)26(44)33(50-17)52-30-22(40)18-15(36)7-14(35)8-16(18)49-28(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-27,29,31-39,41-45H,9H2,1-2H3","UYVBMGULWGRDQT-UHFFFAOYSA-N"
"OCC1OC(OC2=C([O+]=C3C=C(O)C=C(O)C3=C2)C2=CC(O)=C(O)C=C2)C(OC2OCC(O)C(O)C2O)C(O)C1O","InChI=1S/C26H28O15/c27-7-18-20(34)21(35)24(41-25-22(36)19(33)15(32)8-37-25)26(40-18)39-17-6-11-13(30)4-10(28)5-16(11)38-23(17)9-1-2-12(29)14(31)3-9/h1-6,15,18-22,24-27,32-36H,7-8H2,(H3-,28,29,30,31)/p+1","ZPPQIOUITZSYAO-UHFFFAOYSA-O"
"OC1C(O)C(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)OC(C1O)C(O)=O","InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)17-18(13(25)12-10(24)5-9(23)6-11(12)31-17)32-21-16(28)14(26)15(27)19(33-21)20(29)30/h1-6,14-16,19,21-24,26-28H,(H,29,30)","FNTJVYCFNVUBOL-UHFFFAOYSA-N"
"OC1COC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(O)C1O","InChI=1S/C20H18O10/c21-9-3-1-8(2-4-9)18-19(30-20-17(27)15(25)12(24)7-28-20)16(26)14-11(23)5-10(22)6-13(14)29-18/h1-6,12,15,17,20-25,27H,7H2","RNVUDWOQYYWXBJ-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=CC3=[O+]C(=C(OC4OC(CO)C(O)C(O)C4OC4OCC(O)C(O)C4O)C=C23)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C32H38O20/c33-7-19-22(40)24(42)27(45)31(50-19)48-17-5-11(35)4-16-12(17)6-18(28(47-16)10-1-2-13(36)14(37)3-10)49-32-29(25(43)23(41)20(8-34)51-32)52-30-26(44)21(39)15(38)9-46-30/h1-6,15,19-27,29-34,38-45H,7-9H2,(H2-,35,36,37)/p+1","OLBLWNPOURNBCY-UHFFFAOYSA-O"
"OC1COC(OC2=C([O+]=C3C=C(O)C=C(O)C3=C2)C2=CC(O)=C(O)C=C2)C(O)C1O","InChI=1S/C20H18O10/c21-9-4-12(23)10-6-16(30-20-18(27)17(26)14(25)7-28-20)19(29-15(10)5-9)8-1-2-11(22)13(24)3-8/h1-6,14,17-18,20,25-27H,7H2,(H3-,21,22,23,24)/p+1","KUCVMQMKRICXJC-UHFFFAOYSA-O"
"COC1=C(O)C=CC(=C1)C1=C(OC2OC(CO)C(O)C(O)C2O)C=C2C([O-])=CC(O)=CC2=[O+]1","InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)","ZZWPMFROUHHAKY-UHFFFAOYSA-N"
"COC1=C(O)C=CC(=C1)C1=C(OC2OC(CO)C(O)C(O)C2O)C=C2C(OC3OC(CO)C(O)C(O)C3O)=CC(O)=CC2=[O+]1","InChI=1S/C28H32O16/c1-39-16-4-10(2-3-13(16)32)26-17(42-28-25(38)23(36)21(34)19(9-30)44-28)7-12-14(40-26)5-11(31)6-15(12)41-27-24(37)22(35)20(33)18(8-29)43-27/h2-7,18-25,27-30,33-38H,8-9H2,1H3,(H-,31,32)/p+1","IPVSUYLZIAYTOK-UHFFFAOYSA-O"
"CC1OC(OC2=C([O+]=C3C=C(O)C=C(O)C3=C2)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O10/c1-8-17(26)18(27)19(28)21(29-8)31-16-7-11-13(24)5-10(22)6-15(11)30-20(16)9-2-3-12(23)14(25)4-9/h2-8,17-19,21,26-28H,1H3,(H3-,22,23,24,25)/p+1","USWXMMRFOWNEOR-UHFFFAOYSA-O"
"OCC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(OC(=O)C=CC2=CC=C(O)C=C2)C(O)C1O","InChI=1S/C30H26O13/c31-13-21-24(37)26(39)29(42-22(36)10-3-14-1-6-16(32)7-2-14)30(41-21)43-28-25(38)23-19(35)11-18(34)12-20(23)40-27(28)15-4-8-17(33)9-5-15/h1-12,21,24,26,29-35,37,39H,13H2","IKONEAPXVKTZFF-UHFFFAOYSA-N"
"OCC1OC(C(O)C1O)C1=C(O)C(C2OC(CO)C(O)C(O)C2O)=C2OC(=CC(=O)C2=C1O)C1=CC=C(O)C=C1","InChI=1S/C26H28O14/c27-6-12-17(31)21(35)23(37)26(40-12)16-20(34)15(25-22(36)18(32)13(7-28)39-25)19(33)14-10(30)5-11(38-24(14)16)8-1-3-9(29)4-2-8/h1-5,12-13,17-18,21-23,25-29,31-37H,6-7H2","DRLZZQRQMWQRLZ-UHFFFAOYSA-N"
"OCC1OC(C(O)C1O)C1=C2OC(=CC(=O)C2=C(O)C(C2OC(CO)C(O)C(O)C2O)=C1O)C1=CC=C(O)C=C1","InChI=1S/C26H28O14/c27-6-12-17(31)21(35)23(37)25(39-12)15-19(33)14-10(30)5-11(8-1-3-9(29)4-2-8)38-24(14)16(20(15)34)26-22(36)18(32)13(7-28)40-26/h1-5,12-13,17-18,21-23,25-29,31-37H,6-7H2","TUIJPUWSXVFWSH-UHFFFAOYSA-N"
"COC1=C(O)C=CC(C=CC=O)=C1","InChI=1S/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3","DKZBBWMURDFHNE-UHFFFAOYSA-N"
"OC(=O)C=CC1=CC(O)=C(O)C=C1","InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)","QAIPRVGONGVQAS-UHFFFAOYSA-N"
"OCC1OC(C(O)C(O)C1O)C1=C(O)C(C2OC(CO)C(O)C(O)C2O)=C2OC(=CC(=O)C2=C1O)C1=CC(O)=C(O)C=C1","InChI=1S/C27H30O16/c28-5-12-17(33)21(37)23(39)26(42-12)15-19(35)14-10(32)4-11(7-1-2-8(30)9(31)3-7)41-25(14)16(20(15)36)27-24(40)22(38)18(34)13(6-29)43-27/h1-4,12-13,17-18,21-24,26-31,33-40H,5-6H2","ZLPSOQFIIQIIAX-UHFFFAOYSA-N"
"OCC1OC(OC2C(O)C(O)C(CO)OC2OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C27H30O16/c28-7-14-17(33)20(36)22(38)26(40-14)43-25-21(37)18(34)15(8-29)41-27(25)42-24-19(35)16-12(32)5-11(31)6-13(16)39-23(24)9-1-3-10(30)4-2-9/h1-6,14-15,17-18,20-22,25-34,36-38H,7-8H2","LKZDFKLGDGSGEO-UHFFFAOYSA-N"
"OCC1OC(C(O)C(O)C1O)C1=C(O)C2=C(OC(=CC2=O)C2=CC=C(O)C=C2)C=C1O","InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2","MYXNWGACZJSMBT-UHFFFAOYSA-N"
"COC1=C(O)C=CC(C=CC(O)=O)=C1","InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)","KSEBMYQBYZTDHS-UHFFFAOYSA-N"
"OCC1OC(SC(CC=C)=NOS(O)(=O)=O)C(O)C(O)C1O","InChI=1S/C10H17NO9S2/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18)","PHZOWSSBXJXFOR-UHFFFAOYSA-N"
"OCC1OC(SC(CC(O)C2=CC=CC=C2)=NOS(O)(=O)=O)C(O)C(O)C1O","InChI=1S/C15H21NO10S2/c17-7-10-12(19)13(20)14(21)15(25-10)27-11(16-26-28(22,23)24)6-9(18)8-4-2-1-3-5-8/h1-5,9-10,12-15,17-21H,6-7H2,(H,22,23,24)","GAPDDBFHNYHZIS-UHFFFAOYSA-N"
"CSCCCCC(SC1OC(CO)C(O)C(O)C1O)=NOS(O)(=O)=O","InChI=1S/C12H23NO9S3/c1-23-5-3-2-4-8(13-22-25(18,19)20)24-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)","GKUMMDFLKGFCKH-UHFFFAOYSA-N"
"CS(=O)CCCCCCCN=C=S","InChI=1S/C9H17NOS2/c1-13(11)8-6-4-2-3-5-7-10-9-12/h2-8H2,1H3","OGYHCBGORZWBPH-UHFFFAOYSA-N"
"OCC1OC(SC(CC2=CC=C(O)C=C2)=NOS(O)(=O)=O)C(O)C(O)C1O","InChI=1S/C14H19NO10S2/c16-6-9-11(18)12(19)13(20)14(24-9)26-10(15-25-27(21,22)23)5-7-1-3-8(17)4-2-7/h1-4,9,11-14,16-20H,5-6H2,(H,21,22,23)","WWBNBPSEKLOHJU-UHFFFAOYSA-N"
"CS(=O)CCCCCCCCN=C=S","InChI=1S/C10H19NOS2/c1-14(12)9-7-5-3-2-4-6-8-11-10-13/h2-9H2,1H3","BCRXKWOQVFKZAG-UHFFFAOYSA-N"
"OCC1OC(SC(CC(O)C=C)=NOS(O)(=O)=O)C(O)C(O)C1O","InChI=1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)","MYHSVHWQEVDFQT-UHFFFAOYSA-N"
"OCC1OC(SC(CC2=CC=CC=C2)=NOS(O)(=O)=O)C(O)C(O)C1O","InChI=1S/C14H19NO9S2/c16-7-9-11(17)12(18)13(19)14(23-9)25-10(15-24-26(20,21)22)6-8-4-2-1-3-5-8/h1-5,9,11-14,16-19H,6-7H2,(H,20,21,22)","QQGLQYQXUKHWPX-UHFFFAOYSA-N"
"CC1=C2CC3C(=C)CCCC3(C)CC2(O)OC1=O","InChI=1S/C15H20O3/c1-9-5-4-6-14(3)8-15(17)12(7-11(9)14)10(2)13(16)18-15/h11,17H,1,4-8H2,2-3H3","FBMORZZOJSDNRQ-UHFFFAOYSA-N"
"OCC1OC(OC2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2","BJRNKVDFDLYUGJ-UHFFFAOYSA-N"
"COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1CC=C2CO","InChI=1S/C17H24O10/c1-24-15(23)9-6-25-16(11-7(4-18)2-3-8(9)11)27-17-14(22)13(21)12(20)10(5-19)26-17/h2,6,8,10-14,16-22H,3-5H2,1H3","IBFYXTRXDNAPMM-UHFFFAOYSA-N"
"OCC1OC(OC2OC=C3C(=O)OCC=C3C2C=C)C(O)C(O)C1O","InChI=1S/C16H20O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2-3,6-7,10-13,15-20H,1,4-5H2","DUAGQYUORDTXOR-UHFFFAOYSA-N"
"C[C@]12C[C@@]3([C@@H]4C[C@]1([C@@]4([C@H](O2)O3)COC(=O)C5=CC=CC=C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O","InChI=1S/C23H28O11/c1-20-9-22(29)13-7-23(20,32-18-16(27)15(26)14(25)12(8-24)31-18)21(13,19(33-20)34-22)10-30-17(28)11-5-3-2-4-6-11/h2-6,12-16,18-19,24-27,29H,7-10H2,1H3/t12-,13-,14-,15+,16-,18+,19-,20+,21+,22-,23+/m1/s1","YKRGDOXKVOZESV-WRJNSLSBSA-N"
"COC1=C(O)C=C2C(=O)OC3C(O)C(O)C(CO)OC3C2=C1O","InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3","YWJXCIXBAKGUKZ-UHFFFAOYSA-N"
"COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(O)CC12","InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3","AMBQHHVBBHTQBF-UHFFFAOYSA-N"
"CC(=O)OC1C2OC22C3CCC4CC(O)CCC4(C)C3CCC2(C)C1C1=COC(=O)C=C1","InChI=1S/C26H34O6/c1-14(27)31-22-21(15-4-7-20(29)30-13-15)25(3)11-9-18-19(26(25)23(22)32-26)6-5-16-12-17(28)8-10-24(16,18)2/h4,7,13,16-19,21-23,28H,5-6,8-12H2,1-3H3","SCULJPGYOQQXTK-UHFFFAOYSA-N"
"CC12CCC3C(CCC4CC(O)CCC34C)C1(O)CCC2C1=COC(=O)C=C1","InChI=1S/C24H34O4/c1-22-10-7-17(25)13-16(22)4-5-20-19(22)8-11-23(2)18(9-12-24(20,23)27)15-3-6-21(26)28-14-15/h3,6,14,16-20,25,27H,4-5,7-13H2,1-2H3","QEEBRPGZBVVINN-UHFFFAOYSA-N"
"OCC1OC(OC2=CC=C(C=C2)C2CC(=O)C3=C(O2)C=C(O)C=C3)C(O)C(O)C1O","InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2","DEMKZLAVQYISIA-UHFFFAOYSA-N"
"CC12CCC3C(CCC4CC(O)CCC34C)C11OC1CC2C1=COC(=O)C=C1","InChI=1S/C24H32O4/c1-22-9-7-16(25)11-15(22)4-5-18-17(22)8-10-23(2)19(12-20-24(18,23)28-20)14-3-6-21(26)27-13-14/h3,6,13,15-20,25H,4-5,7-12H2,1-2H3","ATLJNLYIJOCWJE-UHFFFAOYSA-N"
"CC1OC(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(OC2OC(COC(=O)C=CC3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C1O","InChI=1S/C36H36O18/c1-14-26(43)30(47)34(54-35-31(48)29(46)27(44)23(52-35)13-49-24(42)9-4-15-2-6-17(37)7-3-15)36(50-14)53-33-28(45)25-21(41)11-18(38)12-22(25)51-32(33)16-5-8-19(39)20(40)10-16/h2-12,14,23,26-27,29-31,34-41,43-44,46-48H,13H2,1H3","LSMKTLJKBSXMMR-UHFFFAOYSA-N"
"OC1CC(CC(OC(=O)C=CC2=CC(O)=C(O)C=C2)C1O)(OC(=O)C=CC1=CC(O)=C(O)C=C1)C(O)=O","InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)","YDDUMTOHNYZQPO-UHFFFAOYSA-N"
"OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(C=C(C=C2O)C(O)=O)C3C2C3=C(C(OC4OC(CO)C(O)C(O)C4O)=CC=C3)C(=O)C3=C2C=C(C=C3O)C(O)=O)C(O)C(O)C1O","InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58)","IPQVTOJGNYVQEO-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C(O)=C3C(=O)C=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C21H20O11/c22-7-14-17(26)19(28)20(29)21(32-14)31-13-6-12-15(18(27)16(13)25)10(24)5-11(30-12)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2","VUGRLRAUZWGZJP-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(OC1OC(COC2OC(CO)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C","InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3","JDCPEKQWFDWQLI-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(OC1OC(COC2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C","InChI=1S/C54H92O23/c1-23(2)10-9-14-54(8,77-48-44(69)40(65)37(62)29(74-48)22-70-46-42(67)38(63)34(59)26(19-55)71-46)24-11-16-53(7)33(24)25(58)18-31-51(5)15-13-32(50(3,4)30(51)12-17-52(31,53)6)75-49-45(41(66)36(61)28(21-57)73-49)76-47-43(68)39(64)35(60)27(20-56)72-47/h10,24-49,55-69H,9,11-22H2,1-8H3","GZYPWOGIYAIIPV-UHFFFAOYSA-N"
"CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(OC7OC(CO)C(O)C7O)C(O)C6O)C(O)=O)C(C)(C)C5CCC34C)C2C1)C(=O)OC1OC(CO)C(O)C(O)C1O","InChI=1S/C47H74O18/c1-42(2)14-16-47(41(59)65-39-33(55)30(52)28(50)23(19-48)61-39)17-15-45(6)21(22(47)18-42)8-9-26-44(5)12-11-27(43(3,4)25(44)10-13-46(26,45)7)62-40-34(56)31(53)35(36(64-40)37(57)58)63-38-32(54)29(51)24(20-49)60-38/h8,22-36,38-40,48-56H,9-20H2,1-7H3,(H,57,58)","KQSFNXMDCOFFGW-UHFFFAOYSA-N"
"OCC1OC(OC2OC=C3C(=O)OCCC3(O)C2C=C)C(O)C(O)C1O","InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2","HEYZWPRKKUGDCR-UHFFFAOYSA-N"
"CC1CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC34C)C2C1C)C(O)=O","InChI=1S/C30H48O4/c1-17-10-13-30(25(33)34)15-14-28(6)19(23(30)18(17)2)8-9-22-27(5)16-20(31)24(32)26(3,4)21(27)11-12-29(22,28)7/h8,17-18,20-24,31-32H,9-16H2,1-7H3,(H,33,34)","HFGSQOYIOKBQOW-UHFFFAOYSA-N"
"CC1C(=O)OC2C(O)C34C5CC(C(C)(C)C)C33C(O)C(=O)OC3OC4(C(=O)O5)C12O","InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3","SQOJOAFXDQDRGF-UHFFFAOYSA-N"
"CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(O)=O)C(C)(C)C5CCC34C)C2C1)C(=O)OC1OC(CO)C(O)C(O)C1O","InChI=1S/C48H76O19/c1-43(2)14-16-48(42(61)67-40-35(58)31(54)29(52)24(20-50)63-40)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(33(56)32(55)36(65-41)38(59)60)66-39-34(57)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-58H,9-20H2,1-7H3,(H,59,60)","NFZYDZXHKFHPGA-UHFFFAOYSA-N"
"CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC35OCC6(CCC(C)(C)CC36)C(O)CC45C)C2(C)CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O","InChI=1S/C42H68O13/c1-21-28(46)33(55-34-31(49)30(48)29(47)22(18-43)53-34)32(50)35(52-21)54-27-10-11-37(4)23(38(27,5)19-44)8-12-39(6)24(37)9-13-42-25-16-36(2,3)14-15-41(25,20-51-42)26(45)17-40(39,42)7/h9,13,21-35,43-50H,8,10-12,14-20H2,1-7H3","KYWSCMDFVARMPN-UHFFFAOYSA-N"
"CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C)C5CCC34C)C2C1)C(O)=O","InChI=1S/C30H48O4/c1-25(2)12-14-30(24(33)34)15-13-28(6)18(19(30)16-25)8-9-22-27(5)17-20(31)23(32)26(3,4)21(27)10-11-29(22,28)7/h8,19-23,31-32H,9-17H2,1-7H3,(H,33,34)","MDZKJHQSJHYOHJ-UHFFFAOYSA-N"
"CC1OC(OC2CCC3(C)C(CCC4(C)C3C=CC3=C5CC(C)(C)CCC5(CO)C(O)CC43C)C2(C)CO)C(O)C(OC2OC(CO)C(O)C(O)C2O)C1O","InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3","WRYJYFCCMSVEPQ-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(CC21C)OC1OC(CO)C(O)C(O)C1O","InChI=1S/C42H72O14/c1-20(2)10-9-13-42(8,56-37-34(52)32(50)30(48)25(19-44)55-37)21-11-15-40(6)28(21)22(45)16-26-39(5)14-12-27(46)38(3,4)35(39)23(17-41(26,40)7)53-36-33(51)31(49)29(47)24(18-43)54-36/h10,21-37,43-52H,9,11-19H2,1-8H3","YURJSTAIMNSZAE-UHFFFAOYSA-N"
"COC1=C(O)C=CC(=C1)C1OC2=C(C=C(C=C2O)C2OC3=CC(O)=CC(O)=C3C(=O)C2O)C1CO","InChI=1S/C25H22O10/c1-33-18-6-10(2-3-15(18)28)23-14(9-26)13-4-11(5-17(30)25(13)35-23)24-22(32)21(31)20-16(29)7-12(27)8-19(20)34-24/h2-8,14,22-24,26-30,32H,9H2,1H3","BMLIIPOXVWESJG-UHFFFAOYSA-N"
"COC1=C(OC)C=C(CC2COC(=O)C2CC2=CC(OC)=C(O)C=C2)C=C1","InChI=1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3","NQWVSMVXKMHKTF-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1O)C1C2C(COC2=O)C(OC2OC3COC(C)OC3C(O)C2O)C2=CC3=C(OCO3)C=C12","InChI=1S/C29H32O13/c1-11-36-9-20-27(40-11)24(31)25(32)29(41-20)42-26-14-7-17-16(38-10-39-17)6-13(14)21(22-15(26)8-37-28(22)33)12-4-18(34-2)23(30)19(5-12)35-3/h4-7,11,15,20-22,24-27,29-32H,8-10H2,1-3H3","VJJPUSNTGOMMGY-UHFFFAOYSA-N"
"OCC(CC1=CC(O)=CC=C1)C(CO)CC1=CC(O)=CC=C1","InChI=1S/C18H22O4/c19-11-15(7-13-3-1-5-17(21)9-13)16(12-20)8-14-4-2-6-18(22)10-14/h1-6,9-10,15-16,19-22H,7-8,11-12H2","DWONJCNDULPHLV-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1OC)C1C2C(COC2=O)C(O)C2=CC3=C(OCO3)C=C12","InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3","YJGVMLPVUAXIQN-UHFFFAOYSA-N"
"COC1=C(O)C=CC(CC2COC(C2CO)C2=CC(OC)=C(O)C=C2)=C1","InChI=1S/C20H24O6/c1-24-18-8-12(3-5-16(18)22)7-14-11-26-20(15(14)10-21)13-4-6-17(23)19(9-13)25-2/h3-6,8-9,14-15,20-23H,7,10-11H2,1-2H3","MHXCIKYXNYCMHY-UHFFFAOYSA-N"
"COC1=C(O)C=CC(CC2COC(=O)C2CC2=CC(OC)=C(O)C=C2)=C1","InChI=1S/C20H22O6/c1-24-18-9-12(3-5-16(18)21)7-14-11-26-20(23)15(14)8-13-4-6-17(22)19(10-13)25-2/h3-6,9-10,14-15,21-22H,7-8,11H2,1-2H3","MATGKVZWFZHCLI-UHFFFAOYSA-N"
"COC1=C(O)C=CC(CC(CO)C(CO)CC2=CC(OC)=C(O)C=C2)=C1","InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3","PUETUDUXMCLALY-UHFFFAOYSA-N"
"COC1=C(O)C=CC(=C1)C1OCC2C1COC2C1=CC(OC)=C(O)C=C1","InChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3","HGXBRUKMWQGOIE-UHFFFAOYSA-N"
"COC1=C(OC)C=C(CC2COC(=O)C2CC2=CC(OC)=C(OC3OC(CO)C(O)C(O)C3O)C=C2)C=C1","InChI=1S/C27H34O11/c1-33-18-6-4-14(10-20(18)34-2)8-16-13-36-26(32)17(16)9-15-5-7-19(21(11-15)35-3)37-27-25(31)24(30)23(29)22(12-28)38-27/h4-7,10-11,16-17,22-25,27-31H,8-9,12-13H2,1-3H3","XOJVHLIYNSOZOO-UHFFFAOYSA-N"
"OC1=CC=CC(CC2COC(=O)C2CC2=CC(O)=CC=C2)=C1","InChI=1S/C18H18O4/c19-15-5-1-3-12(8-15)7-14-11-22-18(21)17(14)10-13-4-2-6-16(20)9-13/h1-6,8-9,14,17,19-20H,7,10-11H2","HVDGDHBAMCBBLR-UHFFFAOYSA-N"
"COC1=C(OC)C=C(C=C1)C1OCC2C1COC2C1=CC(OC)=C(OC2OC(CO)C(O)C(O)C2O)C=C1","InChI=1S/C27H34O11/c1-32-17-6-4-13(8-19(17)33-2)25-15-11-36-26(16(15)12-35-25)14-5-7-18(20(9-14)34-3)37-27-24(31)23(30)22(29)21(10-28)38-27/h4-9,15-16,21-31H,10-12H2,1-3H3","KFFCKOBAHMGTMW-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1OC1OC(CO)C(O)C(O)C1O)C1OCC2C1COC2C1=CC(OC)=C(OC2OC(CO)C(O)C(O)C2O)C(OC)=C1","InChI=1S/C34H46O18/c1-43-17-5-13(6-18(44-2)31(17)51-33-27(41)25(39)23(37)21(9-35)49-33)29-15-11-48-30(16(15)12-47-29)14-7-19(45-3)32(20(8-14)46-4)52-34-28(42)26(40)24(38)22(10-36)50-34/h5-8,15-16,21-30,33-42H,9-12H2,1-4H3","FFDULTAFAQRACT-UHFFFAOYSA-N"
"OC1=CC=C(C=CC=O)C=C1","InChI=1S/C9H8O2/c10-7-1-2-8-3-5-9(11)6-4-8/h1-7,11H","CJXMVKYNVIGQBS-UHFFFAOYSA-N"
"OCC=CC1=CC=C(O)C=C1","InChI=1S/C9H10O2/c10-7-1-2-8-3-5-9(11)6-4-8/h1-6,10-11H,7H2","PTNLHDGQWUGONS-UHFFFAOYSA-N"
"CC(C)C(N=C(O)CC1=CNC2=CC=CC=C12)C(O)=O","InChI=1S/C15H18N2O3/c1-9(2)14(15(19)20)17-13(18)7-10-8-16-12-6-4-3-5-11(10)12/h3-6,8-9,14,16H,7H2,1-2H3,(H,17,18)(H,19,20)","AZEGJHGXTSUPPG-UHFFFAOYSA-N"
"OCC=CC1=CC(O)=C(O)C=C1","InChI=1S/C9H10O3/c10-5-1-2-7-3-4-8(11)9(12)6-7/h1-4,6,10-12H,5H2","ZCKDCRKBURQZPT-UHFFFAOYSA-N"
"CCC(C)C(N=C(O)CC1=CNC2=CC=CC=C12)C(O)=O","InChI=1S/C16H20N2O3/c1-3-10(2)15(16(20)21)18-14(19)8-11-9-17-13-7-5-4-6-12(11)13/h4-7,9-10,15,17H,3,8H2,1-2H3,(H,18,19)(H,20,21)","WPTUQMUCTTVOFW-UHFFFAOYSA-N"
"OC(=O)CCC(N=C(O)CC1=CNC2=CC=CC=C12)C(O)=O","InChI=1S/C15H16N2O5/c18-13(17-12(15(21)22)5-6-14(19)20)7-9-8-16-11-4-2-1-3-10(9)11/h1-4,8,12,16H,5-7H2,(H,17,18)(H,19,20)(H,21,22)","YRKLGWOHYXIKSF-UHFFFAOYSA-N"
"OC(CC1=CNC2=CC=CC=C12)=NC(CC1=CC=CC=C1)C(O)=O","InChI=1S/C19H18N2O3/c22-18(11-14-12-20-16-9-5-4-8-15(14)16)21-17(19(23)24)10-13-6-2-1-3-7-13/h1-9,12,17,20H,10-11H2,(H,21,22)(H,23,24)","BUGQHORRADGONS-UHFFFAOYSA-N"
"CC(=O)OC1=CC=C(C=CC2=CC(OC(C)=O)=CC(OC(C)=O)=C2)C=C1","InChI=1S/C20H18O6/c1-13(21)24-18-8-6-16(7-9-18)4-5-17-10-19(25-14(2)22)12-20(11-17)26-15(3)23/h4-12H,1-3H3","PDAYUJSOJIMKIS-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(C=CC3=CC=C(O)C=C3)=CC(O)=C2)C(O)C(O)C1O","InChI=1S/C20H22O8/c21-10-16-17(24)18(25)19(26)20(28-16)27-15-8-12(7-14(23)9-15)2-1-11-3-5-13(22)6-4-11/h1-9,16-26H,10H2","HSTZMXCBWJGKHG-UHFFFAOYSA-N"
"COC1=CC(C=CC2=CC=C(O)C=C2)=CC(OC)=C1","InChI=1S/C16H16O3/c1-18-15-9-13(10-16(11-15)19-2)4-3-12-5-7-14(17)8-6-12/h3-11,17H,1-2H3","VLEUZFDZJKSGMX-UHFFFAOYSA-N"
"CC12CCC(C)(CC1C1=CC(=O)C3C4(C)CCC(OC5OC(C(O)C(O)C5OC5OC(C(O)C(O)C5O)C(O)=O)C(O)=O)C(C)(CO)C4CCC3(C)C1(C)CC2)C(O)=O","InChI=1S/C42H62O17/c1-37-11-12-38(2,36(54)55)16-19(37)18-15-20(44)31-39(3)9-8-22(40(4,17-43)21(39)7-10-42(31,6)41(18,5)14-13-37)56-35-30(26(48)25(47)29(58-35)33(52)53)59-34-27(49)23(45)24(46)28(57-34)32(50)51/h15,19,21-31,34-35,43,45-49H,7-14,16-17H2,1-6H3,(H,50,51)(H,52,53)(H,54,55)","WBQVRPYEEYUEBQ-UHFFFAOYSA-N"
"CC1OC(OC2C(O)C(O)C(CO)OC2OC2C(O)C(O)C(OC2OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CC(O)C5(C)CCC43C)C2(C)CO)C(O)=O)C(O)C(O)C1O","InChI=1S/C48H78O18/c1-21-29(52)31(54)35(58)40(61-21)65-37-32(55)30(53)24(19-49)62-41(37)66-38-34(57)33(56)36(39(59)60)64-42(38)63-28-12-13-45(5)25(46(28,6)20-50)11-14-48(8)26(45)10-9-22-23-17-43(2,3)18-27(51)44(23,4)15-16-47(22,48)7/h9,21,23-38,40-42,49-58H,10-20H2,1-8H3,(H,59,60)","PTDAHAWQAGSZDD-UHFFFAOYSA-N"
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"CC(C)=CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(CC21C)OC1OC(CO)C(O)C(O)C1O","InChI=1S/C36H62O9/c1-19(2)10-9-13-36(8,43)20-11-15-34(6)26(20)21(38)16-24-33(5)14-12-25(39)32(3,4)30(33)22(17-35(24,34)7)44-31-29(42)28(41)27(40)23(18-37)45-31/h10,20-31,37-43H,9,11-18H2,1-8H3","RAQNTCRNSXYLAH-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(O)CC21C","InChI=1S/C36H62O9/c1-19(2)10-9-13-36(8,45-31-29(43)28(42)27(41)23(18-37)44-31)20-11-15-34(6)26(20)21(38)16-24-33(5)14-12-25(40)32(3,4)30(33)22(39)17-35(24,34)7/h10,20-31,37-43H,9,11-18H2,1-8H3","XNGXWSFSJIQMNC-UHFFFAOYSA-N"
"CCC(C)=CCCC(C)(OC1OC(COC2OCC(O)C(O)C2O)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C2CCC2C(C)(C)C(CCC12C)OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O","InChI=1S/C53H90O22/c1-8-23(2)10-9-15-53(7,75-48-44(67)40(63)38(61)31(72-48)22-69-46-42(65)35(58)28(57)21-68-46)25-13-16-52(6)24-11-12-32-50(3,4)33(14-17-51(32,5)26(24)18-27(56)34(25)52)73-49-45(41(64)37(60)30(20-55)71-49)74-47-43(66)39(62)36(59)29(19-54)70-47/h10,24-49,54-67H,8-9,11-22H2,1-7H3","SNPYJWZTTUVUIS-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C","InChI=1S/C42H72O13/c1-21(2)10-9-14-42(8,55-37-35(51)33(49)31(47)25(20-44)53-37)22-11-16-41(7)29(22)23(45)18-27-39(5)15-13-28(38(3,4)26(39)12-17-40(27,41)6)54-36-34(50)32(48)30(46)24(19-43)52-36/h10,22-37,43-51H,9,11-20H2,1-8H3","SWIROVJVGRGSPO-UHFFFAOYSA-N"
"CC1C2C(OC11CCC(C)CO1)C(O)C1C3CCC4CC(OC5OC(CO)C(OC6OC(CO)C(O)C(OC7OCC(O)C(O)C7O)C6OC6OC(CO)C(O)C(OC7OC(CO)C(O)C(O)C7O)C6O)C(O)C5O)C(O)CC4(C)C3CCC21C","InChI=1S/C56H92O29/c1-19-7-10-56(75-17-19)20(2)31-45(85-56)37(67)32-22-6-5-21-11-26(24(61)12-55(21,4)23(22)8-9-54(31,32)3)76-50-42(72)39(69)44(30(16-60)80-50)81-53-48(47(36(66)29(15-59)79-53)83-49-40(70)33(63)25(62)18-74-49)84-52-43(73)46(35(65)28(14-58)78-52)82-51-41(71)38(68)34(64)27(13-57)77-51/h19-53,57-73H,5-18H2,1-4H3","UVYVLBIGDKGWPX-UHFFFAOYSA-N"
"CC1OC(OC2C(O)C(O)C(CO)OC2OC2CC3(C)C(CC(O)C4C(CCC34C)C(=C)CCC=C(C)C)C3(C)CCC(O)C(C)(C)C23)C(O)C(O)C1O","InChI=1S/C42H70O12/c1-20(2)11-10-12-21(3)23-13-16-41(8)29(23)24(44)17-27-40(7)15-14-28(45)39(5,6)36(40)25(18-42(27,41)9)52-38-35(33(49)31(47)26(19-43)53-38)54-37-34(50)32(48)30(46)22(4)51-37/h11,22-38,43-50H,3,10,12-19H2,1-2,4-9H3","ZVTVWDXRNMHGNY-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C","InChI=1S/C42H72O13/c1-21(2)10-9-14-42(8,51)22-11-16-41(7)29(22)23(45)18-27-39(5)15-13-28(38(3,4)26(39)12-17-40(27,41)6)54-37-35(33(49)31(47)25(20-44)53-37)55-36-34(50)32(48)30(46)24(19-43)52-36/h10,22-37,43-51H,9,11-20H2,1-8H3","RWXIFXNRCLMQCD-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C","InChI=1S/C36H62O8/c1-20(2)10-9-14-36(8,42)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(32(3,4)24(33)12-17-34(25,35)6)44-31-30(41)29(40)28(39)23(19-37)43-31/h10,21-31,37-42H,9,11-19H2,1-8H3","CKUVNOCSBYYHIS-UHFFFAOYSA-N"
"CC(C)=CCC=C(C)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C","InChI=1S/C42H70O12/c1-21(2)10-9-11-22(3)23-12-16-42(8)30(23)24(45)18-28-40(6)15-14-29(39(4,5)27(40)13-17-41(28,42)7)53-38-36(34(49)32(47)26(20-44)52-38)54-37-35(50)33(48)31(46)25(19-43)51-37/h10-11,23-38,43-50H,9,12-20H2,1-8H3","NJUXRKMKOFXMRX-UHFFFAOYSA-N"
"CC(C)=CCCC(C)(OC1OC(CO)C(O)C(O)C1O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3CCC21C","InChI=1S/C36H62O8/c1-20(2)10-9-14-36(8,44-31-30(42)29(41)28(40)23(19-37)43-31)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(39)32(3,4)24(33)12-17-34(25,35)6/h10,21-31,37-42H,9,11-19H2,1-8H3","FVIZARNDLVOMSU-UHFFFAOYSA-N"
"O=C(O)C8OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC7OC(CO)C(O)C(O)C7(OC6OC(CO)C(O)C(O)C6(O)))C(O)C8(O)","InChI=1S/C48H78O19/c1-43(2)16-22-21-8-9-26-45(4)12-11-28(46(5,20-51)25(45)10-13-48(26,7)47(21,6)15-14-44(22,3)27(52)17-43)64-42-38(34(58)33(57)36(65-42)39(60)61)67-41-37(32(56)30(54)24(19-50)63-41)66-40-35(59)31(55)29(53)23(18-49)62-40/h8,22-38,40-42,49-59H,9-20H2,1-7H3,(H,60,61)","WFRQIKSNAYYUJZ-UHFFFAOYSA-N"
"OCC1OC(OC2OC=C(C(CC3=NC=CC4=C3NC3=C4C=CC=C3)C2C=C)C(O)=O)C(O)C(O)C1O","InChI=1S/C26H28N2O9/c1-2-12-15(9-18-20-14(7-8-27-18)13-5-3-4-6-17(13)28-20)16(24(33)34)11-35-25(12)37-26-23(32)22(31)21(30)19(10-29)36-26/h2-8,11-12,15,19,21-23,25-26,28-32H,1,9-10H2,(H,33,34)","UZLBTLIRYSYTRG-UHFFFAOYSA-N"
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"OC1=CC=C(C=C1)C=CC3=CC(O)=CC(OC2OC(CO)C(O)C(O)C2(O))=C3","InChI=1S/C20H22O8/c21-10-16-17(24)18(25)19(26)20(28-16)27-15-8-12(7-14(23)9-15)2-1-11-3-5-13(22)6-4-11/h1-9,16-26H,10H2","HSTZMXCBWJGKHG-UHFFFAOYSA-N"
"OC1CC(CC(OC(=O)C=CC2=CC=C(O)C(O)=C2)C1O)(OC(=O)C=CC1=CC=C(O)C(O)=C1)C(O)=O","InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)","YDDUMTOHNYZQPO-UHFFFAOYSA-N"
"COC1=C(O)C2=C(C=C1O)C(=O)OC1C(O)C(O)C(CO)OC21","InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3","YWJXCIXBAKGUKZ-UHFFFAOYSA-N"
"OC1=CC=NC2=C1C=CC=C2","InChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6H,(H,10,11)","PMZDQRJGMBOQBF-UHFFFAOYSA-N"
"OC1=CC(CC2COC(=O)C2CC2=CC(O)=CC=C2)=CC=C1","InChI=1S/C18H18O4/c19-15-5-1-3-12(8-15)7-14-11-22-18(21)17(14)10-13-4-2-6-16(20)9-13/h1-6,8-9,14,17,19-20H,7,10-11H2","HVDGDHBAMCBBLR-UHFFFAOYSA-N"
"COC1=CC(CC2COC(=O)C2CC2=CC=C(O)C(OC)=C2)=CC=C1O","InChI=1S/C20H22O6/c1-24-18-9-12(3-5-16(18)21)7-14-11-26-20(23)15(14)8-13-4-6-17(22)19(10-13)25-2/h3-6,9-10,14-15,21-22H,7-8,11H2,1-2H3","MATGKVZWFZHCLI-UHFFFAOYSA-N"
"COC1=CC(CC(CO)C(CO)CC2=CC=C(O)C(OC)=C2)=CC=C1O","InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3","PUETUDUXMCLALY-UHFFFAOYSA-N"
"COC1=CC(CC2COC(C2CO)C2=CC(OC)=C(O)C=C2)=CC=C1O","InChI=1S/C20H24O6/c1-24-18-8-12(3-5-16(18)22)7-14-11-26-20(15(14)10-21)13-4-6-17(23)19(9-13)25-2/h3-6,8-9,14-15,20-23H,7,10-11H2,1-2H3","MHXCIKYXNYCMHY-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1OC)C1C2C(COC2=O)C(O)C2=C1C=C1OCOC1=C2","InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3","YJGVMLPVUAXIQN-UHFFFAOYSA-N"
"COC1=CC(CC2C(CC3=CC(OC)=C(OC)C=C3)COC2=O)=CC=C1OC1OC(CO)C(O)C(O)C1O","InChI=1S/C27H34O11/c1-33-18-6-4-14(10-20(18)34-2)8-16-13-36-26(32)17(16)9-15-5-7-19(21(11-15)35-3)37-27-25(31)24(30)23(29)22(12-28)38-27/h4-7,10-11,16-17,22-25,27-31H,8-9,12-13H2,1-3H3","XOJVHLIYNSOZOO-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1O)C1C2C(COC2=O)C(OC2OC3COC(C)OC3C(O)C2O)C2=C1C=C1OCOC1=C2","InChI=1S/C29H32O13/c1-11-36-9-20-27(40-11)24(31)25(32)29(41-20)42-26-14-7-17-16(38-10-39-17)6-13(14)21(22-15(26)8-37-28(22)33)12-4-18(34-2)23(30)19(5-12)35-3/h4-7,11,15,20-22,24-27,29-32H,8-10H2,1-3H3","VJJPUSNTGOMMGY-UHFFFAOYSA-N"
"COC1=CC=C2CC3N(C)CCC4=C(O)C(OC)=C(OC)C(OC5=C(OC)C=C6CCN=C(CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34","InChI=1S/C37H38N2O7/c1-39-15-13-25-33-28(39)17-22-8-11-29(41-2)31(18-22)45-24-9-6-21(7-10-24)16-27-26-20-32(30(42-3)19-23(26)12-14-38-27)46-35(33)37(44-5)36(43-4)34(25)40/h6-11,18-20,28,40H,12-17H2,1-5H3","CLDCTFPNFRITPI-UHFFFAOYSA-N"
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"OC1COC(OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)C(O)C1O","InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2","PZZRDJXEMZMZFD-UHFFFAOYSA-N"
"OC1C(O)C(OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C(O)=C2)OC(C1O)C(O)=O","InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)","DUBCCGAQYVUYEU-UHFFFAOYSA-N"
"OC1C(COC(=O)C=CC2=CC=C(O)C=C2)OC(OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C=C2)C(O)C1O","InChI=1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2","DVGGLGXQSFURLP-UHFFFAOYSA-N"
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"OC1=C(O)C(O)=C2C(=O)C=C(OC2=C1)C1=CC=CC=C1","InChI=1S/C15H10O5/c16-9-6-11(8-4-2-1-3-5-8)20-12-7-10(17)14(18)15(19)13(9)12/h1-7,17-19H","FXNFHKRTJBSTCS-UHFFFAOYSA-N"
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"OC1=C(C=CC=C1)C1CC(=O)C2=C(O1)C=CC=C2","InChI=1S/C15H12O3/c16-12-7-3-1-5-10(12)15-9-13(17)11-6-2-4-8-14(11)18-15/h1-8,15-16H,9H2","KZKWCKFDCPVDFJ-UHFFFAOYSA-N"
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"COC1=CC(C=CC=O)=CC=C1O","InChI=1S/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3","DKZBBWMURDFHNE-UHFFFAOYSA-N"
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"OC(=O)C(CC1=CC=C(O)C(O)=C1)OC(=O)C=CC1=CC=C(O)C(O)=C1","InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)","DOUMFZQKYFQNTF-UHFFFAOYSA-N"
"C1CCC2=C[N+]3=C(C=C2C1)C1=C(C=C3)C2=C([N-]1)C=CC=C2","InChI=1S/C19H16N2/c1-2-6-14-12-21-10-9-16-15-7-3-4-8-17(15)20-19(16)18(21)11-13(14)5-1/h3-4,7-12H,1-2,5-6H2","UQVUEULZDJRMJR-UHFFFAOYSA-N"
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"OC1=CC=C(C=C1CC=C)C1=C(O)C=CC(CC=C)=C1","InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2","FVYXIJYOAGAUQK-UHFFFAOYSA-N"
"OC1=CC=C(CC=C)C=C1C1=CC(CC=C)=CC=C1O","InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2","VVOAZFWZEDHOOU-UHFFFAOYSA-N"
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"OC1COC(OC2=CC3=C(C=C(O)C=C3O)[O+]=C2C2=CC=C(O)C(O)=C2)C(O)C1O","InChI=1S/C20H18O10/c21-9-4-12(23)10-6-16(30-20-18(27)17(26)14(25)7-28-20)19(29-15(10)5-9)8-1-2-11(22)13(24)3-8/h1-6,14,17-18,20,25-27H,7H2,(H3-,21,22,23,24)/p+1","KUCVMQMKRICXJC-UHFFFAOYSA-O"
"COC1=CC(=CC=C1O)C1=C(OC2OC(CO)C(O)C(O)C2O)C=C2C(O)=CC(O)=CC2=[O+]1","InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1","ZZWPMFROUHHAKY-UHFFFAOYSA-O"
"OCC1OC(OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)C(O)C(O)C1O","InChI=1S/C21H20O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-22,28-30H,6H2,(H4-,23,24,25,26,27)/p+1","XENHPQQLDPAYIJ-UHFFFAOYSA-O"
"COC1=CC(=CC(OC)=C1O)C1=[O+]C2=CC(O)=CC(O)=C2C=C1OC1OC(CO)C(O)C(O)C1O","InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1","PXUQTDZNOHRWLI-UHFFFAOYSA-O"
"CC1OC(OCC2OC(OC3=C([O+]=C4C=C(O)C=C(O)C4=C3)C3=CC=C(O)C(O)=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H30O15/c1-9-19(32)21(34)23(36)26(39-9)38-8-18-20(33)22(35)24(37)27(42-18)41-17-7-12-14(30)5-11(28)6-16(12)40-25(17)10-2-3-13(29)15(31)4-10/h2-7,9,18-24,26-27,32-37H,8H2,1H3,(H3-,28,29,30,31)/p+1","USNPULRDBDVJAO-UHFFFAOYSA-O"
"OCC1OC(OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)C(OC2OCC(O)C(O)C2O)C(O)C1O","InChI=1S/C26H28O16/c27-6-17-20(35)21(36)24(42-25-22(37)19(34)14(32)7-38-25)26(41-17)40-16-5-10-11(29)3-9(28)4-15(10)39-23(16)8-1-12(30)18(33)13(31)2-8/h1-5,14,17,19-22,24-27,32,34-37H,6-7H2,(H4-,28,29,30,31,33)/p+1","TWYYVOVDSNRIJM-UHFFFAOYSA-O"
"OCC1OC(OC2C(OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C=C3)OC(CO)C(O)C2O)C(O)C(O)C1O","InChI=1S/C27H30O16/c28-7-17-19(34)21(36)23(38)26(41-17)43-25-22(37)20(35)18(8-29)42-27(25)40-16-6-11-13(32)4-10(30)5-15(11)39-24(16)9-1-2-12(31)14(33)3-9/h1-6,17-23,25-29,34-38H,7-8H2,(H3-,30,31,32,33)/p+1","SXYMMDGPXYVCER-UHFFFAOYSA-O"
"CC(C)CC(NC(=O)CC1=CNC2=C1C=CC=C2)C(O)=O","InChI=1S/C16H20N2O3/c1-10(2)7-14(16(20)21)18-15(19)8-11-9-17-13-6-4-3-5-12(11)13/h3-6,9-10,14,17H,7-8H2,1-2H3,(H,18,19)(H,20,21)","HCZNPUHZYPPINM-UHFFFAOYSA-N"
"COC1=CC=C2C(NC3=C2C=CN=C3C)=C1","InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3","BXNJHAXVSOCGBA-UHFFFAOYSA-N"
"COC1=CC=C2C(NC3=C2C2OCC4C2N2CC(=CC)C4CC32)=C1","InChI=1S/C20H22N2O2/c1-3-10-8-22-16-7-13(10)14-9-24-20(19(14)22)17-12-5-4-11(23-2)6-15(12)21-18(16)17/h3-6,13-14,16,19-21H,7-9H2,1-2H3","XJTWLFBHBFSVRS-UHFFFAOYSA-N"
"CN1CC2(C=C)C3CC4OCC3C1C2C41C(=O)NC2=C1C=CC=C2","InChI=1S/C20H22N2O2/c1-3-19-10-22(2)16-11-9-24-15(8-13(11)19)20(17(16)19)12-6-4-5-7-14(12)21-18(20)23/h3-7,11,13,15-17H,1,8-10H2,2H3,(H,21,23)","NFYYATWFXNPTRM-UHFFFAOYSA-N"
"COC1=CC=C2C(NC3=C2CC2C(CO)C4CC3N2CC4=CC)=C1","InChI=1S/C20H24N2O2/c1-3-11-9-22-18-8-15-13-5-4-12(24-2)6-17(13)21-20(15)19(22)7-14(11)16(18)10-23/h3-6,14,16,18-19,21,23H,7-10H2,1-2H3","RBALEJFQJCAPLN-UHFFFAOYSA-N"
"OC(=O)C1=CC2=C(OCO2)C2=C1C(=CC1=CC=C(O)C=C21)[N+]([O-])=O","InChI=1S/C16H9NO7/c18-8-2-1-7-3-11(17(21)22)13-10(16(19)20)5-12-15(24-6-23-12)14(13)9(7)4-8/h1-5,18H,6H2,(H,19,20)","NBFGYDJKTHENDP-UHFFFAOYSA-N"
"COC1=CC2=C(CC3N(C)CCC4=CC(O)=C(OC)C2=C34)C=C1O","InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3","LZJRNLRASBVRRX-UHFFFAOYSA-N"
"OC1CCC2CN3CCC4=C(NC5=C4C=CC=C5)C3CC2C1C(O)=O","InChI=1S/C20H24N2O3/c23-17-6-5-11-10-22-8-7-13-12-3-1-2-4-15(12)21-19(13)16(22)9-14(11)18(17)20(24)25/h1-4,11,14,16-18,21,23H,5-10H2,(H,24,25)","AADVZSXPNRLYLV-UHFFFAOYSA-N"
"COC(=O)C1=COC(C)C2CN3CCC4=C(NC5=C4C=CC=C5)C3CC12","InChI=1S/C21H24N2O3/c1-12-16-10-23-8-7-14-13-5-3-4-6-18(13)22-20(14)19(23)9-15(16)17(11-26-12)21(24)25-2/h3-6,11-12,15-16,19,22H,7-10H2,1-2H3","GRTOGORTSDXSFK-UHFFFAOYSA-N"
"COC(C)C1C2N3CCC22C(NC4=C2C=CC=C4)=C(C1CC3)C(=O)OC","InChI=1S/C21H26N2O3/c1-12(25-2)16-13-8-10-23-11-9-21(19(16)23)14-6-4-5-7-15(14)22-18(21)17(13)20(24)26-3/h4-7,12-13,16,19,22H,8-11H2,1-3H3","LTOOPESWVADEAE-UHFFFAOYSA-N"
"CON1C(=O)C2(CC3C4COC2CC4C(CN3C)=CC)C2=C1C=CC=C2","InChI=1S/C21H26N2O3/c1-4-13-11-22(2)18-10-21(19-9-14(13)15(18)12-26-19)16-7-5-6-8-17(16)23(25-3)20(21)24/h4-8,14-15,18-19H,9-12H2,1-3H3","SJKRPUOXUNOPOP-UHFFFAOYSA-N"
"COC(=O)C1C(O)CCC2CN3CCC4=C(NC5=C4C=CC=C5)C3CC12","InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3","BLGXFZZNTVWLAY-UHFFFAOYSA-N"
"COC(=O)C1=COC(C)C2CN3CCC4(C3CC12)C(=O)NC1=C4C=CC=C1","InChI=1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)","JMIAZDVHNCCPDM-UHFFFAOYSA-N"
"COC1=CC=C2C(NC3=C2C2OCC4C2N2CC(=CCO)C4CC32)=C1","InChI=1S/C20H22N2O3/c1-24-11-2-3-12-15(6-11)21-18-16-7-13-10(4-5-23)8-22(16)19-14(13)9-25-20(19)17(12)18/h2-4,6,13-14,16,19-21,23H,5,7-9H2,1H3","OUONWRIEOZGMSQ-UHFFFAOYSA-N"
"COC(=O)C12CC3CC(C(C)O)C1N(C3)CCC1=C2NC2=CC=C(OC)C=C12","InChI=1S/C22H28N2O4/c1-12(25)16-8-13-10-22(21(26)28-3)19-15(6-7-24(11-13)20(16)22)17-9-14(27-2)4-5-18(17)23-19/h4-5,9,12-13,16,20,23,25H,6-8,10-11H2,1-3H3","OYMQKBZMKFJPMH-UHFFFAOYSA-N"
"CCC1CN2CCC3(C2CC1C(=COC)C(=O)OC)C(=O)NC1=CC=CC=C31","InChI=1S/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)","DAXYUDFNWXHGBE-UHFFFAOYSA-N"
"COC1=C(OC)C(OC)=C2C(CCC(N(C)CC3=C(O)C=CC=C3)C3=CC(=O)C(OC)=CC=C23)=C1","InChI=1S/C28H31NO6/c1-29(16-18-8-6-7-9-22(18)30)21-12-10-17-14-25(33-3)27(34-4)28(35-5)26(17)19-11-13-24(32-2)23(31)15-20(19)21/h6-9,11,13-15,21,30H,10,12,16H2,1-5H3","SOFSXTKPGSIDCI-UHFFFAOYSA-N"
"CCOC(=O)OC1=C(OC)C=C(C=C1OC)C(=O)OC1CC2CN3CCC4=C(NC5=CC(OC)=CC=C45)C3CC2C(C1OC)C(=O)OC","InChI=1S/C35H42N2O11/c1-7-46-35(40)48-31-26(42-3)12-18(13-27(31)43-4)33(38)47-28-14-19-17-37-11-10-22-21-9-8-20(41-2)15-24(21)36-30(22)25(37)16-23(19)29(32(28)44-5)34(39)45-6/h8-9,12-13,15,19,23,25,28-29,32,36H,7,10-11,14,16-17H2,1-6H3","ZCDNRPPFBQDQHR-UHFFFAOYSA-N"
"CCC1CC2CN3CCC4=C(NC5=C4C=C(OC)C(=C5)C4CC5C(C(CC6=C4NC4=CC=CC=C64)N(C)CC5=CC)C(=O)OC)C(C2)(C13)C(=O)OC","InChI=1S/C43H52N4O5/c1-7-24-15-23-20-43(42(49)52-6)39-27(13-14-47(21-23)40(24)43)29-19-36(50-4)30(17-34(29)45-39)31-16-28-25(8-2)22-46(3)35(37(28)41(48)51-5)18-32-26-11-9-10-12-33(26)44-38(31)32/h8-12,17,19,23-24,28,31,35,37,40,44-45H,7,13-16,18,20-22H2,1-6H3","VCMIRXRRQJNZJT-UHFFFAOYSA-N"
"COC(=O)C1=C2NC3=C(C=CC=C3)C22CCN3C2C2(CCOC2C24CC5CC67CCOC6CCN6CCC8(C76)C6=C(N(C2)C58OC34)C(OC)=CC=C6)C1","InChI=1S/C43H48N4O6/c1-49-29-9-5-7-27-31(29)47-23-40-21-24-20-38-13-18-51-30(38)10-15-45-16-12-42(27,35(38)45)43(24,47)53-37(40)46-17-11-41-26-6-3-4-8-28(26)44-32(41)25(33(48)50-2)22-39(34(41)46)14-19-52-36(39)40/h3-9,24,30,34-37,44H,10-23H2,1-2H3","RZBFPDQKWUWUCK-UHFFFAOYSA-N"
"O=CC6(C)(C(OC1OC(C(=O)O)C(O)C(O)C1(O))C(O)CC5(C)(C6(CCC3(C)(C5(CC=C2C4CC(C)(C)CCC4(C(=O)O)(CCC23(C)))))))","InChI=1S/C36H54O11/c1-31(2)11-13-36(30(44)45)14-12-34(5)18(19(36)15-31)7-8-22-32(3)16-20(38)27(33(4,17-37)21(32)9-10-35(22,34)6)47-29-25(41)23(39)24(40)26(46-29)28(42)43/h7,17,19-27,29,38-41H,8-16H2,1-6H3,(H,42,43)(H,44,45)","WFAOGVATCATFDU-UHFFFAOYSA-N"
"O=C(O)C6OC(OC5C(O)CC4(C)(C(CCC2(C)(C4(CC=C1C3CC(C)(C)CCC3(C(=O)O)(CCC12(C)))))C5(C(=O)O)(C)))C(O)C(O)C6(O)","InChI=1S/C36H54O12/c1-31(2)11-13-36(30(45)46)14-12-33(4)17(18(36)15-31)7-8-20-32(3)16-19(37)26(35(6,29(43)44)21(32)9-10-34(20,33)5)48-28-24(40)22(38)23(39)25(47-28)27(41)42/h7,18-26,28,37-40H,8-16H2,1-6H3,(H,41,42)(H,43,44)(H,45,46)","QOOMNXCRAXXTJZ-UHFFFAOYSA-N"
"O=C(O)C6(C)(C(OC1OC(CO)C(O)C(O)C1(O))C(O)CC5(C)(C6(CCC3(C)(C5(CC=C2C4CC(C)(C)CCC4(C(=O)O)(CCC23(C)))))))","InChI=1S/C36H56O11/c1-31(2)11-13-36(30(44)45)14-12-33(4)18(19(36)15-31)7-8-22-32(3)16-20(38)27(35(6,29(42)43)23(32)9-10-34(22,33)5)47-28-26(41)25(40)24(39)21(17-37)46-28/h7,19-28,37-41H,8-17H2,1-6H3,(H,42,43)(H,44,45)","XCHARIIIZLLEBL-UHFFFAOYSA-N"
"O=C(O)C46(CCC(C)(C)CC6(C3=CCC2C5(C)(CC(O)C(OC1OC(CO)C(O)C(O)C1(O))C(C)(CO)C5(CCC2(C)C3(C)CC4))))","InChI=1S/C36H58O10/c1-31(2)11-13-36(30(43)44)14-12-34(5)19(20(36)15-31)7-8-24-32(3)16-21(39)28(33(4,18-38)23(32)9-10-35(24,34)6)46-29-27(42)26(41)25(40)22(17-37)45-29/h7,20-29,37-42H,8-18H2,1-6H3,(H,43,44)","ZOUJKJNUAOXJGL-UHFFFAOYSA-N"
"O=C(O)C46(CCC(C)(C)CC6(C3=CCC2C5(C)(CCC(OC1OC(CO)C(O)C(O)C1(O))C(C)(CO)C5(CCC2(C)C3(C)CC4))))","InChI=1S/C36H58O9/c1-31(2)13-15-36(30(42)43)16-14-34(5)20(21(36)17-31)7-8-24-32(3)11-10-25(33(4,19-38)23(32)9-12-35(24,34)6)45-29-28(41)27(40)26(39)22(18-37)44-29/h7,21-29,37-41H,8-19H2,1-6H3,(H,42,43)","CCDRPBGPIXPGRW-UHFFFAOYSA-N"
"CC(=O)OCC1OC(OC2CCC3(C)C(CCC4(C)C3C(=O)C=C3C5CC(C)(CCC5(C)CCC43C)C(O)=O)C2(C)CO)C(O)C(O)C1O","InChI=1S/C38H58O11/c1-20(40)47-18-24-27(42)28(43)29(44)31(48-24)49-26-9-10-35(4)25(36(26,5)19-39)8-11-38(7)30(35)23(41)16-21-22-17-34(3,32(45)46)13-12-33(22,2)14-15-37(21,38)6/h16,22,24-31,39,42-44H,8-15,17-19H2,1-7H3,(H,45,46)","XLTWUPQILPHRFU-UHFFFAOYSA-N"
"","InChI=1S/C38H60O10/c1-21(40)46-19-24-28(41)29(42)30(43)31(47-24)48-27-11-12-34(4)25(35(27,5)20-39)10-13-37(7)26(34)9-8-22-23-18-33(2,3)14-16-38(23,32(44)45)17-15-36(22,37)6/h8,23-31,39,41-43H,9-20H2,1-7H3,(H,44,45)","VBPRYVPCTXJOKZ-UHFFFAOYSA-N"
"CC(=O)OCC1OC(OC2C(O)CC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(CCC43C)C(O)=O)C2(C)CO)C(O)C(O)C1O","InChI=1S/C38H60O11/c1-20(40)47-18-24-27(42)28(43)29(44)31(48-24)49-30-23(41)17-34(4)25(35(30,5)19-39)10-11-37(7)26(34)9-8-21-22-16-33(2,3)12-14-38(22,32(45)46)15-13-36(21,37)6/h8,22-31,39,41-44H,9-19H2,1-7H3,(H,45,46)","GMMCESHTNIUAQD-UHFFFAOYSA-N"
"CC1(C)CCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(O)C(C)(C5CCC34C)C(=O)OC3OC(COC(=O)CC(O)=O)C(O)C(O)C3O)C2C1)C(O)=O","InChI=1S/C39H58O14/c1-34(2)11-13-39(32(48)49)14-12-36(4)19(20(39)16-34)7-8-23-35(3)17-21(40)30(47)38(6,24(35)9-10-37(23,36)5)33(50)53-31-29(46)28(45)27(44)22(52-31)18-51-26(43)15-25(41)42/h7,20-24,27-31,40,44-47H,8-18H2,1-6H3,(H,41,42)(H,48,49)","JTKJAIJNMZCGNN-UHFFFAOYSA-N"
"O=C(O)C7OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC6OCC(O)C(O)C6(O))C(O)C7(O)","InChI=1S/C41H66O13/c1-36(2)16-21-20-8-9-24-38(4)12-11-26(39(5,19-42)23(38)10-13-41(24,7)40(20,6)15-14-37(21,3)25(44)17-36)52-35-32(29(47)28(46)31(53-35)33(49)50)54-34-30(48)27(45)22(43)18-51-34/h8,21-32,34-35,42-48H,9-19H2,1-7H3,(H,49,50)","LASVNNIDKPXXMG-UHFFFAOYSA-N"
"O=C(O)C7OC(OC1C(OC(C(=O)O)C(O)C1(O))OC3CCC4(C)(C5C(=O)C=C2C6CC(C(=O)O)(C)CCC6(C)(CCC2(C)C5(C)(CCC4(C3(C)(C))))))C(O)C(O)C7(O)","InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)","LPLVUJXQOOQHMX-UHFFFAOYSA-N"
"O=C(O)C7OC(OC1C(OC(C(=O)O)C(O)C1(O))OC3CCC4(C)(C5C(=O)C=C2C6CC(C(=O)O)(C)CCC6(C)(CCC2(C)C5(C)(CCC4(C3(C)(CO))))))C(O)C(O)C7(O)","InChI=1S/C42H62O17/c1-37-11-12-38(2,36(54)55)16-19(37)18-15-20(44)31-39(3)9-8-22(40(4,17-43)21(39)7-10-42(31,6)41(18,5)14-13-37)56-35-30(26(48)25(47)29(58-35)33(52)53)59-34-27(49)23(45)24(46)28(57-34)32(50)51/h15,19,21-31,34-35,43,45-49H,7-14,16-17H2,1-6H3,(H,50,51)(H,52,53)(H,54,55)","WBQVRPYEEYUEBQ-UHFFFAOYSA-N"
"O=C(O)C7OC(OC1C(OC(C(=O)O)C(O)C1(O))OC6CCC5(C)(C(CCC3(C)(C5(CC=C2C4CC(C(=O)O)(C)CCC4(C)(CCC23(C)))))C6(C)(C)))C(O)C(O)C7(O)","InChI=1S/C42H64O15/c1-37(2)21-10-13-42(7)22(9-8-19-20-18-39(4,36(52)53)15-14-38(20,3)16-17-41(19,42)6)40(21,5)12-11-23(37)54-35-31(27(46)26(45)30(56-35)33(50)51)57-34-28(47)24(43)25(44)29(55-34)32(48)49/h8,20-31,34-35,43-47H,9-18H2,1-7H3,(H,48,49)(H,50,51)(H,52,53)","BCNKILSUUHWRTG-UHFFFAOYSA-N"
"O=C(O)C7OC(OC1C(OC(C(=O)O)C(O)C1(O))OC3CCC4(C)(C5CC=C2C6CC(C(=O)O)(C)CCC6(C)(CCC2(C)C5(C)(CCC4(C3(C)(CO))))))C(O)C(O)C7(O)","InChI=1S/C42H64O16/c1-37-13-14-38(2,36(53)54)17-20(37)19-7-8-22-39(3)11-10-23(40(4,18-43)21(39)9-12-42(22,6)41(19,5)16-15-37)55-35-31(27(47)26(46)30(57-35)33(51)52)58-34-28(48)24(44)25(45)29(56-34)32(49)50/h7,20-31,34-35,43-48H,8-18H2,1-6H3,(H,49,50)(H,51,52)(H,53,54)","SLWCVFLNZDOMEZ-UHFFFAOYSA-N"
"O=C(O)C7OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CCC5(C(=O)O)(CCC1(C)C4(C)(CCC3(C2(C)(C))))))C(O)C(OC6OC(CO)C(O)C(O)C6(O))C7(O)","InChI=1S/C42H66O14/c1-37(2)14-16-42(36(51)52)17-15-40(6)20(21(42)18-37)8-9-24-39(5)12-11-25(38(3,4)23(39)10-13-41(24,40)7)54-35-30(48)31(29(47)32(56-35)33(49)50)55-34-28(46)27(45)26(44)22(19-43)53-34/h8,21-32,34-35,43-48H,9-19H2,1-7H3,(H,49,50)(H,51,52)","BQPYEFAVIPEQIK-UHFFFAOYSA-N"
"CC1(C)CC(O)C2(C)CCC3(C)C(=CCC4C5(C)CCC(OC6OC(C(O)C(O)C6OC6OC(C(O)C(O)C6O)C(O)=O)C(O)=O)C(C)(CO)C5CCC34C)C2C1","InChI=1S/C42H66O15/c1-37(2)16-20-19-8-9-22-39(4)12-11-24(40(5,18-43)21(39)10-13-42(22,7)41(19,6)15-14-38(20,3)23(44)17-37)54-36-32(28(48)27(47)31(56-36)34(52)53)57-35-29(49)25(45)26(46)30(55-35)33(50)51/h8,20-32,35-36,43-49H,9-18H2,1-7H3,(H,50,51)(H,52,53)","GGWWAFAYNMIPPN-UHFFFAOYSA-N"
"O=C(O)C7(C)(C(OC2OC(CO)C(OC1OC(CO)C(O)C(O)C1(O))C(O)C2(O))C(O)CC6(C)(C7(CCC4(C)(C6(CC=C3C5CC(C)(C)CCC5(C(=O)O)(CCC34(C)))))))","InChI=1S/C42H66O16/c1-37(2)11-13-42(36(53)54)14-12-39(4)19(20(42)15-37)7-8-24-38(3)16-21(45)32(41(6,35(51)52)25(38)9-10-40(24,39)5)58-34-30(50)28(48)31(23(18-44)56-34)57-33-29(49)27(47)26(46)22(17-43)55-33/h7,20-34,43-50H,8-18H2,1-6H3,(H,51,52)(H,53,54)","AFLNGLSTOJPKJJ-UHFFFAOYSA-N"
"O=C(O)C7OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC6OC(CO)C(O)C(O)C6(O))C(O)C7(O)","InChI=1S/C42H68O14/c1-37(2)16-21-20-8-9-24-39(4)12-11-26(40(5,19-44)23(39)10-13-42(24,7)41(20,6)15-14-38(21,3)25(45)17-37)54-36-33(30(49)29(48)32(55-36)34(51)52)56-35-31(50)28(47)27(46)22(18-43)53-35/h8,21-33,35-36,43-50H,9-19H2,1-7H3,(H,51,52)","OKIHRVKXRCAJFQ-UHFFFAOYSA-N"
"O=C(O)C57(CCC(C)(C)CC7(C4=CCC3C6(C)(CC(O)C(OC2OC(CO)C(OC1OC(CO)C(O)C(O)C1(O))C(O)C2(O))C(C)(CO)C6(CCC3(C)C4(C)CC5))))","InChI=1S/C42H68O15/c1-37(2)11-13-42(36(52)53)14-12-40(5)20(21(42)15-37)7-8-26-38(3)16-22(46)33(39(4,19-45)25(38)9-10-41(26,40)6)57-35-31(51)29(49)32(24(18-44)55-35)56-34-30(50)28(48)27(47)23(17-43)54-34/h7,21-35,43-51H,8-19H2,1-6H3,(H,52,53)","GQPGGSOQFNPVJI-UHFFFAOYSA-N"
"O=C(O)C8OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(=O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC7OCC(O)C(O)C7(OC6OC(C)C(O)C(O)C6(O)))C(O)C8(O)","InChI=1S/C47H74O17/c1-21-29(51)31(53)34(56)39(60-21)63-36-30(52)24(49)19-59-40(36)64-37-33(55)32(54)35(38(57)58)62-41(37)61-28-12-13-44(5)25(45(28,6)20-48)11-14-47(8)26(44)10-9-22-23-17-42(2,3)18-27(50)43(23,4)15-16-46(22,47)7/h9,21,23-26,28-37,39-41,48-49,51-56H,10-20H2,1-8H3,(H,57,58)","ZNWGBWWXJAYIOM-UHFFFAOYSA-N"
"O=C(O)C8OC(OC5CCC4(C)(C(CCC2(C)(C4(CC=C1C3CC(C)(C)CC(O)C3(C)(CCC12(C)))))C5(C)(CO)))C(OC7OCC(O)C(O)C7(OC6OC(C)C(O)C(O)C6(O)))C(O)C8(O)","InChI=1S/C47H76O17/c1-21-29(51)31(53)34(56)39(60-21)63-36-30(52)24(49)19-59-40(36)64-37-33(55)32(54)35(38(57)58)62-41(37)61-28-12-13-44(5)25(45(28,6)20-48)11-14-47(8)26(44)10-9-22-23-17-42(2,3)18-27(50)43(23,4)15-16-46(22,47)7/h9,21,23-37,39-41,48-56H,10-20H2,1-8H3,(H,57,58)","IBZLICPLPYSFNZ-UHFFFAOYSA-N"
"O=C(O)C8OC(OC5CCC4(C)(C(CCC2(C)(C4(CC=C1C3CC(C)(C)CC(O)C3(C)(CCC12(C)))))C5(C)(CO)))C(OC7OC(CO)C(O)C(O)C7(OC6OCC(O)C(O)C6(O)))C(O)C8(O)","InChI=1S/C47H76O18/c1-42(2)16-22-21-8-9-26-44(4)12-11-28(45(5,20-49)25(44)10-13-47(26,7)46(21,6)15-14-43(22,3)27(51)17-42)62-41-37(33(56)32(55)35(63-41)38(58)59)65-40-36(31(54)30(53)24(18-48)61-40)64-39-34(57)29(52)23(50)19-60-39/h8,22-37,39-41,48-57H,9-20H2,1-7H3,(H,58,59)","MADZMXIFUWFDJK-UHFFFAOYSA-N"
"CC1=C(O)C(=O)CC(OC2CC(C)(C)CC3C4=CCC5C6(C)CCC(OC7OC(C(O)C(O)C7OC7OC(C(O)C(O)C7O)C(O)=O)C(O)=O)C(C)(CO)C6CCC5(C)C4(C)CCC23C)O1","InChI=1S/C48H72O18/c1-21-30(51)24(50)17-29(61-21)62-28-19-43(2,3)18-23-22-9-10-26-45(5)13-12-27(46(6,20-49)25(45)11-14-48(26,8)47(22,7)16-15-44(23,28)4)63-42-38(34(55)33(54)37(65-42)40(59)60)66-41-35(56)31(52)32(53)36(64-41)39(57)58/h9,23,25-29,31-38,41-42,49,51-56H,10-20H2,1-8H3,(H,57,58)(H,59,60)","WDQWPGLHLXQCEK-UHFFFAOYSA-N"
"O=C(O)C8OC(OC1C(OC(C(=O)O)C(O)C1(O))OC4CCC5(C)(C6C=CC3=C2CC(C)(C)CC(O)C2(C)CCC3(C)C6(C)(CCC5(C4(C)(CO)))))C(OC7OC(C)C(O)C(O)C7(O))C(O)C8(O)","InChI=1S/C48H74O19/c1-20-27(51)28(52)33(57)40(62-20)66-37-32(56)30(54)35(39(60)61)65-42(37)67-36-31(55)29(53)34(38(58)59)64-41(36)63-26-12-13-45(5)23(46(26,6)19-49)11-14-48(8)24(45)10-9-21-22-17-43(2,3)18-25(50)44(22,4)15-16-47(21,48)7/h9-10,20,23-37,40-42,49-57H,11-19H2,1-8H3,(H,58,59)(H,60,61)","NWEOPKVXZATAQT-UHFFFAOYSA-N"
"O=C(O)C8OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(=O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC7OC(CO)C(O)C(O)C7(OC6OC(C)C(O)C(O)C6(O)))C(O)C8(O)","InChI=1S/C48H76O18/c1-21-29(52)31(54)35(58)40(61-21)65-37-32(55)30(53)24(19-49)62-41(37)66-38-34(57)33(56)36(39(59)60)64-42(38)63-28-12-13-45(5)25(46(28,6)20-50)11-14-48(8)26(45)10-9-22-23-17-43(2,3)18-27(51)44(23,4)15-16-47(22,48)7/h9,21,23-26,28-38,40-42,49-50,52-58H,10-20H2,1-8H3,(H,59,60)","CROUPKILZUPLQA-UHFFFAOYSA-N"
"CC1OC(OC2C(O)C(O)C(OC2OC2C(O)C(O)C(OC2OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CC(O)C5(C)CCC43C)C2(C)CO)C(O)=O)C(O)=O)C(O)C(O)C1O","InChI=1S/C48H76O19/c1-20-27(51)28(52)33(57)40(62-20)66-37-32(56)30(54)35(39(60)61)65-42(37)67-36-31(55)29(53)34(38(58)59)64-41(36)63-26-12-13-45(5)23(46(26,6)19-49)11-14-48(8)24(45)10-9-21-22-17-43(2,3)18-25(50)44(22,4)15-16-47(21,48)7/h9,20,22-37,40-42,49-57H,10-19H2,1-8H3,(H,58,59)(H,60,61)","SZHUMUJGHFQABW-UHFFFAOYSA-N"
"O=C(O)C8OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(=O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC7OC(CO)C(O)C(O)C7(OC6OC(CO)C(O)C(O)C6(O)))C(O)C8(O)","InChI=1S/C48H76O19/c1-43(2)16-22-21-8-9-26-45(4)12-11-28(46(5,20-51)25(45)10-13-48(26,7)47(21,6)15-14-44(22,3)27(52)17-43)64-42-38(34(58)33(57)36(65-42)39(60)61)67-41-37(32(56)30(54)24(19-50)63-41)66-40-35(59)31(55)29(53)23(18-49)62-40/h8,22-26,28-38,40-42,49-51,53-59H,9-20H2,1-7H3,(H,60,61)","JTXVTHCLTOUSSL-UHFFFAOYSA-N"
"O=C(O)C68(CCC(C)(C)CC8(C5=CCC4C7(C)(CCC(OC3OC(C)C(O)C(OC2OC(CO)C(OC1OC(CO)C(O)C(O)C1(O))C(O)C2(O))C3(O))C(C)(CO)C7(CCC4(C)C5(C)CC6))))","InChI=1S/C48H78O18/c1-22-30(52)38(66-40-35(57)33(55)37(26(20-50)63-40)65-39-34(56)32(54)31(53)25(19-49)62-39)36(58)41(61-22)64-29-11-12-44(4)27(45(29,5)21-51)10-13-47(7)28(44)9-8-23-24-18-43(2,3)14-16-48(24,42(59)60)17-15-46(23,47)6/h8,22,24-41,49-58H,9-21H2,1-7H3,(H,59,60)","GNMXZMIENAWWKB-UHFFFAOYSA-N"
"O=C(O)C8OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC7OC(CO)C(O)C(O)C7(OC6OC(C)C(O)C(O)C6(O)))C(O)C8(O)","InChI=1S/C48H78O18/c1-21-29(52)31(54)35(58)40(61-21)65-37-32(55)30(53)24(19-49)62-41(37)66-38-34(57)33(56)36(39(59)60)64-42(38)63-28-12-13-45(5)25(46(28,6)20-50)11-14-48(8)26(45)10-9-22-23-17-43(2,3)18-27(51)44(23,4)15-16-47(22,48)7/h9,21,23-38,40-42,49-58H,10-20H2,1-8H3,(H,59,60)","PTDAHAWQAGSZDD-UHFFFAOYSA-N"
"CC1(C)CCCC2(CCC3(C)C(=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC34C)C12)C(=O)OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O","InChI=1S/C48H78O20/c1-43(2)11-7-12-48(42(62)68-41-36(33(59)30(56)25(19-51)65-41)66-39-34(60)31(57)28(54)23(17-49)63-39)15-14-46(5)21(37(43)48)8-9-27-44(3)16-22(53)38(45(4,20-52)26(44)10-13-47(27,46)6)67-40-35(61)32(58)29(55)24(18-50)64-40/h8,22-41,49-61H,7,9-20H2,1-6H3","QHLDWKHEJZETQA-UHFFFAOYSA-N"
"O=C(O)CC(=O)OC6CC(C)(C)CC7C5=CCC4C8(C)(CCC(OC3OC(C(=O)O)C(O)C(O)C3(OC2OC(CO)C(O)C(O)C2(OC1OC(C)C(O)C(O)C1(O))))C(C)(CO)C8(CCC4(C)C5(C)CCC67(C)))","InChI=1S/C51H80O21/c1-22-32(57)34(59)38(63)43(66-22)71-40-35(60)33(58)25(20-52)67-44(40)72-41-37(62)36(61)39(42(64)65)70-45(41)69-28-12-13-48(5)26(49(28,6)21-53)11-14-51(8)27(48)10-9-23-24-18-46(2,3)19-29(68-31(56)17-30(54)55)47(24,4)15-16-50(23,51)7/h9,22,24-29,32-41,43-45,52-53,57-63H,10-21H2,1-8H3,(H,54,55)(H,64,65)","UZZVCPOZXWRBFO-UHFFFAOYSA-N"
"COC1C(O)C(OC2C(O)C(O)C(OC2OC2C(O)C(O)C(OC2OC2CCC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CC(O)C5(C)CCC43C)C2(C)CO)C(O)=O)C(O)=O)OC(CO)C1OC(C)=O","InChI=1S/C51H80O21/c1-22(54)66-35-25(20-52)67-43(34(60)36(35)65-9)71-40-33(59)31(57)38(42(63)64)70-45(40)72-39-32(58)30(56)37(41(61)62)69-44(39)68-29-13-14-48(5)26(49(29,6)21-53)12-15-51(8)27(48)11-10-23-24-18-46(2,3)19-28(55)47(24,4)16-17-50(23,51)7/h10,24-40,43-45,52-53,55-60H,11-21H2,1-9H3,(H,61,62)(H,63,64)","UNHSTWUAQGWRPY-UHFFFAOYSA-N"
"O=C(O)C9OC(OC8C(O)CC7(C)(C(CCC5(C)(C7(CC=C4C6CC(C)(C)CCC6(C(=O)OC3OCC(O)C(O)C3(OC2OC(C)C(OC1OCC(O)C(O)C1(O))C(O)C2(O)))(CCC45(C)))))C8(C(=O)O)(C)))C(O)C(O)C9(O)","InChI=1S/C52H80O24/c1-20-36(72-41-33(61)28(56)24(54)18-69-41)32(60)35(63)42(71-20)74-38-29(57)25(55)19-70-44(38)76-46(68)52-14-12-47(2,3)16-22(52)21-8-9-26-48(4)17-23(53)39(75-43-34(62)30(58)31(59)37(73-43)40(64)65)51(7,45(66)67)27(48)10-11-50(26,6)49(21,5)13-15-52/h8,20,22-39,41-44,53-63H,9-19H2,1-7H3,(H,64,65)(H,66,67)","RPWKGRUCXRZSSG-UHFFFAOYSA-N"
"O=C(O)C9OC(OC3CCC4(C)(C5CC=C2C6CC(C)(C)CC(OC1OC(=C(O)C(=O)C1)C)C6(C)(CCC2(C)C5(C)(CCC4(C3(C)(CO))))))C(OC8OCC(O)C(O)C8(OC7OC(C)C(O)C(O)C7(O)))C(O)C9(O)","InChI=1S/C53H82O20/c1-23-34(57)27(55)18-33(67-23)69-32-20-48(3,4)19-26-25-10-11-30-50(6)14-13-31(51(7,22-54)29(50)12-15-53(30,9)52(25,8)17-16-49(26,32)5)70-47-43(39(62)38(61)41(71-47)44(64)65)73-46-42(36(59)28(56)21-66-46)72-45-40(63)37(60)35(58)24(2)68-45/h10,24,26,28-33,35-43,45-47,54,56-63H,11-22H2,1-9H3,(H,64,65)","VWKBHQGCNGULAZ-UHFFFAOYSA-N"
"CC1OC(OC2CC(C)(C)CC3C4=CCC5C6(C)CCC(OC7OC(C(O)C(O)C7OC7OC(CO)C(O)C(O)C7OC7OCC(O)C(O)C7O)C(O)=O)C(C)(CO)C6CCC5(C)C4(C)CCC23C)C(O)C(O)C1O","InChI=1S/C53H86O22/c1-22-31(57)34(60)39(65)45(69-22)72-30-18-48(2,3)17-24-23-9-10-28-50(5)13-12-29(51(6,21-55)27(50)11-14-53(28,8)52(23,7)16-15-49(24,30)4)71-47-42(37(63)36(62)40(73-47)43(66)67)75-46-41(35(61)33(59)26(19-54)70-46)74-44-38(64)32(58)25(56)20-68-44/h9,22,24-42,44-47,54-65H,10-21H2,1-8H3,(H,66,67)","REIWEXDMDVAAEI-UHFFFAOYSA-N"
"CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(O)C(O)C6OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(O)=O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C)CC1OC1OCC(O)C(O)C1O","InChI=1S/C53H86O23/c1-48(2)16-23-22-8-9-28-50(4)12-11-29(51(5,21-56)27(50)10-13-53(28,7)52(22,6)15-14-49(23,3)17-30(48)73-44-38(65)31(58)24(57)20-69-44)72-47-42(37(64)36(63)40(74-47)43(67)68)76-46-41(35(62)33(60)26(19-55)71-46)75-45-39(66)34(61)32(59)25(18-54)70-45/h8,23-42,44-47,54-66H,9-21H2,1-7H3,(H,67,68)","RCDRIURETSURJH-UHFFFAOYSA-N"
"O=C(O)C9OC(OC1C(OC(C(=O)O)C(O)C1(O))OC4CCC5(C)(C6CC=C3C7CC(C)(C)CC(OC2OC(=C(O)C(=O)C2)C)C7(C)(CCC3(C)C6(C)(CCC5(C4(C)(CO))))))C(OC8OC(C)C(O)C(O)C8(O))C(O)C9(O)","InChI=1S/C54H82O22/c1-22-32(57)26(56)18-31(69-22)71-30-20-49(3,4)19-25-24-10-11-28-51(6)14-13-29(52(7,21-55)27(51)12-15-54(28,9)53(24,8)17-16-50(25,30)5)72-47-42(37(62)35(60)40(73-47)44(65)66)76-48-43(38(63)36(61)41(74-48)45(67)68)75-46-39(64)34(59)33(58)23(2)70-46/h10,23,25,27-31,33-43,46-48,55,57-64H,11-21H2,1-9H3,(H,65,66)(H,67,68)","MISLOXVLNGPFID-UHFFFAOYSA-N"
"O=C(O)C9OC(OC3CCC4(C)(C5CC=C2C6CC(C)(C)CC(OC1OC(=C(O)C(=O)C1)C)C6(C)(CCC2(C)C5(C)(CCC4(C3(C)(CO))))))C(OC8OC(CO)C(O)C(O)C8(OC7OC(C)C(O)C(O)C7(O)))C(O)C9(O)","InChI=1S/C54H84O21/c1-23-34(58)27(57)18-33(68-23)71-32-20-49(3,4)19-26-25-10-11-30-51(6)14-13-31(52(7,22-56)29(51)12-15-54(30,9)53(25,8)17-16-50(26,32)5)72-48-44(40(64)39(63)42(73-48)45(66)67)75-47-43(38(62)36(60)28(21-55)70-47)74-46-41(65)37(61)35(59)24(2)69-46/h10,24,26,28-33,35-44,46-48,55-56,58-65H,11-22H2,1-9H3,(H,66,67)","ONAAMCDHQSWPDU-UHFFFAOYSA-N"
"CC1OC(OC2CC3(C)CCC4(C)C(=CCC5C6(C)CCC(OC7OC(C(O)C(O)C7OC7OC(C(O)C(O)C7OC7OC(C)C(O)C(O)C7O)C(O)=O)C(O)=O)C(C)(CO)C6CCC45C)C3CC2(C)C)C(O)C(O)C1O","InChI=1S/C54H86O23/c1-21-29(56)31(58)37(64)45(70-21)73-28-19-50(5)16-17-53(8)23(24(50)18-49(28,3)4)10-11-26-51(6)14-13-27(52(7,20-55)25(51)12-15-54(26,53)9)72-47-41(35(62)33(60)39(74-47)43(66)67)77-48-42(36(63)34(61)40(75-48)44(68)69)76-46-38(65)32(59)30(57)22(2)71-46/h10,21-22,24-42,45-48,55-65H,11-20H2,1-9H3,(H,66,67)(H,68,69)","BZPDIKFPGLGIHP-UHFFFAOYSA-N"
"O=C(O)C9OC(OC4CCC5(C)(C6CC=C3C7CC(C)(C)C(O)C(OC2OCC(O)C(OC1OC(COC(=O)C)C(OC(=O)C)C(OC(=O)C)C1(OC(=O)C))C2(O))C7(C)(CCC3(C)C6(C)(CCC5(C4(C)(CO))))))C(OC8OC(CO)C(O)C(O)C8(O))C(O)C9(O)","InChI=1S/C61H94O28/c1-25(64)78-23-33-44(80-26(2)65)47(81-27(3)66)48(82-28(4)67)55(84-33)86-43-31(68)22-79-52(42(43)74)89-50-49(75)56(5,6)20-30-29-12-13-35-58(8)16-15-36(59(9,24-63)34(58)14-17-61(35,11)60(29,10)19-18-57(30,50)7)85-54-46(40(72)39(71)45(87-54)51(76)77)88-53-41(73)38(70)37(69)32(21-62)83-53/h12,30-50,52-55,62-63,68-75H,13-24H2,1-11H3,(H,76,77)","DOSMRIGRPILHCA-UHFFFAOYSA-N"
"CC1OC(OC2C(O)CC3(C)C(CCC4(C)C3CC=C3C5CC(C)(C)CCC5(CCC43C)C(=O)OC3OCC(O)C(OC4OC(CO)C(O)C(O)C4O)C3OC(=O)C=CC3=CC=C(OC4OC(CO)C(O)C(O)C4O)C=C3)C2(C)C(O)=O)C(O)C(O)C1O","InChI=1S/C62H90O26/c1-27-39(68)42(71)45(74)51(81-27)87-50-32(65)23-58(4)36-14-13-30-31-22-57(2,3)18-20-62(31,21-19-59(30,5)60(36,6)17-16-37(58)61(50,7)55(77)78)56(79)88-54-49(48(33(66)26-80-54)86-53-47(76)44(73)41(70)35(25-64)84-53)85-38(67)15-10-28-8-11-29(12-9-28)82-52-46(75)43(72)40(69)34(24-63)83-52/h8-13,15,27,31-37,39-54,63-66,68-76H,14,16-26H2,1-7H3,(H,77,78)","JRXBWWBHVNZSMB-UHFFFAOYSA-N"
"OC2COC(OCC1OC(OCC=C(C)C)C(O)C(O)C1(O))C(O)C2(O)","InChI=1S/C16H28O10/c1-7(2)3-4-23-16-14(22)12(20)11(19)9(26-16)6-25-15-13(21)10(18)8(17)5-24-15/h3,8-22H,4-6H2,1-2H3","NYSQQJIJJJAWCE-UHFFFAOYSA-N"
"OCC2OC(OC(C)(C)C1CCC(O)(C)C(O)C1)C(O)C(O)C2(O)","InChI=1S/C16H30O8/c1-15(2,8-4-5-16(3,22)10(18)6-8)24-14-13(21)12(20)11(19)9(7-17)23-14/h8-14,17-22H,4-7H2,1-3H3","RPCUMNYZTIHHPA-UHFFFAOYSA-N"
"O=CCC2C(=COC(OC1OC(CO)C(O)C(O)C1(O))C2(C=C))C(=O)OC","InChI=1S/C17H24O10/c1-3-8-9(4-5-18)10(15(23)24-2)7-25-16(8)27-17-14(22)13(21)12(20)11(6-19)26-17/h3,5,7-9,11-14,16-17,19-22H,1,4,6H2,2H3","CSKKDSFETGLMSB-UHFFFAOYSA-N"
"O=C(C=CC1(O)(C(=CC(=O)CC1(C)(C))C))COC2OC(CO)C(O)C(O)C2(O)","InChI=1S/C19H28O9/c1-10-6-12(22)7-18(2,3)19(10,26)5-4-11(21)9-27-17-16(25)15(24)14(23)13(8-20)28-17/h4-6,13-17,20,23-26H,7-9H2,1-3H3","FUXBESIRIBMOMU-UHFFFAOYSA-N"
"O=C2C=C(C)C(C=CC(OC1OC(CO)C(O)C(O)C1(O))C)C(C)(C)C2","InChI=1S/C19H30O7/c1-10-7-12(21)8-19(3,4)13(10)6-5-11(2)25-18-17(24)16(23)15(22)14(9-20)26-18/h5-7,11,13-18,20,22-24H,8-9H2,1-4H3","SZOPSAFLRCYJCX-UHFFFAOYSA-N"
"O=C2C=C(CO)C(CCC(OC1OC(CO)C(O)C(O)C1(O))C)C(C)(C)C2","InChI=1S/C19H32O8/c1-10(26-18-17(25)16(24)15(23)14(9-21)27-18)4-5-13-11(8-20)6-12(22)7-19(13,2)3/h6,10,13-18,20-21,23-25H,4-5,7-9H2,1-3H3","ZZFQYZCZBBRLTI-UHFFFAOYSA-N"
"OCC3OC(OC2CC1(OC1(C=CC(O)C)C(C)(C)C2)(C))C(O)C(O)C3(O)","InChI=1S/C19H32O8/c1-10(21)5-6-19-17(2,3)7-11(8-18(19,4)27-19)25-16-15(24)14(23)13(22)12(9-20)26-16/h5-6,10-16,20-24H,7-9H2,1-4H3","SMBCGBWABYMHIN-UHFFFAOYSA-N"
"OC2COC(OCC1OC(OCC=C(C)CCC=C(C)C)C(O)C(O)C1(O))C(O)C2(O)","InChI=1S/C21H36O10/c1-11(2)5-4-6-12(3)7-8-28-21-19(27)17(25)16(24)14(31-21)10-30-20-18(26)15(23)13(22)9-29-20/h5,7,13-27H,4,6,8-10H2,1-3H3","IEGFOTASSBZIBZ-UHFFFAOYSA-N"
"O=S1CC(O)CS1","InChI=1S/C3H6O2S2/c4-3-1-6-7(5)2-3/h3-4H,1-2H2","MVXFWIGJTYCCIF-UHFFFAOYSA-N"
"O=S(=O)(O)SC=CC","InChI=1S/C3H6O3S2/c1-2-3-7-8(4,5)6/h2-3H,1H3,(H,4,5,6)","RUVGQUCSWPRGRF-UHFFFAOYSA-N"
"O=S(=O)(O)C(C)C","InChI=1S/C3H8O3S/c1-3(2)7(4,5)6/h3H,1-2H3,(H,4,5,6)","HNDXKIMMSFCCFW-UHFFFAOYSA-N"
"O=S(=O)(O)SCCC","InChI=1S/C3H8O3S2/c1-2-3-7-8(4,5)6/h2-3H2,1H3,(H,4,5,6)","XXRSQNIODUGKPF-UHFFFAOYSA-N"
"O=C(O)CC1CCC(=O)C1(CC=CCCOS(=O)(=O)O)","InChI=1S/C12H18O7S/c13-11-6-5-9(8-12(14)15)10(11)4-2-1-3-7-19-20(16,17)18/h1-2,9-10H,3-8H2,(H,14,15)(H,16,17,18)","MLUJBNROAVANKK-UHFFFAOYSA-N"
"O=C(O)C2=CC=C(OC1OC(COS(=O)(=O)O)C(O)C(O)C1(O))C(OC)=C2","InChI=1S/C14H18O12S/c1-23-8-4-6(13(18)19)2-3-7(8)25-14-12(17)11(16)10(15)9(26-14)5-24-27(20,21)22/h2-4,9-12,14-17H,5H2,1H3,(H,18,19)(H,20,21,22)","YHVRMRPNSSPKAB-UHFFFAOYSA-N"
"OC2COC(OC1OC(COC)C(O)C(O)C1(OC))C(O)C2(O)","InChI=1S/C13H24O10/c1-19-4-6-8(16)9(17)11(20-2)13(22-6)23-12-10(18)7(15)5(14)3-21-12/h5-18H,3-4H2,1-2H3","HTULNBQKFKMRAH-UHFFFAOYSA-N"
"OCC4OC(OCC3OC(OCC2OC(OC1(OC(CO)C(O)C1(O))(CO))C(O)C(O)C2(O))C(O)C(O)C3(O))C(O)C(O)C4(O)","InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2","UQZIYBXSHAGNOE-UHFFFAOYSA-N"
"OCC5OC(OC1C(O)C(O)C(OC1(CO))OC2C(O)C(O)C(OC2(CO))OC3C(O)C(O)C(OC3(CO))OC4C(O)C(O)C(O)OC4(CO))C(O)C(O)C5(O)","InChI=1S/C30H52O26/c31-1-6-11(36)12(37)18(43)27(49-6)54-23-8(3-33)51-29(20(45)14(23)39)56-25-10(5-35)52-30(21(46)16(25)41)55-24-9(4-34)50-28(19(44)15(24)40)53-22-7(2-32)48-26(47)17(42)13(22)38/h6-47H,1-5H2","FTNIPWXXIGNQQF-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)CCC2=CC(O)=CC(O)=C2","InChI=1S/C14H14O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h3-9,15-17H,1-2H2","HITJFUSPLYBJPE-UHFFFAOYSA-N"
"O=C(O)C=2C(OC1OC(CO)C(O)C(O)C1(O))=CC=CC=2CC(O)C3=CC=C(O)C=C3","InChI=1S/C21H24O10/c22-9-15-17(25)18(26)19(27)21(31-15)30-14-3-1-2-11(16(14)20(28)29)8-13(24)10-4-6-12(23)7-5-10/h1-7,13,15,17-19,21-27H,8-9H2,(H,28,29)","QZJRBIBADSCJKO-UHFFFAOYSA-N"
"OCC6OC(OCC(C)CCC4(O)(OC3CC2C5CC=C1CC(O)CCC1(C)C5(CCC2(C)C3C4(C))))C(O)C(O)C6(O)","InChI=1S/C33H54O9/c1-17(16-40-30-29(38)28(37)27(36)25(15-34)41-30)7-12-33(39)18(2)26-24(42-33)14-23-21-6-5-19-13-20(35)8-10-31(19,3)22(21)9-11-32(23,26)4/h5,17-18,20-30,34-39H,6-16H2,1-4H3","DFVRTHJUFCVHTR-UHFFFAOYSA-N"
"OC8CC5=CCC4C(CCC3(C)(C4(CC2OC1(OCC(C)CC1)C(C)C23)))C5(C)C(OC7OCC(O)C(O)C7(OC6OC(C)C(O)C(O)C6(O)))C8","InChI=1S/C38H60O12/c1-17-8-11-38(46-15-17)18(2)28-26(50-38)14-24-22-7-6-20-12-21(39)13-27(37(20,5)23(22)9-10-36(24,28)4)48-35-33(30(42)25(40)16-45-35)49-34-32(44)31(43)29(41)19(3)47-34/h6,17-19,21-35,39-44H,7-16H2,1-5H3","SKHJNNFXCKTDBG-UHFFFAOYSA-N"
"OCC8OC(OC6CC5=CCC4C(CCC3(C)(C4(CC2N1CC(C)CCC1C(C)C23)))C5(C)CC6)C(OC7OC(C)C(O)C(O)C7(O))C(O)C8(O)","InChI=1S/C39H63NO10/c1-18-6-9-26-19(2)29-27(40(26)16-18)15-25-23-8-7-21-14-22(10-12-38(21,4)24(23)11-13-39(25,29)5)48-37-35(33(45)31(43)28(17-41)49-37)50-36-34(46)32(44)30(42)20(3)47-36/h7,18-20,22-37,41-46H,6,8-17H2,1-5H3","ZLSYCIYRYZUJCZ-UHFFFAOYSA-N"
"OCC8OC(OCC(C)CCC=4OC5CC6C7CC=C3CC(O)CC(OC2OCC(O)C(O)C2(OC1OC(C)C(O)C(O)C1(O)))C3(C)C7(CCC6(C)(C5(C=4C))))C(O)C(O)C8(O)","InChI=1S/C44H70O17/c1-18(16-55-40-37(53)36(52)34(50)29(15-45)59-40)6-9-27-19(2)31-28(58-27)14-25-23-8-7-21-12-22(46)13-30(44(21,5)24(23)10-11-43(25,31)4)60-42-39(33(49)26(47)17-56-42)61-41-38(54)35(51)32(48)20(3)57-41/h7,18,20,22-26,28-42,45-54H,6,8-17H2,1-5H3","IUJLIWQDGYFELW-UHFFFAOYSA-N"
"OCC8OC(OCC(C)CCC6(O)(OC5CC4C7CC=C3CC(O)CC(OC2OCC(O)C(O)C2(OC1OC(C)C(O)C(O)C1(O)))C3(C)C7(CCC4(C)C5C6(C))))C(O)C(O)C8(O)","InChI=1S/C44H72O18/c1-18(16-56-39-36(53)35(52)33(50)28(15-45)59-39)8-11-44(55)19(2)30-27(62-44)14-25-23-7-6-21-12-22(46)13-29(43(21,5)24(23)9-10-42(25,30)4)60-41-38(32(49)26(47)17-57-41)61-40-37(54)34(51)31(48)20(3)58-40/h6,18-20,22-41,45-55H,7-17H2,1-5H3","HWYCRLFVQVFKPD-UHFFFAOYSA-N"
"O=C(O)CC(O)(C)CC(=O)OCC8COC6(OC5CC4C7CC=C3CC(OC2OC(CO)C(O)C(O)C2(OC1OC(C)C(O)C(O)C1(O)))CCC3(C)C7(CCC4(C)C5C6(C)))(CC8)","InChI=1S/C45H70O17/c1-21-33-29(62-45(21)13-8-23(20-57-45)19-56-32(49)17-42(3,55)16-31(47)48)15-28-26-7-6-24-14-25(9-11-43(24,4)27(26)10-12-44(28,33)5)59-41-39(37(53)35(51)30(18-46)60-41)61-40-38(54)36(52)34(50)22(2)58-40/h6,21-23,25-30,33-41,46,50-55H,7-20H2,1-5H3,(H,47,48)","KRFYMPRAIPKTAI-UHFFFAOYSA-N"
"CC1C2C(CC3C4CC=C5CC(CCC5(C)C4CCC23C)OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)OC11CCC(COC(=O)CC(C)(O)CC(O)=O)CO1","InChI=1S/C45H70O18/c1-21-33-28(63-45(21)12-7-22(20-58-45)19-57-32(50)16-42(2,56)15-31(48)49)14-27-25-6-5-23-13-24(8-10-43(23,3)26(25)9-11-44(27,33)4)59-41-39(37(54)35(52)30(18-47)61-41)62-40-38(55)36(53)34(51)29(17-46)60-40/h5,21-22,24-30,33-41,46-47,51-56H,6-20H2,1-4H3,(H,48,49)","IRPDBBPUEOOEPP-UHFFFAOYSA-N"
"OCC9OC(OC6CC5=CCC4C(CCC3(C)(C4(CC2OC1(OC(O)C(C)CC1)C(C)C23)))C5(C)CC6)C(OC7OC(C)C(O)C(O)C7(O))C(O)C9(OC8OC(C)C(O)C(O)C8(O))","InChI=1S/C45H72O17/c1-18-9-14-45(62-39(18)54)19(2)29-27(61-45)16-26-24-8-7-22-15-23(10-12-43(22,5)25(24)11-13-44(26,29)6)57-42-38(60-41-35(52)33(50)31(48)21(4)56-41)36(53)37(28(17-46)58-42)59-40-34(51)32(49)30(47)20(3)55-40/h7,18-21,23-42,46-54H,8-17H2,1-6H3","LPZCNTXUCIGYQK-UHFFFAOYSA-N"
"OCC9OC(OC6CC5=CCC4C(CC(O)C3(C)(C4(CC2OC1(OC(O)C(C)CC1)C(C)C23)))C5(C)CC6)C(OC7OC(C)C(O)C(O)C7(O))C(O)C9(OC8OC(C)C(O)C(O)C8(O))","InChI=1S/C45H72O18/c1-17-9-12-45(63-39(17)55)18(2)29-26(62-45)14-25-23-8-7-21-13-22(10-11-43(21,5)24(23)15-28(47)44(25,29)6)58-42-38(61-41-35(53)33(51)31(49)20(4)57-41)36(54)37(27(16-46)59-42)60-40-34(52)32(50)30(48)19(3)56-40/h7,17-20,22-42,46-55H,8-16H2,1-6H3","MWTJVBOEJQIILT-UHFFFAOYSA-N"
"OCC9OC(OC6CC5=CCC4C(CCC3(C)(C4(CC2N1CC(C)CCC1C(C)C23)))C5(C)CC6)C(OC7OC(C)C(O)C(O)C7(O))C(O)C9(OC8OC(C)C(O)C(O)C8(O))","InChI=1S/C45H73NO14/c1-19-7-10-28-20(2)31-29(46(28)17-19)16-27-25-9-8-23-15-24(11-13-44(23,5)26(25)12-14-45(27,31)6)57-43-40(60-42-37(53)35(51)33(49)22(4)56-42)38(54)39(30(18-47)58-43)59-41-36(52)34(50)32(48)21(3)55-41/h8,19-22,24-43,47-54H,7,9-18H2,1-6H3","TYNQWWGVEGFKRU-UHFFFAOYSA-N"
"OCC9OC(OC8C(O)C(OC(OC6CC5=CCC4C(CCC3(C)(C4(CC2N1CC(C)CCC1C(C)C23)))C5(C)CC6)C8(OC7OC(C)C(O)C(O)C7(O)))CO)C(O)C(O)C9(O)","InChI=1S/C45H73NO15/c1-19-6-9-27-20(2)31-28(46(27)16-19)15-26-24-8-7-22-14-23(10-12-44(22,4)25(24)11-13-45(26,31)5)57-43-40(61-41-37(54)35(52)32(49)21(3)56-41)39(34(51)30(18-48)59-43)60-42-38(55)36(53)33(50)29(17-47)58-42/h7,19-21,23-43,47-55H,6,8-18H2,1-5H3","ZGVSETXHNHBTRK-UHFFFAOYSA-N"
"OCC8OC(OCC(C)CCC=4OC5CC6C7CCC3CC(OC2OC(CO)C(O)C(O)C2(OC1OC(CO)C(O)C(O)C1(O)))C(O)CC3(C)C7(CCC6(C)(C5(C=4C))))C(O)C(O)C8(O)","InChI=1S/C45H74O19/c1-18(17-58-41-38(56)35(53)32(50)28(14-46)61-41)5-8-25-19(2)31-27(59-25)12-23-21-7-6-20-11-26(24(49)13-45(20,4)22(21)9-10-44(23,31)3)60-43-40(37(55)34(52)30(16-48)63-43)64-42-39(57)36(54)33(51)29(15-47)62-42/h18,20-24,26-43,46-57H,5-17H2,1-4H3","QEJIXVVELVKWFA-UHFFFAOYSA-N"
"CC1C2C(CC3C4CCC5CC(CCC5(C)C4CCC23C)OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C2O)OC11NCC(C)CC1O","InChI=1S/C45H75NO18/c1-18-11-29(50)45(46-14-18)19(2)30-25(64-45)13-24-22-6-5-20-12-21(7-9-43(20,3)23(22)8-10-44(24,30)4)58-40-37(57)35(55)38(28(17-49)61-40)62-42-39(34(54)32(52)27(16-48)60-42)63-41-36(56)33(53)31(51)26(15-47)59-41/h18-42,46-57H,5-17H2,1-4H3","BEHAFIHZKYCTOR-UHFFFAOYSA-N"
"OCC9OC(OCC(C)CCC7(O)(OC6CC5C8CC=C4CC(O)CC(OC3OCC(O)C(OC1OCC(O)C(O)C1(O))C3(OC2OC(C)C(O)C(O)C2(O)))C4(C)C8(CCC5(C)C6C7(C))))C(O)C(O)C9(O)","InChI=1S/C49H80O22/c1-19(16-63-43-39(60)37(58)35(56)30(15-50)67-43)8-11-49(62)20(2)32-29(71-49)14-26-24-7-6-22-12-23(51)13-31(48(22,5)25(24)9-10-47(26,32)4)68-46-42(70-45-40(61)36(57)33(54)21(3)66-45)41(28(53)18-65-46)69-44-38(59)34(55)27(52)17-64-44/h6,19-21,23-46,50-62H,7-18H2,1-5H3","GWOZWWNUSXSLBU-UHFFFAOYSA-N"
"OCC%10OC(OC2C(OC(CO)C(O)C2(OC1OCC(O)C(O)C1(O)))OC9C(O)C(O)C(OC8CC7=CCC6C(CCC5(C)(C6(CC4OC3(NCC(C)CC3)C(C)C45)))C7(C)CC8)OC9(CO))C(O)C(O)C%10(O)","InChI=1S/C50H81NO21/c1-20-7-12-50(51-15-20)21(2)32-28(72-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)65-45-40(63)37(60)41(31(18-54)68-45)69-47-43(71-46-39(62)36(59)34(57)29(16-52)66-46)42(35(58)30(17-53)67-47)70-44-38(61)33(56)27(55)19-64-44/h5,20-21,23-47,51-63H,6-19H2,1-4H3","BYMOGFTUZUEFHY-UHFFFAOYSA-N"
"OCC%10OC(OC2C(OC(CO)C(O)C2(OC1OCC(O)C(O)C1(O)))OC9C(O)C(O)C(OC8CCC7(C)(C(CCC6C7(CCC5(C)(C6(CC4OC3(NCC(C)CC3)C(C)C45))))C8))OC9(CO))C(O)C(O)C%10(O)","InChI=1S/C50H83NO21/c1-20-7-12-50(51-15-20)21(2)32-28(72-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)65-45-40(63)37(60)41(31(18-54)68-45)69-47-43(71-46-39(62)36(59)34(57)29(16-52)66-46)42(35(58)30(17-53)67-47)70-44-38(61)33(56)27(55)19-64-44/h20-47,51-63H,5-19H2,1-4H3","REJLGAUYTKNVJM-UHFFFAOYSA-N"
"OCC%10OC(OCC9(OC7(OC6CC5C8C(O)C=C4CC(OC3OC(CO)C(OC1OC(C)C(O)C(O)C1(O))C(O)C3(OC2OC(C)C(O)C(O)C2(O)))CCC4(C)C8(CCC5(C)C6C7(C)))(CC9))(C))C(O)C(O)C%10(O)","InChI=1S/C51H82O23/c1-19-31-27(73-51(19)12-11-48(4,74-51)18-65-44-38(61)37(60)34(57)28(16-52)69-44)15-25-30-24(8-10-50(25,31)6)49(5)9-7-23(13-22(49)14-26(30)54)68-47-43(72-46-40(63)36(59)33(56)21(3)67-46)41(64)42(29(17-53)70-47)71-45-39(62)35(58)32(55)20(2)66-45/h14,19-21,23-47,52-64H,7-13,15-18H2,1-6H3","PKVDIPUFXQPYFG-UHFFFAOYSA-N"
"OCC9OC(OCC(C)CCC7(O)(OC6CC5C8CC=C4CC(OC3OC(CO)C(OC1OC(C)C(O)C(O)C1(O))C(O)C3(OC2OC(C)C(O)C(O)C2(O)))CCC4(C)C8(CCC5(C)C6C7(C))))C(O)C(O)C9(O)","InChI=1S/C51H84O22/c1-20(19-65-45-39(60)38(59)35(56)30(17-52)69-45)9-14-51(64)21(2)32-29(73-51)16-28-26-8-7-24-15-25(10-12-49(24,5)27(26)11-13-50(28,32)6)68-48-44(72-47-41(62)37(58)34(55)23(4)67-47)42(63)43(31(18-53)70-48)71-46-40(61)36(57)33(54)22(3)66-46/h7,20-23,25-48,52-64H,8-19H2,1-6H3","LVTJOONKWUXEFR-UHFFFAOYSA-N"
"OCC9OC(OCC(C)CCC7(O)(OC6CC5C8CCC4CC(OC3OC(CO)C(OC2OC(CO)C(O)C(O)C2(OC1OC(CO)C(O)C(O)C1(O)))C(O)C3(O))CCC4(C)C8(CCC5(C)C6C7(C))))C(O)C(O)C9(O)","InChI=1S/C51H86O24/c1-20(19-67-45-40(63)36(59)33(56)28(15-52)69-45)7-12-51(66)21(2)32-27(75-51)14-26-24-6-5-22-13-23(8-10-49(22,3)25(24)9-11-50(26,32)4)68-46-42(65)39(62)43(31(18-55)72-46)73-48-44(38(61)35(58)30(17-54)71-48)74-47-41(64)37(60)34(57)29(16-53)70-47/h20-48,52-66H,5-19H2,1-4H3","OFEAYOYKIQKFSK-UHFFFAOYSA-N"
"O=C(OC1C(C)CNC2C(C)C9C(OC12(O))CC8C%10CCC7CC(OC6OC(CO)C(OC5OC(CO)C(O)C(OC3OCC(O)C(O)C3(O))C5(OC4OC(CO)C(O)C(O)C4(O)))C(O)C6(O))CCC7(C)C%10(CCC89(C)))C","InChI=1S/C52H85NO24/c1-19-14-53-44-20(2)32-28(77-52(44,67)45(19)69-21(3)57)13-26-24-7-6-22-12-23(8-10-50(22,4)25(24)9-11-51(26,32)5)70-47-40(66)37(63)41(31(17-56)73-47)74-49-43(76-48-39(65)36(62)34(60)29(15-54)71-48)42(35(61)30(16-55)72-49)75-46-38(64)33(59)27(58)18-68-46/h19-20,22-49,53-56,58-67H,6-18H2,1-5H3","PLWATUDVSHFEQM-UHFFFAOYSA-N"
"OCC%10OC(OCC(C)CCC8(O)(OC7CC6C9CC=C5CC(OC4OC(COC3OC(C)C(O)C(O)C3(OC2OC(C)C(O)C(O)C2(OC1OC(C)C(O)C(O)C1(O))))C(O)C(O)C4(O))CCC5(C)C9(CCC6(C)C7C8(C))))C(O)C(O)C%10(O)","InChI=1S/C57H94O26/c1-21(19-73-50-45(69)41(65)38(62)32(18-58)79-50)10-15-57(72)22(2)34-31(83-57)17-30-28-9-8-26-16-27(11-13-55(26,6)29(28)12-14-56(30,34)7)78-52-47(71)42(66)39(63)33(80-52)20-74-53-48(43(67)36(60)24(4)76-53)82-54-49(44(68)37(61)25(5)77-54)81-51-46(70)40(64)35(59)23(3)75-51/h8,21-25,27-54,58-72H,9-20H2,1-7H3","DNMXAIQCSPIIAD-UHFFFAOYSA-N"
"CC1C2C(CC3C4CCC5CC(CCC5(C)C4CCC23C)OC2OC(CO)C(OC3OC(CO)C(OC4OCC(O)C(O)C4O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C2O)OC11NCC(COC2OC(CO)C(O)C(O)C2O)CC1OC(C)=O","InChI=1S/C58H95NO29/c1-21-36-30(88-58(21)35(79-22(2)64)11-23(14-59-58)19-77-51-44(73)40(69)38(67)31(15-60)81-51)13-28-26-6-5-24-12-25(7-9-56(24,3)27(26)8-10-57(28,36)4)80-53-46(75)42(71)48(33(17-62)83-53)86-55-50(87-54-45(74)41(70)39(68)32(16-61)82-54)47(76)49(34(18-63)84-55)85-52-43(72)37(66)29(65)20-78-52/h21,23-55,59-63,65-76H,5-20H2,1-4H3","JNSUDLCASPZEHI-UHFFFAOYSA-N"
"O=CC=CC=1C=C(OC)C(O)=C(OC)C=1","InChI=1S/C11H12O4/c1-14-9-6-8(4-3-5-12)7-10(15-2)11(9)13/h3-7,13H,1-2H3","CDICDSOGTRCHMG-UHFFFAOYSA-N"
"O=C(OC(C(=O)O)CC(=O)O)C=CC=1C=C(OC)C(O)=C(OC)C=1","InChI=1S/C15H16O9/c1-22-9-5-8(6-10(23-2)14(9)19)3-4-13(18)24-11(15(20)21)7-12(16)17/h3-6,11,19H,7H2,1-2H3,(H,16,17)(H,20,21)","DUDGAPSRYCQPBG-UHFFFAOYSA-N"
"O=C(OC1OC(CO)C(O)C(O)C1(O))C=CC=2C=C(OC)C(O)=C(OC)C=2","InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3","XRKBRPFTFKKHEF-UHFFFAOYSA-N"
"O=C(OC2OC(CO)C(O)C(O)C2(OC(=O)C=CC1=CC(OC)=C(O)C(OC)=C1))C=CC=3C=C(OC)C(O)=C(OC)C=3","InChI=1S/C28H32O14/c1-36-16-9-14(10-17(37-2)23(16)32)5-7-21(30)41-27-26(35)25(34)20(13-29)40-28(27)42-22(31)8-6-15-11-18(38-3)24(33)19(12-15)39-4/h5-12,20,25-29,32-35H,13H2,1-4H3","KQDOTXAUJBODDM-UHFFFAOYSA-N"
"O=C(O)CC(O)(C)CC(=O)OCC2OC(OC=1C(=O)C=COC=1C)C(O)C(O)C2(O)","InChI=1S/C18H24O12/c1-8-16(9(19)3-4-27-8)30-17-15(25)14(24)13(23)10(29-17)7-28-12(22)6-18(2,26)5-11(20)21/h3-4,10,13-15,17,23-26H,5-7H2,1-2H3,(H,20,21)","WCVUIHQUPRXYKT-UHFFFAOYSA-N"
"CCCCC(=O)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(C)=O)C2O)C(OC(=O)CCC)C1OC(=O)CCCC","InChI=1S/C28H46O15/c1-5-8-11-20(34)39-22-17(13-29)38-27(25(41-19(33)10-7-3)24(22)40-21(35)12-9-6-2)43-28(15-31)26(36)23(37-16(4)32)18(14-30)42-28/h17-18,22-27,29-31,36H,5-15H2,1-4H3","TVWKJMQVETZQNH-UHFFFAOYSA-N"
"CCCCC(=O)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(C)=O)C2O)C(OC(=O)CCCC)C1OC(=O)CCCC","InChI=1S/C29H48O15/c1-5-8-11-20(34)40-23-18(14-30)39-28(44-29(16-32)27(37)24(38-17(4)33)19(15-31)43-29)26(42-22(36)13-10-7-3)25(23)41-21(35)12-9-6-2/h18-19,23-28,30-32,37H,5-16H2,1-4H3","AKPIJPQIDBGCGR-UHFFFAOYSA-N"
"CCCCCC(=O)OC1C(OC2(CO)OC(CO)C(OC(C)=O)C2O)OC(CO)C(OC(=O)CCCC)C1OC(=O)CCCC","InChI=1S/C30H50O15/c1-5-8-11-14-23(37)43-27-26(42-22(36)13-10-7-3)24(41-21(35)12-9-6-2)19(15-31)40-29(27)45-30(17-33)28(38)25(39-18(4)34)20(16-32)44-30/h19-20,24-29,31-33,38H,5-17H2,1-4H3","UPRCEYHEHWELCG-UHFFFAOYSA-N"
"CCCCCC(=O)OC1C(OC2(CO)OC(CO)C(OC(C)=O)C2O)OC(CO)C(OC(=O)CCCC)C1OC(=O)CCCCC","InChI=1S/C31H52O15/c1-5-8-11-14-23(37)43-27-25(42-22(36)13-10-7-3)20(16-32)41-30(28(27)44-24(38)15-12-9-6-2)46-31(18-34)29(39)26(40-19(4)35)21(17-33)45-31/h20-21,25-30,32-34,39H,5-18H2,1-4H3","NNYRMMBHXZJRGM-UHFFFAOYSA-N"
"CCCCCC(=O)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(C)=O)C2O)C(OC(=O)CCCCC)C1OC(=O)CCCCC","InChI=1S/C32H54O15/c1-5-8-11-14-23(37)43-26-21(17-33)42-31(47-32(19-35)30(40)27(41-20(4)36)22(18-34)46-32)29(45-25(39)16-13-10-7-3)28(26)44-24(38)15-12-9-6-2/h21-22,26-31,33-35,40H,5-19H2,1-4H3","ULBIMFHIPUGBOI-UHFFFAOYSA-N"
"O=C(OC1CC(O)(C(=O)O)CC(O)C1(O))C=CC=2C=CC(=O)C(=O)C=2","InChI=1S/C16H16O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,19,21,24H,6-7H2,(H,22,23)","ITENTBHADJNDDH-UHFFFAOYSA-N"
"O=C(OC1CC(O)(C(=O)O)CC(O)C1(O))C=CC2=CC=C(O)C=C2","InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(19)24-12-8-16(23,15(21)22)7-11(18)14(12)20/h1-6,11-12,14,17-18,20,23H,7-8H2,(H,21,22)","BMRSEYFENKXDIS-UHFFFAOYSA-N"
"O=C(OC1C(O)CC(O)(C(=O)O)CC1(O))C=CC2=CC=C(O)C=C2","InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(20)24-14-11(18)7-16(23,15(21)22)8-12(14)19/h1-6,11-12,14,17-19,23H,7-8H2,(H,21,22)","XWRHBGVVCOSNKO-UHFFFAOYSA-N"
"O=C(OC1CC(O)(C(=O)O)CC(O)C1(O))C=CC=2C=CC(O)=C(O)C=2","InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)","CWVRJTMFETXNAD-UHFFFAOYSA-N"
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"O=C(C=CC=1C=CC(O)=C(C=1)CC=C(C)C)C=2C=CC(O)=CC=2(O)","InChI=1S/C20H20O4/c1-13(2)3-6-15-11-14(4-9-18(15)22)5-10-19(23)17-8-7-16(21)12-20(17)24/h3-5,7-12,21-22,24H,6H2,1-2H3","TVUGLERLRIQATC-UHFFFAOYSA-N"
"O=C2C=3C=CC(O)=C(C=3(OC(C1=CC=C(O)C=C1)C2))CC=C(C)C","InChI=1S/C20H20O4/c1-12(2)3-8-15-17(22)10-9-16-18(23)11-19(24-20(15)16)13-4-6-14(21)7-5-13/h3-7,9-10,19,21-22H,8,11H2,1-2H3","KYFBXCHUXFKMGQ-UHFFFAOYSA-N"
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"O=C(C=CC=1C=CC(O)=C(O)C=1(OC))C2=CC=C(O)C(=C2)CC=C(C)C","InChI=1S/C21H22O5/c1-13(2)4-5-15-12-16(8-10-18(15)23)17(22)9-6-14-7-11-19(24)20(25)21(14)26-3/h4,6-12,23-25H,5H2,1-3H3","RETRVWFVEFCGOK-UHFFFAOYSA-N"
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"OC=1C=CC(=C(O)C=1)C=2OC=3C=C(O)C(=C(OC)C=3(C=2))CC=C(C)C","InChI=1S/C20H20O5/c1-11(2)4-6-14-17(23)10-19-15(20(14)24-3)9-18(25-19)13-7-5-12(21)8-16(13)22/h4-5,7-10,21-23H,6H2,1-3H3","CNPMAFLUEHEXRE-UHFFFAOYSA-N"
"O=C(OC1OCC(O)C(O)C1(O))C=2C=CC(O)=C(O)C=2","InChI=1S/C12H14O8/c13-6-2-1-5(3-7(6)14)11(18)20-12-10(17)9(16)8(15)4-19-12/h1-3,8-10,12-17H,4H2","VWQASRWQZBVNEI-UHFFFAOYSA-N"
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"O=C(OC1OC(CO)C(O)C(O)C1(O))C2=CC=C(O)C(OC)=C2","InChI=1S/C14H18O9/c1-21-8-4-6(2-3-7(8)16)13(20)23-14-12(19)11(18)10(17)9(5-15)22-14/h2-4,9-12,14-19H,5H2,1H3","YROOZUQRTLHXIO-UHFFFAOYSA-N"
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"O=CC=CC=2C=CC(OC1OC(CO)C(O)C(O)C1(O))=C(OC)C=2","InChI=1S/C16H20O8/c1-22-11-7-9(3-2-6-17)4-5-10(11)23-16-15(21)14(20)13(19)12(8-18)24-16/h2-7,12-16,18-21H,8H2,1H3","PJFKUPRDDXTASO-UHFFFAOYSA-N"
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"O=CC=CC=CCCCCCCCC(=O)O","InChI=1S/C13H20O3/c14-12-10-8-6-4-2-1-3-5-7-9-11-13(15)16/h4,6,8,10,12H,1-3,5,7,9,11H2,(H,15,16)","XHDHWGKEDVWKAN-UHFFFAOYSA-N"
"O=C(O)CCCCCC1CCC(=O)C1(CC=CCC)","InChI=1S/C16H26O3/c1-2-3-5-9-14-13(11-12-15(14)17)8-6-4-7-10-16(18)19/h3,5,13-14H,2,4,6-12H2,1H3,(H,18,19)","WIJWBOWLVOOYFR-UHFFFAOYSA-N"
"O=C(O)CCC=CC=CC(O)CC=CCCCCC","InChI=1S/C16H26O3/c1-2-3-4-5-6-9-12-15(17)13-10-7-8-11-14-16(18)19/h6-10,13,15,17H,2-5,11-12,14H2,1H3,(H,18,19)","KBOVKDIBOBQLRS-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(=O)C=CC=CC=CC(=O)CC","InChI=1S/C18H26O4/c1-2-16(19)12-8-6-7-10-14-17(20)13-9-4-3-5-11-15-18(21)22/h6-8,10,12,14H,2-5,9,11,13,15H2,1H3,(H,21,22)","PQPRTPXWQQQKJC-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC1C(=O)C=CC1(CC=CCC)","InChI=1S/C18H28O3/c1-2-3-7-10-15-13-14-17(19)16(15)11-8-5-4-6-9-12-18(20)21/h3,7,13-16H,2,4-6,8-12H2,1H3,(H,20,21)","IYEHRWJNUWAXAD-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(=O)C=CC=CC=CC(O)CC","InChI=1S/C18H28O4/c1-2-16(19)12-8-6-7-10-14-17(20)13-9-4-3-5-11-15-18(21)22/h6-8,10,12,14,16,19H,2-5,9,11,13,15H2,1H3,(H,21,22)","KLFMLBSZQZVKDC-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC1OC1(CC=CCC=CCC)","InChI=1S/C18H30O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h3-4,7,10,16-17H,2,5-6,8-9,11-15H2,1H3,(H,19,20)","JTEGNNHWOIJBJZ-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(O)C=CC=CCC=CCC","InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14,17,19H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)","RIGGEAZDTKMXSI-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC=CCC=CCC1OC1(CC)","InChI=1S/C18H30O3/c1-2-16-17(21-16)14-12-10-8-6-4-3-5-7-9-11-13-15-18(19)20/h4,6,10,12,16-17H,2-3,5,7-9,11,13-15H2,1H3,(H,19,20)","HKSDVVJONLXYKL-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(=O)C=CC1OC1(CCCCC)","InChI=1S/C18H30O4/c1-2-3-7-11-16-17(22-16)14-13-15(19)10-8-5-4-6-9-12-18(20)21/h13-14,16-17H,2-12H2,1H3,(H,20,21)","RCMABBHQYMBYKV-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(OO)C=CC=CCC=CCC","InChI=1S/C18H30O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h3-4,6,8,11,14,17,21H,2,5,7,9-10,12-13,15-16H2,1H3,(H,19,20)","RWKJTIHNYSIIHW-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC1OC1(C=CC(=O)CCCCC)","InChI=1S/C18H30O4/c1-2-3-7-10-15(19)13-14-17-16(22-17)11-8-5-4-6-9-12-18(20)21/h13-14,16-17H,2-12H2,1H3,(H,20,21)","BJIKXWWZEPAKQC-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC=CCC(OO)C=CC=CCC","InChI=1S/C18H30O4/c1-2-3-4-11-14-17(22-21)15-12-9-7-5-6-8-10-13-16-18(19)20/h3-4,9,11-12,14,17,21H,2,5-8,10,13,15-16H2,1H3,(H,19,20)","FLJRXICXLUZYBE-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(=O)C=CC(O)C(O)CC=CCC","InChI=1S/C18H30O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h3,7,13-14,16-17,20-21H,2,4-6,8-12H2,1H3,(H,22,23)","PLHUEKVESBJIRC-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC=CC=CC(O)CCCCC","InChI=1S/C18H32O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h7,9,12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)","HNICUWMFWZBIFP-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(O)C=CC=CCCCCC","InChI=1S/C18H32O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14,17,19H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)","NPDSHTNEKLQQIJ-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(O)C(O)CC=CCC=CCC","InChI=1S/C18H32O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h3-4,7,10,16-17,19-20H,2,5-6,8-9,11-15H2,1H3,(H,21,22)","QRHSEDZBZMZPOA-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(OO)C=CC=CCCCCC","InChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20)","JGUNZIWGNMQSBM-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC=CCC(O)C(O)CC=CCC","InChI=1S/C18H32O4/c1-2-3-10-13-16(19)17(20)14-11-8-6-4-5-7-9-12-15-18(21)22/h3,8,10-11,16-17,19-20H,2,4-7,9,12-15H2,1H3,(H,21,22)","RGRKFKRAFZJQMS-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(O)C=CC(O)C(O)CC=CCC","InChI=1S/C18H32O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h3,7,13-17,19-21H,2,4-6,8-12H2,1H3,(H,22,23)","MKYUCBXUUSZMQB-UHFFFAOYSA-N"
"O=C(O)CCCCCCC(=O)C(O)C(O)CC=CCCCCC","InChI=1S/C18H32O5/c1-2-3-4-5-6-9-12-15(19)18(23)16(20)13-10-7-8-11-14-17(21)22/h6,9,15,18-19,23H,2-5,7-8,10-14H2,1H3,(H,21,22)","NIOKCFABUMZUDL-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(O)C=CC1OC(CC1(O))C(O)CC","InChI=1S/C18H32O6/c1-2-14(20)17-12-15(21)16(24-17)11-10-13(19)8-6-4-3-5-7-9-18(22)23/h10-11,13-17,19-21H,2-9,12H2,1H3,(H,22,23)","BHWUKOCNOLCGLB-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC=CCC(O)CCCCCC","InChI=1S/C18H34O3/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21/h9,12,17,19H,2-8,10-11,13-16H2,1H3,(H,20,21)","WBHHMMIMDMUBKC-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC1OC1(CCCCCCCC)","InChI=1S/C18H34O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h16-17H,2-15H2,1H3,(H,19,20)","IMYZYCNQZDBZBQ-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC=CCC(O)C(O)CCCCC","InChI=1S/C18H34O4/c1-2-3-10-13-16(19)17(20)14-11-8-6-4-5-7-9-12-15-18(21)22/h8,11,16-17,19-20H,2-7,9-10,12-15H2,1H3,(H,21,22)","CQSLTKIXAJTQGA-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(O)C(O)CC=CCCCCC","InChI=1S/C18H34O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h7,10,16-17,19-20H,2-6,8-9,11-15H2,1H3,(H,21,22)","XEBKSQSGNGRGDW-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(O)C=CC(O)C(O)CCCCC","InChI=1S/C18H34O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)","MDIUMSLCYIJBQC-UHFFFAOYSA-N"
"CCCCCCCCC(O)C(O)CCCCCCCC(=O)OS(O)(=O)=O","InChI=1S/C18H36O7S/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)25-26(22,23)24/h16-17,19-20H,2-15H2,1H3,(H,22,23,24)","SODLPGVKTPLRNA-UHFFFAOYSA-N"
"O=C(O)C=CC(=O)CCCCC","InChI=1S/C9H14O3/c1-2-3-4-5-8(10)6-7-9(11)12/h6-7H,2-5H2,1H3,(H,11,12)","QHYBPAALYZNWPK-UHFFFAOYSA-N"
"O=CCCCCCCCC(=O)O","InChI=1S/C9H16O3/c10-8-6-4-2-1-3-5-7-9(11)12/h8H,1-7H2,(H,11,12)","WLGDDELKYAWBBL-UHFFFAOYSA-N"
"O=C(O)CC(O)CCCCCC","InChI=1S/C9H18O3/c1-2-3-4-5-6-8(10)7-9(11)12/h8,10H,2-7H2,1H3,(H,11,12)","XBUXARJOYUQNTC-UHFFFAOYSA-N"
"O=C(O)CCCCCCC(O)CC(=O)O","InChI=1S/C10H18O5/c11-8(7-10(14)15)5-3-1-2-4-6-9(12)13/h8,11H,1-7H2,(H,12,13)(H,14,15)","OQYZCCKCJQWHIE-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC(COP(=O)(O)O)C(C(CO)O)O)O)O)O)O","InChI=1S/C11H23O13P/c12-1-4(14)7(15)6(3-22-25(19,20)21)24-11-10(18)9(17)8(16)5(2-13)23-11/h4-18H,1-3H2,(H2,19,20,21)","HJZBAIMJDQCPCL-UHFFFAOYSA-N"
"O=C(O)C=CC(=O)O","InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)","VZCYOOQTPOCHFL-UHFFFAOYSA-N"
"O=C(O)CCC(=O)O","InChI=1S/C4H6O4/c5-3(6)1-2-4(7)8/h1-2H2,(H,5,6)(H,7,8)","KDYFGRWQOYBRFD-UHFFFAOYSA-N"
"O=C(O)C(=C)CC(=O)O","InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)","LVHBHZANLOWSRM-UHFFFAOYSA-N"
"O=C(O)CCCC(=O)O","InChI=1S/C5H8O4/c6-4(7)2-1-3-5(8)9/h1-3H2,(H,6,7)(H,8,9)","JFCQEDHGNNZCLN-UHFFFAOYSA-N"
"O=C(O)CC(O)(C)CC(=O)O","InChI=1S/C6H10O5/c1-6(11,2-4(7)8)3-5(9)10/h11H,2-3H2,1H3,(H,7,8)(H,9,10)","NPOAOTPXWNWTSH-UHFFFAOYSA-N"
"O=C(O)C=C(C(=O)O)CC(=O)O","InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)","GTZCVFVGUGFEME-UHFFFAOYSA-N"
"O=C(O)CC(O)(C(=O)O)CC(=O)O","InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)","KRKNYBCHXYNGOX-UHFFFAOYSA-N"
"O=C(O)CC(O)(C(=O)O)C(C)C","InChI=1S/C7H12O5/c1-4(2)7(12,6(10)11)3-5(8)9/h4,12H,3H2,1-2H3,(H,8,9)(H,10,11)","BITYXLXUCSKTJS-UHFFFAOYSA-N"
"O=C(O)CCCCCCC(=O)O","InChI=1S/C8H14O4/c9-7(10)5-3-1-2-4-6-8(11)12/h1-6H2,(H,9,10)(H,11,12)","TYFQFVWCELRYAO-UHFFFAOYSA-N"
"O=C(O)CCCCC(O)CC(=O)O","InChI=1S/C8H14O5/c9-6(5-8(12)13)3-1-2-4-7(10)11/h6,9H,1-5H2,(H,10,11)(H,12,13)","ARJZZFJXSNJKGR-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(=O)O","InChI=1S/C9H16O4/c10-8(11)6-4-2-1-3-5-7-9(12)13/h1-7H2,(H,10,11)(H,12,13)","BDJRBEYXGGNYIS-UHFFFAOYSA-N"
"OC=1N=C(O)C=2N=CN(C=2(N=1))C3OC(CO)C(O)C3(O)","InChI=1S/C10H12N4O6/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19)","UBORTCNDUKBEOP-UHFFFAOYSA-N"
"O=C1C=CN(C(=O)N1)C2OC(CO)C(O)C2(O)","InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)","DRTQHJPVMGBUCF-UHFFFAOYSA-N"
"OCC3OC(OCC(=CCCC(=CCCC(=CCCC(OC2OC(CO)C(OC1OC(C)C(O)C(O)C1(O))C(O)C2(O))(C=C)C)C)C)C)C(O)C(O)C3(O)","InChI=1S/C38H64O16/c1-7-38(6,54-37-33(48)30(45)34(25(18-40)52-37)53-36-32(47)28(43)26(41)23(5)50-36)16-10-15-21(3)12-8-11-20(2)13-9-14-22(4)19-49-35-31(46)29(44)27(42)24(17-39)51-35/h7,11,14-15,23-37,39-48H,1,8-10,12-13,16-19H2,2-6H3","OEOWMDSFDQHCFJ-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC3OC(OCC(=CCCC(=CCCC(=CCCC(OC2OC(CO)C(OC1OC(C)C(O)C(O)C1(O))C(O)C2(O))(C=C)C)C)C)C)C(O)C(O)C3(O)","InChI=1S/C41H66O19/c1-7-41(6,60-40-36(53)33(50)37(25(18-42)57-40)59-39-35(52)31(48)29(46)24(5)56-39)16-10-15-22(3)12-8-11-21(2)13-9-14-23(4)19-55-38-34(51)32(49)30(47)26(58-38)20-54-28(45)17-27(43)44/h7,11,14-15,24-26,29-40,42,46-53H,1,8-10,12-13,16-20H2,2-6H3,(H,43,44)","KRFDPNKVOGWOGC-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC3OC(OCC(=CCCC(=CCCC(=CCCC(OC2OC(COC(=O)CC(=O)O)C(OC1OC(C)C(O)C(O)C1(O))C(O)C2(O))(C=C)C)C)C)C)C(O)C(O)C3(O)","InChI=1S/C44H68O22/c1-7-44(6,66-43-39(58)36(55)40(27(64-43)21-60-31(50)18-29(47)48)65-42-38(57)34(53)32(51)25(5)62-42)16-10-15-23(3)12-8-11-22(2)13-9-14-24(4)19-61-41-37(56)35(54)33(52)26(63-41)20-59-30(49)17-28(45)46/h7,11,14-15,25-27,32-43,51-58H,1,8-10,12-13,16-21H2,2-6H3,(H,45,46)(H,47,48)","ZKXDFLSRCGZCSL-UHFFFAOYSA-N"
"OCC4OC(OC(C=C)(C)CCC=C(C)CCC=C(C)CCC=C(C)COC2OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C2(O))C(O)C(O)C4(OC3OC(C)C(O)C(O)C3(O))","InChI=1S/C44H74O20/c1-8-44(7,64-43-38(56)34(52)39(26(18-45)61-43)63-42-37(55)32(50)29(47)25(6)60-42)17-11-16-22(3)13-9-12-21(2)14-10-15-23(4)19-57-41-36(54)33(51)30(48)27(62-41)20-58-40-35(53)31(49)28(46)24(5)59-40/h8,12,15-16,24-43,45-56H,1,9-11,13-14,17-20H2,2-7H3","VWZHZYXUGKPPIX-UHFFFAOYSA-N"
"CSCC(NC(=O)CCC(NCC1(O)OCC(O)C(O)C1O)C(O)=O)C(O)=O","InChI=1S/C15H26N2O10S/c1-28-5-8(14(24)25)17-10(19)3-2-7(13(22)23)16-6-15(26)12(21)11(20)9(18)4-27-15/h7-9,11-12,16,18,20-21,26H,2-6H2,1H3,(H,17,19)(H,22,23)(H,24,25)","OXQONDBZMLPJFL-UHFFFAOYSA-N"
"C\C=C\S(=O)CC(NC(=O)CCC(NCC1(O)OCC(O)C(O)C1O)C(O)=O)C(O)=O","InChI=1S/C17H28N2O11S/c1-2-5-31(29)7-10(16(26)27)19-12(21)4-3-9(15(24)25)18-8-17(28)14(23)13(22)11(20)6-30-17/h2,5,9-11,13-14,18,20,22-23,28H,3-4,6-8H2,1H3,(H,19,21)(H,24,25)(H,26,27)/b5-2+","WROKSUMDFCBDIW-GORDUTHDSA-N"
"CC(CSCC(NC(=O)CCC(NCC1(O)OCC(O)C(O)C1O)C(O)=O)C(=O)NCC(O)=O)C(O)=O","InChI=1S/C20H33N3O13S/c1-9(18(31)32)6-37-7-11(17(30)21-4-14(26)27)23-13(25)3-2-10(19(33)34)22-8-20(35)16(29)15(28)12(24)5-36-20/h9-12,15-16,22,24,28-29,35H,2-8H2,1H3,(H,21,30)(H,23,25)(H,26,27)(H,31,32)(H,33,34)","XNLDDWIYGNQHQN-UHFFFAOYSA-N"
"O=C(O)C1N(C(=O)CC1)CC2(O)(OC(CO)C(O)C2(O))","InChI=1S/C11H17NO8/c13-3-6-8(15)9(16)11(19,20-6)4-12-5(10(17)18)1-2-7(12)14/h5-6,8-9,13,15-16,19H,1-4H2,(H,17,18)","VMOJEEZNLOLYBG-UHFFFAOYSA-N"
"O=C(O)C(NCC1(O)(OC(CO)C(O)C1(O)))C(C)CC","InChI=1S/C12H23NO7/c1-3-6(2)8(11(17)18)13-5-12(19)10(16)9(15)7(4-14)20-12/h6-10,13-16,19H,3-5H2,1-2H3,(H,17,18)","VYGRYVGDPYFVCA-UHFFFAOYSA-N"
"O=C(OCC(O)COC1OC(CO)C(O)C(O)C1(O))C","InChI=1S/C11H20O9/c1-5(13)18-3-6(14)4-19-11-10(17)9(16)8(15)7(2-12)20-11/h6-12,14-17H,2-4H2,1H3","SMBXNCWYGRMWEJ-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCCCCCCCCC","InChI=1S/C21H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(24)27-18-20(23)19-29-30(25,26)28-17-16-22/h20,23H,2-19,22H2,1H3,(H,25,26)","YVYMBNSKXOXSKW-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCC=CCC=CCCCCC","InChI=1S/C23H44NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h6-7,9-10,22,25H,2-5,8,11-21,24H2,1H3,(H,27,28)","DBHKHNGBVGWQJE-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)(O)OCCN)CCCCCCCC=CCCCCCCCC","InChI=1S/C23H46NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24/h9-10,22,25H,2-8,11-21,24H2,1H3,(H,27,28)","PYVRVRFVLRNJLY-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCCCCCCCCC","InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3","ASWBNKHCZGQVJV-UHFFFAOYSA-N"
"O=C(OC(CO)COC1OC(CO)C(O)C(O)C1(O))CCCCCC=CCC=CCC=CCC","InChI=1S/C25H42O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(28)33-19(16-26)18-32-25-24(31)23(30)22(29)20(17-27)34-25/h3-4,6-7,9-10,19-20,22-27,29-31H,2,5,8,11-18H2,1H3","LJVATEUJGAWSPM-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCC=CCC=CCC=CCC","InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h6-7,9-10,12-13,25,28H,5,8,11,14-24H2,1-4H3","WKQNRCYKYCKESD-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCC=CCC=CCCCCC","InChI=1S/C26H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h9-10,12-13,25,28H,5-8,11,14-24H2,1-4H3","SPJFYYJXNPEZDW-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCC=CCCCCCCCC","InChI=1S/C26H52NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h12-13,25,28H,5-11,14-24H2,1-4H3","YAMUFBLWGFFICM-UHFFFAOYSA-N"
"O=C(OCC(O)COC1OC(CO)C(O)C(O)C1(O))CCCCCCCC=CCC=CCC=CCC","InChI=1S/C27H46O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h3-4,6-7,9-10,21-22,24-29,31-33H,2,5,8,11-20H2,1H3","HUSISCNTLUEZCN-UHFFFAOYSA-N"
"O=C(OCC(O)COC1OC(CO)C(O)C(O)C1(O))CCCCCCCC=CCC=CCCCCC","InChI=1S/C27H48O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(30)34-19-21(29)20-35-27-26(33)25(32)24(31)22(18-28)36-27/h6-7,9-10,21-22,24-29,31-33H,2-5,8,11-20H2,1H3","LBHUIJRTHBBWHP-UHFFFAOYSA-N"
"[H][C@@](O)(COC(=O)CCCCCCCCCCCCCCC)COP(O)(=O)OCCNC1OC(CO)C(O)C(O)C1O","InChI=1S/C27H54NO12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-23(31)37-19-21(30)20-39-41(35,36)38-17-16-28-27-26(34)25(33)24(32)22(18-29)40-27/h21-22,24-30,32-34H,2-20H2,1H3,(H,35,36)/t21-,22?,24?,25?,26?,27?/m1/s1","UISOORRILGPHLE-OEYVFKEPSA-N"
"CC\C=C\C\C=C\C\C=C\CCCCCCCC(=O)OC(CO)COP(O)(=O)OCCNC1OC(CO)C(O)C(O)C1O","InChI=1S/C29H52NO12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(33)41-23(20-31)22-40-43(37,38)39-19-18-30-29-28(36)27(35)26(34)24(21-32)42-29/h3-4,6-7,9-10,23-24,26-32,34-36H,2,5,8,11-22H2,1H3,(H,37,38)/b4-3+,7-6+,10-9+","QFDVZERXJLVROF-IUQGRGSQSA-N"
"CCCCC\C=C\C\C=C\CCCCCCCC(=O)OC(CO)COP(O)(=O)OCCNC1OC(CO)C(O)C(O)C1O","InChI=1S/C29H54NO12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(33)41-23(20-31)22-40-43(37,38)39-19-18-30-29-28(36)27(35)26(34)24(21-32)42-29/h6-7,9-10,23-24,26-32,34-36H,2-5,8,11-22H2,1H3,(H,37,38)/b7-6+,10-9+","HQYLDWZNTJHJNQ-AVQMFFATSA-N"
"O=C(OCC(O)COC2OC(COC1OC(CO)C(O)C(O)C1(O))C(O)C(O)C2(O))CCCCCCCC=CCC=CCC=CCC","InChI=1S/C33H56O14/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(36)43-19-22(35)20-44-32-31(42)29(40)27(38)24(47-32)21-45-33-30(41)28(39)26(37)23(18-34)46-33/h3-4,6-7,9-10,22-24,26-35,37-42H,2,5,8,11-21H2,1H3","MPSGDHOYFIUPSO-UHFFFAOYSA-N"
"O=C(O)C=CC=2C=CC(OC(CO)C(OS(=O)(=O)O)C1=CC=C(O)C(OC)=C1)=C(OC)C=2","InChI=1S/C20H22O11S/c1-28-16-10-13(5-6-14(16)22)20(31-32(25,26)27)18(11-21)30-15-7-3-12(4-8-19(23)24)9-17(15)29-2/h3-10,18,20-22H,11H2,1-2H3,(H,23,24)(H,25,26,27)","DYRUQHNXUJVUOG-UHFFFAOYSA-N"
"OC=1C=CC(=CC=1(OC))C4OCC(C(OC2OC(CO)C(O)C(O)C2(O))C3=CC=C(O)C(OC)=C3)C4(CO)","InChI=1S/C26H34O12/c1-34-18-7-12(3-5-16(18)29)24-14(9-27)15(11-36-24)25(13-4-6-17(30)19(8-13)35-2)38-26-23(33)22(32)21(31)20(10-28)37-26/h3-8,14-15,20-33H,9-11H2,1-2H3","WMABCPOXSNGIJO-UHFFFAOYSA-N"
"OC=1C(OC)=CC(=CC=1(OC))C2OCC3C(OCC23)C5=CC(OC)=C(OC4OC(CO)C(O)C(O)C4(O))C(OC)=C5","InChI=1S/C28H36O13/c1-34-16-5-12(6-17(35-2)21(16)30)25-14-10-39-26(15(14)11-38-25)13-7-18(36-3)27(19(8-13)37-4)41-28-24(33)23(32)22(31)20(9-29)40-28/h5-8,14-15,20,22-26,28-33H,9-11H2,1-4H3","WEKCEGQSIIQPAQ-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=CC(O)=C12)C=5C=C(OC)C(OC(COC3OC(CO)C(O)C(O)C3(O))C(O)C=4C=CC(O)=C(OC)C=4)=C(OC)C=5","InChI=1S/C33H36O16/c1-43-21-6-14(4-5-17(21)36)28(39)26(13-46-33-31(42)30(41)29(40)25(12-34)49-33)48-32-23(44-2)7-15(8-24(32)45-3)20-11-19(38)27-18(37)9-16(35)10-22(27)47-20/h4-11,25-26,28-31,33-37,39-42H,12-13H2,1-3H3","WTKUHKWWAMSHEE-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1OC(CO)C(O)C1=CC(OC)=C(O)C=C1)C1=CC(=O)C2=C(O)C=C(OC3OC(COC(=O)CC(O)=O)C(O)C(O)C3O)C=C2O1","InChI=1S/C36H38O19/c1-48-22-6-15(4-5-18(22)38)31(44)26(13-37)54-35-24(49-2)7-16(8-25(35)50-3)21-11-20(40)30-19(39)9-17(10-23(30)53-21)52-36-34(47)33(46)32(45)27(55-36)14-51-29(43)12-28(41)42/h4-11,26-27,31-34,36-39,44-47H,12-14H2,1-3H3,(H,41,42)","MNSWSYAAJCOKPC-UHFFFAOYSA-N"
"O=C1C(=COC=2C=C(O)C=CC1=2)C3=CC=C(O)C=C3","InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H","ZQSIJRDFPHDXIC-UHFFFAOYSA-N"
"O=C1C=3C=CC(O)=CC=3(OC=C1C2=CC=C(OC)C=C2)","InChI=1S/C16H12O4/c1-19-12-5-2-10(3-6-12)14-9-20-15-8-11(17)4-7-13(15)16(14)18/h2-9,17H,1H3","HKQYGTCOTHHOMP-UHFFFAOYSA-N"
"O=C1C(=COC=2C=C(O)C(OC)=CC1=2)C3=CC=C(O)C=C3","InChI=1S/C16H12O5/c1-20-15-6-11-14(7-13(15)18)21-8-12(16(11)19)9-2-4-10(17)5-3-9/h2-8,17-18H,1H3","DXYUAIFZCFRPTH-UHFFFAOYSA-N"
"O=C2C(=COC=3C=C(OC1OC(CO)C(O)C(O)C1(O))C=CC2=3)C4=CC=C(O)C=C4","InChI=1S/C21H20O9/c22-8-16-18(25)19(26)20(27)21(30-16)29-12-5-6-13-15(7-12)28-9-14(17(13)24)10-1-3-11(23)4-2-10/h1-7,9,16,18-23,25-27H,8H2","KYQZWONCHDNPDP-UHFFFAOYSA-N"
"O=C2C(=COC3=CC(OC1OC(CO)C(O)C(O)C1(O))=CC=C23)C4=CC=C(OC)C=C4","InChI=1S/C22H22O9/c1-28-12-4-2-11(3-5-12)15-10-29-16-8-13(6-7-14(16)18(15)24)30-22-21(27)20(26)19(25)17(9-23)31-22/h2-8,10,17,19-23,25-27H,9H2,1H3","MGJLSBDCWOSMHL-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1=COC2=C(C=CC(OC3OC(CC(O)C3O)OC3OC(CO)C(O)C(O)C3O)=C2)C1=O","InChI=1S/C27H30O13/c1-35-13-4-2-12(3-5-13)16-11-36-18-8-14(6-7-15(18)21(16)30)37-26-22(31)17(29)9-20(39-26)40-27-25(34)24(33)23(32)19(10-28)38-27/h2-8,11,17,19-20,22-29,31-34H,9-10H2,1H3","NATAJDBKBAPGCB-UHFFFAOYSA-N"
"O=C3C(=COC=4C=C(OC2OC(CO)C(O)C(OC1OC(CO)C(O)C(O)C1(O))C2(O))C=CC3=4)C5=CC=C(OC)C=C5","InChI=1S/C28H32O14/c1-37-13-4-2-12(3-5-13)16-11-38-17-8-14(6-7-15(17)20(16)31)39-28-25(36)26(22(33)19(10-30)41-28)42-27-24(35)23(34)21(32)18(9-29)40-27/h2-8,11,18-19,21-30,32-36H,9-10H2,1H3","FIIYLNUSFHWRAF-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1=COC2=CC(OC3OC(COC(=O)CC4CCNCC4)C(O)C(O)C3O)=CC=C2C1=O","InChI=1S/C29H33NO10/c1-36-18-4-2-17(3-5-18)21-14-37-22-13-19(6-7-20(22)25(21)32)39-29-28(35)27(34)26(33)23(40-29)15-38-24(31)12-16-8-10-30-11-9-16/h2-7,13-14,16,23,26-30,33-35H,8-12,15H2,1H3","PNOLBYVRLYUCIC-UHFFFAOYSA-N"
"COC1=CC=C(C=C1)C1=COC2=CC(OC3OC(COC(=O)CC4CCNCC4)C(O)C(O)C3O)=C(OC)C=C2C1=O","InChI=1S/C30H35NO11/c1-37-18-5-3-17(4-6-18)20-14-39-21-13-23(22(38-2)12-19(21)26(20)33)41-30-29(36)28(35)27(34)24(42-30)15-40-25(32)11-16-7-9-31-10-8-16/h3-6,12-14,16,24,27-31,34-36H,7-11,15H2,1-2H3","ZFUBXSYHXUTRFX-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C=CC(=C2)C2COC3=C(C=CC(O)=C3)C2=O)C(O)C(O)C1O","InChI=1S/C21H22O10/c22-7-16-18(26)19(27)20(28)21(31-16)30-15-5-9(1-4-13(15)24)12-8-29-14-6-10(23)2-3-11(14)17(12)25/h1-6,12,16,18-24,26-28H,7-8H2","SHXLURBSILXFRW-UHFFFAOYSA-N"
"O=C(O)C2=COC(OC1OC(CO)C(O)C(O)C1(O))C3C2CC(O)C3(C)","InChI=1S/C16H24O10/c1-5-8(18)2-6-7(14(22)23)4-24-15(10(5)6)26-16-13(21)12(20)11(19)9(3-17)25-16/h4-6,8-13,15-21H,2-3H2,1H3,(H,22,23)","JNNGEAWILNVFFD-UHFFFAOYSA-N"
"O=C(O)C2=COC(OC1OC(CO)C(O)C(O)C1(O))C3C2CCC3(C)","InChI=1S/C16H24O9/c1-6-2-3-7-8(14(21)22)5-23-15(10(6)7)25-16-13(20)12(19)11(18)9(4-17)24-16/h5-7,9-13,15-20H,2-4H2,1H3,(H,21,22)","DSXFHNSGLYXPNG-UHFFFAOYSA-N"
"O=C(OC)C2=COC(OC1OC(CO)C(O)C(O)C1(O))C3C(C=CC23)C(=O)O","InChI=1S/C17H22O11/c1-25-15(24)8-5-26-16(10-6(8)2-3-7(10)14(22)23)28-17-13(21)12(20)11(19)9(4-18)27-17/h2-3,5-7,9-13,16-21H,4H2,1H3,(H,22,23)","QXLZMFXGMGPPHW-UHFFFAOYSA-N"
"O=C(OC)C2=COC(OC1OC(CO)C(O)C(O)C1(O))C3C(=CCC23)CO","InChI=1S/C17H24O10/c1-24-15(23)9-6-25-16(11-7(4-18)2-3-8(9)11)27-17-14(22)13(21)12(20)10(5-19)26-17/h2,6,8,10-14,16-22H,3-5H2,1H3","IBFYXTRXDNAPMM-UHFFFAOYSA-N"
"O=C(OC)C2=COC(OC1OC(CO)C(O)C(O)C1(O))C3C2CC(O)C3(C)","InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3","AMBQHHVBBHTQBF-UHFFFAOYSA-N"
"O=C(O)C(N)CC2=CNC1=CC=CC=C12","InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)","QIVBCDIJIAJPQS-UHFFFAOYSA-N"
"O=C(OC1OC(CO)C(O)C(O)C1(O))C3=CNC2=CC(O)=CC=C23","InChI=1S/C15H17NO8/c17-5-10-11(19)12(20)13(21)15(23-10)24-14(22)8-4-16-9-3-6(18)1-2-7(8)9/h1-4,10-13,15-21H,5H2","VZZSVZUINKFSIE-UHFFFAOYSA-N"
"O=C(O)C=CC1=CC(O)=C(O)C(OC)=C1","InChI=1S/C10H10O5/c1-15-8-5-6(2-3-9(12)13)4-7(11)10(8)14/h2-5,11,14H,1H3,(H,12,13)","YFXWTVLDSKSYLW-UHFFFAOYSA-N"
"O=C(OC(C(=O)O)C(O)C(O)C(O)C(=O)O)C=CC1=CC=C(O)C=C1","InChI=1S/C15H16O10/c16-8-4-1-7(2-5-8)3-6-9(17)25-13(15(23)24)11(19)10(18)12(20)14(21)22/h1-6,10-13,16,18-20H,(H,21,22)(H,23,24)","LWEUFDJHDOPWFE-UHFFFAOYSA-N"
"O=S(C)CCCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C12H23NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21)","GMMLNKINDDUDCF-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CCCCSC)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C12H23NO9S3/c1-23-5-3-2-4-8(13-22-25(18,19)20)24-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)","GKUMMDFLKGFCKH-UHFFFAOYSA-N"
"O=S(C)CCCCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C13H25NO10S3/c1-26(19)6-4-2-3-5-9(14-24-27(20,21)22)25-13-12(18)11(17)10(16)8(7-15)23-13/h8,10-13,15-18H,2-7H2,1H3,(H,20,21,22)","HUCGRJSHMZWRQQ-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CCCC(C)C)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C13H25NO9S2/c1-7(2)4-3-5-9(14-23-25(19,20)21)24-13-12(18)11(17)10(16)8(6-15)22-13/h7-8,10-13,15-18H,3-6H2,1-2H3,(H,19,20,21)","PVFJQLBPPQHTLU-UHFFFAOYSA-N"
"O=S(C)CCCCCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C14H27NO10S3/c1-27(20)7-5-3-2-4-6-10(15-25-28(21,22)23)26-14-13(19)12(18)11(17)9(8-16)24-14/h9,11-14,16-19H,2-8H2,1H3,(H,21,22,23)","OOGAQHVYHLPICD-UHFFFAOYSA-N"
"O=S(C)CCCCCCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C15H29NO10S3/c1-28(21)8-6-4-2-3-5-7-11(16-26-29(22,23)24)27-15-14(20)13(19)12(18)10(9-17)25-15/h10,12-15,17-20H,2-9H2,1H3,(H,22,23,24)","LQZALQLZOQQFGM-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CCCCCCCSC)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C15H29NO9S3/c1-26-8-6-4-2-3-5-7-11(16-25-28(21,22)23)27-15-14(20)13(19)12(18)10(9-17)24-15/h10,12-15,17-20H,2-9H2,1H3,(H,21,22,23)","SJHVRBSHKTUXLG-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CC2=CNC1=CC=CC=C12)SC3OC(CO)C(O)C(O)C3(O)","InChI=1S/C16H20N2O9S2/c19-7-11-13(20)14(21)15(22)16(26-11)28-12(18-27-29(23,24)25)5-8-6-17-10-4-2-1-3-9(8)10/h1-4,6,11,13-17,19-22H,5,7H2,(H,23,24,25)","DNDNWOWHUWNBCK-UHFFFAOYSA-N"
"O=S(C)CCCCCCCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C16H31NO10S3/c1-29(22)9-7-5-3-2-4-6-8-12(17-27-30(23,24)25)28-16-15(21)14(20)13(19)11(10-18)26-16/h11,13-16,18-21H,2-10H2,1H3,(H,23,24,25)","GPMDJOOLATZDQL-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CCCCCCCCS(=O)(=O)C)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C16H31NO11S3/c1-30(22,23)9-7-5-3-2-4-6-8-12(17-28-31(24,25)26)29-16-15(21)14(20)13(19)11(10-18)27-16/h11,13-16,18-21H,2-10H2,1H3,(H,24,25,26)","OZKVQSNRAFPWMK-UHFFFAOYSA-N"
"CCCCCCCCCC(SC1OC(CO)C(O)C(O)C1O)=NOS(O)(=O)=O","InChI=1S/C16H31NO9S2/c1-2-3-4-5-6-7-8-9-12(17-26-28(22,23)24)27-16-15(21)14(20)13(19)11(10-18)25-16/h11,13-16,18-21H,2-10H2,1H3,(H,22,23,24)","XDRONYWVTYLXRW-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CCCCCCCCSC)SC1OC(CO)C(O)C(O)C1(O)","InChI=1S/C16H31NO9S3/c1-27-9-7-5-3-2-4-6-8-12(17-26-29(22,23)24)28-16-15(21)14(20)13(19)11(10-18)25-16/h11,13-16,18-21H,2-10H2,1H3,(H,22,23,24)","CWOJBEDMJKZKAB-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CC2=CNC1=CC=CC(OC)=C12)SC3OC(CO)C(O)C(O)C3(O)","InChI=1S/C17H22N2O10S2/c1-27-10-4-2-3-9-13(10)8(6-18-9)5-12(19-29-31(24,25)26)30-17-16(23)15(22)14(21)11(7-20)28-17/h2-4,6,11,14-18,20-23H,5,7H2,1H3,(H,24,25,26)","IIAGSABLXRZUSE-UHFFFAOYSA-N"
"O=S(=O)(O)ON=C(CC2=CN(OC)C1=CC=CC=C12)SC3OC(CO)C(O)C(O)C3(O)","InChI=1S/C17H22N2O10S2/c1-27-19-7-9(10-4-2-3-5-11(10)19)6-13(18-29-31(24,25)26)30-17-16(23)15(22)14(21)12(8-20)28-17/h2-5,7,12,14-17,20-23H,6,8H2,1H3,(H,24,25,26)","PKKMITFKYRCCOL-UHFFFAOYSA-N"
"O=C(O)CCCCCCCCS(=O)C","InChI=1S/C10H20O3S/c1-14(13)9-7-5-3-2-4-6-8-10(11)12/h2-9H2,1H3,(H,11,12)","XZYIQKMSOAQJCG-UHFFFAOYSA-N"
"O=C1C(O)=C(OC2=CC=CC=C12)C3=CC=C(O)C=C3","InChI=1S/C15H10O4/c16-10-7-5-9(6-8-10)15-14(18)13(17)11-3-1-2-4-12(11)19-15/h1-8,16,18H","GPGOCTLAUAHUQO-UHFFFAOYSA-N"
"O=C1C(O)=C(OC=2C=C(O)C=C(O)C1=2)C3=CC=C(O)C=C3","InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H","IYRMWMYZSQPJKC-UHFFFAOYSA-N"
"O=C1C(O)=C(OC2=CC(O)=CC(O)=C12)C=3C=CC(O)=C(O)C=3","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"O=C1C(O)=C(OC2=CC(O)=CC(O)=C12)C3=CC=C(OC)C=C3","InChI=1S/C16H12O6/c1-21-10-4-2-8(3-5-10)16-15(20)14(19)13-11(18)6-9(17)7-12(13)22-16/h2-7,17-18,20H,1H3","SQFSKOYWJBQGKQ-UHFFFAOYSA-N"
"O=C1C(O)=C(OC2=CC(O)=CC(O)=C12)C=3C=CC(O)=C(OC)C=3","InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3","IZQSVPBOUDKVDZ-UHFFFAOYSA-N"
"O=C1C(O)=C(OC2=CC(O)=CC(O)=C12)C3=CC(O)=C(O)C(OC)=C3","InChI=1S/C16H12O8/c1-23-11-3-6(2-9(19)13(11)20)16-15(22)14(21)12-8(18)4-7(17)5-10(12)24-16/h2-5,17-20,22H,1H3","CFYMYCCYMJIYAB-UHFFFAOYSA-N"
"O=C1C(O)=C(OC2=CC(OC)=CC=C12)C=3C=CC=C(OC)C=3","InChI=1S/C17H14O5/c1-20-11-5-3-4-10(8-11)17-16(19)15(18)13-7-6-12(21-2)9-14(13)22-17/h3-9,19H,1-2H3","PFMGWOVPHHEHAL-UHFFFAOYSA-N"
"O=C2C(OC1OC(CO)C(O)C(O)C1(O))=C(OC3=CC(O)=CC(O)=C23)C4=CC=C(O)C=C4","InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2","JPUKWEQWGBDDQB-UHFFFAOYSA-N"
"O=C2C(OC1OC(C)C(O)C(O)C1(O))=C(OC=3C=C(O)C=C(O)C2=3)C=4C=CC(O)=C(O)C=4","InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3","OXGUCUVFOIWWQJ-UHFFFAOYSA-N"
"O=C2C(OC1OC(CO)C(O)C(O)C1(O))=C(OC3=CC(O)=CC(O)=C23)C4=CC=C(O)C(O)=C4","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2","OVSQVDMCBVZWGM-UHFFFAOYSA-N"
"O=C1C(O)=C(OC=2C=C(O)C=C(O)C1=2)C4=CC=C(OC3OC(CO)C(O)C(O)C3(O))C(O)=C4","InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)32-11-2-1-7(3-9(11)24)20-18(29)16(27)14-10(25)4-8(23)5-12(14)31-20/h1-5,13,15,17,19,21-26,28-30H,6H2","OIUBYZLTFSLSBY-UHFFFAOYSA-N"
"C1=C(C=C(C(=C1O)O)O)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O","InChI=1S/C21H20O13/c22-5-12-15(28)17(30)18(31)21(33-12)34-20-16(29)13-8(24)3-7(23)4-11(13)32-19(20)6-1-9(25)14(27)10(26)2-6/h1-4,12,15,17-18,21-28,30-31H,5H2","FOHXFLPXBUAOJM-UHFFFAOYSA-N"
"O=C2C(O)=C(OC=3C(OC1OC(CO)C(O)C(O)C1(O))=C(O)C=C(O)C2=3)C4=CC=C(O)C(O)=C4","InChI=1S/C21H20O13/c22-5-11-13(27)15(29)17(31)21(32-11)34-19-10(26)4-9(25)12-14(28)16(30)18(33-20(12)19)6-1-2-7(23)8(24)3-6/h1-4,11,13,15,17,21-27,29-31H,5H2","SJRXVLUZMMDCNG-UHFFFAOYSA-N"
"O=C3C4=C(O)C=C(OC1OC(CO)C(O)C(O)C1(O))C=C4(OC(C=2C=CC(O)=C(O)C=2)C3)","InChI=1S/C21H22O11/c22-7-16-18(27)19(28)20(29)21(32-16)30-9-4-12(25)17-13(26)6-14(31-15(17)5-9)8-1-2-10(23)11(24)3-8/h1-5,14,16,18-25,27-29H,6-7H2","RAFHNDRXYHOLSH-UHFFFAOYSA-N"
"O=C2C(O)=C(OC=3C=C(OC1OC(CO)C(O)C(O)C1(O))C(OC)=C(O)C2=3)C4=CC=C(O)C(O)=C4","InChI=1S/C22H22O13/c1-32-21-11(34-22-19(31)17(29)14(26)12(6-23)35-22)5-10-13(16(21)28)15(27)18(30)20(33-10)7-2-3-8(24)9(25)4-7/h2-5,12,14,17,19,22-26,28-31H,6H2,1H3","AFCDXKGLUDDXCK-UHFFFAOYSA-N"
"O=C(OCC4OC(OC=2C(=O)C3=C(O)C=C(O)C=C3(OC=2(C=1C=CC(O)=C(O)C=1)))C(O)C(O)C4(O))C","InChI=1S/C23H22O13/c1-8(24)33-7-15-17(29)19(31)20(32)23(35-15)36-22-18(30)16-13(28)5-10(25)6-14(16)34-21(22)9-2-3-11(26)12(27)4-9/h2-6,15,17,19-20,23,25-29,31-32H,7H2,1H3","IGLUNMMNDNWZOA-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC=2C(=O)C3=C(O)C=C(O)C=C3(OC=2(C=1C=CC(O)=C(O)C=1)))C(O)C(O)C4(O)","InChI=1S/C24H22O15/c25-9-4-12(28)17-13(5-9)37-22(8-1-2-10(26)11(27)3-8)23(19(17)33)39-24-21(35)20(34)18(32)14(38-24)7-36-16(31)6-15(29)30/h1-5,14,18,20-21,24-28,32,34-35H,6-7H2,(H,29,30)","NBQPHANHNTWDML-UHFFFAOYSA-N"
"O=C(O)CC(O)(C)CC(=O)OCC4OC(OC=2C(=O)C3=C(O)C=C(O)C=C3(OC=2(C1=CC=C(O)C=C1)))C(O)C(O)C4(O)","InChI=1S/C27H28O15/c1-27(38,8-17(31)32)9-18(33)39-10-16-20(34)22(36)23(37)26(41-16)42-25-21(35)19-14(30)6-13(29)7-15(19)40-24(25)11-2-4-12(28)5-3-11/h2-7,16,20,22-23,26,28-30,34,36-38H,8-10H2,1H3,(H,31,32)","ZALWWUJLKFBCQF-UHFFFAOYSA-N"
"CC1OC(OC2=CC3=C(C(O)=C2)C(=O)C(OC2OC(CO)C(O)C(O)C2O)=C(O3)C2=CC=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(38-9)39-12-6-13(30)16-14(7-12)40-24(10-2-4-11(29)5-3-10)25(19(16)33)42-27-23(37)21(35)18(32)15(8-28)41-27/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3","JYXSWDCPHRTYGU-UHFFFAOYSA-N"
"O=C3C(OC1OC(C)C(O)C(O)C1(O))=C(OC=4C=C(OC2OC(C)C(O)C(O)C2(O))C=C(O)C3=4)C5=CC=C(O)C(O)=C5","InChI=1S/C27H30O15/c1-8-17(31)20(34)22(36)26(38-8)40-11-6-14(30)16-15(7-11)41-24(10-3-4-12(28)13(29)5-10)25(19(16)33)42-27-23(37)21(35)18(32)9(2)39-27/h3-9,17-18,20-23,26-32,34-37H,1-2H3","GXLQUHPXGLZNGE-UHFFFAOYSA-N"
"CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3","RTATXGUCZHCSNG-UHFFFAOYSA-N"
"O=C3C(OC2OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC=4C=C(O)C=C(O)C3=4)C5=CC=CC=C5(O)","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-10(28)7-14(16)40-24(25)11-4-2-3-5-12(11)29/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3","BJJCTXDEJUWVIC-UHFFFAOYSA-N"
"O=C3C(OC2OC(CO)C(O)C(OC1OC(C)C(O)C(O)C1(O))C2(O))=C(OC=4C=C(O)C=C(O)C3=4)C5=CC=C(O)C=C5","InChI=1S/C27H30O15/c1-9-17(32)20(35)21(36)26(38-9)41-24-18(33)15(8-28)40-27(22(24)37)42-25-19(34)16-13(31)6-12(30)7-14(16)39-23(25)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,24,26-33,35-37H,8H2,1H3","YFPYXTNSQOUHPS-UHFFFAOYSA-N"
"O=C3C(OC2OC(C)C(O)C(O)C2(OC1OC(CO)C(O)C(O)C1(O)))=C(OC4=CC(O)=CC(O)=C34)C=5C=CC(O)=C(O)C=5","InChI=1S/C27H30O16/c1-8-17(33)21(37)25(43-26-22(38)20(36)18(34)15(7-28)41-26)27(39-8)42-24-19(35)16-13(32)5-10(29)6-14(16)40-23(24)9-2-3-11(30)12(31)4-9/h2-6,8,15,17-18,20-22,25-34,36-38H,7H2,1H3","DFNXNCCYQRPZMD-UHFFFAOYSA-N"
"O=C3C(OC2OC(CO)C(O)C(O)C2(OC1OC(CO)C(O)C(O)C1(O)))=C(OC=4C=C(O)C=C(O)C3=4)C5=CC=C(O)C=C5","InChI=1S/C27H30O16/c28-7-14-17(33)20(36)22(38)26(40-14)43-25-21(37)18(34)15(8-29)41-27(25)42-24-19(35)16-12(32)5-11(31)6-13(16)39-23(24)9-1-3-10(30)4-2-9/h1-6,14-15,17-18,20-22,25-34,36-38H,7-8H2","LKZDFKLGDGSGEO-UHFFFAOYSA-N"
"O=C3C(OC2OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC=4C=C(O)C=C(O)C3=4)C5=CC=C(O)C(O)=C5","InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3","IKGXIBQEEMLURG-UHFFFAOYSA-N"
"O=C3C(OC2OC(CO)C(O)C(O)C2(OC1OC(CO)C(O)C(O)C1(O)))=C(OC4=CC(O)=CC(O)=C34)C5=CC=C(O)C=C5","InChI=1S/C27H30O16/c28-7-14-17(33)20(36)22(38)26(40-14)43-25-21(37)18(34)15(8-29)41-27(25)42-24-19(35)16-12(32)5-11(31)6-13(16)39-23(24)9-1-3-10(30)4-2-9/h1-6,14-15,17-18,20-22,25-34,36-38H,7-8H2","LKZDFKLGDGSGEO-UHFFFAOYSA-N"
"O=C2C(OC1OC(CO)C(O)C(O)C1(O))=C(OC3=CC(O)=CC(O)=C23)C=5C=CC(OC4OC(CO)C(O)C(O)C4(O))=C(O)C=5","InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)41-12-2-1-8(3-10(12)31)24-25(19(35)16-11(32)4-9(30)5-13(16)40-24)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2","RPVIQWDFJPYNJM-UHFFFAOYSA-N"
"O=C2C(OC1OC(CO)C(O)C(O)C1(O))=C(OC3=CC(O)=CC(O)=C23)C5=CC(O)=C(O)C(OC4OC(CO)C(O)C(O)C4(O))=C5","InChI=1S/C27H30O18/c28-5-13-17(34)20(37)22(39)26(43-13)42-12-2-7(1-10(32)16(12)33)24-25(19(36)15-9(31)3-8(30)4-11(15)41-24)45-27-23(40)21(38)18(35)14(6-29)44-27/h1-4,13-14,17-18,20-23,26-35,37-40H,5-6H2","FEWRYXXFMHQZRI-UHFFFAOYSA-N"
"O=C3C(OC2OC(C)C(OC1OC(C)C(O)C(O)C1(O))C(O)C2(O))=C(OC4=CC(OC)=CC(O)=C34)C=5C=CC(O)=C(O)C=5","InChI=1S/C28H32O15/c1-9-18(32)20(34)22(36)27(39-9)42-24-10(2)40-28(23(37)21(24)35)43-26-19(33)17-15(31)7-12(38-3)8-16(17)41-25(26)11-4-5-13(29)14(30)6-11/h4-10,18,20-24,27-32,34-37H,1-3H3","DGFGSUOQDJHNFL-UHFFFAOYSA-N"
"O=C3C(OC2OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC4=CC(O)=CC(O)=C34)C=5C=CC(O)=C(OC)C=5","InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(41-9)40-8-16-19(33)22(36)24(38)28(43-16)44-26-20(34)17-13(31)6-11(29)7-15(17)42-25(26)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3","UIDGLYUNOUKLBM-UHFFFAOYSA-N"
"O=C3C(OC2OC(COC1OC(CO)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC=4C=C(O)C(OC)=C(O)C3=4)C=5C=CC(O)=C(O)C=5","InChI=1S/C28H32O18/c1-41-25-11(32)5-12-15(18(25)35)19(36)26(24(43-12)8-2-3-9(30)10(31)4-8)46-28-23(40)21(38)17(34)14(45-28)7-42-27-22(39)20(37)16(33)13(6-29)44-27/h2-5,13-14,16-17,20-23,27-35,37-40H,6-7H2,1H3","WRDDFOFFQDOVRV-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC5OC(OC=3C(=O)C=4C(O)=CC(OC1OC(CO)C(O)C(O)C1(O))=CC=4(OC=3(C2=CC=C(O)C=C2)))C(O)C(O)C5(O)","InChI=1S/C30H32O19/c31-8-15-20(37)23(40)25(42)29(47-15)45-12-5-13(33)19-14(6-12)46-27(10-1-3-11(32)4-2-10)28(22(19)39)49-30-26(43)24(41)21(38)16(48-30)9-44-18(36)7-17(34)35/h1-6,15-16,20-21,23-26,29-33,37-38,40-43H,7-9H2,(H,34,35)","PSZBCORWZMVATQ-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC5OC(OC=3C(=O)C=4C(O)=CC(OC1OC(CO)C(O)C(O)C1(O))=CC=4(OC=3(C=2C=CC(O)=C(O)C=2)))C(O)C(O)C5(O)","InChI=1S/C30H32O20/c31-7-15-20(38)23(41)25(43)29(48-15)46-10-4-13(34)19-14(5-10)47-27(9-1-2-11(32)12(33)3-9)28(22(19)40)50-30-26(44)24(42)21(39)16(49-30)8-45-18(37)6-17(35)36/h1-5,15-16,20-21,23-26,29-34,38-39,41-44H,6-8H2,(H,35,36)","ZLQYEKDHCDLAGO-UHFFFAOYSA-N"
"O=C4C(OC3OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C3(OC2OCC(O)C(O)C2(O)))=C(OC=5C=C(O)C=C(O)C4=5)C6=CC=C(O)C(O)=C6","InChI=1S/C32H38O20/c1-9-19(38)23(42)26(45)30(48-9)47-8-17-21(40)24(43)29(52-31-25(44)20(39)15(37)7-46-31)32(50-17)51-28-22(41)18-14(36)5-11(33)6-16(18)49-27(28)10-2-3-12(34)13(35)4-10/h2-6,9,15,17,19-21,23-26,29-40,42-45H,7-8H2,1H3","RLTNQOUWXZXZCS-UHFFFAOYSA-N"
"O=C(O)CC(O)(C)CC(=O)OCC5OC(OC=3C(=O)C4=C(O)C=C(OC1OC(CO)C(O)C(O)C1(O))C=C4(OC=3(C2=CC=C(O)C=C2)))C(O)C(O)C5(O)","InChI=1S/C33H38O20/c1-33(47,8-19(37)38)9-20(39)48-11-18-23(41)26(44)28(46)32(52-18)53-30-24(42)21-15(36)6-14(49-31-27(45)25(43)22(40)17(10-34)51-31)7-16(21)50-29(30)12-2-4-13(35)5-3-12/h2-7,17-18,22-23,25-28,31-32,34-36,40-41,43-47H,8-11H2,1H3,(H,37,38)","KNBPTHQAIKQFMM-UHFFFAOYSA-N"
"O=C4C(OC2OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC=5C=C(OC3OC(C)C(O)C(O)C3(O))C=C(O)C4=5)C6=CC=C(O)C=C6","InChI=1S/C33H40O19/c1-10-19(36)23(40)26(43)31(47-10)46-9-17-21(38)25(42)28(45)33(51-17)52-30-22(39)18-15(35)7-14(49-32-27(44)24(41)20(37)11(2)48-32)8-16(18)50-29(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-28,31-38,40-45H,9H2,1-2H3","PEFASEPMJYRQBW-UHFFFAOYSA-N"
"O=C4C(OC2OC(CO)C(O)C(O)C2(OC1OC(C)C(O)C(O)C1(O)))=C(OC=5C=C(OC3OC(C)C(O)C(O)C3(O))C=C(O)C4=5)C6=CC=C(O)C(O)=C6","InChI=1S/C33H40O20/c1-9-19(38)23(42)26(45)31(47-9)49-12-6-15(37)18-16(7-12)50-28(11-3-4-13(35)14(36)5-11)29(22(18)41)52-33-30(25(44)21(40)17(8-34)51-33)53-32-27(46)24(43)20(39)10(2)48-32/h3-7,9-10,17,19-21,23-27,30-40,42-46H,8H2,1-2H3","WLPJMCCYDZFCBL-UHFFFAOYSA-N"
"O=C4C(OC2OC(COC1OC(CO)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC5=CC(OC3OC(C)C(O)C(O)C3(O))=CC(O)=C45)C6=CC=C(O)C=C6","InChI=1S/C33H40O20/c1-10-19(37)23(41)27(45)32(48-10)49-13-6-14(36)18-15(7-13)50-29(11-2-4-12(35)5-3-11)30(22(18)40)53-33-28(46)25(43)21(39)17(52-33)9-47-31-26(44)24(42)20(38)16(8-34)51-31/h2-7,10,16-17,19-21,23-28,31-39,41-46H,8-9H2,1H3","QFSDWLPMRWDFID-UHFFFAOYSA-N"
"O=C4C(OC2OC(CO)C(O)C(O)C2(OC1OC(CO)C(O)C(O)C1(O)))=C(OC=5C=C(OC3OC(C)C(O)C(O)C3(O))C=C(O)C4=5)C6=CC=C(O)C(O)=C6","InChI=1S/C33H40O21/c1-9-19(39)23(43)26(46)31(48-9)49-11-5-14(38)18-15(6-11)50-28(10-2-3-12(36)13(37)4-10)29(22(18)42)53-33-30(25(45)21(41)17(8-35)52-33)54-32-27(47)24(44)20(40)16(7-34)51-32/h2-6,9,16-17,19-21,23-27,30-41,43-47H,7-8H2,1H3","CAXLTZYEJPQCKD-UHFFFAOYSA-N"
"O=C4C(OC2OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C2(O))=C(OC5=CC(OC3OC(CO)C(O)C(O)C3(O))=CC(O)=C45)C=6C=CC(O)=C(O)C=6","InChI=1S/C33H40O21/c1-9-19(38)23(42)26(45)31(49-9)48-8-17-21(40)25(44)28(47)33(53-17)54-30-22(41)18-14(37)5-11(50-32-27(46)24(43)20(39)16(7-34)52-32)6-15(18)51-29(30)10-2-3-12(35)13(36)4-10/h2-6,9,16-17,19-21,23-28,31-40,42-47H,7-8H2,1H3","SPUFXPFDJYNCFD-UHFFFAOYSA-N"
"O=C3C(OC1OC(CO)C(O)C(O)C1(O))=C(OC=4C=C(OC2OC(CO)C(O)C(O)C2(O))C=C(O)C3=4)C=6C=C(OC)C(O)=C(OC5OC(CO)C(O)C(O)C5(O))C=6","InChI=1S/C34H42O23/c1-50-13-2-9(3-14(19(13)39)53-33-28(48)25(45)21(41)16(7-36)55-33)30-31(57-34-29(49)26(46)22(42)17(8-37)56-34)23(43)18-11(38)4-10(5-12(18)52-30)51-32-27(47)24(44)20(40)15(6-35)54-32/h2-5,15-17,20-22,24-29,32-42,44-49H,6-8H2,1H3","POYUZVAGWZVXKD-UHFFFAOYSA-N"
"O=C(OCC6OC(OC5C(OC=3C(=O)C4=C(O)C=C(OC1OC(CO)C(O)C(O)C1(O))C=C4(OC=3(C=2C=CC(O)=C(O)C=2)))OC(C)C(O)C5(O))C(O)C(O)C6(O))C=CC7=CC=C(O)C=C7","InChI=1S/C42H46O23/c1-15-28(49)34(55)39(65-41-36(57)33(54)30(51)25(63-41)14-58-26(48)9-4-16-2-6-18(44)7-3-16)42(59-15)64-38-31(52)27-22(47)11-19(60-40-35(56)32(53)29(50)24(13-43)62-40)12-23(27)61-37(38)17-5-8-20(45)21(46)10-17/h2-12,15,24-25,28-30,32-36,39-47,49-51,53-57H,13-14H2,1H3","SHRUKDVTMUBNTL-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=CC(O)=C12)C3=CC=C(O)C=C3","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H","KZNIFHPLKGYRTM-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=CC(O)=C12)C3=CC=C(OC)C=C3","InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3","DANYIYRPLHHOCZ-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=CC(O)=C12)C3=CC=C(OC)C(O)=C3","InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3","MBNGWHIJMBWFHU-UHFFFAOYSA-N"
"O=C1C(OC)=C(OC=2C(OC)=C(O)C=C(O)C1=2)C3=CC=CC=C3","InChI=1S/C17H14O6/c1-21-15-11(19)8-10(18)12-13(20)17(22-2)14(23-16(12)15)9-6-4-3-5-7-9/h3-8,18-19H,1-2H3","OWQLBLNRUZULFV-UHFFFAOYSA-N"
"O=C1C(OC)=C(OC2=CC(O)=CC(O)=C12)C=3C=CC(OC)=C(O)C=3","InChI=1S/C17H14O7/c1-22-12-4-3-8(5-10(12)19)16-17(23-2)15(21)14-11(20)6-9(18)7-13(14)24-16/h3-7,18-20H,1-2H3","ZSPZNFOLWQEVQJ-UHFFFAOYSA-N"
"O=C2C=C(OC3=CC(OC1OC(CO)C(O)C(O)C1(O))=C(O)C(O)=C23)C4=CC=C(O)C=C4","InChI=1S/C21H20O11/c22-7-14-17(26)19(28)20(29)21(32-14)31-13-6-12-15(18(27)16(13)25)10(24)5-11(30-12)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2","VUGRLRAUZWGZJP-UHFFFAOYSA-N"
"OCC1OC(OC2=CC=C(C=C2O)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C(O)C(O)C1O","InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)31-13-2-1-8(3-10(13)24)14-6-12(26)17-11(25)4-9(23)5-15(17)30-14/h1-6,16,18-25,27-29H,7H2","UHNXUSWGOJMEFO-UHFFFAOYSA-N"
"O=C2C=C(OC3=CC(OC1OC(CO)C(O)C(O)C1(O))=CC(O)=C23)C=4C=CC(OC)=C(O)C=4","InChI=1S/C22H22O11/c1-30-14-3-2-9(4-11(14)24)15-7-13(26)18-12(25)5-10(6-16(18)32-15)31-22-21(29)20(28)19(27)17(8-23)33-22/h2-7,17,19-25,27-29H,8H2,1H3","WKUHPOMCLBLCOV-UHFFFAOYSA-N"
"O=C(O)C4OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C=3C=C(OC)C(O)=C(OC)C=3)C(O)C(O)C4(O)","InChI=1S/C23H22O13/c1-32-14-3-8(4-15(33-2)17(14)26)12-7-11(25)16-10(24)5-9(6-13(16)35-12)34-23-20(29)18(27)19(28)21(36-23)22(30)31/h3-7,18-21,23-24,26-29H,1-2H3,(H,30,31)","HJWFFBNADKDQPV-UHFFFAOYSA-N"
"O=C2C=C(OC3=CC(OC1OC(CO)C(O)C(O)C1(O))=CC(O)=C23)C=4C=C(OC)C(O)=C(OC)C=4","InChI=1S/C23H24O12/c1-31-15-3-9(4-16(32-2)19(15)27)13-7-12(26)18-11(25)5-10(6-14(18)34-13)33-23-22(30)21(29)20(28)17(8-24)35-23/h3-7,17,20-25,27-30H,8H2,1-2H3","JGXFMIJHKASCIZ-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC=1C=C(O)C=2C(=O)C=C(OC=2(C=1))C=3C=CC(O)=C(O)C=3)C(O)C(O)C4(O)","InChI=1S/C24H22O14/c25-11-2-1-9(3-12(11)26)15-6-14(28)20-13(27)4-10(5-16(20)37-15)36-24-23(34)22(33)21(32)17(38-24)8-35-19(31)7-18(29)30/h1-6,17,21-27,32-34H,7-8H2,(H,29,30)","RNDGJCZQVKFBPI-UHFFFAOYSA-N"
"O=C3C=C(OC4=CC(OC2OC(CO)C(O)C(O)C2(OC1OCC(O)(CO)C1(O)))=CC(O)=C34)C5=CC=C(O)C=C5","InChI=1S/C26H28O14/c27-8-18-20(32)21(33)22(40-25-23(34)26(35,9-28)10-36-25)24(39-18)37-13-5-14(30)19-15(31)7-16(38-17(19)6-13)11-1-3-12(29)4-2-11/h1-7,18,20-25,27-30,32-35H,8-10H2","NTDLXWMIWOECHG-UHFFFAOYSA-N"
"O=C(O)C5OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C3=CC=C(O)C=C3)C(OC4OC(C(=O)O)C(O)C(O)C4(O))C(O)C5(O)","InChI=1S/C27H26O17/c28-9-3-1-8(2-4-9)13-7-12(30)15-11(29)5-10(6-14(15)41-13)40-27-23(19(34)18(33)22(43-27)25(38)39)44-26-20(35)16(31)17(32)21(42-26)24(36)37/h1-7,16-23,26-29,31-35H,(H,36,37)(H,38,39)","SJFTVAAHLRFBST-UHFFFAOYSA-N"
"O=C(O)C5OC(OC=1C=C(O)C=2C(=O)C=C(OC=2(C=1))C3=CC=C(O)C(OC)=C3)C(OC4OC(C(=O)O)C(O)C(O)C4(O))C(O)C5(O)","InChI=1S/C28H28O18/c1-41-14-4-8(2-3-10(14)29)13-7-12(31)16-11(30)5-9(6-15(16)43-13)42-28-24(20(35)19(34)23(45-28)26(39)40)46-27-21(36)17(32)18(33)22(44-27)25(37)38/h2-7,17-24,27-30,32-36H,1H3,(H,37,38)(H,39,40)","MEUYKMSNZLTEBE-UHFFFAOYSA-N"
"O=C(O)C5OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C=3C=C(OC)C(O)=C(OC)C=3)C(OC4OC(C(=O)O)C(O)C(O)C4(O))C(O)C5(O)","InChI=1S/C29H30O19/c1-42-14-3-8(4-15(43-2)17(14)32)12-7-11(31)16-10(30)5-9(6-13(16)45-12)44-29-25(21(36)20(35)24(47-29)27(40)41)48-28-22(37)18(33)19(34)23(46-28)26(38)39/h3-7,18-25,28-30,32-37H,1-2H3,(H,38,39)(H,40,41)","RDNMWJOGZVGRGW-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1OC1OC(CO)C(O)C(O)C1O)C1=CC(=O)C2=C(O1)C=C(OC1OC(C(O)C(O)C1O)C(O)=O)C=C2O","InChI=1S/C29H32O18/c1-41-15-3-9(4-16(42-2)25(15)46-29-23(37)20(34)19(33)17(8-30)45-29)13-7-12(32)18-11(31)5-10(6-14(18)44-13)43-28-24(38)21(35)22(36)26(47-28)27(39)40/h3-7,17,19-24,26,28-31,33-38H,8H2,1-2H3,(H,39,40)","RXBHGYDCENBXLU-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=C(C(O)=C12)C3OC(CO)C(O)C(O)C3(O))C4=CC=C(O)C=C4","InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2","MYXNWGACZJSMBT-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=C(C(O)=C12)C3OC(CO)C(O)C(O)C3(O))C=4C=CC(O)=C(O)C=4","InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2","ODBRNZZJSYPIDI-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C(O)=CC(O)=C2C3OC(CO)C(O)C(O)C3(O))C4=CC=C(O)C(O)=C4","InChI=1S/C21H20O11/c22-6-14-17(28)18(29)19(30)21(32-14)16-11(26)4-10(25)15-12(27)5-13(31-20(15)16)7-1-2-8(23)9(24)3-7/h1-5,14,17-19,21-26,28-30H,6H2","PLAPMLGJVGLZOV-UHFFFAOYSA-N"
"O=C1C=C(OC=2C=C(OC)C(=C(O)C1=2)C3OC(CO)C(O)C(O)C3(O))C4=CC=C(O)C=C4","InChI=1S/C22H22O10/c1-30-13-7-14-16(11(25)6-12(31-14)9-2-4-10(24)5-3-9)19(27)17(13)22-21(29)20(28)18(26)15(8-23)32-22/h2-7,15,18,20-24,26-29H,8H2,1H3","ABRULANJVVJLFI-UHFFFAOYSA-N"
"O=C1C=C(OC=2C=C(OC)C(=C(O)C1=2)C3OC(CO)C(O)C(O)C3(O))C=4C=CC(O)=C(O)C=4","InChI=1S/C22H22O11/c1-31-13-6-14-16(11(26)5-12(32-14)8-2-3-9(24)10(25)4-8)19(28)17(13)22-21(30)20(29)18(27)15(7-23)33-22/h2-6,15,18,20-25,27-30H,7H2,1H3","DLVLXOYLQKCAME-UHFFFAOYSA-N"
"O=C1C=C(OC=2C=C(O)C(=C(O)C1=2)C4OCC(O)C(O)C4(OC3OC(CO)C(O)C(O)C3(O)))C5=CC=C(O)C=C5","InChI=1S/C26H28O14/c27-7-16-20(33)22(35)23(36)26(39-16)40-25-19(32)13(31)8-37-24(25)18-12(30)6-15-17(21(18)34)11(29)5-14(38-15)9-1-3-10(28)4-2-9/h1-6,13,16,19-20,22-28,30-36H,7-8H2","LOCBOCXGFMHGIJ-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=C(C(O)=C12)C4OC(C(=O)C(O)C4(OC3OC(C)C(O)C(O)C3(O)))C)C=5C=CC(O)=C(O)C=5","InChI=1S/C27H28O14/c1-8-20(33)23(36)26(41-27-24(37)22(35)19(32)9(2)39-27)25(38-8)18-14(31)7-16-17(21(18)34)13(30)6-15(40-16)10-3-4-11(28)12(29)5-10/h3-9,19,22-29,31-32,34-37H,1-2H3","GKLSYIMLZDYQBJ-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C(O)=CC(O)=C2C4OC(CO)C(O)C(O)C4(OC3OC(C)C(O)C(O)C3(O)))C5=CC=C(O)C=C5","InChI=1S/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3","LYGPBZVKGHHTIE-UHFFFAOYSA-N"
"O=C1C=C(OC=2C=C(O)C(=C(O)C1=2)C4OC(CO)C(O)C(O)C4(OC3OC(C)C(O)C(O)C3(O)))C=5C=CC(O)=C(O)C=5","InChI=1S/C27H30O15/c1-8-19(33)22(36)24(38)27(39-8)42-26-23(37)20(34)16(7-28)41-25(26)18-13(32)6-15-17(21(18)35)12(31)5-14(40-15)9-2-3-10(29)11(30)4-9/h2-6,8,16,19-20,22-30,32-38H,7H2,1H3","IUYFTHKQEWZTHY-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=C(C(O)=C12)C4OC(CO)C(O)C(O)C4(OC3OC(CO)C(O)C(O)C3(O)))C=5C=CC(O)=C(OC)C=5","InChI=1S/C28H32O16/c1-40-14-4-9(2-3-10(14)31)13-5-11(32)18-15(41-13)6-12(33)19(22(18)36)26-27(24(38)21(35)16(7-29)42-26)44-28-25(39)23(37)20(34)17(8-30)43-28/h2-6,16-17,20-21,23-31,33-39H,7-8H2,1H3","AQQFWSYLUDMDBP-UHFFFAOYSA-N"
"O=C(OCC5OC(OC4C(O)C(O)C(OC4(C=1C(O)=CC=2OC(=CC(=O)C=2(C=1(O)))C=3C=CC(O)=C(O)C=3))CO)C(O)C(O)C5(O))C=CC6=CC=C(O)C=C6","InChI=1S/C36H36O18/c37-12-23-28(44)32(48)35(54-36-33(49)31(47)29(45)24(53-36)13-50-25(43)8-3-14-1-5-16(38)6-2-14)34(52-23)27-20(42)11-22-26(30(27)46)19(41)10-21(51-22)15-4-7-17(39)18(40)9-15/h1-11,23-24,28-29,31-40,42,44-49H,12-13H2","MWRFISCXYNYBKS-UHFFFAOYSA-N"
"O=C(OCC5OC(OC1C(OC(CO)C(O)C1(O))C=2C(O)=CC=3OC(=CC(=O)C=3(C=2(O)))C4=CC=C(O)C=C4)C(O)C(O)C5(O))C=CC=6C=CC(O)=C(OC)C=6","InChI=1S/C37H38O18/c1-50-22-10-15(2-8-18(22)40)3-9-26(43)51-14-25-30(45)32(47)34(49)37(54-25)55-36-33(48)29(44)24(13-38)53-35(36)28-20(42)12-23-27(31(28)46)19(41)11-21(52-23)16-4-6-17(39)7-5-16/h2-12,24-25,29-30,32-40,42,44-49H,13-14H2,1H3","VJSPPRJRRDZQLT-UHFFFAOYSA-N"
"O=C2C=C(OC=3C=C(OC1OC(CO)C(O)C(O)C1(O))C(=C(O)C2=3)C4OC(CO)C(O)C(O)C4(O))C5=CC=C(O)C=C5","InChI=1S/C27H30O15/c28-7-15-19(32)22(35)24(37)26(40-15)18-14(41-27-25(38)23(36)20(33)16(8-29)42-27)6-13-17(21(18)34)11(31)5-12(39-13)9-1-3-10(30)4-2-9/h1-6,15-16,19-20,22-30,32-38H,7-8H2","HGUVPEBGCAVWID-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OCC(O)C(O)C3(O))C4OCC(O)C(O)C4(O))C5=CC=C(O)C=C5","InChI=1S/C25H26O13/c26-9-3-1-8(2-4-9)13-5-10(27)14-19(32)15(24-21(34)17(30)11(28)6-36-24)20(33)16(23(14)38-13)25-22(35)18(31)12(29)7-37-25/h1-5,11-12,17-18,21-22,24-26,28-35H,6-7H2","LDVNKZYMYPZDAI-UHFFFAOYSA-N"
"O=C1C=C(OC=2C1=C(O)C(=C(O)C=2C3OC(CO)C(O)C3(O))C4OC(CO)C(O)C(O)C4(O))C5=CC=C(O)C=C5","InChI=1S/C26H28O14/c27-6-12-17(31)21(35)23(37)25(39-12)15-19(33)14-10(30)5-11(8-1-3-9(29)4-2-8)38-24(14)16(20(15)34)26-22(36)18(32)13(7-28)40-26/h1-5,12-13,17-18,21-23,25-29,31-37H,6-7H2","TUIJPUWSXVFWSH-UHFFFAOYSA-N"
"O=C1C=C(OC=2C1=C(O)C(=C(O)C=2C3OC(CO)C(O)C(O)C3(O))C4OCC(O)C(O)C4(O))C=5C=CC(O)=C(O)C=5","InChI=1S/C26H28O15/c27-5-13-18(33)21(36)23(38)26(41-13)16-20(35)15(25-22(37)17(32)11(31)6-39-25)19(34)14-10(30)4-12(40-24(14)16)7-1-2-8(28)9(29)3-7/h1-4,11,13,17-18,21-23,25-29,31-38H,5-6H2","WYYFCTVKFALPQV-UHFFFAOYSA-N"
"O=C1C=C(OC=2C1=C(O)C(=C(O)C=2C3OCC(O)C(O)C3(O))C4OC(CO)C(O)C(O)C4(O))C=5C=CC(O)=C(O)C=5","InChI=1S/C26H28O15/c27-5-13-18(33)21(36)23(38)26(41-13)15-19(34)14-10(30)4-12(7-1-2-8(28)9(29)3-7)40-24(14)16(20(15)35)25-22(37)17(32)11(31)6-39-25/h1-4,11,13,17-18,21-23,25-29,31-38H,5-6H2","XBGYTZHKGMCEGE-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OC(CO)C(O)C(O)C3(O))C4OC(CO)C(O)C(O)C4(O))C5=CC=C(O)C=C5","InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2","FIAAVMJLAGNUKW-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OC(CO)C(O)C(O)C3(O))C4OC(CO)C(O)C(O)C4(O))C5=CC=C(O)C(O)=C5","InChI=1S/C27H30O16/c28-5-12-17(33)21(37)23(39)26(42-12)15-19(35)14-10(32)4-11(7-1-2-8(30)9(31)3-7)41-25(14)16(20(15)36)27-24(40)22(38)18(34)13(6-29)43-27/h1-4,12-13,17-18,21-24,26-31,33-40H,5-6H2","ZLPSOQFIIQIIAX-UHFFFAOYSA-N"
"O=C(O)C6OC(OC1=CC=C(C=C1)C=2OC=4C=C(O)C(=C(O)C=4(C(=O)C=2C3OC(CO)C(O)C(O)C3(O)))C5OC(CO)C(O)C(O)C5(O))C(O)C(O)C6(O)","InChI=1S/C33H38O21/c34-6-12-17(37)21(41)24(44)29(52-12)14-10(36)5-11-15(19(14)39)20(40)16(30-25(45)22(42)18(38)13(7-35)53-30)28(51-11)8-1-3-9(4-2-8)50-33-27(47)23(43)26(46)31(54-33)32(48)49/h1-5,12-13,17-18,21-27,29-31,33-39,41-47H,6-7H2,(H,48,49)","MKNZYNHECYGLOH-UHFFFAOYSA-N"
"O=C2C=3C=CC(O)=CC=3(OC(C1=CC=C(O)C=C1)C2)","InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2","FURUXTVZLHCCNA-UHFFFAOYSA-N"
"O=C2C3=C(O)C=C(O)C=C3(OC(C1=CC=CC=C1)C2)","InChI=1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2","URFCJEUYXNAHFI-UHFFFAOYSA-N"
"O=C2C3=C(O)C=C(O)C=C3(OC(C1=CC=C(O)C=C1)C2)","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2","FTVWIRXFELQLPI-UHFFFAOYSA-N"
"O=C2C=3C(O)=CC(O)=CC=3(OC(C1=CC=C(O)C=C1)C2)","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2","FTVWIRXFELQLPI-UHFFFAOYSA-N"
"O=C2C=3C(O)=CC(O)=CC=3(OC(C=1C=CC(O)=C(O)C=1)C2)","InChI=1S/C15H12O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-5,13,16-19H,6H2","SBHXYTNGIZCORC-UHFFFAOYSA-N"
"O=C2C3=C(O)C=C(O)C=C3(OC(C=1C=CC(O)=C(O)C=1)C2(O))","InChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,14-19,21H","CXQWRCVTCMQVQX-UHFFFAOYSA-N"
"O=C2C3=C(O)C=C(O)C=C3(OC(C1=CC(O)=C(O)C(O)=C1)C2(O))","InChI=1S/C15H12O8/c16-6-3-7(17)11-10(4-6)23-15(14(22)13(11)21)5-1-8(18)12(20)9(19)2-5/h1-4,14-20,22H","KJXSIXMJHKAJOD-UHFFFAOYSA-N"
"O=C2C=3C(O)=CC(OC)=CC=3(OC(C1=CC=C(O)C=C1)C2)","InChI=1S/C16H14O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-7,14,17-18H,8H2,1H3","DJOJDHGQRNZXQQ-UHFFFAOYSA-N"
"O=C2C3=C(O)C=C(O)C=C3(OC(C=1C=CC(OC)=C(O)C=1)C2)","InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3","AIONOLUJZLIMTK-UHFFFAOYSA-N"
"O=C3C4=C(O)C=C(OC1OC(CO)C(O)C(O)C1(O))C=C4(OC(C2=CC=C(O)C=C2)C3)","InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2","DLIKSSGEMUFQOK-UHFFFAOYSA-N"
"O=C3C=4C=CC(OC1OC(CO)C(O)C(O)C1(O))=C(O)C=4(OC(C2=CC=C(O)C(O)=C2)C3)","InChI=1S/C21H22O11/c22-7-15-16(26)18(28)19(29)21(32-15)31-13-4-2-9-11(24)6-14(30-20(9)17(13)27)8-1-3-10(23)12(25)5-8/h1-5,14-16,18-19,21-23,25-29H,6-7H2","DGGOLFCPSUVVHX-UHFFFAOYSA-N"
"O=C3C=4C=CC(O)=CC=4(OC(C2=CC=C(OC1OC(CO)C(O)C(O)C1(O))C=C2)C3)","InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2","DEMKZLAVQYISIA-UHFFFAOYSA-N"
"O=C2C=3C(O)=CC(O)=C(C=3(OC(C1=CC=C(O)C=C1)C2))C4OC(CO)C(O)C(O)C4(O)","InChI=1S/C21H22O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-5,13-14,17-19,21-25,27-29H,6-7H2","VPQWOQSQAVBHEV-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=C(C3OCC(O)C(O)C3O)C3=C2C(=O)CC(O3)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C26H30O15/c27-6-16-20(34)21(35)23(37)26(41-16)40-15-5-12(31)18(25-22(36)19(33)13(32)7-38-25)24-17(15)11(30)4-14(39-24)8-1-2-9(28)10(29)3-8/h1-3,5,13-14,16,19-23,25-29,31-37H,4,6-7H2","QETQPQDBDULWLC-UHFFFAOYSA-N"
"OC=3C=C(O)C2=C(OC(C=1C=CC(O)=C(O)C=1)C(O)C2)C=3","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2","PFTAWBLQPZVEMU-UHFFFAOYSA-N"
"OC3=CC(O)=C2C(OC(C1=CC(O)=C(O)C(O)=C1)C(O)C2)=C3","InChI=1S/C15H14O7/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6/h1-4,12,15-21H,5H2","XMOCLSLCDHWDHP-UHFFFAOYSA-N"
"O=C(O)C=CC=1C=CC(O)=C(OC)C=1","InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)","KSEBMYQBYZTDHS-UHFFFAOYSA-N"
"COC1=CC=C(\C=C\C(=O)OCC(O)C(O)=O)C=C1O","InChI=1S/C13H14O7/c1-19-11-4-2-8(6-9(11)14)3-5-12(16)20-7-10(15)13(17)18/h2-6,10,14-15H,7H2,1H3,(H,17,18)/b5-3+","ZWAYKTOAUPIGML-HWKANZROSA-N"
"O=C(OC1OC(CO)C(O)C(O)C1(O))C=CC=2C=CC(O)=C(OC)C=2","InChI=1S/C16H20O9/c1-23-10-6-8(2-4-9(10)18)3-5-12(19)25-16-15(22)14(21)13(20)11(7-17)24-16/h2-6,11,13-18,20-22H,7H2,1H3","JWRQVQWBNRGGPK-UHFFFAOYSA-N"
"O=C(OCC(O)COC(=O)C=CC=1C=CC(O)=C(OC)C=1)C=CC=2C=CC(O)=C(OC)C=2","InChI=1S/C23H24O9/c1-29-20-11-15(3-7-18(20)25)5-9-22(27)31-13-17(24)14-32-23(28)10-6-16-4-8-19(26)21(12-16)30-2/h3-12,17,24-26H,13-14H2,1-2H3","PATJZXBBUQEFOY-UHFFFAOYSA-N"
"COC1=C(O)C=CC(OC2OC(CO)C(OC(=O)\C=C\C3=CC(OC)=C(O)C=C3)C(O)C2O)=C1","InChI=1S/C23H26O11/c1-30-16-9-12(3-6-14(16)25)4-8-19(27)34-22-18(11-24)33-23(21(29)20(22)28)32-13-5-7-15(26)17(10-13)31-2/h3-10,18,20-26,28-29H,11H2,1-2H3/b8-4+","HULDVRYZOFHPLX-XBXARRHUSA-N"
"OC(=NCCCCN=C(O)C=CC=1C=CC(O)=C(OC)C=1)C=CC=2C=CC(O)=C(OC)C=2","InChI=1S/C24H28N2O6/c1-31-21-15-17(5-9-19(21)27)7-11-23(29)25-13-3-4-14-26-24(30)12-8-18-6-10-20(28)22(16-18)32-2/h5-12,15-16,27-28H,3-4,13-14H2,1-2H3,(H,25,29)(H,26,30)","CHEMZHJQHCVLFI-UHFFFAOYSA-N"
"O=C(OCC5OC(OC1C(OC(CO)C(O)C1(O))C=2C(O)=CC=3OC(=CC(=O)C=3(C=2(O)))C=4C=CC(O)=C(O)C=4)C(O)C(O)C5(O))C=CC=6C=CC(O)=C(OC)C=6","InChI=1S/C37H38O19/c1-51-22-8-14(2-5-17(22)40)3-7-26(44)52-13-25-30(46)32(48)34(50)37(55-25)56-36-33(49)29(45)24(12-38)54-35(36)28-20(43)11-23-27(31(28)47)19(42)10-21(53-23)15-4-6-16(39)18(41)9-15/h2-11,24-25,29-30,32-41,43,45-50H,12-13H2,1H3","BKAKNBQTKDWIDR-UHFFFAOYSA-N"
"O=C(OCC5OC(OC1C(OC(CO)C(O)C1(O))C=2C(O)=CC=3OC(=CC(=O)C=3(C=2(O)))C=4C=CC(O)=C(OC)C=4)C(O)C(O)C5(O))C=CC=6C=CC(O)=C(OC)C=6","InChI=1S/C38H40O19/c1-51-22-9-15(3-6-17(22)40)4-8-27(44)53-14-26-31(46)33(48)35(50)38(56-26)57-37-34(49)30(45)25(13-39)55-36(37)29-20(43)12-24-28(32(29)47)19(42)11-21(54-24)16-5-7-18(41)23(10-16)52-2/h3-12,25-26,30-31,33-41,43,45-50H,13-14H2,1-2H3","DJZOTDSGEBENPL-UHFFFAOYSA-N"
"O=C(OCC3OC(OC1OC(COC(=O)C)C(OC(=O)C)C(O)C1(OC(=O)C))(CO)C(OC(=O)C=CC=2C=CC(O)=C(OC)C=2)C3(O))C=CC4=CC=C(O)C(OC)=C4","InChI=1S/C38H44O20/c1-19(40)51-17-29-34(53-20(2)41)33(48)35(54-21(3)42)37(55-29)58-38(18-39)36(56-31(46)13-9-23-7-11-25(44)27(15-23)50-5)32(47)28(57-38)16-52-30(45)12-8-22-6-10-24(43)26(14-22)49-4/h6-15,28-29,32-37,39,43-44,47-48H,16-18H2,1-5H3","VIYLZUDAAGEJSD-UHFFFAOYSA-N"
"O=C(OCC3OC(OC1OC(COC(=O)C)C(OC(=O)C)C(O)C1(OC(=O)C))(COC(=O)C)C(OC(=O)C=CC=2C=CC(O)=C(OC)C=2)C3(O))C=CC=4C=CC(O)=C(OC)C=4","InChI=1S/C40H46O21/c1-20(41)53-18-31-36(56-22(3)43)35(50)37(57-23(4)44)39(58-31)61-40(19-55-21(2)42)38(59-33(48)14-10-25-8-12-27(46)29(16-25)52-6)34(49)30(60-40)17-54-32(47)13-9-24-7-11-26(45)28(15-24)51-5/h7-16,30-31,34-39,45-46,49-50H,17-19H2,1-6H3","OGAPXYQOTIOKDV-UHFFFAOYSA-N"
"O=C2OC(C(O)=C2(OC1OC(CO)C(O)C(O)C1(O)))C(O)C(O)O","InChI=1S/C12H18O12/c13-1-2-3(14)4(15)5(16)12(22-2)24-9-6(17)8(23-11(9)21)7(18)10(19)20/h2-5,7-8,10,12-20H,1H2","DVMKRMXSGLOXJZ-UHFFFAOYSA-N"
"O=C(OCCCC)CC(OC1OC(CO)C(O)C(O)C1(O))C","InChI=1S/C14H26O8/c1-3-4-5-20-10(16)6-8(2)21-14-13(19)12(18)11(17)9(7-15)22-14/h8-9,11-15,17-19H,3-7H2,1-2H3","YUPCLHHTUNDMAN-UHFFFAOYSA-N"
"O=C(O)CC(O)C(C)CC=CC=C(C(=O)OC1OC(CO)C(O)C(O)C1(O))C","InChI=1S/C18H28O10/c1-9(11(20)7-13(21)22)5-3-4-6-10(2)17(26)28-18-16(25)15(24)14(23)12(8-19)27-18/h3-4,6,9,11-12,14-16,18-20,23-25H,5,7-8H2,1-2H3,(H,21,22)","JWAGJGCOOSEMAU-UHFFFAOYSA-N"
"O=C(O)CC2CCC(=O)C2(CC=CCCOC1OC(CO)C(O)C(O)C1(O))","InChI=1S/C18H28O9/c19-9-13-15(23)16(24)17(25)18(27-13)26-7-3-1-2-4-11-10(8-14(21)22)5-6-12(11)20/h1-2,10-11,13,15-19,23-25H,3-9H2,(H,21,22)","JFDNMLUPLXZXGV-UHFFFAOYSA-N"
"COC(COC1OC(CO)C(O)C(O)C1O)\C=C\CC1=C(CC(O)=O)CCC1=O","InChI=1S/C19H28O10/c1-27-11(3-2-4-12-10(7-15(22)23)5-6-13(12)21)9-28-19-18(26)17(25)16(24)14(8-20)29-19/h2-3,11,14,16-20,24-26H,4-9H2,1H3,(H,22,23)/b3-2+","HWKCWIIFDARZFZ-NSCUHMNNSA-N"
"O=C(O)C(O)C(O)(C)C","InChI=1S/C5H10O4/c1-5(2,9)3(6)4(7)8/h3,6,9H,1-2H3,(H,7,8)","JTEYKUFKXGDTEU-UHFFFAOYSA-N"
"O=C(O)CCNC(=O)C(O)C(C)(C)CO","InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)","GHOKWGTUZJEAQD-UHFFFAOYSA-N"
"O=C(C=C(O)C=1C=CC(O)=C(C=1)CC=C(C)C)C=2C=C(C(O)=CC=2(O))CC=C(C)C","InChI=1S/C25H28O5/c1-15(2)5-7-17-11-18(9-10-21(17)26)22(27)13-24(29)20-12-19(8-6-16(3)4)23(28)14-25(20)30/h5-6,9-14,26-28,30H,7-8H2,1-4H3","FFPFIAFZJXSGDK-UHFFFAOYSA-N"
"O=C1OC2=CC(O)=C(OC)C=C2(C=C1)","InChI=1S/C10H8O4/c1-13-9-4-6-2-3-10(12)14-8(6)5-7(9)11/h2-5,11H,1H3","RODXRVNMMDRFIK-UHFFFAOYSA-N"
"O=C2OC3=CC(O)=C(OC1OC(CO)C(O)C(O)C1(O))C=C3(C=C2)","InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2","XHCADAYNFIFUHF-UHFFFAOYSA-N"
"O=C2OC=3C=C(OC1OC(CO)C(O)C(O)C1(O))C(OC)=CC=3(C=C2)","InChI=1S/C16H18O9/c1-22-9-4-7-2-3-12(18)23-8(7)5-10(9)24-16-15(21)14(20)13(19)11(6-17)25-16/h2-5,11,13-17,19-21H,6H2,1H3","SGTCGCCQZOUMJJ-UHFFFAOYSA-N"
"O=C4OC=2C=C(OC1OC(CO)C(O)C(O)C1(O))C=CC=2C=5OC=3C=C(O)C=CC=3C4=5","InChI=1S/C21H18O10/c22-7-14-16(24)17(25)18(26)21(31-14)28-9-2-4-11-13(6-9)30-20(27)15-10-3-1-8(23)5-12(10)29-19(11)15/h1-6,14,16-18,21-26H,7H2","JSKGNHCHUPJTOQ-UHFFFAOYSA-N"
"COC1=CC2=C(OC(=O)C=C2)C=C1OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O","InChI=1S/C22H28O14/c1-31-10-4-8-2-3-14(25)32-9(8)5-11(10)33-22-20(18(29)16(27)13(7-24)35-22)36-21-19(30)17(28)15(26)12(6-23)34-21/h2-5,12-13,15-24,26-30H,6-7H2,1H3","QJGJAMWLRCWSIH-UHFFFAOYSA-N"
"COC1=C(OC2C(O)C(O)C(C)OC2OC2CC(OC3=CC(O)=C(C(=O)CCC4=CC=C(O)C=C4)C(O)=C3)OC(O)C2O)C=C2OC(=O)C=CC2=C1","InChI=1S/C36H38O16/c1-16-31(42)33(44)34(50-26-14-24-18(11-25(26)46-2)6-10-28(41)49-24)36(47-16)51-27-15-29(52-35(45)32(27)43)48-20-12-22(39)30(23(40)13-20)21(38)9-5-17-3-7-19(37)8-4-17/h3-4,6-8,10-14,16,27,29,31-37,39-40,42-45H,5,9,15H2,1-2H3","UAMRWBMUOAVLAI-UHFFFAOYSA-N"
"O=C1OC=2C=C(O)C=CC=2(C=C1)","InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H","ORHBXUUXSCNDEV-UHFFFAOYSA-N"
"O=C1OC=2C=C(O)C(O)=CC=2(C=C1)","InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H","ILEDWLMCKZNDJK-UHFFFAOYSA-N"
"O=C1OC=2C(O)=C(O)C=CC=2(C=C1)","InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H","ATEFPOUAMCWAQS-UHFFFAOYSA-N"
"O=C(OC1OC(CO)C(O)C(O)C1(O))C=CC2=CC=C(O)C=C2","InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(22-10)23-11(18)6-3-8-1-4-9(17)5-2-8/h1-6,10,12-17,19-21H,7H2","DSNCQKUYZOSARM-UHFFFAOYSA-N"
"O=C(O)C=CC2=CC=C(OC1OC(CO)C(O)C(O)C1(O))C=C2","InChI=1S/C15H18O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-1-8(2-5-9)3-6-11(17)18/h1-6,10,12-16,19-21H,7H2,(H,17,18)","LJFYQZQUAULRDF-UHFFFAOYSA-N"
"O=C(O)CCC2=CC=CC=C2(OC1OC(CO)C(O)C(O)C1(O))","InChI=1S/C15H20O8/c16-7-10-12(19)13(20)14(21)15(23-10)22-9-4-2-1-3-8(9)5-6-11(17)18/h1-4,10,12-16,19-21H,5-7H2,(H,17,18)","FXEOLMWSBWXMSF-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)NCCCNCCCCNC(=O)C=CC2=CC=C(O)C=C2","InChI=1S/C25H31N3O4/c29-22-10-4-20(5-11-22)8-14-24(31)27-18-2-1-16-26-17-3-19-28-25(32)15-9-21-6-12-23(30)13-7-21/h4-15,26,29-30H,1-3,16-19H2,(H,27,31)(H,28,32)","QYBCBMVQSCJMSA-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)NCCCN(C(=O)C=CC2=CC=C(O)C=C2)CCCCNC(=O)C=CC3=CC=C(O)C=C3","InChI=1S/C34H37N3O6/c38-29-13-4-26(5-14-29)10-19-32(41)35-22-1-2-24-37(34(43)21-12-28-8-17-31(40)18-9-28)25-3-23-36-33(42)20-11-27-6-15-30(39)16-7-27/h4-21,38-40H,1-3,22-25H2,(H,35,41)(H,36,42)","PFDVWJCSCYDRMZ-UHFFFAOYSA-N"
"O=C(O)C=CC1=CC=C(O)C=C1","InChI=1S/C9H8O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-6,10H,(H,11,12)","NGSWKAQJJWESNS-UHFFFAOYSA-N"
"OC(=O)C=CC1=CC=CC(O)=C1","InChI=1S/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)","KKSDGJDHHZEWEP-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)C=2C=CC(O)=CC=2(O)","InChI=1S/C15H12O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-9,16-17,19H","DXDRHHKMWQZJHT-UHFFFAOYSA-N"
"O=C(C=CC=1C=C(C(O)=CC=1(OC))C(C=C)(C)C)C2=CC=C(O)C=C2","InChI=1S/C21H22O4/c1-5-21(2,3)17-12-15(20(25-4)13-19(17)24)8-11-18(23)14-6-9-16(22)10-7-14/h5-13,22,24H,1H2,2-4H3","KAZSKMJFUPEHHW-UHFFFAOYSA-N"
"O=C1C=6C=CC=CC=6(NC4=C1CN5C(=O)C3=COC(OC2OC(CO)C(O)C(O)C2(O))C(C=C)C3CC45)","InChI=1S/C26H28N2O9/c1-2-11-13-7-17-19-14(20(30)12-5-3-4-6-16(12)27-19)8-28(17)24(34)15(13)10-35-25(11)37-26-23(33)22(32)21(31)18(9-29)36-26/h2-6,10-11,13,17-18,21-23,25-26,29,31-33H,1,7-9H2,(H,27,30)","ODQBQUXGRYBRTP-UHFFFAOYSA-N"
"O=C5C2=COC(OC1OC(CO)C(O)C(O)C1(O))C(C=C)C2CC6C=4NC=3C=CC=CC=3C=4CCN56","InChI=1S/C26H30N2O8/c1-2-12-15-9-18-20-14(13-5-3-4-6-17(13)27-20)7-8-28(18)24(33)16(15)11-34-25(12)36-26-23(32)22(31)21(30)19(10-29)35-26/h2-6,11-12,15,18-19,21-23,25-27,29-32H,1,7-10H2","LBRPLJCNRZUXLS-UHFFFAOYSA-N"
"O=C(C=CC=1C=CC(O)=C(O)C=1)NCCCCN","InChI=1S/C13H18N2O3/c14-7-1-2-8-15-13(18)6-4-10-3-5-11(16)12(17)9-10/h3-6,9,16-17H,1-2,7-8,14H2,(H,15,18)","KTZNZCYTXQYEHT-UHFFFAOYSA-N"
"O=C(OC1OC(CO)C(O)C(O)C1(O))C=CC=2C=CC(O)=C(O)C=2","InChI=1S/C15H18O9/c16-6-10-12(20)13(21)14(22)15(23-10)24-11(19)4-2-7-1-3-8(17)9(18)5-7/h1-5,10,12-18,20-22H,6H2","WQSDYZZEIBAPIN-UHFFFAOYSA-N"
"NC(CCCCNC(=O)C=CC1=CC(O)=C(O)C=C1)C(O)=O","InChI=1S/C15H20N2O5/c16-11(15(21)22)3-1-2-8-17-14(20)7-5-10-4-6-12(18)13(19)9-10/h4-7,9,11,18-19H,1-3,8,16H2,(H,17,20)(H,21,22)","WVFMZTORJFNZPK-UHFFFAOYSA-N"
"O=C(O)C=CC1=CC=C(O)C(O)=C1","InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)","QAIPRVGONGVQAS-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=CC(O)=C12)C=3C=CC(OC)=C(C=3)C=5C(O)=CC(O)=C4C(=O)C=C(OC4=5)C6=CC=C(O)C=C6","InChI=1S/C31H20O10/c1-39-24-7-4-15(26-12-22(37)29-19(34)9-17(33)10-27(29)40-26)8-18(24)28-20(35)11-21(36)30-23(38)13-25(41-31(28)30)14-2-5-16(32)6-3-14/h2-13,32-36H,1H3","IWEIJEPIYMAGTH-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C(O)=CC(O)=C2C3=CC(=CC=C3(O))C4OC=5C=C(OC)C=C(O)C=5(C(=O)C4))C6=CC=C(O)C=C6","InChI=1S/C31H22O10/c1-39-17-9-20(34)29-23(37)12-26(40-27(29)10-17)15-4-7-19(33)18(8-15)28-21(35)11-22(36)30-24(38)13-25(41-31(28)30)14-2-5-16(32)6-3-14/h2-11,13,26,32-36H,12H2,1H3","XMFILYNCNQOLOA-UHFFFAOYSA-N"
"OC9=CC(O)=C2C(OC(C=1C=CC(O)=C(O)C=1)C(O)C2C=8C(O)=CC(O)=C7C=8(OC(C=3C=CC(O)=C(O)C=3)C(O)C7(C6=C(O)C=C(O)C5=C6(OC(C=4C=CC(O)=C(O)C=4)C(O)C5))))=C9","InChI=1S/C45H38O18/c46-18-10-27(54)33-32(11-18)61-42(16-2-5-21(48)25(52)8-16)39(59)37(33)35-29(56)14-30(57)36-38(40(60)43(63-45(35)36)17-3-6-22(49)26(53)9-17)34-28(55)13-23(50)19-12-31(58)41(62-44(19)34)15-1-4-20(47)24(51)7-15/h1-11,13-14,31,37-43,46-60H,12H2","MOJZMWJRUKIQGL-UHFFFAOYSA-N"
"O=C2NC3=CC=CC=C3(OC2(OC1OC(CO)C(O)C(O)C1(O)))","InChI=1S/C14H17NO8/c16-5-8-9(17)10(18)11(19)13(22-8)23-14-12(20)15-6-3-1-2-4-7(6)21-14/h1-4,8-11,13-14,16-19H,5H2,(H,15,20)","PYQSUTLVBSTCSK-UHFFFAOYSA-N"
"O=C2N(O)C3=CC=CC=C3(OC2(OC1OC(CO)C(O)C(O)C1(O)))","InChI=1S/C14H17NO9/c16-5-8-9(17)10(18)11(19)13(23-8)24-14-12(20)15(21)6-3-1-2-4-7(6)22-14/h1-4,8-11,13-14,16-19,21H,5H2","OUSLYTBGQGKTME-UHFFFAOYSA-N"
"O=C2N(O)C=3C=CC(OC)=CC=3(OC2(OC1OC(CO)C(O)C(O)C1(O)))","InChI=1S/C15H19NO10/c1-23-6-2-3-7-8(4-6)24-15(13(21)16(7)22)26-14-12(20)11(19)10(18)9(5-17)25-14/h2-4,9-12,14-15,17-20,22H,5H2,1H3","WTGXAWKVZMQEDA-UHFFFAOYSA-N"
"O=C2NC3=CC=C(OC)C=C3(OC2(OC1OC(CO)C(O)C(O)C1(O)))","InChI=1S/C15H19NO9/c1-22-6-2-3-7-8(4-6)23-15(13(21)16-7)25-14-12(20)11(19)10(18)9(5-17)24-14/h2-4,9-12,14-15,17-20H,5H2,1H3,(H,16,21)","PMBZSEOAOIYRMW-UHFFFAOYSA-N"
"O=C2N(OC)C=3C=CC(OC)=CC=3(OC2(OC1OC(CO)C(O)C(O)C1(O)))","InChI=1S/C16H21NO10/c1-23-7-3-4-8-9(5-7)25-16(14(22)17(8)24-2)27-15-13(21)12(20)11(19)10(6-18)26-15/h3-5,10-13,15-16,18-21H,6H2,1-2H3","UOASSFRPBORTCT-UHFFFAOYSA-N"
"OCC1OC(OC2C(O)C(O)C(OC3OC4=CC=CC=C4N(O)C3=O)OC2CO)C(O)C(O)C1O","InChI=1S/C20H27NO14/c22-5-9-11(24)12(25)14(27)18(32-9)34-16-10(6-23)33-19(15(28)13(16)26)35-20-17(29)21(30)7-3-1-2-4-8(7)31-20/h1-4,9-16,18-20,22-28,30H,5-6H2","XCAANHSYSCAIDI-UHFFFAOYSA-N"
"COC1=CC2=C(C=C1)N(O)C(=O)C(OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O)O2","InChI=1S/C21H29NO15/c1-32-7-2-3-8-9(4-7)33-21(18(30)22(8)31)37-20-17(15(28)13(26)11(6-24)35-20)36-19-16(29)14(27)12(25)10(5-23)34-19/h2-4,10-17,19-21,23-29,31H,5-6H2,1H3","MQFCGITYMKIYRP-UHFFFAOYSA-N"
"O=C1OC2=CC(OC)=CC=C2(N1)","InChI=1S/C8H7NO3/c1-11-5-2-3-6-7(4-5)12-8(10)9-6/h2-4H,1H3,(H,9,10)","MKMCJLMBVKHUMS-UHFFFAOYSA-N"
"O=C1N(O)C2=CC=CC=C2(OC1(O))","InChI=1S/C8H7NO4/c10-7-8(11)13-6-4-2-1-3-5(6)9(7)12/h1-4,8,11-12H","COVOPZQGJGUPEY-UHFFFAOYSA-N"
"O=C(C=CC=3C=C(OC)C=4OC(C=1C=CC(O)=C(OC)C=1)C(C(=O)NCCC2=CC=C(O)C=C2)C=4(C=3))NCCC5=CC=C(O)C=C5","InChI=1S/C36H36N2O8/c1-44-30-21-25(8-13-29(30)41)34-33(36(43)38-18-16-23-5-11-27(40)12-6-23)28-19-24(20-31(45-2)35(28)46-34)7-14-32(42)37-17-15-22-3-9-26(39)10-4-22/h3-14,19-21,33-34,39-41H,15-18H2,1-2H3,(H,37,42)(H,38,43)","DROXVBRNXCRUHP-UHFFFAOYSA-N"
"O=C1C=3C=C(C=CC=3(C(=O)C=2C(O)=CC=CC1=2))CO","InChI=1S/C15H10O4/c16-7-8-4-5-9-11(6-8)14(18)10-2-1-3-12(17)13(10)15(9)19/h1-6,16-17H,7H2","DGGHVFUGMGGLON-UHFFFAOYSA-N"
"O=C1C=3C=CC=C(O)C=3(C(=O)C=2C(O)=CC(=CC1=2)CO)","InChI=1S/C15H10O5/c16-6-7-4-9-13(11(18)5-7)15(20)12-8(14(9)19)2-1-3-10(12)17/h1-5,16-18H,6H2","YDQWDHRMZQUTBA-UHFFFAOYSA-N"
"O=C1C=4C=CC=C(O)C=4(C(=O)C=2C(O)=CC(=CC1=2)COC3OC(CO)C(O)C(O)C3(O))","InChI=1S/C21H20O10/c22-6-13-17(26)19(28)20(29)21(31-13)30-7-8-4-10-15(12(24)5-8)18(27)14-9(16(10)25)2-1-3-11(14)23/h1-5,13,17,19-24,26,28-29H,6-7H2","ASQHVCDULHERIH-UHFFFAOYSA-N"
"O=C2C=4C=CC=CC=4(C(=O)C=3C=C(C(OC1OC(CO)C(O)C(O)C1(O))=CC2=3)CO)","InChI=1S/C21H20O9/c22-7-9-5-12-13(17(25)11-4-2-1-3-10(11)16(12)24)6-14(9)29-21-20(28)19(27)18(26)15(8-23)30-21/h1-6,15,18-23,26-28H,7-8H2","BSYSQCIGSQBEKF-UHFFFAOYSA-N"
"O=C1C=5C=CC=CC=5(C(=O)C=2C(O)=C(C=CC1=2)COC4OC(COC3OCC(O)C(O)C3(O))C(O)C(O)C4(O))","InChI=1S/C26H28O13/c27-14-8-37-25(23(34)20(14)31)38-9-15-21(32)22(33)24(35)26(39-15)36-7-10-5-6-13-16(17(10)28)19(30)12-4-2-1-3-11(12)18(13)29/h1-6,14-15,20-28,31-35H,7-9H2","BMOUMJCDDOLCGR-UHFFFAOYSA-N"
"O=C3C=5C=CC=CC=5(C(=O)C=4C(O)=C(C(OC2OC(COC1OCC(O)C(O)C1(O))C(O)C(O)C2(O))=CC3=4)CO)","InChI=1S/C26H28O14/c27-6-12-14(5-11-16(19(12)31)18(30)10-4-2-1-3-9(10)17(11)29)39-26-24(36)22(34)21(33)15(40-26)8-38-25-23(35)20(32)13(28)7-37-25/h1-5,13,15,20-28,31-36H,6-8H2","NVKNRXOMCYTFJF-UHFFFAOYSA-N"
"O=C3C=5C=CC=CC=5(C(=O)C=4C(OC)=C(C(OC2OC(COC1OCC(O)C(O)C1(O))C(O)C(O)C2(O))=CC3=4)CO)","InChI=1S/C27H30O14/c1-37-25-13(7-28)15(6-12-17(25)19(31)11-5-3-2-4-10(11)18(12)30)40-27-24(36)22(34)21(33)16(41-27)9-39-26-23(35)20(32)14(29)8-38-26/h2-6,14,16,20-24,26-29,32-36H,7-9H2,1H3","XXKWBXGHSBIVHQ-UHFFFAOYSA-N"
"O=C(O)C(N)CC1=CC=C(O)C(OC)=C1","InChI=1S/C10H13NO4/c1-15-9-5-6(2-3-8(9)12)4-7(11)10(13)14/h2-3,5,7,12H,4,11H2,1H3,(H,13,14)","PFDUUKDQEHURQC-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C)CC1=CC=CC=C1","InChI=1S/C11H13NO3/c1-8(13)12-10(11(14)15)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H,12,13)(H,14,15)","CBQJSKKFNMDLON-UHFFFAOYSA-N"
"O=C(O)CC(NC(=O)CC1=CC=CC=C1)C(=O)O","InChI=1S/C12H13NO5/c14-10(6-8-4-2-1-3-5-8)13-9(12(17)18)7-11(15)16/h1-5,9H,6-7H2,(H,13,14)(H,15,16)(H,17,18)","SVFKZPQPMMZHLZ-UHFFFAOYSA-N"
"O=C(O)CC(=O)NC(C(=O)O)CC2=CNC=1C=CC=CC=12","InChI=1S/C14H14N2O5/c17-12(6-13(18)19)16-11(14(20)21)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,11,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)","OVEAWSPZRGBTSS-UHFFFAOYSA-N"
"O=C(O)C(N)CCC(=O)NC(C(=O)O)CC1=CC=CC=C1","InChI=1S/C14H18N2O5/c15-10(13(18)19)6-7-12(17)16-11(14(20)21)8-9-4-2-1-3-5-9/h1-5,10-11H,6-8,15H2,(H,16,17)(H,18,19)(H,20,21)","XHHOHZPNYFQJKL-UHFFFAOYSA-N"
"O=C(O)C(N)CCC(=O)NC(C(=O)O)CC1=CC=C(O)C=C1","InChI=1S/C14H18N2O6/c15-10(13(19)20)5-6-12(18)16-11(14(21)22)7-8-1-3-9(17)4-2-8/h1-4,10-11,17H,5-7,15H2,(H,16,18)(H,19,20)(H,21,22)","VVLXCWVSSLFQDS-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)CCCC1=CC=CC=C1)CCC(=O)N","InChI=1S/C15H20N2O4/c16-13(18)10-9-12(15(20)21)17-14(19)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,12H,4,7-10H2,(H2,16,18)(H,17,19)(H,20,21)","XKQKXKRCMAJADR-UHFFFAOYSA-N"
"O=C(O)C(N)CC2=CC=C(OC=1C=C(C=CC=1(O))CC(N)C(=O)O)C=C2","InChI=1S/C18H20N2O6/c19-13(17(22)23)7-10-1-4-12(5-2-10)26-16-9-11(3-6-15(16)21)8-14(20)18(24)25/h1-6,9,13-14,21H,7-8,19-20H2,(H,22,23)(H,24,25)","FWZXNPNHUWFOCM-UHFFFAOYSA-N"
"O=C(O)C1NC(=O)CC1","InChI=1S/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)","ODHCTXKNWHHXJC-UHFFFAOYSA-N"
"O=C(O)C(N)C(C)CC","InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)","AGPKZVBTJJNPAG-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C)CC(C)C","InChI=1S/C8H15NO3/c1-5(2)4-7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)","WXNXCEHXYPACJF-UHFFFAOYSA-N"
"O=C(O)C(N)CC1=CC=CC=C1","InChI=1S/C9H11NO2/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H,11,12)","COLNVLDHVKWLRT-UHFFFAOYSA-N"
"O=C(O)C(N)CC1=CC=C(O)C=C1","InChI=1S/C9H11NO3/c10-8(9(12)13)5-6-1-3-7(11)4-2-6/h1-4,8,11H,5,10H2,(H,12,13)","OUYCCCASQSFEME-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)CCOC2OC(CO)C(O)C(O)C2(O)","InChI=1S/C14H20O7/c15-7-10-11(17)12(18)13(19)14(21-10)20-6-5-8-1-3-9(16)4-2-8/h1-4,10-19H,5-7H2","ILRCGYURZSFMEG-UHFFFAOYSA-N"
"OCC3(O)(COC(OCC2OC(OCC1=CC=CC=C1)C(O)C(O)C2(O))C3(O))","InChI=1S/C18H26O10/c19-8-18(24)9-27-17(15(18)23)26-7-11-12(20)13(21)14(22)16(28-11)25-6-10-4-2-1-3-5-10/h1-5,11-17,19-24H,6-9H2","NJMQSVWMCODQIP-UHFFFAOYSA-N"
"OCC3(O)(COC(OCC2OC(OCCC1=CC=CC=C1)C(O)C(O)C2(O))C3(O))","InChI=1S/C19H28O10/c20-9-19(25)10-28-18(16(19)24)27-8-12-13(21)14(22)15(23)17(29-12)26-7-6-11-4-2-1-3-5-11/h1-5,12-18,20-25H,6-10H2","GZSQKOFXMZDKPV-UHFFFAOYSA-N"
"OCC3OC(OCC1=CC=CC=C1)C(OC2OC(CO)C(O)C(O)C2(O))C(O)C3(O)","InChI=1S/C19H28O11/c20-6-10-12(22)14(24)16(26)18(28-10)30-17-15(25)13(23)11(7-21)29-19(17)27-8-9-4-2-1-3-5-9/h1-5,10-26H,6-8H2","WKXRKKUZTXIFJY-UHFFFAOYSA-N"
"OCC1OC(OC2=C(O)C=C(O)C3=C2OC(=C(O)C3=O)C2=CC=C(O)C(O)=C2)C(O)C(O)C1O","InChI=1S/C21H20O13/c22-5-11-13(27)15(29)17(31)21(32-11)34-19-10(26)4-9(25)12-14(28)16(30)18(33-20(12)19)6-1-2-7(23)8(24)3-6/h1-4,11,13,15,17,21-27,29-31H,5H2","SJRXVLUZMMDCNG-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1O)C1=C(OC2OC(CO)C(O)C(O)C2O)C(=O)C2=C(O1)C=C(O)C=C2O","InChI=1S/C23H24O13/c1-32-12-3-8(4-13(33-2)16(12)27)21-22(18(29)15-10(26)5-9(25)6-11(15)34-21)36-23-20(31)19(30)17(28)14(7-24)35-23/h3-6,14,17,19-20,23-28,30-31H,7H2,1-2H3","JMFWYRWPJVEZPV-UHFFFAOYSA-N"
"CC1OC(OCC2OC(OC3=C(OC4=C(C(O)=CC(OC5OC(C)C(O)C(O)C5O)=C4)C3=O)C3=CC=C(O)C=C3)C(O)C(O)C2O)C(O)C(O)C1O","InChI=1S/C33H40O19/c1-10-19(36)23(40)26(43)31(47-10)46-9-17-21(38)25(42)28(45)33(51-17)52-30-22(39)18-15(35)7-14(49-32-27(44)24(41)20(37)11(2)48-32)8-16(18)50-29(30)12-3-5-13(34)6-4-12/h3-8,10-11,17,19-21,23-28,31-38,40-45H,9H2,1-2H3","PEFASEPMJYRQBW-UHFFFAOYSA-N"
"COC1=CC=C(C=C1O)C1=CC(=O)C2=C(O1)C=C(OC1OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C1O)C=C2O","InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3","GZSOSUNBTXMUFQ-UHFFFAOYSA-N"
"COC1=CC=C(C=C1O)C1CC(=O)C2=C(O1)C=C(O)C=C2O","InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3","AIONOLUJZLIMTK-UHFFFAOYSA-N"
"OCC=CC1=CC=C(O)C(O)=C1","InChI=1S/C9H10O3/c10-5-1-2-7-3-4-8(11)9(12)6-7/h1-4,6,10-12H,5H2","ZCKDCRKBURQZPT-UHFFFAOYSA-N"
"CC1=C2C=CN=CC2=C(C)C2=C1NC1=C2C=CC=C1","InChI=1S/C17H14N2/c1-10-14-9-18-8-7-12(14)11(2)17-16(10)13-5-3-4-6-15(13)19-17/h3-9,19H,1-2H3","CTSPAMFJBXKSOY-UHFFFAOYSA-N"
"COC1=CC(=CC(O)=C1O)C1=[O+]C2=C(C=C1OC1OC(CO)C(O)C(O)C1O)C(O)=CC(O)=C2","InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27)/p+1","CCQDWIRWKWIUKK-UHFFFAOYSA-O"
"CC(NC(=O)CC1=CNC2=C1C=CC=C2)C(O)=O","InChI=1S/C13H14N2O3/c1-8(13(17)18)15-12(16)6-9-7-14-11-5-3-2-4-10(9)11/h2-5,7-8,14H,6H2,1H3,(H,15,16)(H,17,18)","FBDCJLXTUCMFLF-UHFFFAOYSA-N"
"COC(=O)C1=COC(C)C2CN3CCC4(C3CC12)C(=O)NC1=C4C=CC(OC)=C1OC","InChI=1S/C23H28N2O6/c1-12-14-10-25-8-7-23(18(25)9-13(14)15(11-31-12)21(26)30-4)16-5-6-17(28-2)20(29-3)19(16)24-22(23)27/h5-6,11-14,18H,7-10H2,1-4H3,(H,24,27)","TTZWEOINXHJHCY-UHFFFAOYSA-N"
"CC(C1CC(C)=C(C)C(=O)O1)C1(O)CCC2C3C4OC4C4(O)CC=CC(=O)C4(C)C3CCC12C","InChI=1S/C28H38O6/c1-14-13-19(33-24(30)15(14)2)16(3)27(31)12-9-17-21-18(8-11-25(17,27)4)26(5)20(29)7-6-10-28(26,32)23-22(21)34-23/h6-7,16-19,21-23,31-32H,8-13H2,1-5H3","FAZIYUIDUNHZRG-UHFFFAOYSA-N"
"CC1(C)CC2C3=CCC4C5(C)CCC(O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C)C(O)C1O","InChI=1S/C30H50O4/c1-25(2)16-19-18-8-9-21-27(4)12-11-22(32)28(5,17-31)20(27)10-13-30(21,7)29(18,6)15-14-26(19,3)24(34)23(25)33/h8,19-24,31-34H,9-17H2,1-7H3","CDDWAYFUFNQLRZ-UHFFFAOYSA-N"
"CC(C)=CCC=C(C)C1CCC2(C)C1C(O)CC1C3(C)CCC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)C3CCC21C","InChI=1S/C36H60O7/c1-20(2)10-9-11-21(3)22-12-16-36(8)28(22)23(38)18-26-34(6)15-14-27(33(4,5)25(34)13-17-35(26,36)7)43-32-31(41)30(40)29(39)24(19-37)42-32/h10-11,22-32,37-41H,9,12-19H2,1-8H3","PHLXREOMFNVWOH-UHFFFAOYSA-N"
"COC1=CC=C2CC3N(C)CCC4=C3C(OC3=CC5=C(CCN=C5CC5=CC=C(OC1=C2)C=C5)C=C3OC)=C(OC)C(OC)=C4OC","InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3","YWNUNVSMOKMJMG-UHFFFAOYSA-N"
"COC1=CC=C2CC3N(C)CCC4=C3C(OC3=CC5=C(CCN(C)C5CC5=CC=C(OC1=C2)C=C5)C=C3OC)=C(OC)C(OC)=C4OC","InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3","FUZMQNZACIFDBL-UHFFFAOYSA-N"
"COC1=CC=C(C=CC2=CC(OC)=CC(OC)=C2)C=C1","InChI=1S/C17H18O3/c1-18-15-8-6-13(7-9-15)4-5-14-10-16(19-2)12-17(11-14)20-3/h4-12H,1-3H3","GDHNBPHYVRHYCC-UHFFFAOYSA-N"
"OC(=O)C1=CC2=C(OCO2)C2=C1C(=CC1=CC=CC=C21)[N+]([O-])=O","InChI=1S/C16H9NO6/c18-16(19)10-6-12-15(23-7-22-12)14-9-4-2-1-3-8(9)5-11(13(10)14)17(20)21/h1-6H,7H2,(H,18,19)","MEEXETVZNQYRSP-UHFFFAOYSA-N"
"COC1=C(OC)C2=C(C=C1)C(OC2=O)C1N(C)CCC2=C1C=C1OCOC1=C2","InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3","JZUTXVTYJDCMDU-UHFFFAOYSA-N"
"COC1=CC2=C(C(OC)=C1OC)C1=C(OC)C(OC)=C(OC)C=C1CC(C)(O)C(C)C2","InChI=1S/C24H32O7/c1-13-9-14-10-16(26-3)20(28-5)22(30-7)18(14)19-15(12-24(13,2)25)11-17(27-4)21(29-6)23(19)31-8/h10-11,13,25H,9,12H2,1-8H3","YEFOAORQXAOVJQ-UHFFFAOYSA-N"
"COC1=CC=C(C(C)=O)C(O)=C1","InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3","UILPJVPSNHJFIK-UHFFFAOYSA-N"
"COC1=CC=C(CC2COC(=O)C2CC2=CC=C(O)C(OC)=C2)C=C1OC","InChI=1S/C21H24O6/c1-24-18-7-5-13(11-20(18)26-3)8-15-12-27-21(23)16(15)9-14-4-6-17(22)19(10-14)25-2/h4-7,10-11,15-16,22H,8-9,12H2,1-3H3","NQWVSMVXKMHKTF-UHFFFAOYSA-N"
"COC1=C2OCOC2=CC2=C(C3=C(C=C12)C(=O)OC3)C1=CC2=C(OCO2)C=C1","InChI=1S/C21H14O7/c1-23-19-12-5-13-14(7-24-21(13)22)18(11(12)6-17-20(19)28-9-27-17)10-2-3-15-16(4-10)26-8-25-15/h2-6H,7-9H2,1H3","VINGQMQXGDIELG-UHFFFAOYSA-N"
"COC1=CC2=C3C(CC4=CC=C(OC5=CC(CC6N(C)CCC7=CC(OC)=C(OC3=C1OC)C=C67)=CC=C5O)C=C4)N(C)CC2","InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(41-3)33-21-27(24)28(38)17-23-8-11-30(40)31(18-23)44-26-9-6-22(7-10-26)16-29-35-25(13-15-39(29)2)20-34(42-4)36(43-5)37(35)45-33/h6-11,18-21,28-29,40H,12-17H2,1-5H3","HGNHIFJNOKGSKI-UHFFFAOYSA-N"
"COC1=CC=C2CC3N(C)CCC4=C3C(OC3=CC5=C(CCN(C)C5CC5=CC=C(OC1=C2)C=C5)C=C3OC)=C(OC)C(OC)=C4","InChI=1S/C38H42N2O6/c1-39-15-13-25-20-32(42-4)34-22-28(25)29(39)17-23-7-10-27(11-8-23)45-33-19-24(9-12-31(33)41-3)18-30-36-26(14-16-40(30)2)21-35(43-5)37(44-6)38(36)46-34/h7-12,19-22,29-30H,13-18H2,1-6H3","WVTKBKWTSCPRNU-UHFFFAOYSA-N"
"CN1CC2(C=C)C3CC4OCC3C1CC21C4=NC2=CC=CC=C12","InChI=1S/C20H22N2O/c1-3-19-11-22(2)16-9-20(19)13-6-4-5-7-15(13)21-18(20)17-8-14(19)12(16)10-23-17/h3-7,12,14,16-17H,1,8-11H2,2H3","VTLYEMHGPMGUOT-UHFFFAOYSA-N"
"CCC1=NC2CC3(C4CC1C2CO4)C(=O)N(OC)C1=C3C=CC=C1","InChI=1S/C19H22N2O3/c1-3-14-11-8-17-19(9-15(20-14)12(11)10-24-17)13-6-4-5-7-16(13)21(23-2)18(19)22/h4-7,11-12,15,17H,3,8-10H2,1-2H3","BIGABVPVCRHEES-UHFFFAOYSA-N"
"COCC=C1CN2C3CC45C2CC1C3COC4=NC1=C5C(OC)=C(OC)C=C1OC","InChI=1S/C23H28N2O5/c1-26-6-5-12-10-25-15-9-23-18(25)7-13(12)14(15)11-30-22(23)24-20-16(27-2)8-17(28-3)21(29-4)19(20)23/h5,8,13-15,18H,6-7,9-11H2,1-4H3","RIMDDIPKIZTBHU-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C=CC=C2)C1=CC=CC=C1","InChI=1S/C15H10O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H","VHBFFQKBGNRLFZ-UHFFFAOYSA-N"
"O=C1CC(OC2=C1C=CC=C2)C1=CC=CC=C1","InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2","ZONYXWQDUYMKFB-UHFFFAOYSA-N"
"OC1CC2=C(OC1C1=CC(O)=C(O)C=C1)C=C(O)C=C2O","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2","PFTAWBLQPZVEMU-UHFFFAOYSA-N"
"COC1=CC=C2C=CC(=O)OC2=C1CC=C(C)C","InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3","MBRLOUHOWLUMFF-UHFFFAOYSA-N"
"COC1=CC(C=CC(=O)N2CCC=CC2=O)=CC(OC)=C1OC","InChI=1S/C17H19NO5/c1-21-13-10-12(11-14(22-2)17(13)23-3)7-8-16(20)18-9-5-4-6-15(18)19/h4,6-8,10-11H,5,9H2,1-3H3","VABYUUZNAVQNPG-UHFFFAOYSA-N"
"O=C(C=CC1=CC=CC=C1)C1=CC=CC=C1","InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H","DQFBYFPFKXHELB-UHFFFAOYSA-N"
"O=C1NCCC2=C1NC1=CC=CC=C21","InChI=1S/C11H10N2O/c14-11-10-8(5-6-12-11)7-3-1-2-4-9(7)13-10/h1-4,13H,5-6H2,(H,12,14)","FZHZQHNKCPJTNQ-UHFFFAOYSA-N"
"OC1=CC=C(C=CC2=CC(O)=CC3=C2C(C(O3)C2=CC=C(O)C=C2)C2=CC(O)=CC(O)=C2)C=C1","InChI=1S/C28H22O6/c29-20-7-2-16(3-8-20)1-4-18-11-24(33)15-25-26(18)27(19-12-22(31)14-23(32)13-19)28(34-25)17-5-9-21(30)10-6-17/h1-15,27-33H","FQWLMRXWKZGLFI-UHFFFAOYSA-N"
"OCC1OC(OC2=CC(O)=CC3=[O+]C(=C(OC4OC(CO)C(O)C(O)C4O)C=C23)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O","InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1","RDFLLVCQYHQOBU-UHFFFAOYSA-O"
"NC(=O)CN1CC2CC(C1)C1=CC=CC(=O)N1C2","InChI=1S/C13H17N3O2/c14-12(17)8-15-5-9-4-10(7-15)11-2-1-3-13(18)16(11)6-9/h1-3,9-10H,4-8H2,(H2,14,17)","MRVHCCZFXHOQOT-UHFFFAOYSA-N"
"CC(C)C(NC(=O)CC1=CNC2=CC=CC=C12)C(O)=O","InChI=1S/C15H18N2O3/c1-9(2)14(15(19)20)17-13(18)7-10-8-16-12-6-4-3-5-11(10)12/h3-6,8-9,14,16H,7H2,1-2H3,(H,17,18)(H,19,20)","AZEGJHGXTSUPPG-UHFFFAOYSA-N"
"C1CN2CC3=C(C=CC=C3)N=C2C1","InChI=1S/C11H12N2/c1-2-5-10-9(4-1)8-13-7-3-6-11(13)12-10/h1-2,4-5H,3,6-8H2","WUFQLZTXIWKION-UHFFFAOYSA-N"
"O=C1N2CCCC2=NC2=C1C=CC=C2","InChI=1S/C11H10N2O/c14-11-8-4-1-2-5-9(8)12-10-6-3-7-13(10)11/h1-2,4-5H,3,6-7H2","VARHXCYGZKSOOO-UHFFFAOYSA-N"
"OC1CCN2CC3=C(C=CC=C3)N=C12","InChI=1S/C11H12N2O/c14-10-5-6-13-7-8-3-1-2-4-9(8)12-11(10)13/h1-4,10,14H,5-7H2","YIICVSCAKJMMDJ-UHFFFAOYSA-N"
"CCC1C(CC2=CN=CN2C)COC1=O","InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3","QCHFTSOMWOSFHM-UHFFFAOYSA-N"
"C1CCN2CC3CC(CN4CCCCC34)C2C1","InChI=1S/C15H26N2/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17/h12-15H,1-11H2","SLRCCWJSBJZJBV-UHFFFAOYSA-N"
"O=C1CCCC2C3CCCN4CCCC(CN12)C34","InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2","ZSBXGIUJOOQZMP-UHFFFAOYSA-N"
"CNC(=O)OC1=CC=C2N(C)C3N(C)CCC3(C)C2=C1","InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)","PIJVFDBKTWXHHD-UHFFFAOYSA-N"
"O=C(C=CC=CC1=CC2=C(OCO2)C=C1)N1CCCCC1","InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2","MXXWOMGUGJBKIW-UHFFFAOYSA-N"
"CC(C)C(O)(C(C)O)C(=O)OCC1CCN2CCCC12","InChI=1S/C15H27NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3","BWQSLRZZOVFVHJ-UHFFFAOYSA-N"
"CCC12CCCN3CCC4=C(C13)N(C1=C4C=CC=C1)C(=O)C2","InChI=1S/C19H22N2O/c1-2-19-9-5-10-20-11-8-14-13-6-3-4-7-15(13)21(16(22)12-19)17(14)18(19)20/h3-4,6-7,18H,2,5,8-12H2,1H3","WYJAPUKIYAZSEM-UHFFFAOYSA-N"
"CC(C)C(O)(C(C)O)C(=O)OCC1=CCN2CCC(O)C12","InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3","SFVVQRJOGUKCEG-UHFFFAOYSA-N"
"CC(C)C(O)(C(C)O)C(=O)OCC1CC[N+]2([O-])CCCC12","InChI=1S/C15H27NO5/c1-10(2)15(19,11(3)17)14(18)21-9-12-6-8-16(20)7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3","DLNWZIVYKQXLTN-UHFFFAOYSA-N"
"C1CCC(NC1)C12CC(CC3CCCNC13)C1CCCCN1C2","InChI=1S/C20H35N3/c1-3-9-21-18(8-1)20-13-16(12-15-6-5-10-22-19(15)20)17-7-2-4-11-23(17)14-20/h15-19,21-22H,1-14H2","YUKCLPPRYNXRAF-UHFFFAOYSA-N"
"CCC1C2N3CCC22C(NC4=C2C=CC=C4)=C(C1CC3)C(=O)OC","InChI=1S/C20H24N2O2/c1-3-12-13-8-10-22-11-9-20(18(12)22)14-6-4-5-7-15(14)21-17(20)16(13)19(23)24-2/h4-7,12-13,18,21H,3,8-11H2,1-2H3","RLAKWLFUMAABBE-UHFFFAOYSA-N"
"COC1=CC=C2N=CC=C(C(O)C3CC4CCN3CC4C=C)C2=C1","InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3","LOUPRKONTZGTKE-UHFFFAOYSA-N"
"CCC1C2CC3C4N(C)C5=C(C=CC=C5)C44CC(C2C4O)N3C1O","InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3","CJDRUOGAGYHKKD-UHFFFAOYSA-N"
"C[N+]1=CC2=C(C=CC3=C2OCO3)C2=C1C1=C(C=C2)C=C2OCOC2=C1","InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1","INVGWHRKADIJHF-UHFFFAOYSA-N"
"CC=C1CC(=C)C(C)(O)C(=O)OCC2=CCN3CCC(OC1=O)C23","InChI=1S/C18H23NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,14-15,22H,2,6-10H2,1,3H3","FCEVNJIUIMLVML-UHFFFAOYSA-N"
"O=C1CC2OCC=C3CN4CCC56C4CC3C2C5N1C1=CC=CC=C61","InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2","QMGVPVSNSZLJIA-UHFFFAOYSA-N"
"CC=C1CC(C)C(C)(O)C(=O)OCC2=CCN3CCC(OC1=O)C23","InChI=1S/C18H25NO5/c1-4-12-9-11(2)18(3,22)17(21)23-10-13-5-7-19-8-6-14(15(13)19)24-16(12)20/h4-5,11,14-15,22H,6-10H2,1-3H3","HKODIGSRFALUTA-UHFFFAOYSA-N"
"CCC12CC(C(=O)OC)=C3NC4=CC=CC=C4C33CCN(CC=C1)C23","InChI=1S/C21H24N2O2/c1-3-20-9-6-11-23-12-10-21(19(20)23)15-7-4-5-8-16(15)22-17(21)14(13-20)18(24)25-2/h4-9,19,22H,3,10-13H2,1-2H3","FNGGIPWAZSFKCN-UHFFFAOYSA-N"
"CCC1=CC2CN3CCC4=C(NC5=C4C=CC=C5)C(C2)(C13)C(=O)OC","InChI=1S/C21H24N2O2/c1-3-14-10-13-11-21(20(24)25-2)18-16(8-9-23(12-13)19(14)21)15-6-4-5-7-17(15)22-18/h4-7,10,13,19,22H,3,8-9,11-12H2,1-2H3","CMKFQVZJOWHHDV-UHFFFAOYSA-N"
"COC(=O)C1CC23CCCN4CCC5(C24)C2=CC=CC=C2NC15CC3","InChI=1S/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3","IYLRRIUNGGQRTN-UHFFFAOYSA-N"
"COC1=C(OC)C2=C3C(CC4=C2C=C2OCOC2=C4)N(C)CCC3=C1","InChI=1S/C20H21NO4/c1-21-5-4-11-7-17(22-2)20(23-3)19-13-9-16-15(24-10-25-16)8-12(13)6-14(21)18(11)19/h7-9,14H,4-6,10H2,1-3H3","WSVWKHTVFGTTKJ-UHFFFAOYSA-N"
"COC1=CC=C(CC2=NC=CC3=CC(OC)=C(OC)C=C23)C=C1OC","InChI=1S/C20H21NO4/c1-22-17-6-5-13(10-18(17)23-2)9-16-15-12-20(25-4)19(24-3)11-14(15)7-8-21-16/h5-8,10-12H,9H2,1-4H3","XQYZDYMELSJDRZ-UHFFFAOYSA-N"
"COC1=CC=C2CC3N(C)CCC4=C3C(=C(OC)C(OC)=C4)C2=C1O","InChI=1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3","QELDJEKNFOQJOY-UHFFFAOYSA-N"
"CN1CCC23C4NC5=C(C=CC=C5)C2(CCN4C)C1NC1=C3C=CC=C1","InChI=1S/C22H26N4/c1-25-13-11-22-16-8-4-5-9-17(16)23-19(25)21(22)12-14-26(2)20(22)24-18-10-6-3-7-15(18)21/h3-10,19-20,23-24H,11-14H2,1-2H3","XSYCDVWYEVUDKQ-UHFFFAOYSA-N"
"COC1=C(OC)C2=C(C=C1)C1=C(C3=C(C=C1)C=C1OCOC1=C3)[N+](C)=C2","InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1","LLEJIEBFSOEYIV-UHFFFAOYSA-N"
"COC1=CC2=C(C=C1OC)C1=CC3=CC=C(OC)C(OC)=C3C=[N+]1CC2","InChI=1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1","QUCQEUCGKKTEBI-UHFFFAOYSA-N"
"CC=C1CC(C)C(O)(CO)C(=O)OCC2=CCN3CCC(OC1=O)C23","InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3","BCJMNZRQJAVDLD-UHFFFAOYSA-N"
"CON1C(=O)C2(C3C4C5COC2CC5C3(CN4C)C=C)C2=C1C=CC=C2","InChI=1S/C21H24N2O3/c1-4-20-11-22(2)17-12-10-26-16(9-14(12)20)21(18(17)20)13-7-5-6-8-15(13)23(25-3)19(21)24/h4-8,12,14,16-18H,1,9-11H2,2-3H3","SSSCMFCWHWCCEH-UHFFFAOYSA-N"
"COC(=O)C1CC23CCCN4(=O)CCC5(C24)C2=CC=CC=C2NC15CC3","InChI=1S/C21H26N2O3/c1-26-17(24)15-13-19-7-4-11-23(25)12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3","KWXHCCIXBUPHTG-UHFFFAOYSA-N"
"CCC12CCCN3CCC4=C(C13)N(C1=C4C=CC=C1)C(O)(C2)C(=O)OC","InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3","RXPRRQLKFXBCSJ-UHFFFAOYSA-N"
"CC1C2CCC3C4CC=C5CC(CCC5(C)C4CCC23CN1C)N(C)C","InChI=1S/C24H40N2/c1-16-20-8-9-22-19-7-6-17-14-18(25(3)4)10-12-23(17,2)21(19)11-13-24(20,22)15-26(16)5/h6,16,18-22H,7-15H2,1-5H3","GPLGAQQQNWMVMM-UHFFFAOYSA-N"
"COC1=CC=C(CC2N(C)CCC3=C2C=C(OC)C(OC)=C3)C=C1OC","InChI=1S/C21H27NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-7,11-13,17H,8-10H2,1-5H3","KGPAYJZAMGEDIQ-UHFFFAOYSA-N"
"CCN1CC2(C)CCC(O)C34C1C(CC23)C12CC(C(O)CC41)C(=C)C2O","InChI=1S/C22H33NO3/c1-4-23-10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3","AZAZKLKDEOMJBJ-UHFFFAOYSA-N"
"COC1=CC2=C(C=C1OC)C1=C(C)C3=C(C=[N+]1CC2)C(OC)=C(OC)C=C3","InChI=1S/C22H24NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-12H,8-9H2,1-5H3/q+1","RFKQJTRWODZPHF-UHFFFAOYSA-N"
"CCC1CN2CCC3=C(NC4=CC=CC=C34)C2CC1C(=COC)C(=O)OC","InChI=1S/C22H28N2O3/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3/h5-8,13-14,17,20,23H,4,9-12H2,1-3H3","NMLUOJBSAYAYEM-UHFFFAOYSA-N"
"COC1=C(OC)C=C2C3C(C)C4=C(CN3CCC2=C1)C(OC)=C(OC)C=C4","InChI=1S/C22H27NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-11,13,21H,8-9,12H2,1-5H3","VRSRXLJTYQVOHC-UHFFFAOYSA-N"
"CCN1CC2(C)CCC(O)C34C5CC6C(O)C5C(O)(CC6OC)C(CC23)C14","InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3","HKQZUYOVMYOFIT-UHFFFAOYSA-N"
"CCC1CC2CN3CCC4(O)C5=CC(OC)=CC=C5N=C4C(C2)(C13)C(=O)OC","InChI=1S/C22H28N2O4/c1-4-14-9-13-11-21(20(25)28-3)18(14)24(12-13)8-7-22(26)16-10-15(27-2)5-6-17(16)23-19(21)22/h5-6,10,13-14,18,26H,4,7-9,11-12H2,1-3H3","AVRFPRAAVSCSSZ-UHFFFAOYSA-N"
"CCOC1OC2C(N(C)CCC3=C2C=C2OCOC2=C3)C2=C1C1=C(OCO1)C=C2","InChI=1S/C22H23NO6/c1-3-24-22-18-13(4-5-15-21(18)28-11-25-15)19-20(29-22)14-9-17-16(26-10-27-17)8-12(14)6-7-23(19)2/h4-5,8-9,19-20,22H,3,6-7,10-11H2,1-2H3","RKBDCPZCGRWNMP-UHFFFAOYSA-N"
"COC(=O)C1(O)CC23CCCN4CCC5(C24)C2=CC=C4OCOC4=C2NC15CC3","InChI=1S/C22H26N2O5/c1-27-18(25)21(26)11-19-5-2-9-24-10-8-20(17(19)24)13-3-4-14-16(29-12-28-14)15(13)23-22(20,21)7-6-19/h3-4,17,23,26H,2,5-12H2,1H3","JVIKUDVTJCANPX-UHFFFAOYSA-N"
"CCN1CC2(COC)CCC(O)C34C5CC6C(O)C5C(O)(CC6OC)C(CC23)C14","InChI=1S/C23H37NO5/c1-4-24-10-21(11-28-2)6-5-17(25)23-13-7-12-15(29-3)9-22(27,18(13)19(12)26)14(20(23)24)8-16(21)23/h12-20,25-27H,4-11H2,1-3H3","RBSZCNOWHDHRFZ-UHFFFAOYSA-N"
"CC(C1CCC2C3CC(=O)C4CC(O)CCC4(C)C3CCC12C)C1=NCC(C)CC1","InChI=1S/C27H43NO2/c1-16-5-8-24(28-15-16)17(2)20-6-7-21-19-14-25(30)23-13-18(29)9-11-27(23,4)22(19)10-12-26(20,21)3/h16-23,29H,5-15H2,1-4H3","QAGPPGDCPAPQLW-UHFFFAOYSA-N"
"CCC1CN2CCC3(O)C(=NC4=C3C(OC)=CC=C4)C2CC1C(=COC)C(=O)OC","InChI=1S/C23H30N2O5/c1-5-14-12-25-10-9-23(27)20-17(7-6-8-19(20)29-3)24-21(23)18(25)11-15(14)16(13-28-2)22(26)30-4/h6-8,13-15,18,27H,5,9-12H2,1-4H3","RYENLSMHLCNXJT-UHFFFAOYSA-N"
"CCC1CN2CCC3=CC(OC)=C(OC)C=C3C2CC1CC1NCCC2=CC(O)=C(OC)C=C12","InChI=1S/C28H38N2O4/c1-5-17-16-30-9-7-19-13-27(33-3)28(34-4)15-22(19)24(30)11-20(17)10-23-21-14-26(32-2)25(31)12-18(21)6-8-29-23/h12-15,17,20,23-24,29,31H,5-11,16H2,1-4H3","DTGZHCFJNDAHEN-UHFFFAOYSA-N"
"CCN1CC2(CO)CCC(OC)C34C5CC6C(OC)C5C(O)(CC6OC)C(O)(C(OC)C23)C14","InChI=1S/C25H41NO7/c1-6-26-11-22(12-27)8-7-16(31-3)24-14-9-13-15(30-2)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3","YOTUXHIWBVZAJQ-UHFFFAOYSA-N"
"CCC1CN2CCC3=CC(OC)=C(OC)C=C3C2CC1CC1NCCC2=CC(OC)=C(OC)C=C12","InChI=1S/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3","AUVVAXYIELKVAI-UHFFFAOYSA-N"
"CCN1CC2(CCC(OC)C34C5CC6C(OC)C5(O)C(O)(CC6OC)C(CC23)C14)OC(=O)C1=C(N)C=CC=C1","InChI=1S/C30H42N2O7/c1-5-32-15-27(39-26(33)16-8-6-7-9-19(16)31)11-10-23(37-3)29-21(27)13-18(24(29)32)28(34)14-20(36-2)17-12-22(29)30(28,35)25(17)38-4/h6-9,17-18,20-25,34-35H,5,10-15,31H2,1-4H3","VSUODASNSRJNCP-UHFFFAOYSA-N"
"CCN1CC2(COC(=O)C3=C(N)C=CC=C3)CCC(OC)C34C5CC6C(OC)C5C(O)(CC6OC)C(O)(C(OC)C23)C14","InChI=1S/C32H46N2O8/c1-6-34-15-29(16-42-27(35)17-9-7-8-10-20(17)33)12-11-22(39-3)31-19-13-18-21(38-2)14-30(36,23(19)24(18)40-4)32(37,28(31)34)26(41-5)25(29)31/h7-10,18-19,21-26,28,36-37H,6,11-16,33H2,1-5H3","NNDHDYDFEDRMGH-UHFFFAOYSA-N"
"COCC12CCC(OC)C34C5CC6(O)C(OC(=O)C7=CC=CC=C7)C5C(OC(C)=O)(C(C(OC)C13)C4N(C)C2)C(O)C6OC","InChI=1S/C33H45NO10/c1-17(35)44-33-21-19(14-31(38,28(42-6)26(33)36)27(21)43-29(37)18-10-8-7-9-11-18)32-20(40-4)12-13-30(16-39-3)15-34(2)25(32)22(33)23(41-5)24(30)32/h7-11,19-28,36,38H,12-16H2,1-6H3","FIDOCHXHMJHKRW-UHFFFAOYSA-N"
"COCC12CN(C)C3C4C(OC)C1C3(C1CC3(O)C(OC(=O)C5=CC=CC=C5)C1C4(OC(C)=O)C(O)C3OC)C(CC2O)OC","InChI=1S/C33H45NO11/c1-16(35)45-33-21-18(13-31(39,28(43-6)26(33)37)27(21)44-29(38)17-10-8-7-9-11-17)32-20(41-4)12-19(36)30(15-40-3)14-34(2)25(32)22(33)23(42-5)24(30)32/h7-11,18-28,36-37,39H,12-15H2,1-6H3","XUHJBXVYNBQQBD-UHFFFAOYSA-N"
"CCN1CC2(COC)C3C(OC)C4C1C3(C1CC3(O)C(OC(=O)C5=CC=CC=C5)C1C4(OC(C)=O)C(O)C3OC)C(CC2O)OC","InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3","XFSBVAOIAHNAPC-UHFFFAOYSA-N"
"CCN1CC2(COC)C3C(OC)C4C1C3(C1CC3(O)C(OC(=O)C5=CC=CC=C5)C1C4(OC(C)=O)C(O)C3OC)C(CC2OC(C)=O)OC","InChI=1S/C36H49NO12/c1-8-37-16-33(17-43-4)22(47-18(2)38)14-23(44-5)35-21-15-34(42)30(48-32(41)20-12-10-9-11-13-20)24(21)36(49-19(3)39,29(40)31(34)46-7)25(28(35)37)26(45-6)27(33)35/h9-13,21-31,40,42H,8,14-17H2,1-7H3","RIPYIJVYDYCPKW-UHFFFAOYSA-N"
"OCC2(C)(C(O)CCC3(C)(C4CC=C1C5CC(C=CC5(C)(CCC1(C)C4(C)(CCC23)))(C)C))","InChI=1S/C30H48O2/c1-25(2)14-15-26(3)16-17-29(6)20(21(26)18-25)8-9-23-27(4)12-11-24(32)28(5,19-31)22(27)10-13-30(23,29)7/h8,14-15,21-24,31-32H,9-13,16-19H2,1-7H3","VNGUCOGHCJHFID-UHFFFAOYSA-N"
"O=C(O)C7OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CC(=O)C5(C)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(OC6OC(CO)C(O)C(O)C6(O))C(O)C7(O)","InChI=1S/C42H66O14/c1-37(2)16-21-20-8-9-24-39(4)12-11-26(40(5,19-44)23(39)10-13-42(24,7)41(20,6)15-14-38(21,3)25(45)17-37)54-36-33(30(49)29(48)32(55-36)34(51)52)56-35-31(50)28(47)27(46)22(18-43)53-35/h8,21-24,26-33,35-36,43-44,46-50H,9-19H2,1-7H3,(H,51,52)","YDNHBSRZSMNZPB-UHFFFAOYSA-N"
"O=C(O)C7OC(OC2CCC3(C)(C4CC=C1C5CC(C)(C)CCC5(C(=O)O)(CCC1(C)C4(C)(CCC3(C2(C)(CO))))))C(O)C(OC6OC(CO)C(O)C(O)C6(O))C7(O)","InChI=1S/C42H66O15/c1-37(2)13-15-42(36(52)53)16-14-40(5)20(21(42)17-37)7-8-24-38(3)11-10-25(39(4,19-44)23(38)9-12-41(24,40)6)55-35-30(49)31(29(48)32(57-35)33(50)51)56-34-28(47)27(46)26(45)22(18-43)54-34/h7,21-32,34-35,43-49H,8-19H2,1-6H3,(H,50,51)(H,52,53)","JDGKHHCYVKBIIT-UHFFFAOYSA-N"
"O=C(OC1OC(CO)C(O)C(O)C1(O))C68(CCC(C)(C)CC8(C5=CCC4C7(C)(CCC(OC3OCC(O)C(OC2OC(CO)C(O)C(O)C2(O))C3(O))C(C)(C)C7(CCC4(C)C5(C)CC6(O)))))","InChI=1S/C47H76O18/c1-42(2)14-15-47(41(59)65-40-35(57)33(55)31(53)25(19-49)62-40)22(16-42)21-8-9-27-44(5)12-11-29(43(3,4)26(44)10-13-45(27,6)46(21,7)17-28(47)51)63-38-36(58)37(23(50)20-60-38)64-39-34(56)32(54)30(52)24(18-48)61-39/h8,22-40,48-58H,9-20H2,1-7H3","DYJBTUINEBYYQT-UHFFFAOYSA-N"
"CC1(C)CC2C3=CCC4C5(C)CCC(OC6OC(C(O)C(O)C6OC6OC(CO)C(O)C(O)C6OC6OC(CO)C(O)C(O)C6O)C(O)=O)C(C)(CO)C5CCC4(C)C3(C)CCC2(C)C(O)C1O","InChI=1S/C48H78O20/c1-43(2)16-21-20-8-9-25-45(4)12-11-26(46(5,19-51)24(45)10-13-48(25,7)47(20,6)15-14-44(21,3)38(60)37(43)59)65-42-36(32(57)31(56)34(66-42)39(61)62)68-41-35(30(55)28(53)23(18-50)64-41)67-40-33(58)29(54)27(52)22(17-49)63-40/h8,21-38,40-42,49-60H,9-19H2,1-7H3,(H,61,62)","SKIRLFVEHUVYJK-UHFFFAOYSA-N"
"O=C(O)C9OC(OC3CCC4(C)(C5CC=C2C6CC(C)(C)CC(OC1OC(C)C(O)C(O)C1(O))C6(C)(CCC2(C)C5(C)(CCC4(C3(C)(CO))))))C(OC8OCC(O)C(O)C8(OC7OC(C)C(O)C(O)C7(O)))C(O)C9(O)","InChI=1S/C53H86O21/c1-22-31(56)34(59)38(63)44(68-22)71-30-19-48(3,4)18-25-24-10-11-28-50(6)14-13-29(51(7,21-54)27(50)12-15-53(28,9)52(24,8)17-16-49(25,30)5)70-47-42(37(62)36(61)40(72-47)43(65)66)74-46-41(33(58)26(55)20-67-46)73-45-39(64)35(60)32(57)23(2)69-45/h10,22-23,25-42,44-47,54-64H,11-21H2,1-9H3,(H,65,66)","JDICAJDVZQOPIE-UHFFFAOYSA-N"
"CC(=O)OCC1OC(OC2C(O)COC(OC3C(O)C(C)(C)CC4C5=CCC6C7(C)CCC(OC8OC(C(O)C(O)C8OC8OC(CO)C(O)C(O)C8OC8OC(CO)C(O)C(O)C8O)C(O)=O)C(C)(CO)C7CCC6(C)C5(C)CCC34C)C2O)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O","InChI=1S/C67H104O33/c1-26(71)87-24-35-48(89-27(2)72)52(90-28(3)73)53(91-29(4)74)61(94-35)96-47-32(75)23-88-57(46(47)83)100-55-54(84)62(5,6)20-31-30-12-13-37-64(8)16-15-38(65(9,25-70)36(64)14-17-67(37,11)66(30,10)19-18-63(31,55)7)95-60-51(44(81)43(80)49(97-60)56(85)86)99-59-50(42(79)40(77)34(22-69)93-59)98-58-45(82)41(78)39(76)33(21-68)92-58/h12,31-55,57-61,68-70,75-84H,13-25H2,1-11H3,(H,85,86)","YZNCIXVBVQRGQN-UHFFFAOYSA-N"
"OCC2OC(OCC1OC(O)(CO)C(O)C1(O))C(O)C(O)C2(O)","InChI=1S/C12H22O11/c13-1-4-6(15)8(17)9(18)11(22-4)21-2-5-7(16)10(19)12(20,3-14)23-5/h4-11,13-20H,1-3H2","PVXPPJIGRGXGCY-UHFFFAOYSA-N"
"O=C(O)C3OC(OC1C(O)C(O)OC(CO)C1(O))C(O)C(OC2OC(CO)C(O)C(O)C2(O))C3(OC(=O)C)","InChI=1S/C20H32O18/c1-4(23)33-15-14(37-19-10(27)9(26)7(24)5(2-21)35-19)12(29)20(38-16(15)17(30)31)36-13-8(25)6(3-22)34-18(32)11(13)28/h5-16,18-22,24-29,32H,2-3H2,1H3,(H,30,31)","ICLQXMKQSCTZSF-UHFFFAOYSA-N"
"O4C3CC2C6CC=C1C=CCCC1(C)C6(CCC2(C)C3C(C)C45(NCC(C)CC5))","InChI=1S/C27H41NO/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h5,7-8,17-18,20-24,28H,6,9-16H2,1-4H3","OYNIUJOJEWHJPN-UHFFFAOYSA-N"
"OC6CC5=CCC4C(CCC3(C)(C4(CC2N1CC(C)CCC1C(C)C23)))C5(C)CC6","InChI=1S/C27H43NO/c1-16-5-8-23-17(2)25-24(28(23)15-16)14-22-20-7-6-18-13-19(29)9-11-26(18,3)21(20)10-12-27(22,25)4/h6,16-17,19-25,29H,5,7-15H2,1-4H3","JVKYZPBMZPJNAJ-UHFFFAOYSA-N"
"OCC56(C(O)CC2C(CC=C1CC(O)CCC12(C))C6(CC4N3CC(C)CCC3C(C)C45))","InChI=1S/C27H43NO3/c1-15-4-7-22-16(2)25-23(28(22)13-15)11-21-19-6-5-17-10-18(30)8-9-26(17,3)20(19)12-24(31)27(21,25)14-29/h5,15-16,18-25,29-31H,4,6-14H2,1-3H3","SUXOAOUIWWNLHR-UHFFFAOYSA-N"
"OCC8OC(OC7C(O)C(OC6CC5=CCC4C(CCC3(C)(C4(CC2N1CC(C)CCC1C(C)C23)))C5(C)CC6)OC(CO)C7(O))C(O)C(O)C8(O)","InChI=1S/C39H63NO11/c1-18-5-8-25-19(2)29-26(40(25)15-18)14-24-22-7-6-20-13-21(9-11-38(20,3)23(22)10-12-39(24,29)4)48-37-34(47)35(31(44)28(17-42)50-37)51-36-33(46)32(45)30(43)27(16-41)49-36/h6,18-19,21-37,41-47H,5,7-17H2,1-4H3","OCVQAFQRXHOFMV-UHFFFAOYSA-N"
"OCC7OC(OCC(C)CCC4(O)(OC3CC2C5CCC6(O)(CC(OC1OC(CO)C(O)C(O)C1(O))C(O)CC6(C)(C5(CCC2(C)C3C4(C))))))C(O)C(O)C7(O)","InChI=1S/C39H66O16/c1-17(16-51-34-32(47)30(45)28(43)25(14-40)53-34)5-10-39(50)18(2)27-23(55-39)11-21-19-6-9-38(49)13-24(52-35-33(48)31(46)29(44)26(15-41)54-35)22(42)12-37(38,4)20(19)7-8-36(21,27)3/h17-35,40-50H,5-16H2,1-4H3","URCCSSSNMZAVQK-UHFFFAOYSA-N"
"O=C8C=C4CC(OC3OC(CO)C(OC1OC(C)C(O)C(O)C1(O))C(O)C3(OC2OC(C)C(O)C(O)C2(O)))CCC4(C)C9CCC7(C)(C(CC6N5CC(C)CCC5C(C)C67)C89)","InChI=1S/C45H71NO15/c1-18-7-8-26-19(2)31-27(46(26)16-18)15-25-30-24(10-12-45(25,31)6)44(5)11-9-23(13-22(44)14-28(30)48)58-43-40(61-42-37(54)35(52)33(50)21(4)57-42)38(55)39(29(17-47)59-43)60-41-36(53)34(51)32(49)20(3)56-41/h14,18-21,23-27,29-43,47,49-55H,7-13,15-17H2,1-6H3","WEVOWEDEHQFZEV-UHFFFAOYSA-N"
"OCC8OC(OCC(C)CCC=3OC4CC5C6CC=C2CC(O)CC(OC1OC(CO)C(O)C(O)C1(O))C2(C)C6(CCC5(C)(C4(C=3C))))C(OC7OC(C)C(O)C(O)C7(O))C(O)C8(O)","InChI=1S/C45H72O18/c1-18(17-57-43-40(37(54)34(51)29(16-47)61-43)63-41-38(55)35(52)32(49)20(3)58-41)6-9-26-19(2)31-27(59-26)14-25-23-8-7-21-12-22(48)13-30(45(21,5)24(23)10-11-44(25,31)4)62-42-39(56)36(53)33(50)28(15-46)60-42/h7,18,20,22-25,27-43,46-56H,6,8-17H2,1-5H3","LXYJZECGEIAZOD-UHFFFAOYSA-N"
"OCC9OC(OC8C(O)C(OC(OC6CC5=CCC4C(CCC3(C)(C4(CC2OC1(NCC(C)CC1)C(C)C23)))C5(C)CC6)C8(OC7OC(C)C(O)C(O)C7(O)))CO)C(O)C(O)C9(O)","InChI=1S/C45H73NO16/c1-19-8-13-45(46-16-19)20(2)30-27(62-45)15-26-24-7-6-22-14-23(9-11-43(22,4)25(24)10-12-44(26,30)5)57-42-39(61-40-36(54)34(52)31(49)21(3)56-40)38(33(51)29(18-48)59-42)60-41-37(55)35(53)32(50)28(17-47)58-41/h6,19-21,23-42,46-55H,7-18H2,1-5H3","QCTMYNGDIBTNSK-UHFFFAOYSA-N"
"OCC8OC(OCC(C)CCC5(O)(OC4CC3C6CC=C2CC(O)CC(OC1OC(CO)C(O)C(O)C1(O))C2(C)C6(CCC3(C)C4C5(C))))C(OC7OC(C)C(O)C(O)C7(O))C(O)C8(O)","InChI=1S/C45H74O19/c1-18(17-58-42-39(36(54)33(51)28(16-47)61-42)63-40-37(55)34(52)31(49)20(3)59-40)8-11-45(57)19(2)30-26(64-45)14-25-23-7-6-21-12-22(48)13-29(44(21,5)24(23)9-10-43(25,30)4)62-41-38(56)35(53)32(50)27(15-46)60-41/h6,18-20,22-42,46-57H,7-17H2,1-5H3","MYVJSVSGFJDUAQ-UHFFFAOYSA-N"
"OCC8OC(OCC(C)CCC6(O)(OC5CC4C7CCC3CC(OC2OC(CO)C(O)C(O)C2(OC1OC(CO)C(O)C(O)C1(O)))C(O)CC3(C)C7(CCC4(C)C5C6(C))))C(O)C(O)C8(O)","InChI=1S/C45H76O20/c1-18(17-59-40-37(56)34(53)31(50)27(14-46)61-40)7-10-45(58)19(2)30-26(65-45)12-23-21-6-5-20-11-25(24(49)13-44(20,4)22(21)8-9-43(23,30)3)60-42-39(36(55)33(52)29(16-48)63-42)64-41-38(57)35(54)32(51)28(15-47)62-41/h18-42,46-58H,5-17H2,1-4H3","FRVIYMUWTVFMSJ-UHFFFAOYSA-N"
"CC(CN)CCC1(O)OC2CC3C4CCC5CC(CCC5(C)C4CCC3(C)C2C1C)OC1OC(CO)C(OC2OC(CO)C(O)C(OC3OCC(O)C(O)C3O)C2OC2OC(CO)C(O)C(O)C2O)C(O)C1O","InChI=1S/C50H85NO22/c1-20(15-51)7-12-50(64)21(2)32-28(73-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)66-45-40(63)37(60)41(31(18-54)69-45)70-47-43(72-46-39(62)36(59)34(57)29(16-52)67-46)42(35(58)30(17-53)68-47)71-44-38(61)33(56)27(55)19-65-44/h20-47,52-64H,5-19,51H2,1-4H3","WAUPQAKNDACORQ-UHFFFAOYSA-N"
"OCC%10OC(OC2C(OC(CO)C(O)C2(OC1OCC(O)C(O)C1(O)))OC9C(O)C(O)C(OC8CCC7(C)(C(CCC6C7(CCC4(C)(C6(CC3OC5(O)(CC(C)CNC5(C(C)C34))))))C8))OC9(CO))C(O)C(O)C%10(O)","InChI=1S/C50H83NO22/c1-19-13-50(64)43(51-14-19)20(2)31-27(73-50)12-25-23-6-5-21-11-22(7-9-48(21,3)24(23)8-10-49(25,31)4)66-45-39(63)36(60)40(30(17-54)69-45)70-47-42(72-46-38(62)35(59)33(57)28(15-52)67-46)41(34(58)29(16-53)68-47)71-44-37(61)32(56)26(55)18-65-44/h19-47,51-64H,5-18H2,1-4H3","RLEPKHOQRVRAFV-UHFFFAOYSA-N"
"CC1C2C(CC3C4CCC5CC(CCC5(C)C4CCC23C)OC2OC(CO)C(OC3OC(CO)C(O)C(OC4OC(O)C(O)C(O)C4O)C3OCC(O)C(O)C(O)C(O)CO)C(O)C2O)OC11CCC(C)CN1","InChI=1S/C50H85NO22/c1-20-7-12-50(51-15-20)21(2)32-29(73-50)14-26-24-6-5-22-13-23(8-10-48(22,3)25(24)9-11-49(26,32)4)67-45-40(64)37(61)41(31(18-54)69-45)70-47-43(66-19-28(56)34(58)33(57)27(55)16-52)42(35(59)30(17-53)68-47)71-46-39(63)36(60)38(62)44(65)72-46/h20-47,51-65H,5-19H2,1-4H3","VTANYFPAYZXUQR-UHFFFAOYSA-N"
"OCC9OC(OCC(C)CCC7(O)(OC6CC5C8CC=C4CC(OC3OC(CO)C(O)C(OC1OC(CO)C(O)C(O)C1(O))C3(OC2OC(C)C(O)C(O)C2(O)))CCC4(C)C8(CCC5(C)C6C7(C))))C(O)C(O)C9(O)","InChI=1S/C51H84O23/c1-20(19-66-45-40(62)38(60)34(56)29(16-52)69-45)8-13-51(65)21(2)32-28(74-51)15-27-25-7-6-23-14-24(9-11-49(23,4)26(25)10-12-50(27,32)5)68-48-44(73-46-41(63)37(59)33(55)22(3)67-46)43(36(58)31(18-54)71-48)72-47-42(64)39(61)35(57)30(17-53)70-47/h6,20-22,24-48,52-65H,7-19H2,1-5H3","GMCGZPQYTRHQRU-UHFFFAOYSA-N"
"CC1C2C(CC3C4CCC5CC(CCC5(C)C4CCC23C)OC2OC(CO)C(OC3OC(CO)C(OC4OC=C(O)C(O)C4O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C2O)OC11NCC(COC2OC(CO)C(O)C(O)C2O)CC1OC(C)=O","InChI=1S/C58H93NO29/c1-21-36-30(88-58(21)35(79-22(2)64)11-23(14-59-58)19-77-51-44(73)40(69)38(67)31(15-60)81-51)13-28-26-6-5-24-12-25(7-9-56(24,3)27(26)8-10-57(28,36)4)80-53-46(75)42(71)48(33(17-62)83-53)86-55-50(87-54-45(74)41(70)39(68)32(16-61)82-54)47(76)49(34(18-63)84-55)85-52-43(72)37(66)29(65)20-78-52/h20-21,23-28,30-55,59-63,65-76H,5-19H2,1-4H3","GECBEMRGTFVRIT-UHFFFAOYSA-N"
"CC1C2C(CC3C4CCC5CC(CCC5(C)C4CCC23C)OC2OC(CO)C(OC3OC(CO)C(OC4OCC(O)C(O)C4O)C(O)C3OC3OC(CO)C(O)C(O)C3O)C(O)C2O)OC11NCC(COC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)CC1OC(C)=O","InChI=1S/C64H105NO34/c1-22-38-31(99-64(22)37(88-23(2)71)11-24(14-65-64)20-86-60-54(45(79)42(76)34(17-68)92-60)97-58-48(82)43(77)40(74)32(15-66)90-58)13-29-27-6-5-25-12-26(7-9-62(25,3)28(27)8-10-63(29,38)4)89-57-50(84)46(80)52(35(18-69)93-57)96-61-55(98-59-49(83)44(78)41(75)33(16-67)91-59)51(85)53(36(19-70)94-61)95-56-47(81)39(73)30(72)21-87-56/h22,24-61,65-70,72-85H,5-21H2,1-4H3","ZVGLUWJLKLOZOR-UHFFFAOYSA-N"
"COC1=CC(=CC(=C1O)OC)C=CC(=O)NCCCCN=C(N)N","InChI=1S/C16H24N4O4/c1-23-12-9-11(10-13(24-2)15(12)22)5-6-14(21)19-7-3-4-8-20-16(17)18/h5-6,9-10,22H,3-4,7-8H2,1-2H3,(H,19,21)(H4,17,18,20)","RMPWIMTWMOPCAR-UHFFFAOYSA-N"
"O=C(OC(C(=O)OC)CC(=O)OC)C=CC1=CC(OC)=C(O)C(OC)=C1","InChI=1S/C17H20O9/c1-22-11-7-10(8-12(23-2)16(11)20)5-6-14(18)26-13(17(21)25-4)9-15(19)24-3/h5-8,13,20H,9H2,1-4H3","NKISQZKBGVJCKA-UHFFFAOYSA-N"
"O=C(OC)C2=COC(OC1OC(CO)C(O)C(O)C1(O))C(=CC)C2CC(=O)OCC4OC(OC3=C(OC)C=C(C=CCO)C=C3(OC))C(O)C(O)C4(O)","InChI=1S/C34H46O19/c1-5-16-17(18(31(44)47-4)13-49-32(16)53-34-29(43)26(40)24(38)21(12-36)50-34)11-23(37)48-14-22-25(39)27(41)28(42)33(51-22)52-30-19(45-2)9-15(7-6-8-35)10-20(30)46-3/h5-7,9-10,13,17,21-22,24-29,32-36,38-43H,8,11-12,14H2,1-4H3","UUUCHDSMSNBEBE-UHFFFAOYSA-N"
"O=C(O)C1=CC(=O)C2=CC=CC=C2(N1)","InChI=1S/C10H7NO3/c12-9-5-8(10(13)14)11-7-4-2-1-3-6(7)9/h1-5H,(H,11,12)(H,13,14)","HCZHHEIFKROPDY-UHFFFAOYSA-N"
"OC=1C=CC(=CC=1CC=C(C)C)CCC2=CC(O)=C(C(O)=C2)CC=C(C)C","InChI=1S/C24H30O3/c1-16(2)5-10-20-13-18(9-12-22(20)25)7-8-19-14-23(26)21(24(27)15-19)11-6-17(3)4/h5-6,9,12-15,25-27H,7-8,10-11H2,1-4H3","UMBTUNCDJTWDLW-UHFFFAOYSA-N"
"OC1=CC=2OC3C4=C(OCC3(C=2(C=C1CC=C(C)C)))C=C(O)C(=C4(OC))CC=C(C)C","InChI=1S/C26H30O5/c1-14(2)6-8-16-10-18-19-13-30-23-12-21(28)17(9-7-15(3)4)25(29-5)24(23)26(19)31-22(18)11-20(16)27/h6-7,10-12,19,26-28H,8-9,13H2,1-5H3","WIEKYGJSRGBBTQ-UHFFFAOYSA-N"
"O=C1C=3C=CC(O)=C(C=3(OCC1C=2C=CC(O)=CC=2(O)))CC=C(C)C","InChI=1S/C20H20O5/c1-11(2)3-5-14-17(22)8-7-15-19(24)16(10-25-20(14)15)13-6-4-12(21)9-18(13)23/h3-4,6-9,16,21-23H,5,10H2,1-2H3","JIJYZALGIIQXKE-UHFFFAOYSA-N"
"O=C1C3=C(O)C(=C(O)C=C3(OCC1C2=CC=C(O)C(=C2)CC=C(C)C))CC=C(C)C","InChI=1S/C25H28O5/c1-14(2)5-7-17-11-16(8-10-20(17)26)19-13-30-22-12-21(27)18(9-6-15(3)4)24(28)23(22)25(19)29/h5-6,8,10-12,19,26-28H,7,9,13H2,1-4H3","CEBSROOTTDEPKN-UHFFFAOYSA-N"
"O=C1C(=COC=2C=C(O)C=CC1=2)C=3C=CC(O)=C(C=3)CC=C(C)C","InChI=1S/C20H18O4/c1-12(2)3-4-14-9-13(5-8-18(14)22)17-11-24-19-10-15(21)6-7-16(19)20(17)23/h3,5-11,21-22H,4H2,1-2H3","OBGPEBYHGIUFBN-UHFFFAOYSA-N"
"O=C1C(=COC=2C=C(O)C(=C(O)C1=2)CC=C(C)C)C3=CC(O)=C(O)C(=C3)CC=C(C)C","InChI=1S/C25H26O6/c1-13(2)5-7-15-9-16(10-20(27)23(15)28)18-12-31-21-11-19(26)17(8-6-14(3)4)24(29)22(21)25(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3","QNLGNISMYMFVHP-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)C=2C=CC(O)=C(C=2(O))CC=C(C)C","InChI=1S/C20H20O4/c1-13(2)3-9-16-19(23)12-10-17(20(16)24)18(22)11-6-14-4-7-15(21)8-5-14/h3-8,10-12,21,23-24H,9H2,1-2H3","DUWPGRAKHMEPCM-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)C=2C(O)=C(C(O)=CC=2(OC))CC=C(C)C","InChI=1S/C21H22O5/c1-13(2)4-10-16-18(24)12-19(26-3)20(21(16)25)17(23)11-7-14-5-8-15(22)9-6-14/h4-9,11-12,22,24-25H,10H2,1-3H3","ORXQGKIUCDPEAJ-UHFFFAOYSA-N"
"O=C(C=1C=C(OC)C(O)=C(OC)C=1)C","InChI=1S/C10H12O4/c1-6(11)7-4-8(13-2)10(12)9(5-7)14-3/h4-5,12H,1-3H3","OJOBTAOGJIWAGB-UHFFFAOYSA-N"
"O=C(O)CNC(=O)C(NC(=O)CCC(N)C(=O)O)CS","InChI=1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)","RWSXRVCMGQZWBV-UHFFFAOYSA-N"
"O=C(O)C(N)CCC(=O)NC(C(=O)O)CSCC=C","InChI=1S/C11H18N2O5S/c1-2-5-19-6-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h2,7-8H,1,3-6,12H2,(H,13,14)(H,15,16)(H,17,18)","FUTHBNRZCFKVQZ-UHFFFAOYSA-N"
"O=C(O)C(N)CCC(=O)NC(C(=O)O)CSCC(C(=O)O)C","InChI=1S/C12H20N2O7S/c1-6(10(16)17)4-22-5-8(12(20)21)14-9(15)3-2-7(13)11(18)19/h6-8H,2-5,13H2,1H3,(H,14,15)(H,16,17)(H,18,19)(H,20,21)","USEJNLPKVXGAOO-UHFFFAOYSA-N"
"O=C(O)CNC(=O)C(NC(=O)CCC(N)C(=O)O)CSC(O)CCCCCCC","InChI=1S/C18H33N3O7S/c1-2-3-4-5-6-7-16(25)29-11-13(17(26)20-10-15(23)24)21-14(22)9-8-12(19)18(27)28/h12-13,16,25H,2-11,19H2,1H3,(H,20,26)(H,21,22)(H,23,24)(H,27,28)","APSYQIWGNKNOQE-UHFFFAOYSA-N"
"O=C(O)CC1CCC(=O)C1(CC=CCCO)","InChI=1S/C12H18O4/c13-7-3-1-2-4-10-9(8-12(15)16)5-6-11(10)14/h1-2,9-10,13H,3-8H2,(H,15,16)","RZGFUGXQKMEMOO-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC1C=CC(=O)C1(CC=CCC)","InChI=1S/C18H28O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,13-16H,2,4-6,8-12H2,1H3,(H,20,21)","PMTMAFAPLCGXGK-UHFFFAOYSA-N"
"O=C(O)CCCCCCCC(=O)C=CC=CCCCCC","InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,11,14H,2-5,7,9-10,12-13,15-16H2,1H3,(H,20,21)","LUZSWWYKKLTDHU-UHFFFAOYSA-N"
"O=C(O)C=1N=CC(=CC=1)CCCC","InChI=1S/C10H13NO2/c1-2-3-4-8-5-6-9(10(12)13)11-7-8/h5-7H,2-4H2,1H3,(H,12,13)","DGMPVYSXXIOGJY-UHFFFAOYSA-N"
"NCCCCNC(=O)C1=CC=CC=C1","InChI=1S/C11H16N2O/c12-8-4-5-9-13-11(14)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,12H2,(H,13,14)","VMQHGBUSMBFWHN-UHFFFAOYSA-N"
"OC=1C(=NC=C(C=1CO)COC2OC(CO)C(O)C(O)C2(O))C","InChI=1S/C14H21NO8/c1-6-10(18)8(3-16)7(2-15-6)5-22-14-13(21)12(20)11(19)9(4-17)23-14/h2,9,11-14,16-21H,3-5H2,1H3","MDLTWTOQCHCLSZ-UHFFFAOYSA-N"
"O=C2NC=1C=C(C(=CC=1N(C2(=O))CC(O)C(O)C(O)CO)C)C","InChI=1S/C15H20N2O6/c1-7-3-9-10(4-8(7)2)17(15(23)14(22)16-9)5-11(19)13(21)12(20)6-18/h3-4,11-13,18-21H,5-6H2,1-2H3,(H,16,22)","SLOQSNHEHSCLGS-UHFFFAOYSA-N"
"O=[N+]([O-])C=1C=CC(=C(N)C=1)C","InChI=1S/C7H8N2O2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,8H2,1H3","DSBIJCMXAIKKKI-UHFFFAOYSA-N"
"O=C(O)CCSCCC(=O)O","InChI=1S/C6H10O4S/c7-5(8)1-3-11-4-2-6(9)10/h1-4H2,(H,7,8)(H,9,10)","ODJQKYXPKWQWNK-UHFFFAOYSA-N"
"O=C(O)C=1OC(=CC(=O)C=1)C(=O)O","InChI=1S/C7H4O6/c8-3-1-4(6(9)10)13-5(2-3)7(11)12/h1-2H,(H,9,10)(H,11,12)","PBAYDYUZOSNJGU-UHFFFAOYSA-N"
"OCC3OC(N2C=NC=1C(=NC=NC=12)N)CC3(O)","InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)","OLXZPDWKRNYJJZ-UHFFFAOYSA-N"
"OCC3OC(N2C=NC1=C(N=CN=C12)N)C(O)C3(O)","InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)","OIRDTQYFTABQOQ-UHFFFAOYSA-N"
"OC3C(O)C(OC3(N2C=NC=1C(=NC=NC=12)N))CSC","InChI=1S/C11H15N5O3S/c1-20-2-5-7(17)8(18)11(19-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)","WUUGFSXJNOTRMR-UHFFFAOYSA-N"
"O=C1NC(=O)C=2NC=NC=2(N1)","InChI=1S/C5H4N4O2/c10-4-2-3(7-1-6-2)8-5(11)9-4/h1H,(H3,6,7,8,9,10,11)","LRFVTYWOQMYALW-UHFFFAOYSA-N"
"N1=CC=CC(=C1)C2N(C)CCC2","InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3","SNICXCGAKADSCV-UHFFFAOYSA-N"
"[O-][N+]2(C)(CCCC2(C1=CN=CC=C1))","InChI=1S/C10H14N2O/c1-12(13)7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3","RWFBQHICRCUQJJ-UHFFFAOYSA-N"
"O=C(C=1C=NC(O)=CC=1)CCCNC","InChI=1S/C10H14N2O2/c1-11-6-2-3-9(13)8-4-5-10(14)12-7-8/h4-5,7,11H,2-3,6H2,1H3,(H,12,14)","UMLOUOBDBGOHHR-UHFFFAOYSA-N"
"C\C=C\S(=O)CC(N\C=C1\OCC(O)C(O)C1O)C(O)=O","InChI=1S/C12H19NO7S/c1-2-3-21(19)6-7(12(17)18)13-4-9-11(16)10(15)8(14)5-20-9/h2-4,7-8,10-11,13-16H,5-6H2,1H3,(H,17,18)/b3-2+,9-4+","OQAFURZDHYCZMF-DSXPNFDZSA-N"
"O=C(O)C(NCC1(O)(OCC(O)C(O)C1(O)))CS(=O)CC=C","InChI=1S/C12H21NO8S/c1-2-3-22(20)5-7(11(17)18)13-6-12(19)10(16)9(15)8(14)4-21-12/h2,7-10,13-16,19H,1,3-6H2,(H,17,18)","HXMZQSGMNGTGGB-UHFFFAOYSA-N"
"CCSSCC(NCC1(O)OCC(O)C(O)C1O)C(=O)NCCC(O)=O","InChI=1S/C14H26N2O8S2/c1-2-25-26-6-8(13(22)15-4-3-10(18)19)16-7-14(23)12(21)11(20)9(17)5-24-14/h8-9,11-12,16-17,20-21,23H,2-7H2,1H3,(H,15,22)(H,18,19)","PFYVANXTRYLUEB-UHFFFAOYSA-N"
"O=C(O)CCC(NC(=O)C(NCC1(O)(OCC(O)C(O)C1(O)))C(C)CC)C(=O)O","InChI=1S/C17H30N2O10/c1-3-8(2)12(15(25)19-9(16(26)27)4-5-11(21)22)18-7-17(28)14(24)13(23)10(20)6-29-17/h8-10,12-14,18,20,23-24,28H,3-7H2,1-2H3,(H,19,25)(H,21,22)(H,26,27)","OJDUYMYADCXNAN-UHFFFAOYSA-N"
"OC1COC(O)(CNC(CCC(O)=O)C(=O)NC(CC2=CC=CC=C2)C(O)=O)C(O)C1O","InChI=1S/C20H28N2O10/c23-14-9-32-20(31,17(27)16(14)26)10-21-12(6-7-15(24)25)18(28)22-13(19(29)30)8-11-4-2-1-3-5-11/h1-5,12-14,16-17,21,23,26-27,31H,6-10H2,(H,22,28)(H,24,25)(H,29,30)","RTCOMQOZOQQHTG-UHFFFAOYSA-N"
"O=C(O)C(NCC1(O)(OC(CO)C(O)C1(O)))CC2=CC=CC=C2","InChI=1S/C15H21NO7/c17-7-11-12(18)13(19)15(22,23-11)8-16-10(14(20)21)6-9-4-2-1-3-5-9/h1-5,10-13,16-19,22H,6-8H2,(H,20,21)","FAVRCIXPIVJIPN-UHFFFAOYSA-N"
"O=C(O)C(NCC1(O)(OC(CO)C(O)C1(O)))CC2=CC=C(O)C=C2","InChI=1S/C15H21NO8/c17-6-11-12(19)13(20)15(23,24-11)7-16-10(14(21)22)5-8-1-3-9(18)4-2-8/h1-4,10-13,16-20,23H,5-7H2,(H,21,22)","QLJKHQIODQKMNW-UHFFFAOYSA-N"
"CCCCCCCCC\C=C\C=C\CC(O)C(O)C(N)CO","InChI=1S/C18H35NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h10-13,16-18,20-22H,2-9,14-15,19H2,1H3/b11-10+,13-12+","WWXZQFWOWANITM-AQASXUMVSA-N"
"OCC(N)C(O)C(O)CCCC=CCCCCCCCCC","InChI=1S/C18H37NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h10-11,16-18,20-22H,2-9,12-15,19H2,1H3","CQKNELOTFUSOTP-UHFFFAOYSA-N"
"OCC(N)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C18H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(21)18(22)16(19)15-20/h16-18,20-22H,2-15,19H2,1H3","AERBNCYCJBRYDG-UHFFFAOYSA-N"
"O=C(OC(CO)COP(=O)(O)OCCN)CCCCC=CCC=CCC=CCCCCC","InChI=1S/C23H42NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)31-22(20-25)21-30-32(27,28)29-19-18-24/h6-7,9-10,12-13,22,25H,2-5,8,11,14-21,24H2,1H3,(H,27,28)","QYXNIRQICOBIAE-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(O)C(O)C(COC1OC(CO)C(O)C(O)C1O)NC(C)=O","InChI=1S/C24H47NO9/c1-3-4-5-6-7-8-9-10-11-12-13-18(28)20(29)17(25-16(2)27)15-33-24-23(32)22(31)21(30)19(14-26)34-24/h17-24,26,28-32H,3-15H2,1-2H3,(H,25,27)","IAPUZRMYFXZQIM-UHFFFAOYSA-N"
"O=C(OCC(O)COP(=O)([O-])OCC[N+](C)(C)C)CCCCC=CCC=CCC=CCCCCC","InChI=1S/C26H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-26(29)32-23-25(28)24-34-35(30,31)33-22-21-27(2,3)4/h9-10,12-13,15-16,25,28H,5-8,11,14,17-24H2,1-4H3","MRTUWVDDQVMUCR-UHFFFAOYSA-N"
"CCCCCCCCCCCCC(O)C(O)C(COC1OC(CC(C(O)=O)C(O)=O)C(O)C(O)C1O)NC(C)=O","InChI=1S/C27H49NO12/c1-3-4-5-6-7-8-9-10-11-12-13-19(30)21(31)18(28-16(2)29)15-39-27-24(34)23(33)22(32)20(40-27)14-17(25(35)36)26(37)38/h17-24,27,30-34H,3-15H2,1-2H3,(H,28,29)(H,35,36)(H,37,38)","TZNOUJCNSUIBIN-UHFFFAOYSA-N"
"CCCCCCCCCCCCC\C=C\C=C\C(=O)OCC(O)COP(O)(=O)OCCNC1OC(CO)C(O)C(O)C1O","InChI=1S/C29H54NO12P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(33)39-21-23(32)22-41-43(37,38)40-19-18-30-29-28(36)27(35)26(34)24(20-31)42-29/h14-17,23-24,26-32,34-36H,2-13,18-22H2,1H3,(H,37,38)/b15-14+,17-16+","MNNGEUSDGJJARF-JLXBFWJWSA-N"
"O=C2NC(=O)C(OC1OC(CO)C(O)C(O)C1(O))=C(N)N2","InChI=1S/C10H15N3O8/c11-7-6(8(18)13-10(19)12-7)21-9-5(17)4(16)3(15)2(1-14)20-9/h2-5,9,14-17H,1H2,(H4,11,12,13,18,19)","JJWYIMQKLTVAGZ-UHFFFAOYSA-N"
"NC1=C(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C2O)C(=O)NC(=O)N1","InChI=1S/C15H23N3O12/c16-11-10(12(25)18-15(26)17-11)30-14-9(7(23)5(21)3(1-19)28-14)29-13-8(24)6(22)4(2-20)27-13/h3-9,13-14,19-24H,1-2H2,(H4,16,17,18,25,26)","MZQRZWKZSAUTHQ-UHFFFAOYSA-N"
"NC1=C(OC2OC(CO)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(=O)NC(=O)N1","InChI=1S/C16H25N3O13/c17-12-11(13(27)19-16(28)18-12)32-15-9(26)7(24)10(4(2-21)30-15)31-14-8(25)6(23)5(22)3(1-20)29-14/h3-10,14-15,20-26H,1-2H2,(H4,17,18,19,27,28)","UKGNBVDSWBRBDL-UHFFFAOYSA-N"
"O=C1C(=COC2=CC(O)=CC=C12)C3=CC=C(O)C(O)=C3","InChI=1S/C15H10O5/c16-9-2-3-10-14(6-9)20-7-11(15(10)19)8-1-4-12(17)13(18)5-8/h1-7,16-18H","DDKGKOOLFLYZDL-UHFFFAOYSA-N"
"O=C1C(=COC2=CC(O)=CC(O)=C12)C3=CC=C(O)C=C3","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-13-6-10(17)5-12(18)14(13)15(11)19/h1-7,16-18H","TZBJGXHYKVUXJN-UHFFFAOYSA-N"
"O=C1C(=COC2=CC(O)=CC(O)=C12)C3=CC=C(OC)C=C3","InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3","WUADCCWRTIWANL-UHFFFAOYSA-N"
"O=C2C(=COC3=CC(OC1OC(CO)C(O)C(O)C1(O))=CC(O)=C23)C4=CC=C(OC)C=C4","InChI=1S/C22H22O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3","LFEUICHQZGNOHD-UHFFFAOYSA-N"
"O=C(OCC4OC(OC=1C=CC=2C(=O)C(=COC=2(C=1))C3=CC=C(O)C=C3)C(O)C(O)C4(O))C","InChI=1S/C23H22O10/c1-11(24)30-10-18-20(27)21(28)22(29)23(33-18)32-14-6-7-15-17(8-14)31-9-16(19(15)26)12-2-4-13(25)5-3-12/h2-9,18,20-23,25,27-29H,10H2,1H3","ZMOZJTDOTOZVRT-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC=1C=CC=2C(=O)C(=COC=2(C=1))C3=CC=C(O)C=C3)C(O)C(O)C4(O)","InChI=1S/C24H22O12/c25-12-3-1-11(2-4-12)15-9-33-16-7-13(5-6-14(16)20(15)29)35-24-23(32)22(31)21(30)17(36-24)10-34-19(28)8-18(26)27/h1-7,9,17,21-25,30-32H,8,10H2,(H,26,27)","MTXMHWSVSZKYBT-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC=1C=C(O)C=2C(=O)C(=COC=2(C=1))C3=CC=C(O)C=C3)C(O)C(O)C4(O)","InChI=1S/C24H22O13/c25-11-3-1-10(2-4-11)13-8-34-15-6-12(5-14(26)19(15)20(13)30)36-24-23(33)22(32)21(31)16(37-24)9-35-18(29)7-17(27)28/h1-6,8,16,21-26,31-33H,7,9H2,(H,27,28)","FRAUJUKWSKMNJY-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC1=CC=C2C(=O)C(=COC2(=C1))C3=CC=C(OC)C=C3)C(O)C(O)C4(O)","InChI=1S/C25H24O12/c1-33-13-4-2-12(3-5-13)16-10-34-17-8-14(6-7-15(17)21(16)29)36-25-24(32)23(31)22(30)18(37-25)11-35-20(28)9-19(26)27/h2-8,10,18,22-25,30-32H,9,11H2,1H3,(H,26,27)","RDTAGQKYPGLCBK-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC=1C=C2OC=C(C(=O)C2(=CC=1(OC)))C3=CC=C(OC)C=C3)C(O)C(O)C4(O)","InChI=1S/C26H26O13/c1-34-13-5-3-12(4-6-13)15-10-36-16-8-18(17(35-2)7-14(16)22(15)30)38-26-25(33)24(32)23(31)19(39-26)11-37-21(29)9-20(27)28/h3-8,10,19,23-26,31-33H,9,11H2,1-2H3,(H,27,28)","HOWDEROVXAADRI-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC1=CC(O)=C2C(=O)C(=COC2(=C1))C3=CC=C(OC)C=C3)C(O)C(O)C4(O)","InChI=1S/C25H24O13/c1-34-12-4-2-11(3-5-12)14-9-35-16-7-13(6-15(26)20(16)21(14)30)37-25-24(33)23(32)22(31)17(38-25)10-36-19(29)8-18(27)28/h2-7,9,17,22-26,31-33H,8,10H2,1H3,(H,27,28)","VRCBYTZZZFFKEN-UHFFFAOYSA-N"
"O=C3C(=COC1=C3(C=CC(O)=C1C2OC(CO)C(O)C(O)C2(O)))C4=CC=C(O)C=C4","InChI=1S/C21H20O9/c22-7-14-17(26)18(27)19(28)21(30-14)15-13(24)6-5-11-16(25)12(8-29-20(11)15)9-1-3-10(23)4-2-9/h1-6,8,14,17-19,21-24,26-28H,7H2","HKEAFJYKMMKDOR-UHFFFAOYSA-N"
"OCCC2=CNC1=CC=CC=C12","InChI=1S/C10H11NO/c12-6-5-8-7-11-10-4-2-1-3-9(8)10/h1-4,7,11-12H,5-6H2","MBBOMCVGYCRMEA-UHFFFAOYSA-N"
"NCCC2=CNC1=CC=CC=C12","InChI=1S/C10H12N2/c11-6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6,11H2","APJYDQYYACXCRM-UHFFFAOYSA-N"
"O=C(O)C(N)CC2=CNC=1C=CC=CC=12","InChI=1S/C11H12N2O2/c12-9(11(14)15)5-7-6-13-10-4-2-1-3-8(7)10/h1-4,6,9,13H,5,12H2,(H,14,15)","QIVBCDIJIAJPQS-UHFFFAOYSA-N"
"N#CCCCCCCCCS(=O)C","InChI=1S/C10H19NOS/c1-13(12)10-8-6-4-2-3-5-7-9-11/h2-8,10H2,1H3","XGRYRNQISNOEGY-UHFFFAOYSA-N"
"O=S(C)CCCCCCCCN=C=S","InChI=1S/C10H19NOS2/c1-14(12)9-7-5-3-2-4-6-8-11-10-13/h2-9H2,1H3","BCRXKWOQVFKZAG-UHFFFAOYSA-N"
"O=C(O)C(N)CCCCCCCS(=O)C","InChI=1S/C10H21NO3S/c1-15(14)8-6-4-2-3-5-7-9(11)10(12)13/h9H,2-8,11H2,1H3,(H,12,13)","PUZLVBQOZIVDKI-UHFFFAOYSA-N"
"CS(=O)CCCCCCCCC(N)C(O)=O","InChI=1S/C11H23NO3S/c1-16(15)9-7-5-3-2-4-6-8-10(12)11(13)14/h10H,2-9,12H2,1H3,(H,13,14)","QRXRWDDFTQIZAV-UHFFFAOYSA-N"
"N#CCCCCS(=O)C","InChI=1S/C6H11NOS/c1-9(8)6-4-2-3-5-7/h2-4,6H2,1H3","FGYQUFZANKOISC-UHFFFAOYSA-N"
"N#CCCCCCCS(=O)C","InChI=1S/C8H15NOS/c1-11(10)8-6-4-2-3-5-7-9/h2-6,8H2,1H3","MVGLREOVTAENKK-UHFFFAOYSA-N"
"CS(=O)CCCCCCCN","InChI=1S/C8H19NOS/c1-11(10)8-6-4-2-3-5-7-9/h2-9H2,1H3","NEMIGFQIONIZCH-UHFFFAOYSA-N"
"N#CCCCCCCCS(=O)C","InChI=1S/C9H17NOS/c1-12(11)9-7-5-3-2-4-6-8-10/h2-7,9H2,1H3","VRYSUGWFYFXWLB-UHFFFAOYSA-N"
"O=S(C)CCCCCCCN=C=S","InChI=1S/C9H17NOS2/c1-13(11)8-6-4-2-3-5-7-10-9-12/h2-8H2,1H3","OGYHCBGORZWBPH-UHFFFAOYSA-N"
"CS(=O)CCCCCCCCN","InChI=1S/C9H21NOS/c1-12(11)9-7-5-3-2-4-6-8-10/h2-10H2,1H3","SSWZIHDEYOORCA-UHFFFAOYSA-N"
"O=C2C(O)=C(OC3=CC(OC1OC(C)C(O)C(O)C1(O))=CC(O)=C23)C4=CC=C(O)C=C4","InChI=1S/C21H20O10/c1-8-15(24)17(26)19(28)21(29-8)30-11-6-12(23)14-13(7-11)31-20(18(27)16(14)25)9-2-4-10(22)5-3-9/h2-8,15,17,19,21-24,26-28H,1H3","HQNOUCSPWAGQND-UHFFFAOYSA-N"
"O=C2C(O)=C(OC3=CC(OC1OC(CO)C(O)C(O)C1(O))=C(O)C(O)=C23)C=4C=CC(O)=C(O)C=4","InChI=1S/C21H20O13/c22-5-11-14(26)17(29)19(31)21(34-11)33-10-4-9-12(15(27)13(10)25)16(28)18(30)20(32-9)6-1-2-7(23)8(24)3-6/h1-4,11,14,17,19,21-27,29-31H,5H2","IDTDRZPBDLMCLB-UHFFFAOYSA-N"
"O=C2C(O)=C(OC=3C=C(OC1OC(C)C(O)C(O)C1(O))C=C(O)C2=3)C4=CC=C(O)C(OC)=C4","InChI=1S/C22H22O11/c1-8-16(25)18(27)20(29)22(31-8)32-10-6-12(24)15-14(7-10)33-21(19(28)17(15)26)9-3-4-11(23)13(5-9)30-2/h3-8,16,18,20,22-25,27-29H,1-2H3","XLQFMBLUUSGXQY-UHFFFAOYSA-N"
"O=C2C(OC1OC(CO)C(O)C(O)C1(O))=C(OC=3C=C(O)C=C(O)C2=3)C=4C=C(OC)C(O)=C(OC)C=4","InChI=1S/C23H24O13/c1-32-12-3-8(4-13(33-2)16(12)27)21-22(18(29)15-10(26)5-9(25)6-11(15)34-21)36-23-20(31)19(30)17(28)14(7-24)35-23/h3-6,14,17,19-20,23-28,30-31H,7H2,1-2H3","JMFWYRWPJVEZPV-UHFFFAOYSA-N"
"O=C3C(OC1OC(CO)C(O)C(O)C1(O))=C(OC4=CC(OC2OC(C)C(O)C(O)C2(O))=CC(O)=C34)C5=CC=C(O)C=C5","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(38-9)39-12-6-13(30)16-14(7-12)40-24(10-2-4-11(29)5-3-10)25(19(16)33)42-27-23(37)21(35)18(32)15(8-28)41-27/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3","JYXSWDCPHRTYGU-UHFFFAOYSA-N"
"O=C(OC2=CC(O)=C3C(=O)C(OC1OC(CO)C(O)C(O)C1(O))=C(OC3(=C2))C4=CC=C(O)C=C4)C=CC5=CC=C(O)C=C5","InChI=1S/C30H26O13/c31-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(40-22(35)10-3-14-1-6-16(32)7-2-14)12-20(23)41-28(29)15-4-8-17(33)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2","CAHLQXBTMALBQE-UHFFFAOYSA-N"
"O=C(OC1C(OC(CO)C(O)C1(O))OC7C(OC=5C(=O)C6=C(O)C=C(OC3OC(CO)C(OC2OC(CO)C(O)C(O)C2(O))C(O)C3(O))C=C6(OC=5(C4=CC=C(O)C=C4)))OC(CO)C(O)C7(O))C=CC=8C=CC(O)=C(OC)C=8","InChI=1S/C49H58O29/c1-68-23-10-17(2-8-21(23)55)3-9-29(57)75-44-36(63)32(59)26(14-51)72-48(44)78-45-37(64)33(60)27(15-52)73-49(45)77-43-34(61)30-22(56)11-20(12-24(30)70-41(43)18-4-6-19(54)7-5-18)69-46-40(67)38(65)42(28(16-53)74-46)76-47-39(66)35(62)31(58)25(13-50)71-47/h2-12,25-28,31-33,35-40,42,44-56,58-60,62-67H,13-16H2,1H3","KFEVJAZSURUKLX-UHFFFAOYSA-N"
"O=C1C=C(OC=2C=C(O)C=CC1=2)C3=CC=C(O)C=C3","InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-8,16-17H","LCAWNFIFMLXZPQ-UHFFFAOYSA-N"
"O=C1C=C(OC=2C=C(O)C=C(O)C1=2)C3=CC=C(O)C(O)=C3","InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H","IQPNAANSBPBGFQ-UHFFFAOYSA-N"
"O=C(O)C4OC(OC1=CC=2OC(=CC(=O)C=2(C(O)=C1(O)))C3=CC=CC=C3)C(O)C(O)C4(O)","InChI=1S/C21H18O11/c22-9-6-10(8-4-2-1-3-5-8)30-11-7-12(14(23)15(24)13(9)11)31-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21,23-27H,(H,28,29)","IKIIZLYTISPENI-UHFFFAOYSA-N"
"O=C2C=C(OC3=CC(OC1OC(CO)C(O)C(O)C1(O))=CC(O)=C23)C4=CC=C(O)C=C4","InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2","KMOUJOKENFFTPU-UHFFFAOYSA-N"
"O=C(O)C4OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C=3C=CC(OC)=C(O)C=3)C(O)C(O)C4(O)","InChI=1S/C22H20O12/c1-31-13-3-2-8(4-10(13)23)14-7-12(25)16-11(24)5-9(6-15(16)33-14)32-22-19(28)17(26)18(27)20(34-22)21(29)30/h2-7,17-20,22-24,26-28H,1H3,(H,29,30)","XCKMDTYMOHXUHG-UHFFFAOYSA-N"
"O=C(OCC4OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C3=CC=C(O)C=C3)C(O)C(O)C4(O))C","InChI=1S/C23H22O11/c1-10(24)31-9-18-20(28)21(29)22(30)23(34-18)32-13-6-14(26)19-15(27)8-16(33-17(19)7-13)11-2-4-12(25)5-3-11/h2-8,18,20-23,25-26,28-30H,9H2,1H3","LYFXRHUNCZZUTQ-UHFFFAOYSA-N"
"O=C2C(=COC3=CC(OC1OC(CO)C(O)C(O)C1(O))=C(OC)C=C23)C4=CC=C(OC)C=C4","InChI=1S/C23H24O10/c1-29-12-5-3-11(4-6-12)14-10-31-15-8-17(16(30-2)7-13(15)19(14)25)32-23-22(28)21(27)20(26)18(9-24)33-23/h3-8,10,18,20-24,26-28H,9H2,1-2H3","YLYJXNTZVUEFJZ-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C3=CC=C(O)C=C3)C(O)C(O)C4(O)","InChI=1S/C24H22O13/c25-11-3-1-10(2-4-11)15-7-14(27)20-13(26)5-12(6-16(20)36-15)35-24-23(33)22(32)21(31)17(37-24)9-34-19(30)8-18(28)29/h1-7,17,21-26,31-33H,8-9H2,(H,28,29)","JXWAQRJFONLTSI-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC=1C=C(O)C=2C(=O)C=C(OC=2(C=1))C3=CC=C(O)C(OC)=C3)C(O)C(O)C4(O)","InChI=1S/C25H24O14/c1-35-16-4-10(2-3-12(16)26)15-7-14(28)21-13(27)5-11(6-17(21)38-15)37-25-24(34)23(33)22(32)18(39-25)9-36-20(31)8-19(29)30/h2-7,18,22-27,32-34H,8-9H2,1H3,(H,29,30)","PLQBKZOSLQNLOX-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC1=CC(O)=C2C(=O)C=C(OC2(=C1))C=3C=C(OC)C(O)=C(OC)C=3)C(O)C(O)C4(O)","InChI=1S/C26H26O15/c1-36-16-3-10(4-17(37-2)22(16)32)14-7-13(28)21-12(27)5-11(6-15(21)40-14)39-26-25(35)24(34)23(33)18(41-26)9-38-20(31)8-19(29)30/h3-7,18,23-27,32-35H,8-9H2,1-2H3,(H,29,30)","KAJUQFNDHKZYAG-UHFFFAOYSA-N"
"O=C1C=C(OC2=CC(O)=CC(O)=C12)C=4C=C(OC)C(OC(CO)C(O)C=3C=CC(O)=C(OC)C=3)=C(OC)C=4","InChI=1S/C27H26O11/c1-34-20-6-13(4-5-16(20)30)26(33)24(12-28)38-27-22(35-2)7-14(8-23(27)36-3)19-11-18(32)25-17(31)9-15(29)10-21(25)37-19/h4-11,24,26,28-31,33H,12H2,1-3H3","WXNJNHFYIWEHIL-UHFFFAOYSA-N"
"O=C(O)C5OC(OC=1C=C(O)C=2C(=O)C=C(OC=2(C=1))C3=CC=C(O)C(O)=C3)C(OC4OC(C(=O)O)C(O)C(O)C4(O))C(O)C5(O)","InChI=1S/C27H26O18/c28-9-2-1-7(3-10(9)29)13-6-12(31)15-11(30)4-8(5-14(15)42-13)41-27-23(19(35)18(34)22(44-27)25(39)40)45-26-20(36)16(32)17(33)21(43-26)24(37)38/h1-6,16-23,26-30,32-36H,(H,37,38)(H,39,40)","PBBVWJQPAZYQDB-UHFFFAOYSA-N"
"O=C3C=C(OC=4C=C(OC2OC(COC1OC(C)C(O)C(O)C1(O))C(O)C(O)C2(O))C=C(O)C3=4)C5=CC=C(OC)C(O)=C5","InChI=1S/C28H32O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-8,10,19,21-30,32-37H,9H2,1-2H3","GZSOSUNBTXMUFQ-UHFFFAOYSA-N"
"O=C3C=C(OC4=CC(OC2OC(CO)C(O)C(O)C2(OC1OC(C)C(O)C(O)C1(O)))=CC(O)=C34)C=5C=C(OC)C(O)=C(OC)C=5","InChI=1S/C29H34O16/c1-10-21(33)24(36)26(38)28(41-10)45-27-25(37)23(35)19(9-30)44-29(27)42-12-6-13(31)20-14(32)8-15(43-16(20)7-12)11-4-17(39-2)22(34)18(5-11)40-3/h4-8,10,19,21,23-31,33-38H,9H2,1-3H3","AIBMPOJXBGZIPQ-UHFFFAOYSA-N"
"COC1=CC(=CC(OC)=C1O)C1=CC(=O)C2=C(O)C=C(OC3OC(C(O)C(O)C3OC3OC(COC(=O)\C=C\C4=CC=C(O)C=C4)C(O)C(O)C3O)C(O)=O)C=C2O1","InChI=1S/C38H38O20/c1-51-23-9-16(10-24(52-2)28(23)43)21-13-20(41)27-19(40)11-18(12-22(27)55-21)54-38-35(32(47)31(46)34(57-38)36(49)50)58-37-33(48)30(45)29(44)25(56-37)14-53-26(42)8-5-15-3-6-17(39)7-4-15/h3-13,25,29-35,37-40,43-48H,14H2,1-2H3,(H,49,50)/b8-5+","BGFPUQODHQFMFB-VMPITWQZSA-N"
"O=C1C=C(OC=2C=C(OC)C(=C(O)C1=2)C3OC(CO)C(O)C(O)C3(O))C=4C=CC(O)=C(OC)C=4","InChI=1S/C23H24O11/c1-31-13-5-9(3-4-10(13)25)12-6-11(26)17-15(33-12)7-14(32-2)18(20(17)28)23-22(30)21(29)19(27)16(8-24)34-23/h3-7,16,19,21-25,27-30H,8H2,1-2H3","JCIFZANQIXZLGH-UHFFFAOYSA-N"
"O=C1C=C(OC=2C=C(O)C(=C(O)C1=2)C4OC(CO)C(O)C(O)C4(OC3OC(CO)C(O)C(O)C3(O)))C5=CC=C(O)C(O)=C5","InChI=1S/C27H30O16/c28-6-15-20(35)23(38)26(43-27-24(39)22(37)19(34)16(7-29)42-27)25(41-15)18-12(33)5-14-17(21(18)36)11(32)4-13(40-14)8-1-2-9(30)10(31)3-8/h1-5,15-16,19-20,22-31,33-39H,6-7H2","QWAZWXOCSOFIPS-UHFFFAOYSA-N"
"O=C(OC1C(O)C(O)C(OC1(C))OC2C(OC(CO)C(O)C2(O))C4=C(O)C=C(O)C=3C(=O)C=C(OC=34)C5=CC=C(O)C=C5)C","InChI=1S/C29H32O15/c1-10-25(41-11(2)31)23(38)24(39)29(40-10)44-28-22(37)21(36)18(9-30)43-27(28)20-15(34)7-14(33)19-16(35)8-17(42-26(19)20)12-3-5-13(32)6-4-12/h3-8,10,18,21-25,27-30,32-34,36-39H,9H2,1-2H3","RJQUXMJLUPJNPG-UHFFFAOYSA-N"
"O=C(OCC5OC(OC4C(O)C(O)C(OC4(C=1C(O)=CC=2OC(=CC(=O)C=2(C=1(O)))C3=CC=C(O)C=C3))CO)C(O)C(O)C5(O))C=CC6=CC=C(O)C=C6","InChI=1S/C36H36O17/c37-13-23-28(43)32(47)35(53-36-33(48)31(46)29(44)24(52-36)14-49-25(42)10-3-15-1-6-17(38)7-2-15)34(51-23)27-20(41)12-22-26(30(27)45)19(40)11-21(50-22)16-4-8-18(39)9-5-16/h1-12,23-24,28-29,31-39,41,43-48H,13-14H2","RECLDAGWBWVMCW-UHFFFAOYSA-N"
"O=C1C=C(OC2=C1C(O)=C(C(O)=C2C3OC(CO)C(O)C(O)C3(O))C4OCC(O)C(O)C4(O))C5=CC=C(O)C=C5","InChI=1S/C26H28O14/c27-6-13-18(32)21(35)23(37)26(40-13)16-20(34)15(25-22(36)17(31)11(30)7-38-25)19(33)14-10(29)5-12(39-24(14)16)8-1-3-9(28)4-2-8/h1-5,11,13,17-18,21-23,25-28,30-37H,6-7H2","OVMFOVNOXASTPA-UHFFFAOYSA-N"
"O=C1C=C(OC=2C1=C(O)C(=C(O)C=2C3OC(CO)C(O)C(O)C3(O))C4OC(CO)C(O)C(O)C4(O))C5=CC=C(O)C=C5","InChI=1S/C27H30O15/c28-6-12-17(32)21(36)23(38)26(41-12)15-19(34)14-10(31)5-11(8-1-3-9(30)4-2-8)40-25(14)16(20(15)35)27-24(39)22(37)18(33)13(7-29)42-27/h1-5,12-13,17-18,21-24,26-30,32-39H,6-7H2","FIAAVMJLAGNUKW-UHFFFAOYSA-N"
"O=C1C=C(OC=2C1=C(O)C(=C(O)C=2C3OC(CO)C(O)C(O)C3(O))C4OC(CO)C(O)C(O)C4(O))C5=CC=C(O)C(O)=C5","InChI=1S/C27H30O16/c28-5-12-17(33)21(37)23(39)26(42-12)15-19(35)14-10(32)4-11(7-1-2-8(30)9(31)3-7)41-25(14)16(20(15)36)27-24(40)22(38)18(34)13(6-29)43-27/h1-4,12-13,17-18,21-24,26-31,33-40H,5-6H2","ZLPSOQFIIQIIAX-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)C1CC(=O)C2=C(O1)C=C(O)C=C2O","InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2","FTVWIRXFELQLPI-UHFFFAOYSA-N"
"O=C2C3=C(O)C=C(OC)C=C3(OC(C1=CC=C(O)C=C1)C2)","InChI=1S/C16H14O5/c1-20-11-6-12(18)16-13(19)8-14(21-15(16)7-11)9-2-4-10(17)5-3-9/h2-7,14,17-18H,8H2,1H3","DJOJDHGQRNZXQQ-UHFFFAOYSA-N"
"OC1=CC=C(C=C1)C3OC=2C=C(O)C=C(O)C=2CC3(O)","InChI=1S/C15H14O5/c16-9-3-1-8(2-4-9)15-13(19)7-11-12(18)5-10(17)6-14(11)20-15/h1-6,13,15-19H,7H2","RSYUFYQTACJFML-UHFFFAOYSA-N"
"O=C(O)CC(=O)OCC4OC(OC=1C(=O)C=3C(O)=CC(O)=CC=3(OC=1C2=CC(O)=C(O)C=C2(O)))C(O)C(O)C4(O)","InChI=1S/C24H22O16/c25-7-1-12(29)17-13(2-7)38-22(8-3-10(27)11(28)4-9(8)26)23(19(17)34)40-24-21(36)20(35)18(33)14(39-24)6-37-16(32)5-15(30)31/h1-4,14,18,20-21,24-29,33,35-36H,5-6H2,(H,30,31)","HPUSNSBFKNJRQA-UHFFFAOYSA-N"
"O=C(O)C=CC1=CC=C(O)C(OC)=C1","InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)","KSEBMYQBYZTDHS-UHFFFAOYSA-N"
"COC1=C(O)C=CC(\C=C\C(=O)NCC=C)=C1","InChI=1S/C13H15NO3/c1-3-8-14-13(16)7-5-10-4-6-11(15)12(9-10)17-2/h3-7,9,15H,1,8H2,2H3,(H,14,16)/b7-5+","NAYMCRXFMBIDTH-FNORWQNLSA-N"
"O=C(C=CC=1C=CC(O)=C(OC)C=1)NCCCCN","InChI=1S/C14H20N2O3/c1-19-13-10-11(4-6-12(13)17)5-7-14(18)16-9-3-2-8-15/h4-7,10,17H,2-3,8-9,15H2,1H3,(H,16,18)","SFUVCMKSYKHYLD-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C(OC)=C1)NCCCCNC(=N)N","InChI=1S/C15H22N4O3/c1-22-13-10-11(4-6-12(13)20)5-7-14(21)18-8-2-3-9-19-15(16)17/h4-7,10,20H,2-3,8-9H2,1H3,(H,18,21)(H4,16,17,19)","UBMDAKWARMURDL-UHFFFAOYSA-N"
"COC1=C(O)C=CC(\C=C\C(=O)NCCCCC(N)C(O)=O)=C1","InChI=1S/C16H22N2O5/c1-23-14-10-11(5-7-13(14)19)6-8-15(20)18-9-3-2-4-12(17)16(21)22/h5-8,10,12,19H,2-4,9,17H2,1H3,(H,18,20)(H,21,22)/b8-6+","VHOPIWUPYREUSE-SOFGYWHQSA-N"
"COC1=CC(\C=C\C(=O)N\C=C\C2=CC=C(O)C=C2)=CC=C1O","InChI=1S/C18H17NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-12,20-21H,1H3,(H,19,22)/b9-5+,11-10+","PMRDPCAGHFQFMZ-NJNCEADSSA-N"
"COC1=C(O)C=CC(\C=C\C(=O)N\C=C\C2=CC=C(O)C=C2)=C1","InChI=1S/C18H17NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-12,20-21H,1H3,(H,19,22)/b9-5+,11-10+","PMRDPCAGHFQFMZ-NJNCEADSSA-N"
"O=C(C=CC=1C=CC(O)=C(OC)C=1)NCCC2=CC=C(O)C=C2","InChI=1S/C18H19NO4/c1-23-17-12-14(4-8-16(17)21)5-9-18(22)19-11-10-13-2-6-15(20)7-3-13/h2-9,12,20-21H,10-11H2,1H3,(H,19,22)","NPNNKDMSXVRADT-UHFFFAOYSA-N"
"CCCCCCCCNC(O)CCC1=CC(OC)=C(O)C=C1","InChI=1S/C18H31NO3/c1-3-4-5-6-7-8-13-19-18(21)12-10-15-9-11-16(20)17(14-15)22-2/h9,11,14,18-21H,3-8,10,12-13H2,1-2H3","HNHHAOUUFVYDEW-UHFFFAOYSA-N"
"COC1=CC(\C=C\NC(=O)\C=C\C2=CC=C(O)C(OC)=C2)=CC=C1O","InChI=1S/C19H19NO5/c1-24-17-11-13(3-6-15(17)21)5-8-19(23)20-10-9-14-4-7-16(22)18(12-14)25-2/h3-12,21-22H,1-2H3,(H,20,23)/b8-5+,10-9+","IQGMDSXKRPLDBE-CPSCNVPRSA-N"
"O=C(C=CC1=CC=C(O)C(OC)=C1)NCCC=2C=CC(OC)=C(O)C=2","InChI=1S/C19H21NO5/c1-24-17-7-4-14(11-16(17)22)9-10-20-19(23)8-5-13-3-6-15(21)18(12-13)25-2/h3-8,11-12,21-22H,9-10H2,1-2H3,(H,20,23)","ACSWAJLDOHJFNA-UHFFFAOYSA-N"
"COC1=C(O)C=CC(C=CC(=O)OC2C(O)C(O)C(CO)OC2OC2COC(C(O)C2O)C2=C(O)C3=C(OC(=CC3=O)C3=CC=C(O)C=C3)C=C2O)=C1","InChI=1S/C36H36O17/c1-48-22-10-15(2-8-18(22)39)3-9-26(42)53-35-33(47)29(43)24(13-37)51-36(35)52-25-14-49-34(32(46)30(25)44)28-20(41)12-23-27(31(28)45)19(40)11-21(50-23)16-4-6-17(38)7-5-16/h2-12,24-25,29-30,32-39,41,43-47H,13-14H2,1H3","IWFBTVKUANPWLB-UHFFFAOYSA-N"
"O=C(OC1C(OC(C(=O)O)C(O)C1(O))OC5C(OC2=CC=C(C=C2)C=3OC4=CC(O)=CC(O)=C4(C(=O)C=3))OC(C(=O)O)C(O)C5(O))C=CC=6C=CC(O)=C(OC)C=6","InChI=1S/C37H34O20/c1-51-22-10-14(2-8-18(22)39)3-9-24(42)54-32-28(45)26(43)31(35(49)50)56-37(32)57-33-29(46)27(44)30(34(47)48)55-36(33)52-17-6-4-15(5-7-17)21-13-20(41)25-19(40)11-16(38)12-23(25)53-21/h2-13,26-33,36-40,43-46H,1H3,(H,47,48)(H,49,50)","LNCLTICCQWMCNS-UHFFFAOYSA-N"
"O=C(OC1C(OC(C(=O)O)C(O)C1(O))OC5C(OC2=CC(O)=C3C(=O)C=C(OC3(=C2))C=4C=CC(O)=C(OC)C=4)OC(C(=O)O)C(O)C5(O))C=CC=6C=CC(O)=C(OC)C=6","InChI=1S/C38H36O21/c1-52-22-9-14(3-6-17(22)39)4-8-25(43)56-33-29(46)27(44)32(36(50)51)58-38(33)59-34-30(47)28(45)31(35(48)49)57-37(34)54-16-11-19(41)26-20(42)13-21(55-24(26)12-16)15-5-7-18(40)23(10-15)53-2/h3-13,27-34,37-41,44-47H,1-2H3,(H,48,49)(H,50,51)","CQSOKHCNRZFEOH-UHFFFAOYSA-N"
"O=C(O)C2N(C(=O)C1NCCC1)CCC2","InChI=1S/C10H16N2O3/c13-9(7-3-1-5-11-7)12-6-2-4-8(12)10(14)15/h7-8,11H,1-6H2,(H,14,15)","RWCOTTLHDJWHRS-UHFFFAOYSA-N"
"O=C(O)CC(NC(=O)C(N)C(C)CC)C(=O)O","InChI=1S/C10H18N2O5/c1-3-5(2)8(11)9(15)12-6(10(16)17)4-7(13)14/h5-6,8H,3-4,11H2,1-2H3,(H,12,15)(H,13,14)(H,16,17)","WKXVAXOSIPTXEC-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C(C)C)C(C)C","InChI=1S/C10H20N2O3/c1-5(2)7(11)9(13)12-8(6(3)4)10(14)15/h5-8H,11H2,1-4H3,(H,12,13)(H,14,15)","KRNYOVHEKOBTEF-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C(O)C)CC(C)C","InChI=1S/C10H20N2O4/c1-5(2)4-7(10(15)16)12-9(14)8(11)6(3)13/h5-8,13H,4,11H2,1-3H3,(H,12,14)(H,15,16)","BQBCIBCLXBKYHW-UHFFFAOYSA-N"
"O=C(O)C1N(C(=O)C(N)CC(C)C)CCC1","InChI=1S/C11H20N2O3/c1-7(2)6-8(12)10(14)13-5-3-4-9(13)11(15)16/h7-9H,3-6,12H2,1-2H3,(H,15,16)","VTJUNIYRYIAIHF-UHFFFAOYSA-N"
"O=C(O)CCC(NC(=O)C(N)C(C)CC)C(=O)O","InChI=1S/C11H20N2O5/c1-3-6(2)9(12)10(16)13-7(11(17)18)4-5-8(14)15/h6-7,9H,3-5,12H2,1-2H3,(H,13,16)(H,14,15)(H,17,18)","KTGFOCFYOZQVRJ-UHFFFAOYSA-N"
"O=C(O)C(N)CCC(=O)NC(C(=O)O)CC(C)C","InChI=1S/C11H20N2O5/c1-6(2)5-8(11(17)18)13-9(14)4-3-7(12)10(15)16/h6-8H,3-5,12H2,1-2H3,(H,13,14)(H,15,16)(H,17,18)","MYFMARDICOWMQP-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C(C)CC)CCC(=O)N","InChI=1S/C11H21N3O4/c1-3-6(2)9(13)10(16)14-7(11(17)18)4-5-8(12)15/h6-7,9H,3-5,13H2,1-2H3,(H2,12,15)(H,14,16)(H,17,18)","CNPNWGHRMBQHBZ-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C(C)CC)C(C)C","InChI=1S/C11H22N2O3/c1-5-7(4)8(12)10(14)13-9(6(2)3)11(15)16/h6-9H,5,12H2,1-4H3,(H,13,14)(H,15,16)","BCXBIONYYJCSDF-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)CC(C)C)C(C)C","InChI=1S/C11H22N2O3/c1-6(2)5-8(12)10(14)13-9(7(3)4)11(15)16/h6-9H,5,12H2,1-4H3,(H,13,14)(H,15,16)","MDSUKZSLOATHMH-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C(C)C)C(C)CC","InChI=1S/C11H22N2O3/c1-5-7(4)9(11(15)16)13-10(14)8(12)6(2)3/h6-9H,5,12H2,1-4H3,(H,13,14)(H,15,16)","PNVLWFYAPWAQMU-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C)CC1=CC=CC=C1","InChI=1S/C12H16N2O3/c1-8(13)11(15)14-10(12(16)17)7-9-5-3-2-4-6-9/h2-6,8,10H,7,13H2,1H3,(H,14,15)(H,16,17)","OMNVYXHOSHNURL-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)CC(C)C)CC(C)C","InChI=1S/C12H24N2O3/c1-7(2)5-9(13)11(15)14-10(12(16)17)6-8(3)4/h7-10H,5-6,13H2,1-4H3,(H,14,15)(H,16,17)","LCPYQJIKPJDLLB-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C1NCCC1)CC2=CC=CC=C2","InChI=1S/C14H18N2O3/c17-13(11-7-4-8-15-11)16-12(14(18)19)9-10-5-2-1-3-6-10/h1-3,5-6,11-12,15H,4,7-9H2,(H,16,17)(H,18,19)","IWIANZLCJVYEFX-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)CC1=CC=CC=C1)C(C)C","InChI=1S/C14H20N2O3/c1-9(2)12(14(18)19)16-13(17)11(15)8-10-6-4-3-5-7-10/h3-7,9,11-12H,8,15H2,1-2H3,(H,16,17)(H,18,19)","IEHDJWSAXBGJIP-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C(C)C)CC1=CC=CC=C1","InChI=1S/C14H20N2O3/c1-9(2)12(15)13(17)16-11(14(18)19)8-10-6-4-3-5-7-10/h3-7,9,11-12H,8,15H2,1-2H3,(H,16,17)(H,18,19)","GJNDXQBALKCYSZ-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)CC1=CC=CC=C1)C(C)CC","InChI=1S/C15H22N2O3/c1-3-10(2)13(15(19)20)17-14(18)12(16)9-11-7-5-4-6-8-11/h4-8,10,12-13H,3,9,16H2,1-2H3,(H,17,18)(H,19,20)","JWBLQDDHSDGEGR-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)CC(C)C)CC1=CC=CC=C1","InChI=1S/C15H22N2O3/c1-10(2)8-12(16)14(18)17-13(15(19)20)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9,16H2,1-2H3,(H,17,18)(H,19,20)","KFKWRHQBZQICHA-UHFFFAOYSA-N"
"O=C(O)CNC(=O)CCC(N)C(=O)O","InChI=1S/C7H12N2O5/c8-4(7(13)14)1-2-5(10)9-3-6(11)12/h4H,1-3,8H2,(H,9,10)(H,11,12)(H,13,14)","ACIJGUBIMXQCMF-UHFFFAOYSA-N"
"O=C(O)CNC(=O)C(N)CC(C)C","InChI=1S/C8H16N2O3/c1-5(2)3-6(9)8(13)10-4-7(11)12/h5-6H,3-4,9H2,1-2H3,(H,10,13)(H,11,12)","LESXFEZIFXFIQR-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)CN)CC(C)C","InChI=1S/C8H16N2O3/c1-5(2)3-6(8(12)13)10-7(11)4-9/h5-6H,3-4,9H2,1-2H3,(H,10,11)(H,12,13)","DKEXFJVMVGETOO-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)CC(C)C)C","InChI=1S/C9H18N2O3/c1-5(2)4-7(10)8(12)11-6(3)9(13)14/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)","HSQGMTRYSIHDAC-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C)CC(C)C","InChI=1S/C9H18N2O3/c1-5(2)4-7(9(13)14)11-8(12)6(3)10/h5-7H,4,10H2,1-3H3,(H,11,12)(H,13,14)","RDIKFPRVLJLMER-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)C(C)CC)CO","InChI=1S/C9H18N2O4/c1-3-5(2)7(10)8(13)11-6(4-12)9(14)15/h5-7,12H,3-4,10H2,1-2H3,(H,11,13)(H,14,15)","TWVKGYNQQAUNRN-UHFFFAOYSA-N"
"O=C(O)C(NC(=O)C(N)CO)CC(C)C","InChI=1S/C9H18N2O4/c1-5(2)3-7(9(14)15)11-8(13)6(10)4-12/h5-7,12H,3-4,10H2,1-2H3,(H,11,13)(H,14,15)","NFDYGNFETJVMSE-UHFFFAOYSA-N"
"O=C1OC2=CC(OC)=C(OC)C=C2(C=C1)","InChI=1S/C11H10O4/c1-13-9-5-7-3-4-11(12)15-8(7)6-10(9)14-2/h3-6H,1-2H3","GUAFOGOEJLSQBT-UHFFFAOYSA-N"
"O=C3OC=1C=C(O)C=CC=1C=4OC=2C=C(O)C=CC=2C3=4","InChI=1S/C15H8O5/c16-7-1-3-9-11(5-7)19-14-10-4-2-8(17)6-12(10)20-15(18)13(9)14/h1-6,16-17H","ZZIALNLLNHEQPJ-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)NCCCCN","InChI=1S/C13H18N2O2/c14-9-1-2-10-15-13(17)8-5-11-3-6-12(16)7-4-11/h3-8,16H,1-2,9-10,14H2,(H,15,17)","CJHDBEPXEKGBDW-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)NCCCCNC(=N)N","InChI=1S/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)","AKIHYQWCLCDMMI-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)NCCC2=CC=C(O)C=C2","InChI=1S/C17H17NO3/c19-15-6-1-13(2-7-15)5-10-17(21)18-12-11-14-3-8-16(20)9-4-14/h1-10,19-20H,11-12H2,(H,18,21)","RXGUTQNKCXHALN-UHFFFAOYSA-N"
"O=C(C=CC1=CC=C(O)C=C1)NCCCN(C(=O)C=CC=2C=CC(O)=C(O)C=2)CCCCNC(=O)C=CC=3C=CC(O)=C(O)C=3","InChI=1S/C34H37N3O8/c38-27-11-4-24(5-12-27)8-15-32(43)36-19-3-21-37(34(45)17-10-26-7-14-29(40)31(42)23-26)20-2-1-18-35-33(44)16-9-25-6-13-28(39)30(41)22-25/h4-17,22-23,38-42H,1-3,18-21H2,(H,35,44)(H,36,43)","XYBWBOHZMFLRBQ-UHFFFAOYSA-N"
"OC1C(O)C(OC(OC2=CC=C(C=C2)C2=CC(=O)C3=C(O)C=C(O)C=C3O2)C1OC1OC(C(O)C(O)C1OC(=O)\C=C\C1=CC=C(O)C=C1)C(O)=O)C(O)=O","InChI=1S/C36H32O19/c37-16-6-1-14(2-7-16)3-10-23(41)52-31-27(44)25(42)30(34(48)49)54-36(31)55-32-28(45)26(43)29(33(46)47)53-35(32)50-18-8-4-15(5-9-18)21-13-20(40)24-19(39)11-17(38)12-22(24)51-21/h1-13,25-32,35-39,42-45H,(H,46,47)(H,48,49)/b10-3+","NCJNNMWJQIKYLO-XCVCLJGOSA-N"
"O=C(O)C=CC1=CC=CC(O)=C1","InChI=1S/C9H8O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-6,10H,(H,11,12)","KKSDGJDHHZEWEP-UHFFFAOYSA-N"
"O=C(OC)C=CC1=CC=CC=C1","InChI=1S/C10H10O2/c1-12-10(11)8-7-9-5-3-2-4-6-9/h2-8H,1H3","CCRCUPLGCSFEDV-UHFFFAOYSA-N"
"O=C(O)C=CC1=CC=C(OC)C=C1","InChI=1S/C10H10O3/c1-13-9-5-2-8(3-6-9)4-7-10(11)12/h2-7H,1H3,(H,11,12)","AFDXODALSZRGIH-UHFFFAOYSA-N"
"NCCCCNC(=O)\C=C\C1=CC=CC=C1","InChI=1S/C13H18N2O/c14-10-4-5-11-15-13(16)9-8-12-6-2-1-3-7-12/h1-3,6-9H,4-5,10-11,14H2,(H,15,16)/b9-8+","UYLFIIUIXMINML-CMDGGOBGSA-N"
"O=C(C=1C(O)=C(C(O)=C(C=1(O))C2OC(CO)C(O)C(O)C2(O))C3OC(CO)C(O)C(O)C3(O))CCC4=CC=C(O)C=C4","InChI=1S/C27H34O15/c28-7-12-17(32)22(37)24(39)26(41-12)15-19(34)14(11(31)6-3-9-1-4-10(30)5-2-9)20(35)16(21(15)36)27-25(40)23(38)18(33)13(8-29)42-27/h1-2,4-5,12-13,17-18,22-30,32-40H,3,6-8H2","WAWHTTXPRUWFCZ-UHFFFAOYSA-N"
"O=C(O)C3NCC=2NC1=CC=CC=C1C=2C3","InChI=1S/C12H12N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-4,10,13-14H,5-6H2,(H,15,16)","FSNCEEGOMTYXKY-UHFFFAOYSA-N"
"O=C2OCC=1C(=O)N4C(=CC=1C2CC)C=3N=C5C=CC=CC5(=CC=3C4)","InChI=1S/C20H16N2O3/c1-2-13-14-8-17-18-12(7-11-5-3-4-6-16(11)21-18)9-22(17)19(23)15(14)10-25-20(13)24/h3-8,13H,2,9-10H2,1H3","PEZXVOHRDBYBFR-UHFFFAOYSA-N"
"O=C2OCC=1C(=O)N4C(=CC=1C2(O)CC)C3=NC=5C=CC=CC=5(C=C3C4)","InChI=1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3","VSJKWCGYPAHWDS-UHFFFAOYSA-N"
"O=C(O)C(O)(C=2C=C3C=1N=C4C=CC=CC4(=CC=1CN3(C(=O)C=2COC(=O)C)))CC","InChI=1S/C22H20N2O6/c1-3-22(29,21(27)28)16-9-18-19-14(8-13-6-4-5-7-17(13)23-19)10-24(18)20(26)15(16)11-30-12(2)25/h4-9,29H,3,10-11H2,1-2H3,(H,27,28)","ZXQLECPLGKEUQV-UHFFFAOYSA-N"
"O=C3C7=C(C=C4C=2NC1=CC=CC=C1C=2CCN34)C(C=C)C5OC7(OC6C(O5)OC(CO)C(O)C6(O))","InChI=1S/C26H26N2O8/c1-2-11-14-9-16-19-13(12-5-3-4-6-15(12)27-19)7-8-28(16)23(32)18(14)25-34-22-21(31)20(30)17(10-29)33-26(22)36-24(11)35-25/h2-6,9,11,17,20-22,24-27,29-31H,1,7-8,10H2","QBVLOMJKKLVAPJ-UHFFFAOYSA-N"
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"CCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/CCCCC","InChI=1S/C41H74NO9P/c1-3-5-7-9-11-13-14-15-16-18-20-22-27-31-40(43)47-35-37(36-49-52(45,46)48-34-33-42)50-41(44)32-28-24-23-26-30-39-38(51-39)29-25-21-19-17-12-10-8-6-4-2/h12,17,21,23,25-26,37-39H,3-11,13-16,18-20,22,24,27-36,42H2,1-2H3,(H,45,46)/b17-12-,25-21-,26-23-","YOYIPDIQILBNBX-FXEOECEESA-N"
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"CCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC(O)\C=C/C=C\C\C=C/CCCCC","InChI=1S/C41H74NO9P/c1-3-5-7-9-11-13-15-16-17-19-21-23-28-32-40(44)48-36-39(37-50-52(46,47)49-35-34-42)51-41(45)33-29-25-24-27-31-38(43)30-26-22-20-18-14-12-10-8-6-4-2/h12,14,20,22,24,26-27,30,38-39,43H,3-11,13,15-19,21,23,25,28-29,31-37,42H2,1-2H3,(H,46,47)/b14-12-,22-20-,27-24-,30-26-","FOMAQERMJBSHAU-HPYUBYMDSA-N"
"CCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCCCCCCC(O)\C=C\C=C/CCCCC","InChI=1S/C39H74NO9P/c1-3-5-7-9-11-12-13-14-15-16-18-22-26-30-38(42)46-34-37(35-48-50(44,45)47-33-32-40)49-39(43)31-27-23-19-21-25-29-36(41)28-24-20-17-10-8-6-4-2/h17,20,24,28,36-37,41H,3-16,18-19,21-23,25-27,29-35,40H2,1-2H3,(H,44,45)/b20-17-,28-24+","BLRFSIIHFKZEDN-PCHRQBGLSA-N"
"CCCCCCCCCCCCCCCCOCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/CC(O)\C=C\C=C/C\C=C/C\C=C/CC","InChI=1S/C43H76NO8P/c1-3-5-7-9-11-13-15-16-17-18-20-24-28-32-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-31-27-23-22-26-30-34-41(45)33-29-25-21-19-14-12-10-8-6-4-2/h6,8,12,14,21,23,25-27,29-30,33,41-42,45H,3-5,7,9-11,13,15-20,22,24,28,31-32,34-40,44H2,1-2H3,(H,47,48)/b8-6-,14-12-,25-21-,27-23-,30-26-,33-29+","HKWJONJWEPKVTD-KMDVESRMSA-N"
"CCCCCCCCCCCCCCCCOCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/CCCCC","InChI=1S/C41H76NO8P/c1-3-5-7-9-11-12-13-14-15-16-19-22-26-30-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-29-25-21-18-17-20-24-28-32-39(43)31-27-23-10-8-6-4-2/h18,20-21,23-24,27-28,32,39-40,43H,3-17,19,22,25-26,29-31,33-38,42H2,1-2H3,(H,45,46)/b21-18-,24-20-,27-23-,32-28+","STAPRPTUZGZBLD-QQGSTFQISA-N"
"CCCCCCCCCCCCCCCCOCC(COP(O)(=O)OCCN)OC(=O)CCC(O)\C=C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC","InChI=1S/C43H76NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-23-25-27-29-31-33-41(45)34-35-43(46)52-42(40-51-53(47,48)50-38-36-44)39-49-37-32-30-28-26-24-22-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21,23,27,29,31,33,41-42,45H,3-4,6,8-10,12,14-16,18,20,22,24-26,28,30,32,34-40,44H2,1-2H3,(H,47,48)/b7-5-,13-11-,19-17-,23-21-,29-27-,33-31+","IDPCOHSYCVCJIV-RMHQBJAJSA-N"
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"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/CCCCC","InChI=1S/C41H72NO9P/c1-3-5-7-9-11-12-13-14-15-16-20-24-28-32-40(44)48-36-39(37-50-52(46,47)49-35-34-42)51-41(45)33-29-25-21-18-17-19-23-27-31-38(43)30-26-22-10-8-6-4-2/h12-13,18-19,21-23,26-27,31,38-39,43H,3-11,14-17,20,24-25,28-30,32-37,42H2,1-2H3,(H,46,47)/b13-12-,21-18-,23-19-,26-22-,31-27+","CZIBJLCOBSDECU-HMDLBMMTSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCCCCCC\C=C/C=C/C(O)CCCCC","InChI=1S/C39H72NO9P/c1-3-5-7-8-9-10-11-12-13-16-19-22-26-30-38(42)46-34-37(35-48-50(44,45)47-33-32-40)49-39(43)31-27-23-20-17-14-15-18-21-25-29-36(41)28-24-6-4-2/h10-11,18,21,25,29,36-37,41H,3-9,12-17,19-20,22-24,26-28,30-35,40H2,1-2H3,(H,44,45)/b11-10-,21-18-,29-25+","OGMSPCSYRLGBIK-CDWHNJLCSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/CC1OC1CCCCC","InChI=1S/C41H72NO9P/c1-3-5-7-8-9-10-11-12-13-17-20-23-27-31-40(43)47-35-37(36-49-52(45,46)48-34-33-42)50-41(44)32-28-24-21-18-15-14-16-19-22-26-30-39-38(51-39)29-25-6-4-2/h10-11,14,16,18,21-22,26,37-39H,3-9,12-13,15,17,19-20,23-25,27-36,42H2,1-2H3,(H,45,46)/b11-10-,16-14-,21-18-,26-22-","FPHCVTCCOAXJFD-UXDZAWFQSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC","InChI=1S/C41H70NO9P/c1-3-5-7-8-9-10-11-12-13-17-20-23-27-31-40(43)47-35-37(36-49-52(45,46)48-34-33-42)50-41(44)32-28-24-21-18-15-14-16-19-22-26-30-39-38(51-39)29-25-6-4-2/h6,10-11,14,16,18,21-22,25-26,37-39H,3-5,7-9,12-13,15,17,19-20,23-24,27-36,42H2,1-2H3,(H,45,46)/b11-10-,16-14-,21-18-,25-6-,26-22-","WZWNPGBLELJTRC-LIHWUGRXSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C=C/C(O)CCCCC","InChI=1S/C41H72NO9P/c1-3-5-7-8-9-10-11-12-15-18-21-24-28-32-40(44)48-36-39(37-50-52(46,47)49-35-34-42)51-41(45)33-29-25-22-19-16-13-14-17-20-23-27-31-38(43)30-26-6-4-2/h10-11,13-14,19-20,22-23,27,31,38-39,43H,3-9,12,15-18,21,24-26,28-30,32-37,42H2,1-2H3,(H,46,47)/b11-10-,14-13-,22-19-,23-20-,31-27+","RRVFMOQYJGFOHP-SVESCYRASA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1CC","InChI=1S/C41H70NO9P/c1-3-5-6-7-8-9-10-12-16-19-22-25-28-31-40(43)47-35-37(36-49-52(45,46)48-34-33-42)50-41(44)32-29-26-23-20-17-14-11-13-15-18-21-24-27-30-39-38(4-2)51-39/h9-11,14-15,18,20,23-24,27,37-39H,3-8,12-13,16-17,19,21-22,25-26,28-36,42H2,1-2H3,(H,45,46)/b10-9-,14-11-,18-15-,23-20-,27-24-","QBLAQPHAGKHVQF-GDXQJOFXSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C41H72NO9P/c1-3-5-6-7-8-9-10-13-17-20-23-26-29-32-40(44)48-36-39(37-50-52(46,47)49-35-34-42)51-41(45)33-30-27-24-21-18-15-12-11-14-16-19-22-25-28-31-38(43)4-2/h9-10,12,14-16,21-22,24-25,38-39,43H,3-8,11,13,17-20,23,26-37,42H2,1-2H3,(H,46,47)/b10-9-,15-12-,16-14-,24-21-,25-22-","ZDCQEGRZBIKTCV-BPTHFSRZSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCO","InChI=1S/C41H72NO9P/c1-2-3-4-5-6-7-8-14-17-20-23-26-29-32-40(44)48-37-39(38-50-52(46,47)49-36-34-42)51-41(45)33-30-27-24-21-18-15-12-10-9-11-13-16-19-22-25-28-31-35-43/h7-9,11-12,15-16,19,21,24,39,43H,2-6,10,13-14,17-18,20,22-23,25-38,42H2,1H3,(H,46,47)/b8-7-,11-9-,15-12-,19-16-,24-21-","QAGKBILNACNFNV-JVZLGTRQSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCCC(O)\C=C\C=C/C\C=C/C\C=C/C\C=C/CC","InChI=1S/C41H70NO9P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-38(43)31-29-33-41(45)51-39(37-50-52(46,47)49-35-34-42)36-48-40(44)32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13-14,16-17,19,23,25,27,30,38-39,43H,3-4,6,8-10,12,15,18,20-22,24,26,28-29,31-37,42H2,1-2H3,(H,46,47)/b7-5-,13-11-,16-14-,19-17-,25-23-,30-27+","SYSAUTIDYBPVAJ-XEMBCXIBSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/C\C=C/CC","InChI=1S/C41H70NO9P/c1-3-5-7-9-11-13-14-15-16-18-20-22-27-31-40(43)47-35-37(36-49-52(45,46)48-34-33-42)50-41(44)32-28-24-23-26-30-39-38(51-39)29-25-21-19-17-12-10-8-6-4-2/h6,8,12-14,17,21,23,25-26,37-39H,3-5,7,9-11,15-16,18-20,22,24,27-36,42H2,1-2H3,(H,45,46)/b8-6-,14-13-,17-12-,25-21-,26-23-","QNISVSSHGJQJFS-AGTGIJSWSA-N"
"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC(O)\C=C/C=C\C\C=C/CCCCC","InChI=1S/C41H72NO9P/c1-3-5-7-9-11-13-15-16-17-19-21-23-28-32-40(44)48-36-39(37-50-52(46,47)49-35-34-42)51-41(45)33-29-25-24-27-31-38(43)30-26-22-20-18-14-12-10-8-6-4-2/h12-15,20,22,24,26-27,30,38-39,43H,3-11,16-19,21,23,25,28-29,31-37,42H2,1-2H3,(H,46,47)/b14-12-,15-13-,22-20-,27-24-,30-26-","KANUTLMESOYWBP-JRMKNBGWSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/CC(O)\C=C\C=C/C\C=C/C\C=C/CC","InChI=1S/C43H74NO8P/c1-3-5-7-9-11-13-15-16-17-18-20-24-28-32-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-31-27-23-22-26-30-34-41(45)33-29-25-21-19-14-12-10-8-6-4-2/h6,8,12,14,21,23,25-27,29-30,32-33,37,41-42,45H,3-5,7,9-11,13,15-20,22,24,28,31,34-36,38-40,44H2,1-2H3,(H,47,48)/b8-6-,14-12-,25-21-,27-23-,30-26-,33-29+,37-32-","BDOYCCTVTPWYRE-GVCVQWOCSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/CC1OC1C\C=C/CCCCC","InChI=1S/C41H74NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-21-25-29-34-46-36-38(37-48-51(44,45)47-35-33-42)49-41(43)32-28-24-20-18-19-23-27-31-40-39(50-40)30-26-22-10-8-6-4-2/h18,20,22-23,26-27,29,34,38-40H,3-17,19,21,24-25,28,30-33,35-37,42H2,1-2H3,(H,44,45)/b20-18-,26-22-,27-23-,34-29-","LTHODZSXHQIRPR-DEXPISFVSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/CC1OC1C\C=C/C\C=C/CC","InChI=1S/C41H72NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-21-25-29-34-46-36-38(37-48-51(44,45)47-35-33-42)49-41(43)32-28-24-20-18-19-23-27-31-40-39(50-40)30-26-22-10-8-6-4-2/h6,8,18,20,22-23,26-27,29,34,38-40H,3-5,7,9-17,19,21,24-25,28,30-33,35-37,42H2,1-2H3,(H,44,45)/b8-6-,20-18-,26-22-,27-23-,34-29-","MANDXRTVOXHWRZ-RKLGUUCLSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/C\C=C/CC","InChI=1S/C41H72NO8P/c1-3-5-7-9-11-12-13-14-15-16-19-22-26-30-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-29-25-21-18-17-20-24-28-32-39(43)31-27-23-10-8-6-4-2/h6,8,18,20-21,23-24,27-28,30,32,35,39-40,43H,3-5,7,9-17,19,22,25-26,29,31,33-34,36-38,42H2,1-2H3,(H,45,46)/b8-6-,21-18-,24-20-,27-23-,32-28+,35-30-","ZAPQUMCEMOGHEH-WVKUTOATSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/CCCCC","InChI=1S/C41H74NO8P/c1-3-5-7-9-11-12-13-14-15-16-19-22-26-30-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-29-25-21-18-17-20-24-28-32-39(43)31-27-23-10-8-6-4-2/h18,20-21,23-24,27-28,30,32,35,39-40,43H,3-17,19,22,25-26,29,31,33-34,36-38,42H2,1-2H3,(H,45,46)/b21-18-,24-20-,27-23-,32-28+,35-30-","MOFSRTWFULYXNI-XGDYEINXSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCCCCCC\C=C/C=C/C(O)CCCCC","InChI=1S/C39H74NO8P/c1-3-5-7-8-9-10-11-12-13-14-18-21-24-28-33-45-35-38(36-47-49(43,44)46-34-32-40)48-39(42)31-27-23-20-17-15-16-19-22-26-30-37(41)29-25-6-4-2/h19,22,26,28,30,33,37-38,41H,3-18,20-21,23-25,27,29,31-32,34-36,40H2,1-2H3,(H,43,44)/b22-19-,30-26+,33-28-","MTLXRSDIIZJXPF-AFMMARBKSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC","InChI=1S/C41H72NO8P/c1-3-5-7-8-9-10-11-12-13-16-19-22-25-29-34-46-36-38(37-48-51(44,45)47-35-33-42)49-41(43)32-28-24-21-18-15-14-17-20-23-27-31-40-39(50-40)30-26-6-4-2/h6,14,17-18,21,23,26-27,29,34,38-40H,3-5,7-13,15-16,19-20,22,24-25,28,30-33,35-37,42H2,1-2H3,(H,44,45)/b17-14-,21-18-,26-6-,27-23-,34-29-","HTRPPHNDLJGZJG-GATDGZIBSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/C\C=C/C=C/C(O)C\C=C/C\C=C/CC","InChI=1S/C43H74NO8P/c1-3-5-7-9-11-12-13-14-15-18-21-24-28-32-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-31-27-23-20-17-16-19-22-26-30-34-41(45)33-29-25-10-8-6-4-2/h6,8,16-17,22-23,25-27,29-30,32,34,37,41-42,45H,3-5,7,9-15,18-21,24,28,31,33,35-36,38-40,44H2,1-2H3,(H,47,48)/b8-6-,17-16-,26-22-,27-23-,29-25-,34-30+,37-32-","QHFOWXSGAYXXMA-UVTNQYBISA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C=C/C(O)CCCCC","InChI=1S/C41H74NO8P/c1-3-5-7-8-9-10-11-12-13-17-20-23-26-30-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-29-25-22-19-16-14-15-18-21-24-28-32-39(43)31-27-6-4-2/h14-15,19,21-22,24,28,30,32,35,39-40,43H,3-13,16-18,20,23,25-27,29,31,33-34,36-38,42H2,1-2H3,(H,45,46)/b15-14-,22-19-,24-21-,32-28+,35-30-","TVCKHWPNRMOVCP-IKUYWAENSA-N"
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"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1CC","InChI=1S/C41H72NO8P/c1-3-5-6-7-8-9-10-11-15-18-21-24-27-30-34-46-36-38(37-48-51(44,45)47-35-33-42)49-41(43)32-29-26-23-20-17-14-12-13-16-19-22-25-28-31-40-39(4-2)50-40/h12,14,16,19-20,23,25,28,30,34,38-40H,3-11,13,15,17-18,21-22,24,26-27,29,31-33,35-37,42H2,1-2H3,(H,44,45)/b14-12-,19-16-,23-20-,28-25-,34-30-","XOSRDNIOMKMWNT-UHKSSJJUSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C=C\C(O)C\C=C/CC","InChI=1S/C43H74NO8P/c1-3-5-7-8-9-10-11-12-16-19-22-25-28-32-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-31-27-24-21-18-15-13-14-17-20-23-26-30-34-41(45)33-29-6-4-2/h6,14-15,17-18,23-24,26-27,29-30,32,34,37,41-42,45H,3-5,7-13,16,19-22,25,28,31,33,35-36,38-40,44H2,1-2H3,(H,47,48)/b17-14-,18-15-,26-23-,27-24-,29-6-,34-30-,37-32-","WRLKLUNBEVQZBV-FMZRDGNOSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C41H74NO8P/c1-3-5-6-7-8-9-10-11-16-19-22-25-28-31-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-30-27-24-21-18-15-13-12-14-17-20-23-26-29-32-39(43)4-2/h13-15,17,21,23-24,26,31,35,39-40,43H,3-12,16,18-20,22,25,27-30,32-34,36-38,42H2,1-2H3,(H,45,46)/b15-13-,17-14-,24-21-,26-23-,35-31-","JXBHSFQGTHGBOI-XNIUPQLPSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C=C/C(O)CC","InChI=1S/C43H74NO8P/c1-3-5-6-7-8-9-10-11-18-21-24-27-30-33-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-32-29-26-23-20-17-15-13-12-14-16-19-22-25-28-31-34-41(45)4-2/h12-13,16-17,19-20,25-26,28-29,31,33-34,37,41-42,45H,3-11,14-15,18,21-24,27,30,32,35-36,38-40,44H2,1-2H3,(H,47,48)/b13-12-,19-16-,20-17-,28-25-,29-26-,34-31+,37-33-","BQMDNNROBDLIRB-IQBXUUPLSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCO","InChI=1S/C41H74NO8P/c1-2-3-4-5-6-7-8-9-17-20-23-26-29-32-36-47-38-40(39-49-51(45,46)48-37-34-42)50-41(44)33-30-27-24-21-18-15-13-11-10-12-14-16-19-22-25-28-31-35-43/h10,12-13,15-16,19,21,24,32,36,40,43H,2-9,11,14,17-18,20,22-23,25-31,33-35,37-39,42H2,1H3,(H,45,46)/b12-10-,15-13-,19-16-,24-21-,36-32-","MLJLJGSJRTURCA-WDLJJFDPSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCCC1OC1C\C=C/C\C=C/C\C=C/CCCCC","InChI=1S/C41H74NO8P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-34-46-36-38(37-48-51(44,45)47-35-33-42)49-41(43)32-29-31-40-39(50-40)30-27-25-23-21-19-16-14-12-10-8-6-4-2/h12,14,19,21,25,27-28,34,38-40H,3-11,13,15-18,20,22-24,26,29-33,35-37,42H2,1-2H3,(H,44,45)/b14-12-,21-19-,27-25-,34-28-","XHJFYYUPKGPSFH-VLMOQABJSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCCC(O)\C=C\C=C/C\C=C/C\C=C/CCCCC","InChI=1S/C41H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-30-32-39(43)31-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,24,26,28-29,31,35,39-40,43H,3-11,13,15-17,19,21-23,25,27,30,32-34,36-38,42H2,1-2H3,(H,45,46)/b14-12-,20-18-,26-24-,31-28+,35-29-","UJUOJVKUPIFXHE-HTYFZYRCSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/CC(O)\C=C\C=C/C\C=C/C\C=C/C\C=C/CC","InChI=1S/C43H74NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-32-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-31-28-30-34-41(45)33-29-26-24-22-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,20,24,26,28-30,32-33,37,41-42,45H,3-5,7,9-11,13,15-17,19,21-23,25,27,31,34-36,38-40,44H2,1-2H3,(H,47,48)/b8-6-,14-12-,20-18-,26-24-,30-28-,33-29+,37-32-","PZMCLXKKXRSFRS-UWWKQIJASA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/C\C=C/CC","InChI=1S/C41H72NO8P/c1-3-5-7-9-11-13-14-15-16-17-19-21-25-29-34-46-36-38(37-48-51(44,45)47-35-33-42)49-41(43)32-28-24-23-27-31-40-39(50-40)30-26-22-20-18-12-10-8-6-4-2/h6,8,12,18,22-23,26-27,29,34,38-40H,3-5,7,9-11,13-17,19-21,24-25,28,30-33,35-37,42H2,1-2H3,(H,44,45)/b8-6-,18-12-,26-22-,27-23-,34-29-","CASHXTOLFNNGPJ-SQRODZBVSA-N"
"CCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC(O)\C=C/C=C\C\C=C/CCCCC","InChI=1S/C41H74NO8P/c1-3-5-7-9-11-13-15-16-17-18-20-22-26-30-35-47-37-40(38-49-51(45,46)48-36-34-42)50-41(44)33-29-25-24-28-32-39(43)31-27-23-21-19-14-12-10-8-6-4-2/h12,14,21,23-24,27-28,30-31,35,39-40,43H,3-11,13,15-20,22,25-26,29,32-34,36-38,42H2,1-2H3,(H,45,46)/b14-12-,23-21-,28-24-,31-27-,35-30-","NJTPXIVRIMQPFB-LHBRILSUSA-N"
"CCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C42H76NO8P/c1-3-5-6-7-8-9-10-11-14-17-20-23-26-29-32-36-48-38-41(39-50-52(46,47)49-37-35-43)51-42(45)34-31-28-25-22-19-16-13-12-15-18-21-24-27-30-33-40(44)4-2/h13,15-16,18,22,24-25,27,32,36,40-41,44H,3-12,14,17,19-21,23,26,28-31,33-35,37-39,43H2,1-2H3,(H,46,47)/b16-13-,18-15-,25-22-,27-24-,36-32-","UBZUCYNDRIJVGW-LXLGLFKYSA-N"
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"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C=C/C(O)CCCCC","InChI=1S/C43H76NO9P/c1-3-5-7-8-9-10-11-12-13-14-17-20-23-26-30-34-42(46)50-38-41(39-52-54(48,49)51-37-36-44)53-43(47)35-31-27-24-21-18-15-16-19-22-25-29-33-40(45)32-28-6-4-2/h12-13,15-16,21-22,24-25,29,33,40-41,45H,3-11,14,17-20,23,26-28,30-32,34-39,44H2,1-2H3,(H,48,49)/b13-12-,16-15-,24-21-,25-22-,33-29+","OSWMVLVOQYBKCQ-IKMMEEQVSA-N"
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"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C43H76NO9P/c1-3-5-6-7-8-9-10-11-12-16-19-22-25-28-31-34-42(46)50-38-41(39-52-54(48,49)51-37-36-44)53-43(47)35-32-29-26-23-20-17-14-13-15-18-21-24-27-30-33-40(45)4-2/h11-12,14-15,17-18,23-24,26-27,40-41,45H,3-10,13,16,19-22,25,28-39,44H2,1-2H3,(H,48,49)/b12-11-,17-14-,18-15-,26-23-,27-24-","FFQLAUAVQCLGTO-SCJWGXKZSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCO","InChI=1S/C43H76NO9P/c1-2-3-4-5-6-7-8-9-13-16-19-22-25-28-31-34-42(46)50-39-41(40-52-54(48,49)51-38-36-44)53-43(47)35-32-29-26-23-20-17-14-11-10-12-15-18-21-24-27-30-33-37-45/h9-10,12-14,17-18,21,23,26,41,45H,2-8,11,15-16,19-20,22,24-25,27-40,44H2,1H3,(H,48,49)/b12-10-,13-9-,17-14-,21-18-,26-23-","YQTDBHMDOXFRPB-XBTVFBAPSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCCC1OC1C\C=C/C\C=C/C\C=C/CCCCC","InChI=1S/C43H76NO9P/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-33-42(45)49-37-39(38-51-54(47,48)50-36-35-44)52-43(46)34-30-32-41-40(53-41)31-28-26-24-22-20-16-14-12-10-8-6-4-2/h12,14,17-18,20,22,26,28,39-41H,3-11,13,15-16,19,21,23-25,27,29-38,44H2,1-2H3,(H,47,48)/b14-12-,18-17-,22-20-,28-26-","UPEDVDYCQKSZMJ-UKHBWALSSA-N"
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"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCCC(O)\C=C\C=C/C\C=C/C\C=C/CCCCC","InChI=1S/C43H76NO9P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-34-42(46)50-38-41(39-52-54(48,49)51-37-36-44)53-43(47)35-31-33-40(45)32-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h12,14,17-19,21,25,27,29,32,40-41,45H,3-11,13,15-16,20,22-24,26,28,30-31,33-39,44H2,1-2H3,(H,48,49)/b14-12-,18-17-,21-19-,27-25-,32-29+","VOBZZXOQOUYHDG-BZXDWQGOSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/CCCCC","InChI=1S/C43H76NO9P/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-29-33-42(45)49-37-39(38-51-54(47,48)50-36-35-44)52-43(46)34-30-26-25-28-32-41-40(53-41)31-27-23-21-19-12-10-8-6-4-2/h12,15-16,19,23,25,27-28,39-41H,3-11,13-14,17-18,20-22,24,26,29-38,44H2,1-2H3,(H,47,48)/b16-15-,19-12-,27-23-,28-25-","IDHMBNBHODEFBY-PEWLDHNQSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/C\C=C/CC","InChI=1S/C43H74NO9P/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-29-33-42(45)49-37-39(38-51-54(47,48)50-36-35-44)52-43(46)34-30-26-25-28-32-41-40(53-41)31-27-23-21-19-12-10-8-6-4-2/h6,8,12,15-16,19,23,25,27-28,39-41H,3-5,7,9-11,13-14,17-18,20-22,24,26,29-38,44H2,1-2H3,(H,47,48)/b8-6-,16-15-,19-12-,27-23-,28-25-","SIRLTLCSAWWHKF-IDDXEADPSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC(O)\C=C\C=C/C\C=C/C\C=C/CC","InChI=1S/C43H74NO9P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-30-34-42(46)50-38-41(39-52-54(48,49)51-37-36-44)53-43(47)35-31-27-26-29-33-40(45)32-28-24-22-20-14-12-10-8-6-4-2/h6,8,12,14,16-17,22,24,26,28-29,32,40-41,45H,3-5,7,9-11,13,15,18-21,23,25,27,30-31,33-39,44H2,1-2H3,(H,48,49)/b8-6-,14-12-,17-16-,24-22-,29-26-,32-28+","OAONSYIXKBACHU-WVOPVWNJSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC(O)\C=C/C=C\C\C=C/CCCCC","InChI=1S/C43H76NO9P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-30-34-42(46)50-38-41(39-52-54(48,49)51-37-36-44)53-43(47)35-31-27-26-29-33-40(45)32-28-24-22-20-14-12-10-8-6-4-2/h12,14,16-17,22,24,26,28-29,32,40-41,45H,3-11,13,15,18-21,23,25,27,30-31,33-39,44H2,1-2H3,(H,48,49)/b14-12-,17-16-,24-22-,29-26-,32-28-","VDWHRQAMYBWHGO-VJRZMVGHSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCCCCCCC(O)\C=C\C=C/CCCCC","InChI=1S/C41H76NO9P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-24-28-32-40(44)48-36-39(37-50-52(46,47)49-35-34-42)51-41(45)33-29-25-21-23-27-31-38(43)30-26-22-19-10-8-6-4-2/h14-15,19,22,26,30,38-39,43H,3-13,16-18,20-21,23-25,27-29,31-37,42H2,1-2H3,(H,46,47)/b15-14-,22-19-,30-26+","YGGNZIGOWDYFPI-LMWOETAFSA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/CC(O)\C=C\C=C/C\C=C/C\C=C/CC","InChI=1S/C45H78NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-26-30-34-39-51-41-44(42-53-55(49,50)52-40-38-46)54-45(48)37-33-29-25-24-28-32-36-43(47)35-31-27-23-21-14-12-10-8-6-4-2/h6,8,12,14,23,25,27-29,31-32,34-35,39,43-44,47H,3-5,7,9-11,13,15-22,24,26,30,33,36-38,40-42,46H2,1-2H3,(H,49,50)/b8-6-,14-12-,27-23-,29-25-,32-28-,35-31+,39-34-","JQWGOOXVOODUIA-XIWDCYOXSA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/CC1OC1C\C=C/CCCCC","InChI=1S/C43H78NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-23-27-31-36-48-38-40(39-50-53(46,47)49-37-35-44)51-43(45)34-30-26-22-20-21-25-29-33-42-41(52-42)32-28-24-10-8-6-4-2/h20,22,24-25,28-29,31,36,40-42H,3-19,21,23,26-27,30,32-35,37-39,44H2,1-2H3,(H,46,47)/b22-20-,28-24-,29-25-,36-31-","WLNUMGITYHBIGP-UHQQLNJESA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/CCCCC","InChI=1S/C43H78NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-21-24-28-32-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-31-27-23-20-19-22-26-30-34-41(45)33-29-25-10-8-6-4-2/h20,22-23,25-26,29-30,32,34,37,41-42,45H,3-19,21,24,27-28,31,33,35-36,38-40,44H2,1-2H3,(H,47,48)/b23-20-,26-22-,29-25-,34-30+,37-32-","MGODIQYTYGWFSP-CLUXBNISSA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC","InChI=1S/C45H78NO8P/c1-3-5-7-8-9-10-11-12-13-14-17-20-23-26-29-33-38-50-40-42(41-52-55(48,49)51-39-37-46)53-45(47)36-32-28-25-22-19-16-15-18-21-24-27-31-35-44-43(54-44)34-30-6-4-2/h6,16,18-19,21,25,27-28,30-31,33,38,42-44H,3-5,7-15,17,20,22-24,26,29,32,34-37,39-41,46H2,1-2H3,(H,48,49)/b19-16-,21-18-,28-25-,30-6-,31-27-,38-33-","OFBRRKIIHXTXLC-ACQXAVMQSA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1CC","InChI=1S/C43H76NO8P/c1-3-5-6-7-8-9-10-11-12-13-17-20-23-26-29-32-36-48-38-40(39-50-53(46,47)49-37-35-44)51-43(45)34-31-28-25-22-19-16-14-15-18-21-24-27-30-33-42-41(4-2)52-42/h14,16,18,21-22,25,27,30,32,36,40-42H,3-13,15,17,19-20,23-24,26,28-29,31,33-35,37-39,44H2,1-2H3,(H,46,47)/b16-14-,21-18-,25-22-,30-27-,36-32-","YJOKKZDVARXRKS-LYCOSWHASA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C=C\C(O)C\C=C/CC","InChI=1S/C45H78NO8P/c1-3-5-7-8-9-10-11-12-13-14-18-21-24-27-30-34-39-51-41-44(42-53-55(49,50)52-40-38-46)54-45(48)37-33-29-26-23-20-17-15-16-19-22-25-28-32-36-43(47)35-31-6-4-2/h6,16-17,19-20,25-26,28-29,31-32,34,36,39,43-44,47H,3-5,7-15,18,21-24,27,30,33,35,37-38,40-42,46H2,1-2H3,(H,49,50)/b19-16-,20-17-,28-25-,29-26-,31-6-,36-32-,39-34-","JOLOQAXLBQZUBL-IHXAGSJMSA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C43H78NO8P/c1-3-5-6-7-8-9-10-11-12-15-18-21-24-27-30-33-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-32-29-26-23-20-17-14-13-16-19-22-25-28-31-34-41(45)4-2/h14,16-17,19,23,25-26,28,33,37,41-42,45H,3-13,15,18,20-22,24,27,29-32,34-36,38-40,44H2,1-2H3,(H,47,48)/b17-14-,19-16-,26-23-,28-25-,37-33-","ANCAYQLYUYMKFT-GZPCIZTNSA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C=C/C(O)CC","InChI=1S/C45H78NO8P/c1-3-5-6-7-8-9-10-11-12-17-20-23-26-29-32-35-39-51-41-44(42-53-55(49,50)52-40-38-46)54-45(48)37-34-31-28-25-22-19-16-14-13-15-18-21-24-27-30-33-36-43(47)4-2/h13-14,18-19,21-22,27-28,30-31,33,35-36,39,43-44,47H,3-12,15-17,20,23-26,29,32,34,37-38,40-42,46H2,1-2H3,(H,49,50)/b14-13-,21-18-,22-19-,30-27-,31-28-,36-33+,39-35-","ZXWCLVRGQYWIDJ-FOIPUGTFSA-N"
"CCCCCCCCCCCCCCCC\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCO","InChI=1S/C43H78NO8P/c1-2-3-4-5-6-7-8-9-10-16-19-22-25-28-31-34-38-49-40-42(41-51-53(47,48)50-39-36-44)52-43(46)35-32-29-26-23-20-17-14-12-11-13-15-18-21-24-27-30-33-37-45/h11,13-14,17-18,21,23,26,34,38,42,45H,2-10,12,15-16,19-20,22,24-25,27-33,35-37,39-41,44H2,1H3,(H,47,48)/b13-11-,17-14-,21-18-,26-23-,38-34-","FGTFISUIRQWRHZ-CACGPZCKSA-N"
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"CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/CCCCC","InChI=1S/C43H74NO9P/c1-3-5-7-9-11-12-13-14-15-16-17-18-22-26-30-34-42(46)50-38-41(39-52-54(48,49)51-37-36-44)53-43(47)35-31-27-23-20-19-21-25-29-33-40(45)32-28-24-10-8-6-4-2/h11-12,14-15,20-21,23-25,28-29,33,40-41,45H,3-10,13,16-19,22,26-27,30-32,34-39,44H2,1-2H3,(H,48,49)/b12-11-,15-14-,23-20-,25-21-,28-24-,33-29+","RJULKXOWLDKOQV-QJIFGGNESA-N"
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"CCCCCCCCCCCCC\C=C/C\C=C/OCC(COP(O)(=O)OCCN)OC(=O)CCC\C=C/CC(O)\C=C/C=C\C\C=C/CCCCC","InChI=1S/C43H76NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-28-32-37-49-39-42(40-51-53(47,48)50-38-36-44)52-43(46)35-31-27-26-30-34-41(45)33-29-25-23-21-14-12-10-8-6-4-2/h12,14,22-26,29-30,32-33,37,41-42,45H,3-11,13,15-21,27-28,31,34-36,38-40,44H2,1-2H3,(H,47,48)/b14-12-,24-22-,25-23-,30-26-,33-29-,37-32-","PLVINEPQWUWKME-BDBSPJFSSA-N"
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"CCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCC(O)\C=C\C=C/C\C=C/C\C=C/C\C=C/CC","InChI=1S/C42H73O11P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-38(44)31-29-33-42(47)53-40(37-52-54(48,49)51-35-39(45)34-43)36-50-41(46)32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,23,25,27,30,38-40,43-45H,3-4,6,8-10,12,14-16,18,20-22,24,26,28-29,31-37H2,1-2H3,(H,48,49)/b7-5-,13-11-,19-17-,25-23-,30-27+","RWHURFWWGOPNBC-XAZUFWHMSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CC\C=C/C\C=C/CC(O)\C=C\C=C/C\C=C/C\C=C/CC","InChI=1S/C46H77O11P/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-28-32-36-45(50)54-40-44(41-56-58(52,53)55-39-43(49)38-47)57-46(51)37-33-29-25-24-27-31-35-42(48)34-30-26-22-20-14-12-10-8-6-4-2/h6,8,12,14,16-17,22,25-27,29-31,34,42-44,47-49H,3-5,7,9-11,13,15,18-21,23-24,28,32-33,35-41H2,1-2H3,(H,52,53)/b8-6-,14-12-,17-16-,26-22-,29-25-,31-27-,34-30+","VNYNPSSFKCLPNF-PFPHDYFVSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCC\C=C/C\C=C/CC1OC1C\C=C/CCCCC","InChI=1S/C44H77O11P/c1-3-5-7-9-11-12-13-14-15-16-17-18-21-25-29-33-43(47)51-37-40(38-53-56(49,50)52-36-39(46)35-45)54-44(48)34-30-26-22-19-20-24-28-32-42-41(55-42)31-27-23-10-8-6-4-2/h14-15,19,22-24,27-28,39-42,45-46H,3-13,16-18,20-21,25-26,29-38H2,1-2H3,(H,49,50)/b15-14-,22-19-,27-23-,28-24-","KGKLUMYBLQBJIP-JRTWBABGSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCCCCC\C=C/C=C/C(O)CCCCC","InChI=1S/C42H77O11P/c1-3-5-7-8-9-10-11-12-13-14-15-18-21-24-28-32-41(46)50-36-40(37-52-54(48,49)51-35-39(45)34-43)53-42(47)33-29-25-22-19-16-17-20-23-27-31-38(44)30-26-6-4-2/h12-13,20,23,27,31,38-40,43-45H,3-11,14-19,21-22,24-26,28-30,32-37H2,1-2H3,(H,48,49)/b13-12-,23-20-,31-27+","FWNRYKAINLXFHM-DYMQBEGYSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCC\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC","InChI=1S/C44H75O11P/c1-3-5-7-8-9-10-11-12-13-14-15-19-22-25-29-33-43(47)51-37-40(38-53-56(49,50)52-36-39(46)35-45)54-44(48)34-30-26-23-20-17-16-18-21-24-28-32-42-41(55-42)31-27-6-4-2/h6,12-13,16,18,20,23-24,27-28,39-42,45-46H,3-5,7-11,14-15,17,19,21-22,25-26,29-38H2,1-2H3,(H,49,50)/b13-12-,18-16-,23-20-,27-6-,28-24-","NFCXJLCSYCAURE-OGWROKBFSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCC\C=C/C\C=C/C\C=C/C=C/C(O)CCCCC","InChI=1S/C44H77O11P/c1-3-5-7-8-9-10-11-12-13-14-17-20-23-26-30-34-43(48)52-38-42(39-54-56(50,51)53-37-41(47)36-45)55-44(49)35-31-27-24-21-18-15-16-19-22-25-29-33-40(46)32-28-6-4-2/h12-13,15-16,21-22,24-25,29,33,40-42,45-47H,3-11,14,17-20,23,26-28,30-32,34-39H2,1-2H3,(H,50,51)/b13-12-,16-15-,24-21-,25-22-,33-29+","RFXSAQGKFUJDQR-IKMMEEQVSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1CC","InChI=1S/C44H75O11P/c1-3-5-6-7-8-9-10-11-12-15-18-21-24-27-30-33-43(47)51-37-40(38-53-56(49,50)52-36-39(46)35-45)54-44(48)34-31-28-25-22-19-16-13-14-17-20-23-26-29-32-42-41(4-2)55-42/h11-13,16-17,20,22,25-26,29,39-42,45-46H,3-10,14-15,18-19,21,23-24,27-28,30-38H2,1-2H3,(H,49,50)/b12-11-,16-13-,20-17-,25-22-,29-26-","JFXZHMNZUGQTRN-DIZGXOHQSA-N"
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"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OC1C(O)C(O)C(O)C(O)C1O)OC(=O)CCCCCCCC(O)\C=C\C=C/CCCCC","InChI=1S/C45H81O14P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-24-28-32-38(47)56-34-37(35-57-60(54,55)59-45-43(52)41(50)40(49)42(51)44(45)53)58-39(48)33-29-25-21-23-27-31-36(46)30-26-22-19-10-8-6-4-2/h14-15,19,22,26,30,36-37,40-46,49-53H,3-13,16-18,20-21,23-25,27-29,31-35H2,1-2H3,(H,54,55)/b15-14-,22-19-,30-26+","UYWSMPAQBGHDMY-LMWOETAFSA-N"
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"CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OC1C(O)C(O)C(O)C(O)C1O)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C47H79O14P/c1-3-5-6-7-8-9-10-11-12-16-19-22-25-28-31-34-40(49)58-36-39(37-59-62(56,57)61-47-45(54)43(52)42(51)44(53)46(47)55)60-41(50)35-32-29-26-23-20-17-14-13-15-18-21-24-27-30-33-38(48)4-2/h8-9,11-12,14-15,17-18,23-24,26-27,38-39,42-48,51-55H,3-7,10,13,16,19-22,25,28-37H2,1-2H3,(H,56,57)/b9-8-,12-11-,17-14-,18-15-,26-23-,27-24-","LKKIZFRBMQONSM-WHBJEXBBSA-N"
"CCCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OC1C(O)C(O)C(O)C(O)C1O)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C48H85O14P/c1-3-5-6-7-8-9-10-11-12-13-17-20-23-26-29-32-35-41(50)59-37-40(38-60-63(57,58)62-48-46(55)44(53)43(52)45(54)47(48)56)61-42(51)36-33-30-27-24-21-18-15-14-16-19-22-25-28-31-34-39(49)4-2/h15-16,18-19,24-25,27-28,39-40,43-49,52-56H,3-14,17,20-23,26,29-38H2,1-2H3,(H,57,58)/b18-15-,19-16-,27-24-,28-25-","GTGJWENWFXZMDB-DAGXNVNYSA-N"
"CCCCCC(O)\C=C\C=C/CCCCCCCC(=O)OC(COC(=O)CCCCCCCCC\C=C/C\C=C/C\C=C/CC)COP(O)(=O)OC1C(O)C(O)C(O)C(O)C1O","InChI=1S/C47H81O14P/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-20-23-26-30-34-40(49)58-36-39(37-59-62(56,57)61-47-45(54)43(52)42(51)44(53)46(47)55)60-41(50)35-31-27-24-21-18-19-22-25-29-33-38(48)32-28-6-4-2/h5,7,9-10,12-13,22,25,29,33,38-39,42-48,51-55H,3-4,6,8,11,14-21,23-24,26-28,30-32,34-37H2,1-2H3,(H,56,57)/b7-5-,10-9-,13-12-,25-22-,33-29+","PNQYEZOLWBRGSS-BNTKJWBQSA-N"
"CCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/C\C=C/CC1OC1C\C=C/CCCCC","InChI=1S/C42H74NO11P/c1-3-5-7-9-11-12-13-14-15-16-19-23-27-31-40(44)50-33-36(34-51-55(48,49)52-35-37(43)42(46)47)53-41(45)32-28-24-20-17-18-22-26-30-39-38(54-39)29-25-21-10-8-6-4-2/h17,20-22,25-26,36-39H,3-16,18-19,23-24,27-35,43H2,1-2H3,(H,46,47)(H,48,49)/b20-17-,25-21-,26-22-","IRZRWFRLFFLLBH-VEYJYJBBSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/C\C=C/CC1OC1C\C=C/CCCCC","InChI=1S/C44H78NO11P/c1-3-5-7-9-11-12-13-14-15-16-17-18-21-25-29-33-42(46)52-35-38(36-53-57(50,51)54-37-39(45)44(48)49)55-43(47)34-30-26-22-19-20-24-28-32-41-40(56-41)31-27-23-10-8-6-4-2/h19,22-24,27-28,38-41H,3-18,20-21,25-26,29-37,45H2,1-2H3,(H,48,49)(H,50,51)/b22-19-,27-23-,28-24-","PDTGPKOJLVEZOS-GZOSKYHJSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/C\C=C/C=C/C(O)C\C=C/CCCCC","InChI=1S/C44H78NO11P/c1-3-5-7-9-11-12-13-14-15-16-17-18-22-26-30-34-42(47)53-36-40(37-54-57(51,52)55-38-41(45)44(49)50)56-43(48)35-31-27-23-20-19-21-25-29-33-39(46)32-28-24-10-8-6-4-2/h20-21,23-25,28-29,33,39-41,46H,3-19,22,26-27,30-32,34-38,45H2,1-2H3,(H,49,50)(H,51,52)/b23-20-,25-21-,28-24-,33-29+","LPXLOPOQEBMATM-RCVWLJBVSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC","InChI=1S/C44H76NO11P/c1-3-5-7-8-9-10-11-12-13-14-15-19-22-25-29-33-42(46)52-35-38(36-53-57(50,51)54-37-39(45)44(48)49)55-43(47)34-30-26-23-20-17-16-18-21-24-28-32-41-40(56-41)31-27-6-4-2/h6,16,18,20,23-24,27-28,38-41H,3-5,7-15,17,19,21-22,25-26,29-37,45H2,1-2H3,(H,48,49)(H,50,51)/b18-16-,23-20-,27-6-,28-24-","RLRDYNVQBKTVOT-USROCRQDSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1CC","InChI=1S/C44H76NO11P/c1-3-5-6-7-8-9-10-11-12-15-18-21-24-27-30-33-42(46)52-35-38(36-53-57(50,51)54-37-39(45)44(48)49)55-43(47)34-31-28-25-22-19-16-13-14-17-20-23-26-29-32-41-40(4-2)56-41/h13,16-17,20,22,25-26,29,38-41H,3-12,14-15,18-19,21,23-24,27-28,30-37,45H2,1-2H3,(H,48,49)(H,50,51)/b16-13-,20-17-,25-22-,29-26-","LFNVSLLSSLUWLY-YYTNFJIHSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCC(O)CC","InChI=1S/C44H78NO11P/c1-3-5-6-7-8-9-10-11-12-16-19-22-25-28-31-34-42(47)53-36-40(37-54-57(51,52)55-38-41(45)44(49)50)56-43(48)35-32-29-26-23-20-17-14-13-15-18-21-24-27-30-33-39(46)4-2/h14-15,17-18,23-24,26-27,39-41,46H,3-13,16,19-22,25,28-38,45H2,1-2H3,(H,49,50)(H,51,52)/b17-14-,18-15-,26-23-,27-24-","BJOZIRUAPXXXAL-ULZSGHTGSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/C\C=C/C\C=C/C\C=C/CCCCCO","InChI=1S/C44H78NO11P/c1-2-3-4-5-6-7-8-9-13-16-19-22-25-28-31-34-42(47)53-37-40(38-54-57(51,52)55-39-41(45)44(49)50)56-43(48)35-32-29-26-23-20-17-14-11-10-12-15-18-21-24-27-30-33-36-46/h10,12,14,17-18,21,23,26,40-41,46H,2-9,11,13,15-16,19-20,22,24-25,27-39,45H2,1H3,(H,49,50)(H,51,52)/b12-10-,17-14-,21-18-,26-23-","SBJAIWLZUXOUCX-LYTQZAILSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/CCCCC","InChI=1S/C44H78NO11P/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-29-33-42(46)52-35-38(36-53-57(50,51)54-37-39(45)44(48)49)55-43(47)34-30-26-25-28-32-41-40(56-41)31-27-23-21-19-12-10-8-6-4-2/h12,19,23,25,27-28,38-41H,3-11,13-18,20-22,24,26,29-37,45H2,1-2H3,(H,48,49)(H,50,51)/b19-12-,27-23-,28-25-","QYKJQWICMYIGJW-YAQZKPSTSA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/C\C=C/CC","InChI=1S/C44H76NO11P/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-29-33-42(46)52-35-38(36-53-57(50,51)54-37-39(45)44(48)49)55-43(47)34-30-26-25-28-32-41-40(56-41)31-27-23-21-19-12-10-8-6-4-2/h6,8,12,19,23,25,27-28,38-41H,3-5,7,9-11,13-18,20-22,24,26,29-37,45H2,1-2H3,(H,48,49)(H,50,51)/b8-6-,19-12-,27-23-,28-25-","UZHYNONRHGKHKK-CEXVDVJOSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/CC1OC1C\C=C/CC","InChI=1S/C46H76NO11P/c1-3-5-7-8-9-10-11-12-13-14-18-21-24-27-31-35-44(48)54-37-40(38-55-59(52,53)56-39-41(47)46(50)51)57-45(49)36-32-28-25-22-19-16-15-17-20-23-26-30-34-43-42(58-43)33-29-6-4-2/h6,12-13,16-17,19-20,25-26,28-30,40-43H,3-5,7-11,14-15,18,21-24,27,31-39,47H2,1-2H3,(H,50,51)(H,52,53)/b13-12-,19-16-,20-17-,28-25-,29-6-,30-26-","QDQUELPWYILSFA-YQUQWSCKSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCC\C=C/CC1OC1C\C=C/C\C=C/CCCCC","InChI=1S/C44H76NO11P/c1-3-5-7-9-11-13-14-15-16-17-18-20-22-24-29-33-42(46)52-35-38(36-53-57(50,51)54-37-39(45)44(48)49)55-43(47)34-30-26-25-28-32-41-40(56-41)31-27-23-21-19-12-10-8-6-4-2/h12,15-16,19,23,25,27-28,38-41H,3-11,13-14,17-18,20-22,24,26,29-37,45H2,1-2H3,(H,48,49)(H,50,51)/b16-15-,19-12-,27-23-,28-25-","VJLPMPNSVYAYLT-PEWLDHNQSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(N)C(O)=O)OC(=O)CCCCCCCC(O)\C=C\C=C/CCCCC","InChI=1S/C42H76NO11P/c1-3-5-7-9-11-12-13-14-15-16-17-18-20-24-28-32-40(45)51-34-38(35-52-55(49,50)53-36-39(43)42(47)48)54-41(46)33-29-25-21-23-27-31-37(44)30-26-22-19-10-8-6-4-2/h14-15,19,22,26,30,37-39,44H,3-13,16-18,20-21,23-25,27-29,31-36,43H2,1-2H3,(H,47,48)(H,49,50)/b15-14-,22-19-,30-26+","PQYGYHLZQFYDNW-LMWOETAFSA-N"
"CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCC","InChI=1S/C34H69NO5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31(37)33(39)30(29-36)35-34(40)32(38)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h30-33,36-39H,3-29H2,1-2H3,(H,35,40)","RHIXBFQKTNYVCX-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C36H73NO5/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-34(40)36(42)37-32(31-38)35(41)33(39)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h32-35,38-41H,3-31H2,1-2H3,(H,37,42)","BBAFBDLICMHBNU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C38H77NO5/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-36(42)38(44)39-34(33-40)37(43)35(41)31-29-27-25-23-21-16-14-12-10-8-6-4-2/h34-37,40-43H,3-33H2,1-2H3,(H,39,44)","RYCCNLKFNBMCIU-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C40H81NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-38(44)40(46)41-36(35-42)39(45)37(43)33-31-29-27-25-23-16-14-12-10-8-6-4-2/h36-39,42-45H,3-35H2,1-2H3,(H,41,46)","XJDLBNONNWFVMN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C41H83NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-39(45)41(47)42-37(36-43)40(46)38(44)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h37-40,43-46H,3-36H2,1-2H3,(H,42,47)","LXCDJSOYWPJYDC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C42H85NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h38-41,44-47H,3-37H2,1-2H3,(H,43,48)","ZFUXWVVVWGWGPQ-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)C(O)CCCCCCCC\C=C/CCCCCCCCCCCC","InChI=1S/C42H83NO5/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(46)42(48)43-38(37-44)41(47)39(45)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h21-22,38-41,44-47H,3-20,23-37H2,1-2H3,(H,43,48)/b22-21-","DNHNBCDDNLBZMD-DQRAZIAOSA-N"
"CCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C34H67NO4/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-32(37)31(30-36)35-34(39)33(38)29-27-25-23-21-18-16-14-12-10-8-6-4-2/h26,28,31-33,36-38H,3-25,27,29-30H2,1-2H3,(H,35,39)/b28-26+","YWZGQPJRQXHVQX-BYCLXTJYSA-N"
"CCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C38H75NO4/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-37(42)38(43)39-35(34-40)36(41)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h30,32,35-37,40-42H,3-29,31,33-34H2,1-2H3,(H,39,43)/b32-30+","CFYLSUZUMMPFNC-NHQGMKOOSA-N"
"CCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C40H79NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-39(44)40(45)41-37(36-42)38(43)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h32,34,37-39,42-44H,3-31,33,35-36H2,1-2H3,(H,41,45)/b34-32+","FCCZDEAAQZWMGI-NWBJSICCSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C41H81NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(45)41(46)42-38(37-43)39(44)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h33,35,38-40,43-45H,3-32,34,36-37H2,1-2H3,(H,42,46)/b35-33+","SDFGVADIYWFGIV-LAPDZXRHSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(O)C(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C42H83NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(46)42(47)43-39(38-44)40(45)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h34,36,39-41,44-46H,3-33,35,37-38H2,1-2H3,(H,43,47)/b36-34+","WAYLDHLWVYQNSQ-JMUUFCRMSA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(CO)NC(=O)C(O)CCCCCCCC\C=C/CCCCCCCCCCCC","InChI=1S/C42H81NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(46)42(47)43-39(38-44)40(45)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h21-22,34,36,39-41,44-46H,3-20,23-33,35,37-38H2,1-2H3,(H,43,47)/b22-21-,36-34+","PYGVPCBXCGQXNA-SZHIUZGGSA-N"
"CCCCCCCCCCCCCCC\C=C\C(O)C(CO)NC(=O)C(O)CCCCCCCCCCCCCC","InChI=1S/C36H71NO4/c1-3-5-7-9-11-13-15-17-18-19-21-22-24-26-28-30-34(39)33(32-38)37-36(41)35(40)31-29-27-25-23-20-16-14-12-10-8-6-4-2/h28,30,33-35,38-40H,3-27,29,31-32H2,1-2H3,(H,37,41)/b30-28+","LGIPKUHFCLCHJK-SJCQXOIGSA-N"
"CCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C34H69NO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(38)35-31(30-36)34(39)32(37)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-32,34,36-37,39H,3-30H2,1-2H3,(H,35,38)","IVBULNXGVIHEKN-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C36H73NO4/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-35(40)37-33(32-38)36(41)34(39)30-28-26-24-22-20-16-14-12-10-8-6-4-2/h33-34,36,38-39,41H,3-32H2,1-2H3,(H,37,40)","IEZRNEGTKRQRFV-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C38H77NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-37(42)39-35(34-40)38(43)36(41)32-30-28-26-24-22-16-14-12-10-8-6-4-2/h35-36,38,40-41,43H,3-34H2,1-2H3,(H,39,42)","HFJJUTILDZFUOE-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C40H81NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-39(44)41-37(36-42)40(45)38(43)34-32-30-28-26-24-16-14-12-10-8-6-4-2/h37-38,40,42-43,45H,3-36H2,1-2H3,(H,41,44)","CIMNZQFRNXDRER-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C41H83NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-40(45)42-38(37-43)41(46)39(44)35-33-31-29-27-25-16-14-12-10-8-6-4-2/h38-39,41,43-44,46H,3-37H2,1-2H3,(H,42,45)","MBPABCUJJLJOFM-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCC","InChI=1S/C42H85NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-41(46)43-39(38-44)42(47)40(45)36-34-32-30-28-26-16-14-12-10-8-6-4-2/h39-40,42,44-45,47H,3-38H2,1-2H3,(H,43,46)","ZESJDNWGTANZCC-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCC(O)C(O)C(CO)NC(=O)CCCCCCCCC\C=C/CCCCCCCCCCCC","InChI=1S/C42H83NO4/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-41(46)43-39(38-44)42(47)40(45)36-34-32-30-28-26-16-14-12-10-8-6-4-2/h21-22,39-40,42,44-45,47H,3-20,23-38H2,1-2H3,(H,43,46)/b22-21-","DNXQPFZSRNGGHL-DQRAZIAOSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)C(O)CCCCCCCCCCCCCCCC","InChI=1S/C44H89NO4/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-27-29-31-33-35-37-39-43(48)45-41(40-46)44(49)42(47)38-36-34-32-30-28-26-18-16-14-12-10-8-6-4-2/h41-42,44,46-47,49H,3-40H2,1-2H3,(H,45,48)","DFLSLCOGWUJURA-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCC","InChI=1S/C32H63NO3/c1-3-5-7-9-11-13-15-16-18-20-22-24-26-28-32(36)33-30(29-34)31(35)27-25-23-21-19-17-14-12-10-8-6-4-2/h25,27,30-31,34-35H,3-24,26,28-29H2,1-2H3,(H,33,36)/b27-25+","PIVKMDKERPTVGC-IMVLJIQESA-N"
"CCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCC","InChI=1S/C33H65NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)34-31(30-35)32(36)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h26,28,31-32,35-36H,3-25,27,29-30H2,1-2H3,(H,34,37)/b28-26+","KXVLPPCAUYSNGY-BYCLXTJYSA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(CO)NC(=O)CCCCCCCCCCC","InChI=1S/C30H59NO3/c1-3-5-7-9-11-13-14-15-16-18-19-21-23-25-29(33)28(27-32)31-30(34)26-24-22-20-17-12-10-8-6-4-2/h23,25,28-29,32-33H,3-22,24,26-27H2,1-2H3,(H,31,34)/b25-23+","HXFPPRPLRSPNIB-WJTDDFOZSA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(CO)NC(=O)CCCCCCCCCCCCC","InChI=1S/C32H63NO3/c1-3-5-7-9-11-13-15-16-18-19-21-23-25-27-31(35)30(29-34)33-32(36)28-26-24-22-20-17-14-12-10-8-6-4-2/h25,27,30-31,34-35H,3-24,26,28-29H2,1-2H3,(H,33,36)/b27-25+","ZKRPGPZHULJLKJ-IMVLJIQESA-N"
"CCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C34H67NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h27,29,32-33,36-37H,3-26,28,30-31H2,1-2H3,(H,35,38)/b29-27+","YDNKGFDKKRUKPY-ORIPQNMZSA-N"
"CCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C35H69NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35(39)36-33(32-37)34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h28,30,33-34,37-38H,3-27,29,31-32H2,1-2H3,(H,36,39)/b30-28+","ICWGMOFDULMCFL-SJCQXOIGSA-N"
"CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C36H71NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h29,31,34-35,38-39H,3-28,30,32-33H2,1-2H3,(H,37,40)/b31-29+","VODZWWMEJITOND-OWWNRXNESA-N"
"CCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C37H73NO3/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-33-37(41)38-35(34-39)36(40)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h30,32,35-36,39-40H,3-29,31,33-34H2,1-2H3,(H,38,41)/b32-30+","SNMLDULQFHAZRC-NHQGMKOOSA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C38H75NO3/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-38(42)39-36(35-40)37(41)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h31,33,36-37,40-41H,3-30,32,34-35H2,1-2H3,(H,39,42)/b33-31+","XWBWIAOWSABHFI-QOSDPKFLSA-N"
"CCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C39H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-39(43)40-37(36-41)38(42)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h32,34,37-38,41-42H,3-31,33,35-36H2,1-2H3,(H,40,43)/b34-32+","FWXJRGLCUAXNLA-NWBJSICCSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C40H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h33,35,38-39,42-43H,3-32,34,36-37H2,1-2H3,(H,41,44)/b35-33+","KEPQASGDXIEOIL-LAPDZXRHSA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(CO)NC(=O)CCCCCCCCC\C=C/CCCCCCCCCC","InChI=1S/C40H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h19-20,33,35,38-39,42-43H,3-18,21-32,34,36-37H2,1-2H3,(H,41,44)/b20-19-,35-33+","OINPSEGEBLVAKZ-MBXZFYGDSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C41H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(45)42-39(38-43)40(44)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h34,36,39-40,43-44H,3-33,35,37-38H2,1-2H3,(H,42,45)/b36-34+","NAJHAHQNQCNWOP-JMUUFCRMSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C42H83NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h35,37,40-41,44-45H,3-34,36,38-39H2,1-2H3,(H,43,46)/b37-35+","ZJVVOYPTFQEGPH-MHAUTQJVSA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(CO)NC(=O)CCCCCCCCC\C=C/CCCCCCCCCCCC","InChI=1S/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h21-22,35,37,40-41,44-45H,3-20,23-34,36,38-39H2,1-2H3,(H,43,46)/b22-21-,37-35+","FUWLDBVRSLAFFJ-DBOQMASJSA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(CO)NC(=O)CCCCCCCCCCCCCCCC\C=C/C\C=C/CC","InChI=1S/C42H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h5,7,11,13,35,37,40-41,44-45H,3-4,6,8-10,12,14-34,36,38-39H2,1-2H3,(H,43,46)/b7-5-,13-11-,37-35+","VMOXUICDIMVPPG-UZRIYOBRSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C43H85NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-39-43(47)44-41(40-45)42(46)38-36-34-32-30-28-26-16-14-12-10-8-6-4-2/h36,38,41-42,45-46H,3-35,37,39-40H2,1-2H3,(H,44,47)/b38-36+","QHPYSHVSWAOLHS-BSKJHSHCSA-N"
"CCCCCCCCCCCCC\C=C/CCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C43H83NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-39-43(47)44-41(40-45)42(46)38-36-34-32-30-28-26-16-14-12-10-8-6-4-2/h22-23,36,38,41-42,45-46H,3-21,24-35,37,39-40H2,1-2H3,(H,44,47)/b23-22-,38-36+","YWTUDCXNLITZPX-HVZKQDKLSA-N"
"CCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C34H65NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-33(37)32(31-36)35-34(38)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h19,21,27,29,32-33,36-37H,3-18,20,22-26,28,30-31H2,1-2H3,(H,35,38)/b21-19+,29-27+","GMWIWVUTMCBDSP-ZNPGVSGMSA-N"
"CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C36H69NO3/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-36(40)37-34(33-38)35(39)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h21,23,29,31,34-35,38-39H,3-20,22,24-28,30,32-33H2,1-2H3,(H,37,40)/b23-21+,31-29+","WNPWDGNHTKGEDS-LLRUVXLESA-N"
"CCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C38H73NO3/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-38(42)39-36(35-40)37(41)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h23,25,31,33,36-37,40-41H,3-22,24,26-30,32,34-35H2,1-2H3,(H,39,42)/b25-23+,33-31+","NBSDZPNNDCXPFZ-CZIXKSQASA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C40H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-26-28-30-32-34-36-40(44)41-38(37-42)39(43)35-33-31-29-27-25-23-16-14-12-10-8-6-4-2/h25,27,33,35,38-39,42-43H,3-24,26,28-32,34,36-37H2,1-2H3,(H,41,44)/b27-25+,35-33+","AWTNSRHUZXWBCO-MXBGQREFSA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C41H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-25-27-29-31-33-35-37-41(45)42-39(38-43)40(44)36-34-32-30-28-26-24-16-14-12-10-8-6-4-2/h26,28,34,36,39-40,43-44H,3-25,27,29-33,35,37-38H2,1-2H3,(H,42,45)/b28-26+,36-34+","YVMFSKMDQVDKIS-QCVIXQMPSA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C42H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h27,29,35,37,40-41,44-45H,3-26,28,30-34,36,38-39H2,1-2H3,(H,43,46)/b29-27+,37-35+","ZCUCZYYSYGKQQV-GHQHJQBOSA-N"
"CCCCCCCCCCCC\C=C/CCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C42H79NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h21-22,27,29,35,37,40-41,44-45H,3-20,23-26,28,30-34,36,38-39H2,1-2H3,(H,43,46)/b22-21-,29-27+,37-35+","KADBCXSPXAVXJL-QWGNBJIWSA-N"
"CCCCCCCCC\C=C\CC\C=C\C(O)C(CO)NC(=O)CCCCCCCCCCCCCCCC\C=C/C\C=C/CC","InChI=1S/C42H77NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-42(46)43-40(39-44)41(45)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2/h5,7,11,13,27,29,35,37,40-41,44-45H,3-4,6,8-10,12,14-26,28,30-34,36,38-39H2,1-2H3,(H,43,46)/b7-5-,13-11-,29-27+,37-35+","QMPJMPWWIPZEKC-AREXDUQASA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C43H83NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-39-43(47)44-41(40-45)42(46)38-36-34-32-30-28-26-16-14-12-10-8-6-4-2/h28,30,36,38,41-42,45-46H,3-27,29,31-35,37,39-40H2,1-2H3,(H,44,47)/b30-28+,38-36+","SHGDZPJYRJJAQG-INARCNGISA-N"
"CCCCCCCCCCCCC\C=C/CCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C43H81NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-27-29-31-33-35-37-39-43(47)44-41(40-45)42(46)38-36-34-32-30-28-26-16-14-12-10-8-6-4-2/h22-23,28,30,36,38,41-42,45-46H,3-21,24-27,29,31-35,37,39-40H2,1-2H3,(H,44,47)/b23-22-,30-28+,38-36+","TUYKPRFCRLPEFF-QOESPIHISA-N"
"CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C44H85NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-44(48)45-42(41-46)43(47)39-37-35-33-31-29-27-16-14-12-10-8-6-4-2/h29,31,37,39,42-43,46-47H,3-28,30,32-36,38,40-41H2,1-2H3,(H,45,48)/b31-29+,39-37+","ZLOXRQZQPDQQBX-NBGJCBSLSA-N"
"CCCCCCCCCCCCCC\C=C/CCCCCCCCCC(=O)NC(CO)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C44H83NO3/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-40-44(48)45-42(41-46)43(47)39-37-35-33-31-29-27-16-14-12-10-8-6-4-2/h23-24,29,31,37,39,42-43,46-47H,3-22,25-28,30,32-36,38,40-41H2,1-2H3,(H,45,48)/b24-23-,31-29+,39-37+","ZGVFAJCEIZNYIA-XCDRWYSCSA-N"
"CCCCCCCCCCCCCCCCCC(=O)NC(CO)C(O)\C=C\CCCCCCCCCCCCCCC","InChI=1S/C38H75NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37(41)36(35-40)39-38(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31,33,36-37,40-41H,3-30,32,34-35H2,1-2H3,(H,39,42)/b33-31+","BDIIZHQNVIYLPJ-QOSDPKFLSA-N"
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"CCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCCCCC\C=C/CCCCCC","InChI=1S/C38H71O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(41)45-33-36(34-47-49(43,44)46-32-35(40)31-39)48-38(42)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h13-16,35-36,39-40H,3-12,17-34H2,1-2H3,(H,43,44)/b15-13-,16-14-","GHQNERCMPIDAAU-VMNXYWKNSA-N"
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"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCCCCC\C=C/CCCCCCCC","InChI=1S/C42H81O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h18,20,39-40,43-44H,3-17,19,21-38H2,1-2H3,(H,47,48)/b20-18-","ZEFGRNLJASLRBZ-ZZEZOPTASA-N"
"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC","InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,39-40,43-44H,3-11,13,15-17,19,21-38H2,1-2H3,(H,47,48)/b14-12-,20-18-","JPRWHUSRRGNLOV-MLWYYCKJSA-N"
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"CCCCCCCCCCCCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CC\C=C/C\C=C/C\C=C/C\C=C/C\C=C/C\C=C/CC","InChI=1S/C46H79O10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-46(50)56-44(42-55-57(51,52)54-40-43(48)39-47)41-53-45(49)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,21-22,26,28,32,34,43-44,47-48H,3-4,6,8-10,12,14-16,18,20,23-25,27,29-31,33,35-42H2,1-2H3,(H,51,52)/b7-5-,13-11-,19-17-,22-21-,28-26-,34-32-","CLQKBJHAUYGCOB-HSBBONCLSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCCCCC\C=C/CCCCCCCC","InChI=1S/C42H79O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17-20,39-40,43-44H,3-16,21-38H2,1-2H3,(H,47,48)/b19-17-,20-18-","DSNRWDQKZIEDDB-CLFAGFIQSA-N"
"CCCCCCCC\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCCCCC\C=C/C\C=C/CCCCC","InChI=1S/C42H77O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(45)49-37-40(38-51-53(47,48)50-36-39(44)35-43)52-42(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,17-20,39-40,43-44H,3-11,13,15-16,21-38H2,1-2H3,(H,47,48)/b14-12-,19-17-,20-18-","FSVTVWTVWNNIQX-RQOIEFAZSA-N"
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"CCCCC\C=C/C\C=C/CCCCCCCC(=O)OCC(COP(O)(=O)OCC(O)CO)OC(=O)CCCCCC\C=C/C\C=C/C\C=C/C\C=C/CC","InChI=1S/C44H75O10P/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34-36-44(48)54-42(40-53-55(49,50)52-38-41(46)37-45)39-51-43(47)35-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-19,21-22,24,41-42,45-46H,3-4,6,8-10,15-16,20,23,25-40H2,1-2H3,(H,49,50)/b7-5-,13-11-,14-12-,19-17-,21-18-,24-22-","IOSMTWQOMVSNAG-DMQHYRIXSA-N"
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"CCCCCCCCCCCCC\C=C\C(O)C(COP([O-])(=O)OCC[N+](C)(C)C)NC(=O)CCCCCCCCC\C=C/CCCCCCCCCCC","InChI=1S/C46H91N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-28-30-32-34-36-38-40-46(50)47-44(43-54-55(51,52)53-42-41-48(3,4)5)45(49)39-37-35-33-31-29-27-19-17-15-13-11-9-7-2/h23-24,37,39,44-45,49H,6-22,25-36,38,40-43H2,1-5H3,(H-,47,50,51,52)/b24-23-,39-37+","MNOXGTBPCAFFCM-SJWJHEOESA-N"
"CCCCCCCCCCCCCCCCCCCCCCCC(=O)NC(COP([O-])(=O)OCC[N+](C)(C)C)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C47H95N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(51)48-45(44-55-56(52,53)54-43-42-49(3,4)5)46(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h38,40,45-46,50H,6-37,39,41-44H2,1-5H3,(H-,48,51,52,53)/b40-38+","QEDPUVGSSDPBMD-OGSMZCTISA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(COP([O-])(=O)OCC[N+](C)(C)C)NC(=O)CCCCCCCCC\C=C/CCCCCCCCCCCC","InChI=1S/C47H93N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(51)48-45(44-55-56(52,53)54-43-42-49(3,4)5)46(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h24-25,38,40,45-46,50H,6-23,26-37,39,41-44H2,1-5H3,(H-,48,51,52,53)/b25-24-,40-38+","SUTDVWUQTJGTCQ-IMMYYDDQSA-N"
"CCCCCCCCCCCCC\C=C\C(O)C(COP([O-])(=O)OCC[N+](C)(C)C)NC(=O)CCCCCCCCCCCCCCCC\C=C/C\C=C/CC","InChI=1S/C47H91N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(51)48-45(44-55-56(52,53)54-43-42-49(3,4)5)46(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h8,10,14,16,38,40,45-46,50H,6-7,9,11-13,15,17-37,39,41-44H2,1-5H3,(H-,48,51,52,53)/b10-8-,16-14-,40-38+","SAFPQDBNJOKZOV-CBMSYKLZSA-N"
"CCCCCCCCCCCCC\C=C/CCCCCCCCCC(=O)NC(COP([O-])(=O)OCC[N+](C)(C)C)C(O)\C=C\CCCCCCCCCCCCC","InChI=1S/C48H95N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-48(52)49-46(45-56-57(53,54)55-44-43-50(3,4)5)47(51)41-39-37-35-33-31-29-19-17-15-13-11-9-7-2/h25-26,39,41,46-47,51H,6-24,27-38,40,42-45H2,1-5H3,(H-,49,52,53,54)/b26-25-,41-39+","PUPRMEGREMBBOX-CQKYAMJZSA-N"
"CCCCCCCCCCCCCCCC(=O)NC(COP([O-])(=O)OCC[N+](C)(C)C)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C39H77N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-38(42)37(36-47-48(44,45)46-35-34-41(3,4)5)40-39(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h22,24,30,32,37-38,42H,6-21,23,25-29,31,33-36H2,1-5H3,(H-,40,43,44,45)/b24-22+,32-30+","RYPRHPLEPBYJJE-CUCSTAJMSA-N"
"CCCCCCCCCCCCCCCCCCCCCC(=O)NC(COP([O-])(=O)OCC[N+](C)(C)C)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C45H89N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-27-29-31-33-35-37-39-45(49)46-43(42-53-54(50,51)52-41-40-47(3,4)5)44(48)38-36-34-32-30-28-26-19-17-15-13-11-9-7-2/h28,30,36,38,43-44,48H,6-27,29,31-35,37,39-42H2,1-5H3,(H-,46,49,50,51)/b30-28+,38-36+","UCLWWTCDZKLHGY-INARCNGISA-N"
"CCCCCCCCCCCCCCCCCCCCCCC(=O)NC(COP([O-])(=O)OCC[N+](C)(C)C)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C46H91N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-28-30-32-34-36-38-40-46(50)47-44(43-54-55(51,52)53-42-41-48(3,4)5)45(49)39-37-35-33-31-29-27-19-17-15-13-11-9-7-2/h29,31,37,39,44-45,49H,6-28,30,32-36,38,40-43H2,1-5H3,(H-,47,50,51,52)/b31-29+,39-37+","PENYJGUXTJATDH-NBGJCBSLSA-N"
"CCCCCCCCCCCC\C=C/CCCCCCCCCC(=O)NC(COP([O-])(=O)OCC[N+](C)(C)C)C(O)\C=C\CC\C=C\CCCCCCCCC","InChI=1S/C47H91N2O6P/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-47(51)48-45(44-55-56(52,53)54-43-42-49(3,4)5)46(50)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2/h24-25,30,32,38,40,45-46,50H,6-23,26-29,31,33-37,39,41-44H2,1-5H3,(H-,48,51,52,53)/b25-24-,32-30+,40-38+","BLBKGYQIQUVNRP-CLQBYUGCSA-N"
"CCCCCCCCCCCCCCCCCC(=O)NC(COP([O-])(=O)OCC[N+](C)(C)C)C(O)\C=C\CCCCCCCCCCCCCCC","InChI=1S/C43H87N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-42(46)41(40-51-52(48,49)50-39-38-45(3,4)5)44-43(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h34,36,41-42,46H,6-33,35,37-40H2,1-5H3,(H-,44,47,48,49)/b36-34+","RKSINWLCEVSJKG-JMUUFCRMSA-N"
"CSCC[C@@H]1N=C(O)[C@@H]2CCCN2C1=O","InChI=1S/C10H16N2O2S/c1-15-6-4-7-10(14)12-5-2-3-8(12)9(13)11-7/h7-8H,2-6H2,1H3,(H,11,13)/t7-,8-/m0/s1","VFVAGPWBFWJBMN-YUMQZZPRSA-N"
"O=C(O)CCCCCCCC(O)C(O)CCCCCCO","InChI=1S/C16H32O5/c17-13-9-5-4-7-11-15(19)14(18)10-6-2-1-3-8-12-16(20)21/h14-15,17-19H,1-13H2,(H,20,21)","MEHUJCGAYMDLEL-UHFFFAOYSA-N"
"COc1cc2c(cc1OC)C(=O)Cc1ccc3c(c1CN(C)CC2)OCO3","InChI=1S/C21H23NO5/c1-22-7-6-14-9-19(24-2)20(25-3)10-15(14)17(23)8-13-4-5-18-21(16(13)11-22)27-12-26-18/h4-5,9-10H,6-8,11-12H2,1-3H3","XPOJSWHIKCNLEQ-UHFFFAOYSA-N"
"C[N+]1(C)CCc2cc3c(c4c2C1Cc1ccc(O)cc1-4)OCO3","InChI=1S/C19H19NO3/c1-20(2)6-5-12-8-16-19(23-10-22-16)18-14-9-13(21)4-3-11(14)7-15(20)17(12)18/h3-4,8-9,15H,5-7,10H2,1-2H3/p+1","DQWPYNHMMBDKES-UHFFFAOYSA-O"
"COc1ccc2c(OC)c3ccoc3nc2c1OC","InChI=1S/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H3","SLSIBLKBHNKZTB-UHFFFAOYSA-N"
"Cn1c2c(c(=O)c3ccccc31)C[C@@H](O)C(C)(C)O2","InChI=1S/C15H17NO3/c1-15(2)12(17)8-10-13(18)9-6-4-5-7-11(9)16(3)14(10)19-15/h4-7,12,17H,8H2,1-3H3/t12-/m1/s1","HUPKGVIVTBASQC-GFCCVEGCSA-N"
"COc1c2c(nc3ccccc13)OC(C(C)(O)CO)C2","InChI=1S/C15H17NO4/c1-15(18,8-17)12-7-10-13(19-2)9-5-3-4-6-11(9)16-14(10)20-12/h3-6,12,17-18H,7-8H2,1-2H3","NETGEQWGGLFVRL-UHFFFAOYSA-N"
"COc1c2c(nc3occc13)C(CC=C(C)C)(OC)C(O)CC2","InChI=1S/C18H23NO4/c1-11(2)7-9-18(22-4)14(20)6-5-12-15(21-3)13-8-10-23-17(13)19-16(12)18/h7-8,10,14,20H,5-6,9H2,1-4H3","RNZIQNGNLJSLHV-UHFFFAOYSA-N"
"COc1c2c(nc3occc13)C(CCC(C)(C)O)(OC)C(O)CC2","InChI=1S/C18H25NO5/c1-17(2,21)8-9-18(23-4)13(20)6-5-11-14(22-3)12-7-10-24-16(12)19-15(11)18/h7,10,13,20-21H,5-6,8-9H2,1-4H3","KHGNFPUMBJSZSM-UHFFFAOYSA-N"
"COc1c2ccoc2nc2c(OC)c(O[C@@H]3O[C@H](C)[C@@H](O)[C@@H](O)[C@H]3O)ccc12","InChI=1S/C19H21NO8/c1-8-13(21)14(22)15(23)19(27-8)28-11-5-4-9-12(17(11)25-3)20-18-10(6-7-26-18)16(9)24-2/h4-8,13-15,19,21-23H,1-3H3/t8-,13-,14-,15-,19+/m1/s1","KJOKSAQCWDHTOL-JHHSONQDSA-N"
"COc1c2ccoc2nc2c(OC)c(O[C@H]3O[C@H](C)[C@@H](O)[C@H](O)[C@@H]3O)ccc12","InChI=1S/C19H21NO8/c1-8-13(21)14(22)15(23)19(27-8)28-11-5-4-9-12(17(11)25-3)20-18-10(6-7-26-18)16(9)24-2/h4-8,13-15,19,21-23H,1-3H3/t8-,13-,14+,15+,19-/m1/s1","KJOKSAQCWDHTOL-LBSYMCQFSA-N"
"C=C[C@H]1CN2CCC1CC2[C@@H](O)c1ccnc2ccccc12","InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14?,18?,19-/m0/s1","KMPWYEUPVWOPIM-PSWNHGHYSA-N"
"C=C[C@H]1CN2CCC1CC2[C@H](O)c1ccnc2ccccc12","InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14?,18?,19+/m0/s1","KMPWYEUPVWOPIM-KAGGUIQQSA-N"
"C/C(=C\COc1cc(O)nc2ccccc12)CCC(O)C(C)(C)O","InChI=1S/C19H25NO4/c1-13(8-9-17(21)19(2,3)23)10-11-24-16-12-18(22)20-15-7-5-4-6-14(15)16/h4-7,10,12,17,21,23H,8-9,11H2,1-3H3,(H,20,22)/b13-10+","PBWIOAMUZKICDN-JLHYYAGUSA-N"
"CCC1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc(O)ccc3nc2-1","InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3","HAWSQZCWOQZXHI-UHFFFAOYSA-N"
"COc1ccc2c(OC)c(C=O)c(O)nc2c1OC","InChI=1S/C13H13NO5/c1-17-9-5-4-7-10(12(9)19-3)14-13(16)8(6-15)11(7)18-2/h4-6H,1-3H3,(H,14,16)","VWYALKKHDZGUAU-UHFFFAOYSA-N"
"COc1cc(=O)n(C)c2c(OCC(O)C(C)(C)O)cccc12","InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3","IUPYLWAXGAJZQC-UHFFFAOYSA-N"
"COc1cc(=O)n(C)c2c(OCC3OC(C)(C)OC3(C)C)cccc12","InChI=1S/C19H25NO5/c1-18(2)15(24-19(3,4)25-18)11-23-13-9-7-8-12-14(22-6)10-16(21)20(5)17(12)13/h7-10,15H,11H2,1-6H3","HFXBOPGUQAUMHA-UHFFFAOYSA-N"
"CN1C(CC(=O)c2ccccc2)CCCC1C[C@H](O)c1ccccc1","InChI=1S/C22H27NO2/c1-23-19(15-21(24)17-9-4-2-5-10-17)13-8-14-20(23)16-22(25)18-11-6-3-7-12-18/h2-7,9-12,19-21,24H,8,13-16H2,1H3/t19?,20?,21-/m0/s1","MXYUKLILVYORSK-CBNMVNINSA-N"
"C1CCC([C@@]23CC(CC4CCCN[C@H]42)[C@@H]2CCCCN2C3)NC1","InChI=1S/C20H35N3/c1-3-9-21-18(8-1)20-13-16(12-15-6-5-10-22-19(15)20)17-7-2-4-11-23(17)14-20/h15-19,21-22H,1-14H2/t15?,16?,17-,18?,19+,20-/m0/s1","YUKCLPPRYNXRAF-GYKGFCEISA-N"
"O=C(/C=C/C=C/c1ccc2c(c1)OCO2)N1CCCCC1","InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2/b6-2+,7-3+","MXXWOMGUGJBKIW-YPCIICBESA-N"
"CN1CCCCC1c1ccc(-c2cccnc2)nc1.Cl.Cl.Cl","InChI=1S/C16H19N3.3ClH/c1-19-10-3-2-6-16(19)14-7-8-15(18-12-14)13-5-4-9-17-11-13;;;/h4-5,7-9,11-12,16H,2-3,6,10H2,1H3;3*1H","ZIHLGGJGJAYMRK-UHFFFAOYSA-N"
"O=c1cccc2n1C[C@@H]1CCCN3CCC[C@H]2[C@H]13","InChI=1S/C15H20N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h1,6-7,11-12,15H,2-5,8-10H2/t11-,12+,15-/m0/s1","MMCQRJPAMIHLQX-ZOWXZIJZSA-N"
"O=C1CCC[C@@H]2[C@H]3CCC[N+]4([O-])CCC[C@@H](CN12)[C@@H]34","InChI=1S/C15H24N2O2/c18-14-7-1-6-13-12-5-3-9-17(19)8-2-4-11(15(12)17)10-16(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-,17?/m0/s1","XVPBINOPNYFXID-LHDUFFHYSA-N"
"CC(C)C(O)(C(=O)OC[C@@H]1CC[N+]2([O-])CCC[C@@H]12)C(C)O","InChI=1S/C15H27NO5/c1-10(2)15(19,11(3)17)14(18)21-9-12-6-8-16(20)7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3/t11?,12-,13-,15?,16?/m0/s1","DLNWZIVYKQXLTN-IKZJNQNNSA-N"
"C[C@H]1C(=O)O[C@@H]2CCN3CC=C(COC(=O)C(C)(O)C1(C)O)C23","InChI=1S/C16H23NO6/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3/t9-,11+,12?,15?,16?/m0/s1","QVCMHGGNRFRMAD-XRQQVQNLSA-N"
"COC(C)C(O)(C(=O)OCC1=CCN2CCC(O)[C@@H]12)C(C)C","InChI=1S/C16H27NO5/c1-10(2)16(20,11(3)21-4)15(19)22-9-12-5-7-17-8-6-13(18)14(12)17/h5,10-11,13-14,18,20H,6-9H2,1-4H3/t11?,13?,14-,16?/m1/s1","LMFKRLGHEKVMNT-XUKJDLPSSA-N"
"C/C=C1/C[C@H](C)[C@](O)(CO)C(=O)OCC2=CCN3CC[C@@H](OC1=O)[C@@H]23","InChI=1S/C18H25NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,11,14-15,20,23H,5-10H2,1-2H3/b12-3-/t11-,14+,15+,18+/m0/s1","BCJMNZRQJAVDLD-VMOBWIEOSA-N"
"CC(C)[C@H]1C(=O)OC2CCN3CC=C(COC(=O)C(C)(O)C1(C)O)[C@H]23","InChI=1S/C18H27NO6/c1-10(2)13-15(20)25-12-6-8-19-7-5-11(14(12)19)9-24-16(21)18(4,23)17(13,3)22/h5,10,12-14,22-23H,6-9H2,1-4H3/t12?,13-,14+,17?,18?/m0/s1","SOODLZHDDSGRKL-YHRDOBKISA-N"
"CC(=O)O[C@@]1(C)C(=O)OC/C2=C/CN(C)CCC(OC(=O)[C@@](O)([C@H](C)O)C[C@H]1C)C2=O","InChI=1S/C21H31NO9/c1-12-10-21(28,13(2)23)19(27)30-16-7-9-22(5)8-6-15(17(16)25)11-29-18(26)20(12,4)31-14(3)24/h6,12-13,16,23,28H,7-11H2,1-5H3/b15-6-/t12-,13+,16?,20-,21+/m1/s1","MPJBVZKNLCGQHF-OXDPSKHNSA-N"
"C/C=C(/C)C(=O)O[C@H]1CCN2CC=C(COC(=O)C(O)(C(C)OC)C(C)(C)O)[C@H]12","InChI=1S/C21H33NO7/c1-7-13(2)18(23)29-16-9-11-22-10-8-15(17(16)22)12-28-19(24)21(26,14(3)27-6)20(4,5)25/h7-8,14,16-17,25-26H,9-12H2,1-6H3/b13-7-/t14?,16-,17+,21?/m0/s1","QHOZSLCIKHUPSU-UHLCJWRDSA-N"
"CN1C2CC(OC(=O)C(CO)c3ccccc3)CC1[C@H]1OC21","InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11?,12?,13?,14?,15-,16?/m1/s1","STECJAGHUSJQJN-BAPHQMLMSA-N"
"COc1ccc(C(=O)OC2C[C@@H]3CC[C@H](C2)N3C=O)cc1OC","InChI=1S/C17H21NO5/c1-21-15-6-3-11(7-16(15)22-2)17(20)23-14-8-12-4-5-13(9-14)18(12)10-19/h3,6-7,10,12-14H,4-5,8-9H2,1-2H3/t12-,13+,14?","KKWQKDSIGOIGIK-PBWFPOADSA-N"
"COc1ccc(C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)N3C)cc1OC","InChI=1S/C17H23NO4/c1-18-12-5-6-13(18)10-14(9-12)22-17(19)11-4-7-15(20-2)16(8-11)21-3/h4,7-8,12-14H,5-6,9-10H2,1-3H3/t12-,13+,14+","AEFPCFUCFQBXDQ-WDNDVIMCSA-N"
"CN1C2CC(OC(=O)C(CO)c3ccccc3)CC1C(O)C2","InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3","WTQYWNWRJNXDEG-UHFFFAOYSA-N"
"CN1[C@@H]2CC(OC(=O)C(CO)c3ccccc3)C[C@H]1C(O)C2","InChI=1S/C17H23NO4/c1-18-12-7-13(9-15(18)16(20)8-12)22-17(21)14(10-19)11-5-3-2-4-6-11/h2-6,12-16,19-20H,7-10H2,1H3/t12-,13?,14?,15+,16?/m1/s1","WTQYWNWRJNXDEG-GVNIGQRWSA-N"
"COc1ccc(C(=O)OC2CC3CCC(C2)N3C(C)=O)cc1OC","InChI=1S/C18H23NO5/c1-11(20)19-13-5-6-14(19)10-15(9-13)24-18(21)12-4-7-16(22-2)17(8-12)23-3/h4,7-8,13-15H,5-6,9-10H2,1-3H3","HZEOENYXYFFKIU-UHFFFAOYSA-N"
"COc1ccc(C(=O)OC2C[C@@H]3CC[C@H](C2)N3C(=O)N2[C@H]3CC[C@@H]2CC(OC(=O)c2ccc(OC)c(OC)c2)C3)cc1OC","InChI=1S/C33H40N2O9/c1-39-27-11-5-19(13-29(27)41-3)31(36)43-25-15-21-7-8-22(16-25)34(21)33(38)35-23-9-10-24(35)18-26(17-23)44-32(37)20-6-12-28(40-2)30(14-20)42-4/h5-6,11-14,21-26H,7-10,15-18H2,1-4H3/t21-,22+,23-,24+,25?,26?","JAXWQXGHHUWAKY-ICFBRBJFSA-N"
"CN1C2CC(OC(=O)C3CCC(C(=O)OC4CC5C6OC6C(C4)N5C)(c4ccccc4)c4ccccc43)CC1C1OC12","InChI=1S/C34H38N2O6/c1-35-24-14-19(15-25(35)29-28(24)41-29)39-32(37)22-12-13-34(18-8-4-3-5-9-18,23-11-7-6-10-21(22)23)33(38)40-20-16-26-30-31(42-30)27(17-20)36(26)2/h3-11,19-20,22,24-31H,12-17H2,1-2H3","DZKBRKKSFHBYIN-UHFFFAOYSA-N"
"COc1ccc(C(=O)OC2CC3CCC(C2)N3CCN2C3CCC2CC(OC(=O)c2ccc(OC)c(OC)c2)C3)cc1OC","InChI=1S/C34H44N2O8/c1-39-29-11-5-21(15-31(29)41-3)33(37)43-27-17-23-7-8-24(18-27)35(23)13-14-36-25-9-10-26(36)20-28(19-25)44-34(38)22-6-12-30(40-2)32(16-22)42-4/h5-6,11-12,15-16,23-28H,7-10,13-14,17-20H2,1-4H3","KOCZJZLYLZKBJT-UHFFFAOYSA-N"
"COc1cc(C(=O)O[C@@H]2C[C@@H]3CC[C@H](C2)N3)ccc1O","InChI=1S/C15H19NO4/c1-19-14-6-9(2-5-13(14)17)15(18)20-12-7-10-3-4-11(8-12)16-10/h2,5-6,10-12,16-17H,3-4,7-8H2,1H3/t10-,11+,12+","GWWGRYGNRKFSSX-GDNZZTSVSA-N"
"COc1ccc(C(=O)OC2C[C@@H]3CC[C@H](C2)N3O)cc1OC","InChI=1S/C16H21NO5/c1-20-14-6-3-10(7-15(14)21-2)16(18)22-13-8-11-4-5-12(9-13)17(11)19/h3,6-7,11-13,19H,4-5,8-9H2,1-2H3/t11-,12+,13?","QKXIPWXFQDIWOM-FUNVUKJBSA-N"
"COc1ccc2c(c1)[nH]c1c(C)nccc12","InChI=1S/C13H12N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-7,15H,1-2H3","BXNJHAXVSOCGBA-UHFFFAOYSA-N"
"O=C(O)[C@@H]1Cc2c([nH]c3ccccc23)C2CCC(=O)N21","InChI=1S/C15H14N2O3/c18-13-6-5-11-14-9(7-12(15(19)20)17(11)13)8-3-1-2-4-10(8)16-14/h1-4,11-12,16H,5-7H2,(H,19,20)/t11?,12-/m0/s1","NVWTUEWEKRBVPS-KIYNQFGBSA-N"
"CNCCCCc1cnc(C)c2[nH]c3ccccc3c12","InChI=1S/C17H21N3/c1-12-17-16(14-8-3-4-9-15(14)20-17)13(11-19-12)7-5-6-10-18-2/h3-4,8-9,11,18,20H,5-7,10H2,1-2H3","OMGIBPZQATWNBX-UHFFFAOYSA-N"
"c1cnc2c(C3NCCc4c3[nH]c3ccccc43)cccc2c1","InChI=1S/C20H17N3/c1-2-9-17-14(7-1)15-10-12-22-19(20(15)23-17)16-8-3-5-13-6-4-11-21-18(13)16/h1-9,11,19,22-23H,10,12H2","MFLKAHOBCOBBJX-UHFFFAOYSA-N"
"c1ccc2c3c([nH]c2c1)[C@@H]1C2CCC([C@H]4CCCN[C@@H]24)N1CC3","InChI=1S/C20H25N3/c1-2-6-16-12(4-1)13-9-11-23-17-8-7-15(20(23)19(13)22-16)18-14(17)5-3-10-21-18/h1-2,4,6,14-15,17-18,20-22H,3,5,7-11H2/t14-,15?,17?,18-,20+/m1/s1","SBGPASZOVGSOFJ-AFNOLGPFSA-N"
"O=C1CC2OCC=C3CN4CC[C@]56c7ccccc7N1C5[C@H]2[C@H]3C[C@H]46","InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16?,17-,19-,20?,21+/m0/s1","QMGVPVSNSZLJIA-XBPPHNHDSA-N"
"CN1C[C@H](CO)C=C2c3cccc4[nH]cc(c34)C[C@H]21","InChI=1S/C16H18N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-5,7,10,15,17,19H,6,8-9H2,1H3/t10-,15-/m1/s1","BIXJFIJYBLJTMK-MEBBXXQBSA-N"
"CN1C[C@H](CO)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21","InChI=1S/C16H20N2O/c1-18-8-10(9-19)5-13-12-3-2-4-14-16(12)11(7-17-14)6-15(13)18/h2-4,7,10,13,15,17,19H,5-6,8-9H2,1H3/t10-,13-,15-/m1/s1","UFKTZIXVYHGAES-WDBKCZKBSA-N"
"CC(C)[C@@]1(N=C(O)[C@@H]2C[C@@H]3c4cccc5[nH]cc(c45)C[C@H]3N(C)C2)O[C@@]2(O)[C@@H]3CCCN3C(=O)[C@H](Cc3ccccc3)N2C1=O","InChI=1S/C35H41N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,18,20,23,25,27-29,36,44H,8,13-17,19H2,1-3H3,(H,37,41)/t23-,25-,27-,28+,29+,34-,35+/m1/s1","DEQITUUQPICUMR-HJPBWRTMSA-N"
"C/C=C1/CN2[C@H]3C[C@@H]1C1(C(=O)OC)[C@@H]2C[C@]2(c4ccccc4NC32)[C@H]1O","InChI=1S/C21H24N2O3/c1-3-11-10-23-15-8-13(11)21(19(25)26-2)16(23)9-20(18(21)24)12-6-4-5-7-14(12)22-17(15)20/h3-7,13,15-18,22,24H,8-10H2,1-2H3/b11-3-/t13-,15-,16-,17?,18+,20+,21?/m0/s1","RLUORQGMBKDXPO-GHBMVFGLSA-N"
"COC(=O)C1=CO[C@@H](C)C2CN3CC[C@]4(C(O)=Nc5c4ccc(OC)c5OC)C3CC12","InChI=1S/C23H28N2O6/c1-12-14-10-25-8-7-23(18(25)9-13(14)15(11-31-12)21(26)30-4)16-5-6-17(28-2)20(29-3)19(16)24-22(23)27/h5-6,11-14,18H,7-10H2,1-4H3,(H,24,27)/t12-,13?,14?,18?,23+/m0/s1","TTZWEOINXHJHCY-XHNSDYIJSA-N"
"COC(=O)C1=CO[C@@H](C)[C@@H]2CN3CC[C@@]4(C(O)=Nc5c4ccc(OC)c5OC)[C@@H]3C[C@H]12","InChI=1S/C23H28N2O6/c1-12-14-10-25-8-7-23(18(25)9-13(14)15(11-31-12)21(26)30-4)16-5-6-17(28-2)20(29-3)19(16)24-22(23)27/h5-6,11-14,18H,7-10H2,1-4H3,(H,24,27)/t12-,13-,14-,18-,23-/m0/s1","TTZWEOINXHJHCY-AYEVVIACSA-N"
"CC[C@]1(O)CC2CN(CCc3c([nH]c4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C=O)C3C45CCN4CC=C[C@@](CC)(C(OC(C)=O)[C@]3(O)C(=O)OC)[C@H]45)C2)C1.O=S(=O)(O)O","InChI=1S/C46H56N4O10.H2O4S/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(14-18-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-20-31-34(21-35(32)57-4)50(26-51)38-44(31)16-19-49-17-11-15-43(8-2,37(44)49)39(60-27(3)52)46(38,56)41(54)59-6;1-5(2,3)4/h9-13,15,20-21,26,28,37-39,47,55-56H,7-8,14,16-19,22-25H2,1-6H3;(H2,1,2,3,4)/t28?,37-,38?,39?,42-,43+,44?,45-,46-;/m0./s1","AQTQHPDCURKLKT-JTHKZTNMSA-N"
"CC[C@]1(O)C[C@H]2CN(CCc3c([nH]c4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C)[C@H]3[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]5(CC)C=CCN6CC[C@]43[C@@H]65)C2)C1.O=S(=O)(O)O","InChI=1S/C46H58N4O9.H2O4S/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7;1-5(2,3)4/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3;(H2,1,2,3,4)/t28-,37+,38-,39-,42+,43-,44-,45+,46+;/m1./s1","KDQAABAKXDWYSZ-JKDPCDLQSA-N"
"CN=C(O)Oc1ccc2c(c1)[C@]1(C)CCN(C)[C@@H]1N2C","InChI=1S/C15H21N3O2/c1-15-7-8-17(3)13(15)18(4)12-6-5-10(9-11(12)15)20-14(19)16-2/h5-6,9,13H,7-8H2,1-4H3,(H,16,19)/t13-,15+/m1/s1","PIJVFDBKTWXHHD-HIFRSBDPSA-N"
"CN(C)CCc1ccc(O)cc1","InChI=1S/C10H15NO/c1-11(2)8-7-9-3-5-10(12)6-4-9/h3-6,12H,7-8H2,1-2H3","KUBCEEMXQZUPDQ-UHFFFAOYSA-N"
"CO[C@@H]1C=C[C@@]23c4cc5c(cc4CO[C@]2(O)CN(C)[C@@H]3C1)OCO5","InChI=1S/C18H21NO5/c1-19-9-18(20)17(4-3-12(21-2)6-16(17)19)13-7-15-14(22-10-23-15)5-11(13)8-24-18/h3-5,7,12,16,20H,6,8-10H2,1-2H3/t12-,16-,17+,18-/m1/s1","YLWAQARRNQVEHD-GQAVTEOGSA-N"
"COc1ccc2c3c1O[C@H]1C[C@@H](O)C=C[C@@]31CCN(C)C2","InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1","ASUTZQLVASHGKV-JDFRZJQESA-N"
"CN1CCC2=C[C@@H](O)[C@@H]3OC(=O)c4cc5c(cc4C3[C@H]21)OCO5","InChI=1S/C17H17NO5/c1-18-3-2-8-4-11(19)16-14(15(8)18)9-5-12-13(22-7-21-12)6-10(9)17(20)23-16/h4-6,11,14-16,19H,2-3,7H2,1H3/t11-,14?,15+,16+/m1/s1","DGQPIOQRPAGNGB-IXFHYDNRSA-N"
"COc1ccc2c(c1O)-c1ccccc1CCN(C)C2","InChI=1S/C17H19NO2/c1-18-10-9-12-5-3-4-6-14(12)16-13(11-18)7-8-15(20-2)17(16)19/h3-8,19H,9-11H2,1-2H3","ZGZXDJPQXTUPSG-UHFFFAOYSA-N"
"O[C@H]1CC2CCN3Cc4cc5c(cc4[C@H]([C@@H]1O)[C@@H]23)OCO5","InChI=1S/C16H19NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h4-5,8,11,14-16,18-19H,1-3,6-7H2/t8?,11-,14-,15+,16+/m0/s1","VJILFEGOWCJNIK-WIOQNRRMSA-N"
"COc1cc2c(cc1OC)-c1c(OC)c(OC)cc3c1C(C2)N(C)CC3","InChI=1S/C21H25NO4/c1-22-7-6-12-9-18(25-4)21(26-5)20-14-11-17(24-3)16(23-2)10-13(14)8-15(22)19(12)20/h9-11,15H,6-8H2,1-5H3","RUZIUYOSRDWYQF-UHFFFAOYSA-N"
"COc1cc2c(cc1OC)-c1c3c(c(OC)c4c1C(C2)NCC4)OCO3","InChI=1S/C20H21NO5/c1-22-14-7-10-6-13-16-11(4-5-21-13)18(24-3)20-19(25-9-26-20)17(16)12(10)8-15(14)23-2/h7-8,13,21H,4-6,9H2,1-3H3","YYPGFVKLIUMIEL-UHFFFAOYSA-N"
"CN1CCc2cc3c(c4c2[C@H]1Cc1ccccc1-4)OCO3","InChI=1S/C18H17NO2/c1-19-7-6-12-9-15-18(21-10-20-15)17-13-5-3-2-4-11(13)8-14(19)16(12)17/h2-5,9,14H,6-8,10H2,1H3/t14-/m1/s1","JCTYWRARKVGOBK-CQSZACIVSA-N"
"COc1cc2c3c(c1OC)C1(C=CC(=O)C=C1)CC3NCC2","InChI=1S/C18H19NO3/c1-21-14-9-11-5-8-19-13-10-18(6-3-12(20)4-7-18)16(15(11)13)17(14)22-2/h3-4,6-7,9,13,19H,5,8,10H2,1-2H3","OGJKMZVUJJYWKO-UHFFFAOYSA-N"
"C[n+]1cc2c3c(ccc2c2ccc4cc5c(cc4c21)OCO5)OCO3","InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1","INVGWHRKADIJHF-UHFFFAOYSA-N"
"COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3c(cc4c(c3Oc3cc5c(cc3OC)CCN(C)[C@@H]5C2)OCO4)CCN1C","InChI=1S/C37H38N2O6/c1-38-13-11-24-18-31(41-4)33-20-27(24)28(38)16-23-7-10-30(40-3)32(17-23)44-26-8-5-22(6-9-26)15-29-35-25(12-14-39(29)2)19-34-36(37(35)45-33)43-21-42-34/h5-10,17-20,28-29H,11-16,21H2,1-4H3/t28-,29+/m1/s1","YVPXVXANRNDGTA-WDYNHAJCSA-N"
"COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(O)c(c3CCN1C)Oc1cc3c(cc1OC)CCN(C)[C@@H]3C2","InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(42-4)34-20-27(24)29(38)17-23-8-11-31(41-3)33(18-23)44-25-9-6-22(7-10-25)16-30-28-21-35(43-5)36(40)37(45-34)26(28)13-15-39(30)2/h6-11,18-21,29-30,40H,12-17H2,1-5H3/t29-,30+/m1/s1","CASHVZNATRNXDE-IHLOFXLRSA-N"
"COc1ccc2cc1Oc1ccc(cc1)CC1=NCCc3cc(OC)c(cc31)Oc1c(OC)c(OC)c(OC)c3c1[C@@H](C2)N(C)CC3","InChI=1S/C38H40N2O7/c1-40-16-14-26-34-29(40)18-23-9-12-30(41-2)32(19-23)46-25-10-7-22(8-11-25)17-28-27-21-33(31(42-3)20-24(27)13-15-39-28)47-36(34)38(45-6)37(44-5)35(26)43-4/h7-12,19-21,29H,13-18H2,1-6H3/t29-/m1/s1","YWNUNVSMOKMJMG-GDLZYMKVSA-N"
"COc1cc2c(cc1OC)[C@H]1Cc3ccc(OC)c(OC)c3CN1CC2","InChI=1S/C21H25NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,10-11,17H,7-9,12H2,1-4H3/t17-/m1/s1","AEQDJSLRWYMAQI-QGZVFWFLSA-N"
"COc1ccc2c(c1O)-c1c(O)c(OC)cc3c1C(C2)[N+](C)(C)CC3","InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1","YLRXAIKMLINXQY-UHFFFAOYSA-O"
"COc1cc2c(cc1OC)-c1cc3ccc(OC)c(OC)c3c[n+]1CC2","InChI=1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1","QUCQEUCGKKTEBI-UHFFFAOYSA-N"
"CN1CCc2cc3c(cc2[C@H]1[C@@H]1OC(=O)c2c1ccc1c2OCO1)OCO3","InChI=1S/C20H17NO6/c1-21-5-4-10-6-14-15(25-8-24-14)7-12(10)17(21)18-11-2-3-13-19(26-9-23-13)16(11)20(22)27-18/h2-3,6-7,17-18H,4-5,8-9H2,1H3/t17-,18+/m0/s1","IYGYMKDQCDOMRE-ZWKOTPCHSA-N"
"COc1cc2c(cc1O)CC1c3c(cc(O)c(OC)c3-2)CCN1C","InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3","LZJRNLRASBVRRX-UHFFFAOYSA-N"
"Oc1ccc(CC2NCCc3cc(O)c(O)cc32)cc1O","InChI=1S/C16H17NO4/c18-13-2-1-9(6-14(13)19)5-12-11-8-16(21)15(20)7-10(11)3-4-17-12/h1-2,6-8,12,17-21H,3-5H2","ABXZOXDTHTTZJW-UHFFFAOYSA-N"
"COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2","InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1","YBHILYKTIRIUTE-UHFFFAOYSA-N"
"COc1ccc(C(=O)C2=NCCc3cc(OC)c(OC)cc32)cc1OC","InChI=1S/C20H21NO5/c1-23-15-6-5-13(10-16(15)24-2)20(22)19-14-11-18(26-4)17(25-3)9-12(14)7-8-21-19/h5-6,9-11H,7-8H2,1-4H3","BSYFCWAPBDZVAX-UHFFFAOYSA-N"
"COc1ccc2c(c1OC)C(=O)O[C@H]2[C@@H]1c2cc3c(cc2CCN1C)OCO3","InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19+/m0/s1","JZUTXVTYJDCMDU-RBUKOAKNSA-N"
"O=C(O)c1cccc2nc3ccccc3nc12","InChI=1S/C13H8N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7H,(H,16,17)","JGCSKOVQDXEQHI-UHFFFAOYSA-N"
"COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(c(OC)cc3CCN1C)Oc1c(OC)c(OC)c(OC)c3c1[C@H](C2)N(C)CC3","InChI=1S/C39H44N2O7/c1-40-16-14-25-21-32(43-4)34-22-28(25)29(40)18-23-8-11-26(12-9-23)47-33-20-24(10-13-31(33)42-3)19-30-35-27(15-17-41(30)2)36(44-5)38(45-6)39(46-7)37(35)48-34/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1","FUZMQNZACIFDBL-KYJUHHDHSA-N"
"COc1cc(C[C@@H]2c3cc(OC)c(OC)cc3CCN2C)c(Oc2cc3c(cc2OC)-c2c(O)c(OC)cc4c2[C@H](C3)N(C)CC4)cc1OC","InChI=1S/C40H46N2O8/c1-41-11-9-22-15-31(44-3)33(46-5)19-26(22)28(41)14-25-18-32(45-4)35(48-7)21-30(25)50-36-17-24-13-29-38-23(10-12-42(29)2)16-37(49-8)40(43)39(38)27(24)20-34(36)47-6/h15-21,28-29,43H,9-14H2,1-8H3/t28-,29+/m1/s1","DRACRVAKPKYPSB-WDYNHAJCSA-N"
"COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1[C@@H](N(C)Cc1ccccc1O)CC2","InChI=1S/C28H31NO6/c1-29(16-18-8-6-7-9-22(18)30)21-12-10-17-14-25(33-3)27(34-4)28(35-5)26(17)19-11-13-24(32-2)23(31)15-20(19)21/h6-9,11,13-15,21,30H,10,12,16H2,1-5H3/t21-/m0/s1","SOFSXTKPGSIDCI-NRFANRHFSA-N"
"CC[C@H]1CN2CCc3cc(OC)c(OC)cc3[C@@H]2C[C@@H]1C[C@H]1NCCc2cc(OC)c(OC)cc21","InChI=1S/C29H40N2O4/c1-6-18-17-31-10-8-20-14-27(33-3)29(35-5)16-23(20)25(31)12-21(18)11-24-22-15-28(34-4)26(32-2)13-19(22)7-9-30-24/h13-16,18,21,24-25,30H,6-12,17H2,1-5H3/t18-,21-,24+,25-/m0/s1","AUVVAXYIELKVAI-CKBKHPSWSA-N"
"COc1ccc(CC2c3cc(OC)c(OC)cc3CCN2C)cc1OC","InChI=1S/C21H27NO4/c1-22-9-8-15-12-20(25-4)21(26-5)13-16(15)17(22)10-14-6-7-18(23-2)19(11-14)24-3/h6-7,11-13,17H,8-10H2,1-5H3","KGPAYJZAMGEDIQ-UHFFFAOYSA-N"
"COc1ccc2c(c1OC)C(=O)O[C@H]2[C@H]1c2c(cc3c(c2OC)OCO3)CCN1C","InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3/t17-,18-/m1/s1","AKNNEGZIBPJZJG-QZTJIDSGSA-N"
"COC1=CC23CCN(C)C(Cc4ccc(OC)c(O)c42)C3=CC1=O","InChI=1S/C19H21NO4/c1-20-7-6-19-10-16(24-3)14(21)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9-10,13,22H,6-8H2,1-3H3","GVTRUVGBZQJVTF-UHFFFAOYSA-N"
"COC1=C[C@@H]2[C@@H]3Cc4ccc(OC)c(O)c4[C@]2(CCN3C)CC1=O","InChI=1S/C19H23NO4/c1-20-7-6-19-10-14(21)16(24-3)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9,12-13,22H,6-8,10H2,1-3H3/t12-,13+,19-/m1/s1","INYYVPJSBIVGPH-QHRIQVFBSA-N"
"COc1cc2c3c(c1O)-c1c(cccc1OC)CC3[N+](C)(C)CC2","InChI=1S/C20H23NO3/c1-21(2)9-8-13-11-16(24-4)20(22)19-17(13)14(21)10-12-6-5-7-15(23-3)18(12)19/h5-7,11,14H,8-10H2,1-4H3/p+1","LIWPWIJZEAZVBL-UHFFFAOYSA-O"
"CN[C@H]1CCc2cc(OC)c(OC)c(OC)c2-c2ccc(OC)c(=O)cc21","InChI=1S/C21H25NO5/c1-22-15-8-6-12-10-18(25-3)20(26-4)21(27-5)19(12)13-7-9-17(24-2)16(23)11-14(13)15/h7,9-11,15,22H,6,8H2,1-5H3/t15-/m0/s1","NNJPGOLRFBJNIW-HNNXBMFYSA-N"
"C[O+]=C1C2=CN(C)CCC2=CC2=C1OCO2","InChI=1S/C12H14NO3/c1-13-4-3-8-5-10-12(16-7-15-10)11(14-2)9(8)6-13/h5-6H,3-4,7H2,1-2H3/q+1","KGZAOSLMBZSSTE-UHFFFAOYSA-N"
"CCC1[C@@H]2CC3C4N(C)c5ccccc5C45C[C@@H](C2[C@@H]5O)N3[C@@H]1O","InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10?,11-,14?,15-,16?,17?,18-,19+,20?/m0/s1","CJDRUOGAGYHKKD-PSOGFBMNSA-N"
"CC[C@H]1C2CC3C4N(C)c5ccccc5[C@]45C[C@@H](C2C5O)N3[C@@H]1O","InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11?,14?,15-,16?,17?,18?,19+,20+/m0/s1","CJDRUOGAGYHKKD-GHVJXGQCSA-N"
"C/C=C1/CN2CC[C@]34C(=C(C=O)[C@H]1C[C@H]23)Nc1c(O)cccc14","InChI=1S/C19H20N2O2/c1-2-11-9-21-7-6-19-14-4-3-5-15(23)17(14)20-18(19)13(10-22)12(11)8-16(19)21/h2-5,10,12,16,20,23H,6-9H2,1H3/b11-2-/t12-,16-,19+/m0/s1","JDOFCMASVRMYJU-JYTRXFNOSA-N"
"C/C=C1/CN2CCC34C(=C(C=O)[C@H]1C[C@H]23)Nc1c(O)cccc14","InChI=1S/C19H20N2O2/c1-2-11-9-21-7-6-19-14-4-3-5-15(23)17(14)20-18(19)13(10-22)12(11)8-16(19)21/h2-5,10,12,16,20,23H,6-9H2,1H3/b11-2-/t12-,16-,19?/m0/s1","JDOFCMASVRMYJU-PCKYSSEZSA-N"
"COC(=O)C1CC23CCCN4CCC5(c6ccccc6NC15CC2)[C@@H]43","InChI=1S/C21H26N2O2/c1-25-17(24)15-13-19-7-4-11-23-12-10-20(18(19)23)14-5-2-3-6-16(14)22-21(15,20)9-8-19/h2-3,5-6,15,18,22H,4,7-13H2,1H3/t15?,18-,19?,20?,21?/m0/s1","IYLRRIUNGGQRTN-GNONBNCHSA-N"
"COC(=O)C1C[C@]23CCCN4CCC5(c6ccccc6N[C@@]15C2C)[C@@H]43","InChI=1S/C21H26N2O2/c1-13-19-8-5-10-23-11-9-20(18(19)23)14-6-3-4-7-16(14)22-21(13,20)15(12-19)17(24)25-2/h3-4,6-7,13,15,18,22H,5,8-12H2,1-2H3/t13?,15?,18-,19+,20?,21-/m0/s1","CZLWGXKWXLVFJU-ZTNIHGJBSA-N"
"CC[C@]12CCCN3CCC4(C(=C(C(=O)OC)C1)Nc1ccccc14)C32","InChI=1S/C21H26N2O2/c1-3-20-9-6-11-23-12-10-21(19(20)23)15-7-4-5-8-16(15)22-17(21)14(13-20)18(24)25-2/h4-5,7-8,19,22H,3,6,9-13H2,1-2H3/t19?,20-,21?/m0/s1","GIGFIWJRTMBSRP-KBWCOIMZSA-N"
"CCC12CCCN3CCC4(C(=C(C(=O)OC)C1)[NH2+]c1ccccc14)[C@@H]32","InChI=1S/C21H26N2O2/c1-3-20-9-6-11-23-12-10-21(19(20)23)15-7-4-5-8-16(15)22-17(21)14(13-20)18(24)25-2/h4-5,7-8,19,22H,3,6,9-13H2,1-2H3/p+1/t19-,20?,21?/m0/s1","GIGFIWJRTMBSRP-MWXLCCTBSA-O"
"C/C=C1/CN2CCC34c5ccccc5NC3[C@H](CO)[C@H]1CC24","InChI=1S/C19H24N2O/c1-2-12-10-21-8-7-19-15-5-3-4-6-16(15)20-18(19)14(11-22)13(12)9-17(19)21/h2-6,13-14,17-18,20,22H,7-11H2,1H3/b12-2-/t13-,14+,17?,18?,19?/m0/s1","GNFMIIWVXDLWDU-QDWGTDOJSA-N"
"C/C=C1/C[N+]2(C)C3CC1C(CO)C2Cc1c3[nH]c2ccccc12","InChI=1S/C20H25N2O/c1-3-12-10-22(2)18-9-15-13-6-4-5-7-17(13)21-20(15)19(22)8-14(12)16(18)11-23/h3-7,14,16,18-19,21,23H,8-11H2,1-2H3/q+1/b12-3-","KRTATNOTKFNEFT-BASWHVEKSA-N"
"C/C=C1/CN2CCC34C(=C(C=O)[C@H]1CC23)Nc1ccccc14","InChI=1S/C19H20N2O/c1-2-12-10-21-8-7-19-15-5-3-4-6-16(15)20-18(19)14(11-22)13(12)9-17(19)21/h2-6,11,13,17,20H,7-10H2,1H3/b12-2-/t13-,17?,19?/m0/s1","VFUITWPFKLGEQA-IJEMKVKBSA-N"
"C=CC1CN2CCC1CC2[C@H](O)c1ccnc2ccc(OC)cc12","InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13?,14?,19?,20-/m1/s1","LOUPRKONTZGTKE-WGFDLZGGSA-N"
"CN1c2ccccc2C(=O)N2CCc3c([nH]c4ccccc34)[C@H]21","InChI=1S/C19H17N3O/c1-21-16-9-5-3-7-14(16)19(23)22-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-9,18,20H,10-11H2,1H3/t18-/m0/s1","TXDUTHBFYKGSAH-SFHVURJKSA-N"
"C/C=C1\CN2CCC34C(=C(C(=O)OC)[C@H]1C[C@@H]23)Nc1c(O)cccc14","InChI=1S/C20H22N2O3/c1-3-11-10-22-8-7-20-13-5-4-6-14(23)17(13)21-18(20)16(19(24)25-2)12(11)9-15(20)22/h3-6,12,15,21,23H,7-10H2,1-2H3/b11-3+/t12-,15+,20?/m0/s1","FAJVFJABOWWACZ-XMOBNUJDSA-N"
"COC(=O)[C@H]1[C@H]2C[C@H]3c4[nH]c5cc(OC)ccc5c4CCN3C[C@H]2C[C@@H](OC(=O)c2cc(OC)c(OC)c(OC)c2)[C@@H]1OC","InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24+,27-,28+,31+/m1/s1","QEVHRUUCFGRFIF-VPHNHGCZSA-N"
"O=C(O)[C@H]1[C@@H](O)CCC2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21","InChI=1S/C20H24N2O3/c23-17-6-5-11-10-22-8-7-13-12-3-1-2-4-15(12)21-19(13)16(22)9-14(11)18(17)20(24)25/h1-4,11,14,16-18,21,23H,5-10H2,(H,24,25)/t11?,14-,16-,17-,18+/m0/s1","AADVZSXPNRLYLV-COAIYVANSA-N"
"COC(=O)[C@H]1[C@@H](O)CC[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21","InChI=1S/C21H26N2O3/c1-26-21(25)19-15-10-17-20-14(13-4-2-3-5-16(13)22-20)8-9-23(17)11-12(15)6-7-18(19)24/h2-5,12,15,17-19,22,24H,6-11H2,1H3/t12-,15+,17+,18+,19-/m1/s1","BLGXFZZNTVWLAY-FJDMERLMSA-N"
"COC(=O)C1=CO[C@@H](C)[C@@H]2CN3CCc4c([nH]c5cc(OC)ccc45)[C@@H]3C[C@H]12","InChI=1S/C22H26N2O4/c1-12-17-10-24-7-6-15-14-5-4-13(26-2)8-19(14)23-21(15)20(24)9-16(17)18(11-28-12)22(25)27-3/h4-5,8,11-12,16-17,20,23H,6-7,9-10H2,1-3H3/t12-,16-,17-,20-/m0/s1","KXEMQEGRZWUKJS-RURTYGRKSA-N"
"Cc1cc2nc3c(O)nc(=O)nc-3n(CC(O)C(O)C(O)CO)c2cc1C","InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)","AUNGANRZJHBGPY-UHFFFAOYSA-N"
"C[C@@H]1CC[C@H]2[C@H](C)[C@H]3CC[C@]4(O)[C@@H](C[C@H]5[C@H]4C[C@@H](O)[C@H]4C[C@H](O)CC[C@@]45C)[C@@H]3CN2C1","InChI=1S/C27H45NO3/c1-15-4-5-24-16(2)18-7-9-27(31)20(19(18)14-28(24)13-15)11-21-22(27)12-25(30)23-10-17(29)6-8-26(21,23)3/h15-25,29-31H,4-14H2,1-3H3/t15-,16-,17-,18-,19-,20+,21+,22-,23-,24+,25-,26-,27+/m1/s1","NQGYOUYEGZOZBN-QAJIXOGVSA-N"
"CC1CC[C@@H]2N(C1)CC1C(CC[C@H]3[C@@H]4CC(=O)[C@H]5CC(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)[C@H]4C[C@@H]13)[C@]2(C)O","InChI=1S/C33H53NO8/c1-16-4-7-27-33(3,40)22-6-5-18-19(21(22)14-34(27)13-16)11-23-20(18)12-25(36)24-10-17(8-9-32(23,24)2)41-31-30(39)29(38)28(37)26(15-35)42-31/h16-24,26-31,35,37-40H,4-15H2,1-3H3/t16?,17?,18-,19-,20+,21?,22?,23+,24-,26-,27+,28-,29+,30-,31-,32-,33+/m1/s1","DHQFYEJMFMYGCV-CRPZZPISSA-N"
"C[C@H]1CC[C@@H]2N(CC3[C@@H]4C[C@H]5C(CC(=O)[C@H]6CC(OC7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)CC[C@@]65C)[C@@H]4CC[C@H]3[C@]2(C)O)C1","InChI=1S/C33H53NO8/c1-16-4-7-27-33(3,40)22-6-5-18-19(21(22)14-34(27)13-16)11-23-20(18)12-25(36)24-10-17(8-9-32(23,24)2)41-31-30(39)29(38)28(37)26(15-35)42-31/h16-24,26-31,35,37-40H,4-15H2,1-3H3/t16-,17?,18+,19+,20?,21?,22+,23-,24+,26+,27-,28+,29-,30+,31?,32+,33-/m0/s1","DHQFYEJMFMYGCV-WNLYLCEVSA-N"
"C[C@H]1CC[C@H]2[C@H](C)C3CC[C@H]4[C@@H]5C[C@@H](O)[C@H]6C[C@@H](O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O)CC[C@]6(C)[C@H]5C[C@H]4[C@@H]3CN2C1","InChI=1S/C33H55NO7/c1-16-4-7-26-17(2)19-5-6-20-21(23(19)14-34(26)13-16)11-24-22(20)12-27(36)25-10-18(8-9-33(24,25)3)40-32-31(39)30(38)29(37)28(15-35)41-32/h16-32,35-39H,4-15H2,1-3H3/t16-,17+,18-,19?,20+,21+,22-,23+,24-,25+,26-,27+,28+,29+,30-,31+,32+,33+/m0/s1","RRZZOQYXEGRKNH-DLFMHHDFSA-N"
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"CCN1C[C@@]2(COC)C3[C@@H](OC)[C@H]4[C@@H]1[C@]3([C@@H](OC)C[C@H]2O)[C@]1(O)C[C@]2(O)[C@@H](OC)[C@H](O)[C@@]4(OC(C)=O)C1[C@H]2OC(=O)c1ccccc1","InChI=1S/C34H47NO12/c1-7-35-15-30(16-42-3)19(37)13-20(43-4)33-23(30)22(44-5)21(25(33)35)34(47-17(2)36)24-27(46-29(39)18-11-9-8-10-12-18)31(40,14-32(24,33)41)28(45-6)26(34)38/h8-12,19-28,37-38,40-41H,7,13-16H2,1-6H3/t19-,20+,21+,22+,23?,24?,25-,26+,27-,28+,30+,31-,32+,33-,34+/m1/s1","GMSKTJVHWUUOMY-GHBKSVICSA-N"
"CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CCC3=O)CC[C@H](OC)[C@]34C5C[C@@H]6[C@@H](OC)C[C@@](O)(C5[C@H]6OC)[C@](O)(C13)[C@@H](OC)C24","InChI=1S/C36H48N2O10/c1-6-37-17-33(18-48-31(41)19-9-7-8-10-22(19)38-25(39)11-12-26(38)40)14-13-24(45-3)35-21-15-20-23(44-2)16-34(42,27(21)28(20)46-4)36(43,32(35)37)30(47-5)29(33)35/h7-10,20-21,23-24,27-30,32,42-43H,6,11-18H2,1-5H3/t20-,21?,23+,24+,27?,28+,29?,30+,32?,33+,34-,35+,36-/m1/s1","KFXVNXQXPRPLQA-RXSGGJJFSA-N"
"CCN1C[C@@]2(COC)C3[C@@H](OC)[C@H]4C1[C@@]3(C1C[C@]3(O)[C@@H](OC)[C@H](O)[C@@]4(OC(C)=O)C1[C@H]3OC(=O)c1ccccc1)[C@@H](OC)C[C@H]2OC(C)=O","InChI=1S/C36H49NO12/c1-8-37-16-33(17-43-4)22(47-18(2)38)14-23(44-5)35-21-15-34(42)30(48-32(41)20-12-10-9-11-13-20)24(21)36(49-19(3)39,29(40)31(34)46-7)25(28(35)37)26(45-6)27(33)35/h9-13,21-31,40,42H,8,14-17H2,1-7H3/t21?,22-,23+,24?,25+,26+,27?,28?,29+,30-,31+,33+,34-,35+,36-/m1/s1","RIPYIJVYDYCPKW-YGLHNUDVSA-N"
"C=C1[C@H]2C[C@]3(C4C[C@@H]5[C@@]6(C)CC[C@H](O)[C@@]5(C4N(CC)C6)[C@@H]3CC2=O)[C@@H]1O","InChI=1S/C22H31NO3/c1-4-23-10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-13,15-19,25-26H,2,4-10H2,1,3H3/t12-,13?,15-,16-,17+,18?,19-,20+,21-,22+/m1/s1","CBOSLVQFGANWTL-NQZGNCTHSA-N"
"C=C1[C@@H]2C[C@]3(C(CC2=O)[C@@]24C(O)CC[C@@]5(C)CN(CC)C2[C@@H]3CC54)[C@@H]1O","InChI=1S/C22H31NO3/c1-4-23-10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-13,15-19,25-26H,2,4-10H2,1,3H3/t12-,13-,15?,16?,17?,18?,19+,20-,21-,22-/m0/s1","CBOSLVQFGANWTL-VTXPNNKDSA-N"
"CCN1C[C@]2(COC)CC[C@H](O)[C@@]34C5C[C@@H]6[C@@H](OC)C[C@@](O)(C5[C@H]6OC)[C@@](O)([C@@H](OC)C23)[C@@H]14","InChI=1S/C25H41NO7/c1-6-26-11-22(12-30-2)8-7-16(27)24-14-9-13-15(31-3)10-23(28,17(14)18(13)32-4)25(29,21(24)26)20(33-5)19(22)24/h13-21,27-29H,6-12H2,1-5H3/t13-,14?,15+,16+,17?,18+,19?,20+,21+,22+,23-,24+,25-/m1/s1","JVBLTQQBEQQLEV-LPHVGPHASA-N"
"C=C1[C@H]2C[C@]3(C4CC5[C@@]6(C)CC[C@H](O)[C@]5(C3C[C@@H]2O)C4[N+]([O-])(CC)C6)[C@@H]1O","InChI=1S/C22H33NO4/c1-4-23(27)10-20(3)6-5-17(25)22-15(20)7-13(18(22)23)21-9-12(11(2)19(21)26)14(24)8-16(21)22/h12-19,24-26H,2,4-10H2,1,3H3/t12-,13?,14+,15?,16?,17+,18?,19-,20+,21-,22+,23?/m1/s1","DEMQJEXKIJFBRD-LGTBQFFLSA-N"
"CCN1C[C@]2(C)CC[C@H](O)[C@@]34C5C[C@@H]6[C@@H](OC)C[C@@](O)(C5[C@H]6OC)[C@@H](CC32)[C@@H]14","InChI=1S/C23H37NO4/c1-5-24-11-21(2)7-6-17(25)23-13-8-12-15(27-3)10-22(26,18(13)19(12)28-4)14(20(23)24)9-16(21)23/h12-20,25-26H,5-11H2,1-4H3/t12-,13?,14+,15+,16?,17+,18?,19+,20-,21+,22+,23-/m1/s1","PEUHZLSMLRCFJM-RRSXYISTSA-N"
"CCN1C[C@]2(C)CC[C@H](OC)[C@]34C5C[C@@H]6CC[C@@](O)(C5C(=O)O6)[C@H](C13)[C@@H](OC(=O)c1ccccc1)C42","InChI=1S/C29H37NO6/c1-4-30-15-27(2)12-11-19(34-3)29-18-14-17-10-13-28(33,20(18)26(32)35-17)21(24(29)30)22(23(27)29)36-25(31)16-8-6-5-7-9-16/h5-9,17-24,33H,4,10-15H2,1-3H3/t17-,18?,19-,20?,21-,22+,23?,24?,27-,28+,29-/m0/s1","XVVZJDDPRFFKTQ-MFJRHRAESA-N"
"CCN1C[C@]2(C)CC[C@H](OC)[C@@]34C5C[C@@H]6CC[C@@](O)(C5C(=O)O6)C([C@@H](O)C32)[C@@H]14","InChI=1S/C22H33NO5/c1-4-23-10-20(2)7-6-13(27-3)22-12-9-11-5-8-21(26,14(12)19(25)28-11)15(18(22)23)16(24)17(20)22/h11-18,24,26H,4-10H2,1-3H3/t11-,12?,13-,14?,15?,16+,17?,18+,20-,21+,22-/m0/s1","YPSAOPXJHSESSR-MMOBYWJYSA-N"
"CCN1C[C@]2(COC)CC[C@H](OC)[C@@]34C5C[C@@H]6[C@@H](OC)C[C@@](O)(C5[C@H]6OC(=O)c5ccccc5)[C@@H](CC23)C14","InChI=1S/C31H43NO6/c1-5-32-16-29(17-35-2)12-11-24(37-4)31-20-13-19-22(36-3)15-30(34,21(27(31)32)14-23(29)31)25(20)26(19)38-28(33)18-9-7-6-8-10-18/h6-10,19-27,34H,5,11-17H2,1-4H3/t19-,20?,21+,22+,23?,24+,25?,26+,27?,29+,30+,31-/m1/s1","NDYOWPIMXBSPHT-FXMMJRGESA-N"
"CCN1C[C@]2(COC(=O)c3ccccc3N3C(=O)CC(C)C3=O)CCC(OC)C34C5C[C@@H]6[C@@H](OC)C[C@@](O)(C5[C@H]6OC(C)=O)[C@](O)(C13)[C@@H](OC)C42","InChI=1S/C38H50N2O11/c1-7-39-17-35(18-50-33(44)21-10-8-9-11-24(21)40-27(42)14-19(2)32(40)43)13-12-26(48-5)37-23-15-22-25(47-4)16-36(45,28(23)29(22)51-20(3)41)38(46,34(37)39)31(49-6)30(35)37/h8-11,19,22-23,25-26,28-31,34,45-46H,7,12-18H2,1-6H3/t19?,22-,23?,25+,26?,28?,29+,30?,31+,34?,35+,36-,37?,38-/m1/s1","IPWQJEONCUFCOR-PUEURLJZSA-N"
"OC1=N/C(=C\c2c[nH]c3ccccc23)C(O)=N1","InChI=1S/C12H9N3O2/c16-11-10(14-12(17)15-11)5-7-6-13-9-4-2-1-3-8(7)9/h1-6,13H,(H2,14,15,16,17)/b10-5-","WJZHVBZSCOLDKV-YHYXMXQVSA-N"
"CC1(C)S[C@@H]2[C@H](N=C(O)Cc3ccccc3)C(=O)N2C1C(=O)O","InChI=1S/C16H18N2O4S/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12?,14-/m1/s1","JGSARLDLIJGVTE-YXHCSQSYSA-N"
"C/C=C/C[C@@H](C)[C@@H](O)C1C(O)=NC(CC)C(=O)N(C)CC(=O)N(C)C(CC(C)C)C(O)=NC(C(C)C)C(=O)N(C)C(CC(C)C)C(O)=NC(C)C(O)=N[C@H](C)C(=O)N(C)C(CC(C)C)C(=O)N(C)C(CC(C)C)C(=O)N(C)C(C(C)C)C(=O)N1C","InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+/t40-,41?,42-,43?,44?,45?,46?,47?,49?,50?,51?,52-/m1/s1","PMATZTZNYRCHOR-NFOUMSERSA-N"
"C/C=C/CC(C)C(O)C1C(O)=NC(CC)C(=O)N(C)CC(=O)N(C)C(CC(C)C)C(O)=NC(C(C)C)C(=O)N(C)C(CC(C)C)C(O)=NC(C)C(O)=NC(C)C(=O)N(C)C(CC(C)C)C(=O)N(C)C(CC(C)C)C(=O)N(C)C(C(C)C)C(=O)N1C","InChI=1S/C62H111N11O12/c1-25-27-28-40(15)52(75)51-56(79)65-43(26-2)58(81)67(18)33-48(74)68(19)44(29-34(3)4)55(78)66-49(38(11)12)61(84)69(20)45(30-35(5)6)54(77)63-41(16)53(76)64-42(17)57(80)70(21)46(31-36(7)8)59(82)71(22)47(32-37(9)10)60(83)72(23)50(39(13)14)62(85)73(51)24/h25,27,34-47,49-52,75H,26,28-33H2,1-24H3,(H,63,77)(H,64,76)(H,65,79)(H,66,78)/b27-25+","PMATZTZNYRCHOR-IMVLJIQESA-N"
"OC1=N[C@@H](Cc2c[nH]c3ccccc23)C(O)=NC1Cc1c[nH]c2ccccc12","InChI=1S/C22H20N4O2/c27-21-19(9-13-11-23-17-7-3-1-5-15(13)17)25-22(28)20(26-21)10-14-12-24-18-8-4-2-6-16(14)18/h1-8,11-12,19-20,23-24H,9-10H2,(H,25,28)(H,26,27)/t19-,20?/m0/s1","DNHODRZUCGXYKU-XJDOXCRVSA-N"
"CC(C)C[C@H]1N=C(O)[C@@H](CCCN)N=C(O)[C@@H](C(C)C)N=C(O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N=C(O)[C@@H](CC(C)C)N=C(O)[C@@H](CCCN)N=C(O)[C@@H](C(C)C)N=C(O)[C@H]2CCCN2C(=O)[C@H](Cc2ccccc2)N=C1O","InChI=1S/C60H92N12O10/c1-35(2)31-43-53(75)67-45(33-39-19-11-9-12-20-39)59(81)71-29-17-25-47(71)55(77)70-50(38(7)8)58(80)64-42(24-16-28-62)52(74)66-44(32-36(3)4)54(76)68-46(34-40-21-13-10-14-22-40)60(82)72-30-18-26-48(72)56(78)69-49(37(5)6)57(79)63-41(23-15-27-61)51(73)65-43/h9-14,19-22,35-38,41-50H,15-18,23-34,61-62H2,1-8H3,(H,63,79)(H,64,80)(H,65,73)(H,66,74)(H,67,75)(H,68,76)(H,69,78)(H,70,77)/t41-,42-,43-,44-,45+,46+,47-,48-,49-,50-/m1/s1","IUAYMJGZBVDSGL-OBXPKUPVSA-N"
"NC(CCC(O)=NC(CSSCC(N=C(O)CCC(N)C(=O)O)C(O)=NCC(=O)O)C(O)=NCC(=O)O)C(=O)O","InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)","YPZRWBKMTBYPTK-UHFFFAOYSA-N"
"COc1ccc2c3c1OC1CC(O)C=C[C@@]31CCN(C)C2","InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12?,14?,17-/m0/s1","ASUTZQLVASHGKV-AJUCZRQESA-N"
"C/C=C(/C)C(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(C)=O","InChI=1S/C21H22O7/c1-6-11(2)20(24)27-18-16-14(28-21(4,5)19(18)25-12(3)22)9-7-13-8-10-15(23)26-17(13)16/h6-10,18-19H,1-5H3/b11-6-","LYUZYPKZQDYMEE-WDZFZDKYSA-N"
"CC(=O)OC1C(OC(=O)CC(C)C)c2c(ccc3ccc(=O)oc23)OC1(C)C","InChI=1S/C21H24O7/c1-11(2)10-16(24)27-19-17-14(28-21(4,5)20(19)25-12(3)22)8-6-13-7-9-15(23)26-18(13)17/h6-9,11,19-20H,10H2,1-5H3","KLUTZDJBVDPOFE-UHFFFAOYSA-N"
"CC(=O)OC1c2c(ccc3ccc(=O)oc23)OC(C)(C)C1OC(=O)CC(C)C","InChI=1S/C21H24O7/c1-11(2)10-16(24)27-20-19(25-12(3)22)17-14(28-21(20,4)5)8-6-13-7-9-15(23)26-18(13)17/h6-9,11,19-20H,10H2,1-5H3","ALKTVPFKDYZFGA-UHFFFAOYSA-N"
"CC1=CCC2C(C)(C)C(=O)CC2(C)C1COc1ccc2ccc(=O)oc2c1","InChI=1S/C23H26O4/c1-14-5-9-19-22(2,3)20(24)12-23(19,4)17(14)13-26-16-8-6-15-7-10-21(25)27-18(15)11-16/h5-8,10-11,17,19H,9,12-13H2,1-4H3","BUPDBEMKWPDILI-UHFFFAOYSA-N"
"CC1(C)[C@@H](O)CC[C@]2(C)[C@@H]1CC[C@](C)(O)[C@H]2COc1ccc2ccc(=O)oc2c1","InChI=1S/C24H32O5/c1-22(2)18-9-12-24(4,27)19(23(18,3)11-10-20(22)25)14-28-16-7-5-15-6-8-21(26)29-17(15)13-16/h5-8,13,18-20,25,27H,9-12,14H2,1-4H3/t18-,19+,20+,23-,24+/m1/s1","WNANPKYNOALKIV-XJRISUEFSA-N"
"CC(O)=NC1C(O)[C@H](O)C(CO)O[C@H]1Oc1ccc2c(C)cc(=O)oc2c1","InChI=1S/C18H21NO8/c1-8-5-14(22)26-12-6-10(3-4-11(8)12)25-18-15(19-9(2)21)17(24)16(23)13(7-20)27-18/h3-6,13,15-18,20,23-24H,7H2,1-2H3,(H,19,21)/t13?,15?,16-,17?,18-/m1/s1","QCTHLCFVVACBSA-XAMVCXPESA-N"
"C/C=C(\C)C(=O)OC1Cc2c(ccc3ccc(=O)oc23)OC1(C)C","InChI=1S/C19H20O5/c1-5-11(2)18(21)22-15-10-13-14(24-19(15,3)4)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/b11-5+","RRHCDWLSHIIIIT-VZUCSPMQSA-N"
"COc1cc2cc(Oc3ccc4ccc(=O)oc4c3)c(=O)oc2cc1OC(C)=O","InChI=1S/C21H14O8/c1-11(22)26-18-10-16-13(7-17(18)25-2)8-19(21(24)29-16)27-14-5-3-12-4-6-20(23)28-15(12)9-14/h3-10H,1-2H3","JGZOXTSCOZGQNQ-UHFFFAOYSA-N"
"Cc1cc(=O)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc12","InChI=1S/C16H18O8/c1-7-4-12(18)23-10-5-8(2-3-9(7)10)22-16-15(21)14(20)13(19)11(6-17)24-16/h2-5,11,13-17,19-21H,6H2,1H3/t11-,13-,14+,15-,16-/m1/s1","YUDPTGPSBJVHCN-YMILTQATSA-N"
"COc1c(C(C)C)oc2cc3oc(=O)ccc3cc12","InChI=1S/C15H14O4/c1-8(2)14-15(17-3)10-6-9-4-5-13(16)18-11(9)7-12(10)19-14/h4-8H,1-3H3","YQBNJPACAUPNLV-UHFFFAOYSA-N"
"COc1ccc2ccc(=O)oc2c1CC=C(C)C","InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3","MBRLOUHOWLUMFF-UHFFFAOYSA-N"
"COc1ccc2ccc(=O)oc2c1CC1OC1(C)C","InChI=1S/C15H16O4/c1-15(2)12(19-15)8-10-11(17-3)6-4-9-5-7-13(16)18-14(9)10/h4-7,12H,8H2,1-3H3","LSZONYLDFHGRDP-UHFFFAOYSA-N"
"CC(C)=CCOc1c2ccoc2cc2oc(=O)ccc12","InChI=1S/C16H14O4/c1-10(2)5-7-19-16-11-3-4-15(17)20-14(11)9-13-12(16)6-8-18-13/h3-6,8-9H,7H2,1-2H3","IGWDEVSBEKYORK-UHFFFAOYSA-N"
"CC1(C)OC1COc1c2occc2cc2ccc(=O)oc12","InChI=1S/C16H14O5/c1-16(2)11(21-16)8-19-15-13-10(5-6-18-13)7-9-3-4-12(17)20-14(9)15/h3-7,11H,8H2,1-2H3","CTJZWFCPUDPLME-UHFFFAOYSA-N"
"COc1cc2ccc(=O)oc2c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c1O","InChI=1S/C16H18O10/c1-23-7-4-6-2-3-9(18)25-14(6)15(11(7)20)26-16-13(22)12(21)10(19)8(5-17)24-16/h2-4,8,10,12-13,16-17,19-22H,5H2,1H3/t8-,10-,12+,13-,16+/m1/s1","CRSFLLTWRCYNNX-QBNNUVSCSA-N"
"O=c1oc2cc(O)ccc2c2ccccc12","InChI=1S/C13H8O3/c14-8-5-6-10-9-3-1-2-4-11(9)13(15)16-12(10)7-8/h1-7,14H","WXUQMTRHPNOXBV-UHFFFAOYSA-N"
"CC1(C)Oc2ccc3ccc(=O)oc3c2CC1=O","InChI=1S/C14H12O4/c1-14(2)11(15)7-9-10(18-14)5-3-8-4-6-12(16)17-13(8)9/h3-6H,7H2,1-2H3","UKSKSIFYCHCZDG-UHFFFAOYSA-N"
"CC1(C)Oc2ccc3ccc(=O)oc3c2CC1O","InChI=1S/C14H14O4/c1-14(2)11(15)7-9-10(18-14)5-3-8-4-6-12(16)17-13(8)9/h3-6,11,15H,7H2,1-2H3","UJSHBYQGQRPVNO-UHFFFAOYSA-N"
"C=C1CC[C@@H]2C(C)(C)[C@@H](OC(C)=O)CC[C@@]2(C)[C@H]1COc1ccc2ccc(=O)oc2c1","InChI=1S/C26H32O5/c1-16-6-10-22-25(3,4)23(30-17(2)27)12-13-26(22,5)20(16)15-29-19-9-7-18-8-11-24(28)31-21(18)14-19/h7-9,11,14,20,22-23H,1,6,10,12-13,15H2,2-5H3/t20-,22+,23-,26-/m0/s1","MNGYOFNIAOWXIT-VBZBYZBJSA-N"
"O=c1ccc2ccc3occc3c2o1","InChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H","XDROKJSWHURZGO-UHFFFAOYSA-N"
"CC1OC1(C)C(=O)OC1c2cc3ccc(=O)oc3cc2OC(C)(C)C1OC(=O)C1(C)OC1C","InChI=1S/C24H26O9/c1-11-23(5,31-11)20(26)29-18-14-9-13-7-8-17(25)28-15(13)10-16(14)33-22(3,4)19(18)30-21(27)24(6)12(2)32-24/h7-12,18-19H,1-6H3","XVGNCXGTKQLGAI-UHFFFAOYSA-N"
"CC(C)(OC(=O)c1ccccc1)C1Cc2cc3ccc(=O)oc3cc2O1","InChI=1S/C21H18O5/c1-21(2,26-20(23)13-6-4-3-5-7-13)18-11-15-10-14-8-9-19(22)25-16(14)12-17(15)24-18/h3-10,12,18H,11H2,1-2H3","VIPXLQMQEIDXMH-UHFFFAOYSA-N"
"O=c1ccc2cc(O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)c(O)cc2o1","InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15+/m0/s1","XHCADAYNFIFUHF-XKNKYKOPSA-N"
"CC1=C(C=CC2=C1OC(=O)C(=C2O)NC(=O)C3=CC(=C(C=C3)O)CC=C(C)C)O[C@H]4[C@@H]([C@@H]([C@H](C(O4)(C)C)OC)OC(=O)N)O","InChI=1S/C31H36N2O11/c1-14(2)7-8-16-13-17(9-11-19(16)34)27(37)33-21-22(35)18-10-12-20(15(3)24(18)42-28(21)38)41-29-23(36)25(43-30(32)39)26(40-6)31(4,5)44-29/h7,9-13,23,25-26,29,34-36H,8H2,1-6H3,(H2,32,39)(H,33,37)/t23-,25+,26-,29-/m1/s1","YJQPYGGHQPGBLI-KGSXXDOSSA-N"
"CC(C)=CCC/C(C)=C/COc1ccc2ccc(=O)oc2c1","InChI=1S/C19H22O3/c1-14(2)5-4-6-15(3)11-12-21-17-9-7-16-8-10-19(20)22-18(16)13-17/h5,7-11,13H,4,6,12H2,1-3H3/b15-11+","RSDDHGSKLOSQFK-RVDMUPIBSA-N"
"CCC(C)C(=O)O[C@@H]1[C@H](OC(C)=O)c2c(ccc3ccc(=O)oc23)OC1(C)C","InChI=1S/C21H24O7/c1-6-11(2)20(24)27-19-18(25-12(3)22)16-14(28-21(19,4)5)9-7-13-8-10-15(23)26-17(13)16/h7-11,18-19H,6H2,1-5H3/t11?,18-,19-/m1/s1","GVBNSPFBYXGREE-CDDDFZJFSA-N"
"CC(=O)OC1CC[C@]2(C)C(CC[C@@](C)(O)[C@H]2COc2ccc3ccc(=O)oc3c2)C1(C)C","InChI=1S/C26H34O6/c1-16(27)31-22-11-12-25(4)20(24(22,2)3)10-13-26(5,29)21(25)15-30-18-8-6-17-7-9-23(28)32-19(17)14-18/h6-9,14,20-22,29H,10-13,15H2,1-5H3/t20?,21-,22?,25+,26+/m0/s1","RIPKCRCUFJSKKD-FBQVDBQASA-N"
"CC1=CC[C@H]2C(C)(C)[C@H](O)CC[C@]2(C)[C@@H]1COc1ccc2ccc(=O)oc2c1","InChI=1S/C24H30O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h5-8,10,13,18,20-21,25H,9,11-12,14H2,1-4H3/t18-,20+,21-,24-/m1/s1","MCTDXPDDZLFJHR-LOCCHRAXSA-N"
"CC(C)=C1CC[C@H](C)[C@](C)(COc2ccc3ccc(=O)oc3c2)[C@H]1CCC(=O)O","InChI=1S/C24H30O5/c1-15(2)19-9-5-16(3)24(4,20(19)10-11-22(25)26)14-28-18-8-6-17-7-12-23(27)29-21(17)13-18/h6-8,12-13,16,20H,5,9-11,14H2,1-4H3,(H,25,26)/t16-,20-,24-/m0/s1","CVWWNYPTZYQCSE-YFBXQHAESA-N"
"CC(=O)O[C@@H]1CC[C@@]2(C)[C@H](C(=O)C=C(C)[C@@H]2COc2ccc3ccc(=O)oc3c2)C1(C)C","InChI=1S/C26H30O6/c1-15-12-20(28)24-25(3,4)22(31-16(2)27)10-11-26(24,5)19(15)14-30-18-8-6-17-7-9-23(29)32-21(17)13-18/h6-9,12-13,19,22,24H,10-11,14H2,1-5H3/t19-,22+,24+,26+/m0/s1","TXEAVXYHQMQTHQ-SKIBMGEXSA-N"
"COC(=O)CC[C@H]1C(=C(C)C)CC[C@H](C)[C@]1(C)COc1ccc2ccc(=O)oc2c1","InChI=1S/C25H32O5/c1-16(2)20-10-6-17(3)25(4,21(20)11-13-23(26)28-5)15-29-19-9-7-18-8-12-24(27)30-22(18)14-19/h7-9,12,14,17,21H,6,10-11,13,15H2,1-5H3/t17-,21-,25-/m0/s1","LWKZASDDSMSRFV-ADSMNUKGSA-N"
"CC1=CCC2C(C)(C)C(=O)CC[C@]2(C)[C@@H]1COc1ccc2ccc(=O)oc2c1","InChI=1S/C24H28O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h5-8,10,13,18,20H,9,11-12,14H2,1-4H3/t18-,20?,24-/m1/s1","VPAXJOUATWLOPR-JGJQPKLHSA-N"
"CC1=CC[C@@H]2C(C)(C)C(=O)CC[C@@]2(C)[C@@H]1COc1ccc2ccc(=O)oc2c1","InChI=1S/C24H28O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h5-8,10,13,18,20H,9,11-12,14H2,1-4H3/t18-,20-,24+/m1/s1","VPAXJOUATWLOPR-FPGHNAPASA-N"
"CC1=CC[C@@H]2C(C)(C)[C@H](O)CC[C@@]2(C)[C@@H]1COc1ccc2ccc(=O)oc2c1","InChI=1S/C24H30O4/c1-15-5-9-20-23(2,3)21(25)11-12-24(20,4)18(15)14-27-17-8-6-16-7-10-22(26)28-19(16)13-17/h5-8,10,13,18,20-21,25H,9,11-12,14H2,1-4H3/t18-,20-,21-,24+/m1/s1","MCTDXPDDZLFJHR-XLRKYUMYSA-N"
"Cc1cc(OC(=O)c2c(C)cc(OC(=O)c3c(C)cc(O)cc3O)cc2O)cc(O)c1C(=O)O","InChI=1S/C24H20O10/c1-10-4-13(25)7-16(26)20(10)23(31)34-15-6-12(3)21(18(28)9-15)24(32)33-14-5-11(2)19(22(29)30)17(27)8-14/h4-9,25-28H,1-3H3,(H,29,30)","ATQPZSQVWCPVGV-UHFFFAOYSA-N"
"COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)O)c(O)c2C)c(O)c1C","InChI=1S/C19H20O7/c1-8-7-13(11(4)16(20)14(8)18(22)23)26-19(24)15-9(2)6-12(25-5)10(3)17(15)21/h6-7,20-21H,1-5H3,(H,22,23)","NMKBRSYSHBPUPY-UHFFFAOYSA-N"
"COc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)O)c(O)c2C)c(OC)c1C","InChI=1S/C20H22O7/c1-9-8-14(11(3)17(21)15(9)19(22)23)27-20(24)16-10(2)7-13(25-5)12(4)18(16)26-6/h7-8,21H,1-6H3,(H,22,23)","MIJKZXWOOXIEEU-UHFFFAOYSA-N"
"CN(C)CCOC(=O)/C=C/c1ccccc1","InChI=1S/C13H17NO2/c1-14(2)10-11-16-13(15)9-8-12-6-4-3-5-7-12/h3-9H,10-11H2,1-2H3/b9-8+","BWJAQVSVFPHGSU-CMDGGOBGSA-N"
"Cc1cc(O)c(C=O)c2c1C(=O)Oc1c(CO)c(O)c3c(c1O2)C(O)OC3=O","InChI=1S/C18H12O10/c1-5-2-8(21)6(3-19)13-9(5)16(23)27-14-7(4-20)12(22)10-11(15(14)26-13)18(25)28-17(10)24/h2-3,18,20-22,25H,4H2,1H3","QQTKVXCQLZIJPP-UHFFFAOYSA-N"
"OCC1OC(Oc2cc(O)cc(/C=C/c3ccc(O)cc3)c2)C(O)C(O)C1O","InChI=1S/C20H22O8/c21-10-16-17(24)18(25)19(26)20(28-16)27-15-8-12(7-14(23)9-15)2-1-11-3-5-13(22)6-4-11/h1-9,16-26H,10H2/b2-1+","HSTZMXCBWJGKHG-OWOJBTEDSA-N"
"O=C(CCc1ccc(O)cc1)c1c(O)cc(O)cc1O[C@@H]1OC(CO)[C@@H](O)C(O)C1O","InChI=1S/C21H24O10/c22-9-16-18(27)19(28)20(29)21(31-16)30-15-8-12(24)7-14(26)17(15)13(25)6-3-10-1-4-11(23)5-2-10/h1-2,4-5,7-8,16,18-24,26-29H,3,6,9H2/t16?,18-,19?,20?,21-/m1/s1","IOUVKUPGCMBWBT-IZUIXIRESA-N"
"CNC1C(O)[C@@H](O)C(CO)O[C@H]1OC1[C@H](OC2C(O)[C@@H](O)C(NC(=N)N)C(O)[C@@H]2NC(=N)N)O[C@@H](C)C1(O)CO","InChI=1S/C21H41N7O12/c1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35/h5-18,26,29-36H,3-4H2,1-2H3,(H4,22,23,27)(H4,24,25,28)/t5-,6?,7?,8-,9?,10-,11?,12-,13?,14?,15?,16?,17-,18-,21?/m0/s1","ASXBYYWOLISCLQ-PMUJNECLSA-N"
"NC[C@@H]1O[C@@H](O[C@@H]2[C@@H](N)C[C@@H](N)[C@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](N)[C@@H]3O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O","InChI=1S/C18H36N4O11/c19-2-6-10(25)12(27)13(28)18(30-6)33-16-5(21)1-4(20)15(14(16)29)32-17-11(26)8(22)9(24)7(3-23)31-17/h4-18,23-29H,1-3,19-22H2/t4-,5+,6+,7+,8-,9+,10+,11+,12-,13+,14-,15+,16-,17+,18+/m1/s1","SBUJHOSQTJFQJX-HZKXJDKASA-N"
"N#CC(O[C@@H]1O[C@H](CO[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)c1ccccc1","InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10?,11-,12-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1","XUCIJNAGGSZNQT-SWRVSKMJSA-N"
"CCC[C@@H]1C[C@@H](C(O)=NC(C(C)O)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1","InChI=1S/C18H34N2O6S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)/t9?,10-,11+,12?,13+,14-,15-,16-,18-/m1/s1","OJMMVQQUTAEWLP-NOWPCOIGSA-N"
"CCC[C@H]1C[C@H](C(O)=NC(C(C)O)[C@H]2O[C@H](SC)[C@H](O)[C@@H](O)[C@H]2O)N(C)C1","InChI=1S/C18H34N2O6S/c1-5-6-10-7-11(20(3)8-10)17(25)19-12(9(2)21)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,21-24H,5-8H2,1-4H3,(H,19,25)/t9?,10-,11+,12?,13-,14+,15+,16+,18+/m0/s1","OJMMVQQUTAEWLP-GOCNHCMZSA-N"
"COc1cc(O)c(C(C)=O)c(O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)c1","InChI=1S/C21H30O14/c1-7(23)13-9(24)3-8(31-2)4-10(13)33-21-19(30)17(28)15(26)12(35-21)6-32-20-18(29)16(27)14(25)11(5-22)34-20/h3-4,11-12,14-22,24-30H,5-6H2,1-2H3/t11-,12-,14-,15-,16+,17+,18-,19-,20-,21-/m1/s1","YCEAKPBEZWCNSI-PEQRZCQJSA-N"
"CCCCCC(=O)Cc1cc(O)cc2c1C(=O)Oc1cc(O)c(C(=O)O)c(CCCCC)c1O2","InChI=1S/C26H30O8/c1-3-5-7-9-16(27)11-15-12-17(28)13-20-22(15)26(32)34-21-14-19(29)23(25(30)31)18(24(21)33-20)10-8-6-4-2/h12-14,28-29H,3-11H2,1-2H3,(H,30,31)","KVTYWHGIZSCFLG-UHFFFAOYSA-N"
"CC/C(=C\C=C\C1C=CC2CCCC2C1C(=O)c1ccc[nH]1)C1OC(C(C)C(=O)O)CCC1C","InChI=1S/C29H39NO4/c1-4-20(28-18(2)13-16-25(34-28)19(3)29(32)33)8-5-10-22-15-14-21-9-6-11-23(21)26(22)27(31)24-12-7-17-30-24/h5,7-8,10,12,14-15,17-19,21-23,25-26,28,30H,4,6,9,11,13,16H2,1-3H3,(H,32,33)/b10-5+,20-8+","HSZFOQSMGNAIJM-RVLOVFQDSA-N"
"C[C@H]1OC(OC2[C@@H](CO)OC(OC3[C@@H](CO)OC(O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)C1N[C@H]1C=C(CO)[C@@H](O)[C@H](O)[C@H]1O","InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11?,12-,13+,14+,15+,16-,17-,18-,19-,20-,21?,22?,23?,24?,25?/m1/s1","XUFXOAAUWZOOIT-GPNAOJRPSA-N"
"O=[N+]([O-])c1ccc(C(O)C(CO)N=C(O)C(Cl)Cl)cc1","InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)","WIIZWVCIJKGZOK-UHFFFAOYSA-N"
"Nc1ncnc2c1ncn2[C@H]1C[C@H](O)[C@@H](CO)O1","InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)/t5-,6+,7+/m0/s1","OLXZPDWKRNYJJZ-RRKCRQDMSA-N"
"Nc1nc(O)nc2c1ncn2C1OC(CO)C(O)C1O","InChI=1S/C10H13N5O5/c11-7-4-8(14-10(19)13-7)15(2-12-4)9-6(18)5(17)3(1-16)20-9/h2-3,5-6,9,16-18H,1H2,(H3,11,13,14,19)","MIKUYHXYGGJMLM-UHFFFAOYSA-N"
"Nc1ncnc2c1ncn2[C@H]1O[C@@H](COP(=O)([O-])O)[C@H](O)[C@H]1O.[Na+]","InChI=1S/C10H14N5O7P.Na/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20;/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20);/q;+1/p-1/t4-,6-,7+,10-;/m0./s1","FYWLYWMEGHCZAX-XKIWAKPUSA-M"
"N=c1ccn(C2O[C@@H](COP(=O)(O)O)[C@H](O)[C@H]2O)c([O-])n1.[Na+]","InChI=1S/C9H14N3O8P.Na/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18;/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18);/q;+1/p-1/t4-,6-,7+,8?;/m0./s1","AJCAHIYEOVKFDR-JXAVVIDVSA-M"
"Cc1ncc(C[n+]2csc(CCO)c2C)c(=N)[nH]1","InChI=1S/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1","JZRWCGZRTZMZEH-UHFFFAOYSA-N"
"C[C@H]1CCCC(O)CCC/C=C/c2cc(O)cc(O)c2C(=O)O1","InChI=1S/C18H24O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,14,19-21H,2,4-6,8-9H2,1H3/b7-3+/t12-,14?/m0/s1","FPQFYIAXQDXNOR-FLBVUZLHSA-N"
"O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O)ccc21","InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2/t14-/m0/s1","FURUXTVZLHCCNA-AWEZNQCLSA-N"
"O=C1c2c(O)cc(O)cc2OC(c2ccc(O)c(O)c2)C1O","InChI=1S/C15H12O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,14-19,21H","CXQWRCVTCMQVQX-UHFFFAOYSA-N"
"COc1ccc(C(=O)/C=C/c2ccc(OC)cc2OC)c(O)c1","InChI=1S/C18H18O5/c1-21-13-7-8-15(17(20)10-13)16(19)9-5-12-4-6-14(22-2)11-18(12)23-3/h4-11,20H,1-3H3/b9-5+","ZTIPWOFLPVWZDX-WEVVVXLNSA-N"
"COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc3c2=O)cc1","InChI=1S/C22H22O9/c1-28-12-4-2-11(3-5-12)15-10-29-16-8-13(6-7-14(16)18(15)24)30-22-21(27)20(26)19(25)17(9-23)31-22/h2-8,10,17,19-23,25-27H,9H2,1H3/t17-,19-,20+,21-,22-/m1/s1","MGJLSBDCWOSMHL-MIUGBVLSSA-N"
"C=C(C)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1","InChI=1S/C23H22O6/c1-11(2)16-8-14-15(28-16)6-5-12-22(24)21-13-7-18(25-3)19(26-4)9-17(13)27-10-20(21)29-23(12)14/h5-7,9,16,20-21H,1,8,10H2,2-4H3","JUVIOZPCNVVQFO-UHFFFAOYSA-N"
"CC(C)=CCc1c2c(c3occ(-c4ccc(O)cc4)c(=O)c3c1O)C=CC(C)(C)O2","InChI=1S/C25H24O5/c1-14(2)5-10-17-21(27)20-22(28)19(15-6-8-16(26)9-7-15)13-29-24(20)18-11-12-25(3,4)30-23(17)18/h5-9,11-13,26-27H,10H2,1-4H3","DCTLJGWMHPGCOS-UHFFFAOYSA-N"
"CC1(C)C=Cc2c(c3c(c4c(=O)c(-c5ccc(O)cc5)coc24)OC(C)(C)CC3)O1","InChI=1S/C25H24O5/c1-24(2)11-9-16-21(29-24)17-10-12-25(3,4)30-23(17)19-20(27)18(13-28-22(16)19)14-5-7-15(26)8-6-14/h5-9,11,13,26H,10,12H2,1-4H3","FMCWKGDGAHVFMC-UHFFFAOYSA-N"
"CC(C)=CCc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(O)c2c1OC(c1ccc(O)cc1)C(O)C2=O","InChI=1S/C26H30O11/c1-11(2)3-8-14-16(35-26-23(34)21(32)19(30)17(10-27)36-26)9-15(29)18-20(31)22(33)24(37-25(14)18)12-4-6-13(28)7-5-12/h3-7,9,17,19,21-24,26-30,32-34H,8,10H2,1-2H3/t17-,19-,21+,22?,23-,24?,26-/m1/s1","GRDZTDZJQRPNCN-GHYODRBMSA-N"
"C=C(CO[C@@H]1O[C@@H](CO[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O)[C@@H]1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1","InChI=1S/C34H40O16/c1-13(9-45-34-31(41)29(39)28(38)24(50-34)12-47-33-30(40)27(37)17(35)10-46-33)19-7-16-18(48-19)5-4-14-26(36)25-15-6-21(42-2)22(43-3)8-20(15)44-11-23(25)49-32(14)16/h4-6,8,17,19,23-25,27-31,33-35,37-41H,1,7,9-12H2,2-3H3/t17-,19-,23?,24-,25?,27-,28+,29-,30+,31+,33-,34+/m0/s1","CMQOKNQYLSMKJC-ZIYIFGDVSA-N"
"C=C(CO)C1Cc2c(ccc3c2OC2COc4cc(OC)c(OC)cc4C2C3=O)O1","InChI=1S/C23H22O7/c1-11(9-24)16-7-14-15(29-16)5-4-12-22(25)21-13-6-18(26-2)19(27-3)8-17(13)28-10-20(21)30-23(12)14/h4-6,8,16,20-21,24H,1,7,9-10H2,2-3H3","ZJMLELXRQUXRIU-UHFFFAOYSA-N"
"CC(C)=CCc1c(O)cc(O)c2c1O[C@H](c1ccccc1)CC2=O","InChI=1S/C20H20O4/c1-12(2)8-9-14-15(21)10-16(22)19-17(23)11-18(24-20(14)19)13-6-4-3-5-7-13/h3-8,10,18,21-22H,9,11H2,1-2H3/t18-/m0/s1","DAWSYIQAGQMLFS-SFHVURJKSA-N"
"O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12","InChI=1S/C21H20O11/c22-7-16-18(27)19(28)20(29)21(32-16)30-9-4-12(25)17-13(26)6-14(31-15(17)5-9)8-1-2-10(23)11(24)3-8/h1-6,16,18-25,27-29H,7H2/t16-,18-,19+,20-,21-/m1/s1","PEFNSGRTCBGNAN-QNDFHXLGSA-N"
"Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@H](O)C2","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15-/m1/s1","PFTAWBLQPZVEMU-UKRRQHHQSA-N"
"COc1cc2c(O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3","InChI=1S/C21H16O7/c1-24-15-6-11-12(7-16(15)25-2)20(22)13-8-26-21(23)19(13)18(11)10-3-4-14-17(5-10)28-9-27-14/h3-7,22H,8-9H2,1-2H3","VMEJANRODATDOF-UHFFFAOYSA-N"
"COc1ccc([C@H]2OC[C@@H]3[C@@H](c4ccc(OC)c(OC)c4)OC[C@H]23)cc1OC","InChI=1S/C22H26O6/c1-23-17-7-5-13(9-19(17)25-3)21-15-11-28-22(16(15)12-27-21)14-6-8-18(24-2)20(10-14)26-4/h5-10,15-16,21-22H,11-12H2,1-4H3/t15-,16-,21+,22+/m0/s1","PEUUVVGQIVMSAW-RZTYQLBFSA-N"
"COc1cc2c(OC(C)=O)c3c(c(-c4ccc5c(c4)OCO5)c2cc1OC)C(=O)OC3","InChI=1S/C23H18O8/c1-11(24)31-22-14-8-18(27-3)17(26-2)7-13(14)20(21-15(22)9-28-23(21)25)12-4-5-16-19(6-12)30-10-29-16/h4-8H,9-10H2,1-3H3","KEGZEHANNYRNOK-UHFFFAOYSA-N"
"CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](N)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(O)cccc1C3=O","InChI=1S/C26H27NO10/c1-9-21(30)13(27)6-16(36-9)37-15-8-26(35,10(2)28)7-12-18(15)25(34)20-19(23(12)32)22(31)11-4-3-5-14(29)17(11)24(20)33/h3-5,9,13,15-16,21,29-30,32,34-35H,6-8,27H2,1-2H3/t9-,13-,15-,16-,21+,26-/m0/s1","XREUEWVEMYWFFA-CSKJXFQVSA-N"
"O=C1c2ccccc2C(=O)c2c(O)c(O)cc(O)c21","InChI=1S/C14H8O5/c15-8-5-9(16)14(19)11-10(8)12(17)6-3-1-2-4-7(6)13(11)18/h1-5,15-16,19H","BBNQQADTFFCFGB-UHFFFAOYSA-N"
"O=C(O)CCC(O)=Nc1ccccc1C(=O)O","InChI=1S/C11H11NO5/c13-9(5-6-10(14)15)12-8-4-2-1-3-7(8)11(16)17/h1-4H,5-6H2,(H,12,13)(H,14,15)(H,16,17)","OGPDRYVIHAFSNL-UHFFFAOYSA-N"
"COc1ccc2c(c1O)C(=O)c1ccccc1C2=O","InChI=1S/C15H10O4/c1-19-11-7-6-10-12(15(11)18)14(17)9-5-3-2-4-8(9)13(10)16/h2-7,18H,1H3","BYQWRZGQEZAOPQ-UHFFFAOYSA-N"
"Cc1c(C(=O)O)c(O)cc2c1C(=O)c1c(O)c([C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c(O)c1C2=O","InChI=1S/C22H20O13/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34)/t7-,14-,19+,20-,21-/m1/s1","DGQLVPJVXFOQEV-NGOCYOHBSA-N"
"C=C1CCC2[C@@](C)(C(=O)O)CCC[C@]2(C)[C@H]1CCc1ccoc1","InChI=1S/C20H28O3/c1-14-5-8-17-19(2,10-4-11-20(17,3)18(21)22)16(14)7-6-15-9-12-23-13-15/h9,12-13,16-17H,1,4-8,10-11H2,2-3H3,(H,21,22)/t16-,17?,19+,20-/m0/s1","ZQHJXKYYELWEOK-NGWLPYQTSA-N"
"COc1cc([C@@H]2c3cc4c(cc3[C@H](O)C3COC(=O)[C@@H]32)OCO4)cc(OC)c1OC","InChI=1S/C22H22O8/c1-25-16-4-10(5-17(26-2)21(16)27-3)18-11-6-14-15(30-9-29-14)7-12(11)20(23)13-8-28-22(24)19(13)18/h4-7,13,18-20,23H,8-9H2,1-3H3/t13?,18-,19+,20+/m1/s1","YJGVMLPVUAXIQN-DPUNPDONSA-N"
"COc1cc(C(=O)O[C@H]2C/C(C)=C\CC[C@]3(C)O[C@@H]3C(O)C2C(C)C)cc(OC)c1OC","InChI=1S/C25H36O7/c1-14(2)20-17(11-15(3)9-8-10-25(4)23(32-25)21(20)26)31-24(27)16-12-18(28-5)22(30-7)19(13-16)29-6/h9,12-14,17,20-21,23,26H,8,10-11H2,1-7H3/b15-9-/t17-,20?,21?,23+,25-/m0/s1","JOMAEHBZUXNYRX-LRWPUCEASA-N"
"COc1cc(C)c2c(c1C=O)Oc1c(c(C)c(O)c3c1C(O)OC3=O)OC2=O","InChI=1S/C19H14O9/c1-6-4-9(25-3)8(5-20)15-10(6)17(22)27-14-7(2)13(21)11-12(16(14)26-15)19(24)28-18(11)23/h4-5,19,21,24H,1-3H3","SKCUFZLDTAYNBZ-UHFFFAOYSA-N"
"C[C@H]1COC2=C1C(=O)C(=O)c1c2ccc2c1CCCC2(C)C","InChI=1S/C19H20O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,10H,4-5,8-9H2,1-3H3/t10-/m0/s1","GVKKJJOMQCNPGB-JTQLQIEISA-N"
"Cc1cc(O)c2c3c4c(cc(O)c13)C(C)(C)C(=O)c1c(O)cc(O)c(c1-4)C2=O","InChI=1S/C22H16O6/c1-7-4-9(23)15-18-13(7)10(24)5-8-14(18)19-16(20(15)27)11(25)6-12(26)17(19)21(28)22(8,2)3/h4-6,23-26H,1-3H3","ABLACSIRCKEUOB-UHFFFAOYSA-N"
"CC[C@H](C(=O)[C@H](C)[C@H](O)[C@@H](C)CCc1ccc(C)c([O-])c1C(=O)O)[C@@H]1O[C@@](CC)([C@@H]2CC[C@@](O)(CC)[C@@H](C)O2)C[C@H]1C.[Na+]","InChI=1S/C34H54O8.Na/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39;/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39);/q;+1/p-1/t19-,21+,22+,23+,25+,26-,28+,31+,33-,34+;/m0./s1","RDHDUYAKDYQPEW-DBDPTFCUSA-M"
"CC[C@@H](C(=O)[C@@H](C)[C@@H](O)[C@H](C)CCc1ccc(C)c([O-])c1C(=O)O)[C@H]1O[C@](CC)([C@H]2CC[C@](O)(CC)[C@H](C)O2)C[C@@H]1C.[Na+]","InChI=1S/C34H54O8.Na/c1-9-25(31-21(6)18-34(11-3,42-31)26-16-17-33(40,10-2)23(8)41-26)30(37)22(7)28(35)19(4)12-14-24-15-13-20(5)29(36)27(24)32(38)39;/h13,15,19,21-23,25-26,28,31,35-36,40H,9-12,14,16-18H2,1-8H3,(H,38,39);/q;+1/p-1/t19-,21+,22+,23+,25+,26-,28+,31+,33-,34+;/m1./s1","RDHDUYAKDYQPEW-HWLWSTNVSA-M"
"C[C@H]1CCCC(=O)CCC/C=C/c2cc(O)cc(O)c2C(=O)O1","InChI=1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3/b7-3+/t12-/m0/s1","MBMQEIFVQACCCH-QBODLPLBSA-N"
"O=c1c2cc(O)c(O)cc2oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12","InChI=1S/C19H18O11/c20-4-11-15(25)17(27)18(28)19(30-11)12-8(23)3-10-13(16(12)26)14(24)5-1-6(21)7(22)2-9(5)29-10/h1-3,11,15,17-23,25-28H,4H2/t11-,15-,17+,18-,19+/m1/s1","AEDDIBAIWPIIBD-ZJKJAXBQSA-N"
"CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)C2O)[C@@H](CC=O)C[C@@H](C)C(=O)/C=C/[C@]2(C)O[C@H]2[C@@H]1C","InChI=1S/C31H51NO9/c1-9-25-20(5)29-31(6,41-29)12-10-23(34)17(2)14-21(11-13-33)28(19(4)24(35)16-26(36)39-25)40-30-27(37)22(32(7)8)15-18(3)38-30/h10,12-13,17-22,24-25,27-30,35,37H,9,11,14-16H2,1-8H3/b12-10+/t17-,18-,19+,20-,21+,22+,24-,25-,27?,28-,29+,30+,31+/m1/s1","IUPCWCLVECYZRV-DOMYNTMMSA-N"
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"CC(C)(O)CCC(=O)[C@](C)(O)C1[C@H](O)C[C@@]2(C)C3CC=C4[C@@H](C=C(OC5OC(CO)C(O)C(O)C5O)C(=O)C4(C)C)[C@]3(C)C(=O)C[C@]12C","InChI=1S/C36H54O12/c1-31(2,45)12-11-23(39)36(8,46)28-19(38)14-33(5)22-10-9-17-18(35(22,7)24(40)15-34(28,33)6)13-20(29(44)32(17,3)4)47-30-27(43)26(42)25(41)21(16-37)48-30/h9,13,18-19,21-22,25-28,30,37-38,41-43,45-46H,10-12,14-16H2,1-8H3/t18-,19-,21?,22?,25?,26?,27?,28?,30?,33+,34-,35+,36+/m1/s1","QCAZYVAEXLGYLV-BDZCBAMZSA-N"
"CC1(C)C(OC2OCC(O)C(O)C2O)CC[C@]23C[C@]24CC[C@]2(C)C([C@@]5(C)CC[C@@H](C(C)(C)O)O5)[C@@H](O)C[C@@]2(C)C4C[C@H](OC2OC(CO)C(O)C(O)C2O)C13","InChI=1S/C41H68O14/c1-35(2)24(54-33-29(48)26(45)20(44)17-51-33)9-11-41-18-40(41)13-12-37(5)31(39(7)10-8-25(55-39)36(3,4)50)19(43)15-38(37,6)23(40)14-21(32(35)41)52-34-30(49)28(47)27(46)22(16-42)53-34/h19-34,42-50H,8-18H2,1-7H3/t19-,20?,21-,22?,23?,24?,25-,26?,27?,28?,29?,30?,31?,32?,33?,34?,37+,38-,39+,40-,41+/m0/s1","QMNWISYXSJWHRY-IBCLAKHGSA-N"
"CC1(C)C2CC[C@]3(C)C(C(=O)C=C4[C@@H]5C[C@@](C)(C(=O)O)CC[C@]5(C)CC[C@]43C)[C@@]2(C)CC[C@@H]1O[C@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O[C@H]1O[C@@H](C(=O)O)[C@H](O)[C@@H](O)C1O.N","InChI=1S/C42H62O16.H3N/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50;/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54);1H3/t19-,21?,22-,23+,24+,25-,26-,27?,28+,29-,30+,31?,34+,35-,38+,39-,40-,41+,42+;/m0./s1","ILRKKHJEINIICQ-HVYVWBRBSA-N"
"CC12CC[C@](C)(C(=O)O)CC1C1=CC(=O)[C@@H]3C4(C)CC[C@H](O[C@@H]5O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]5O[C@H]5O[C@@H](C(=O)O)[C@H](O)[C@@H](O)[C@@H]5O)C(C)(C)[C@@H]4CCC3(C)[C@]1(C)CC2.N","InChI=1S/C42H62O16.H3N/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50;/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54);1H3/t19?,21-,22-,23+,24+,25+,26+,27-,28+,29+,30-,31+,34+,35+,38?,39-,40?,41+,42?;/m0./s1","ILRKKHJEINIICQ-XXJJNYGISA-N"
"C[C@@H]1[C@H]2C3=CCC4[C@@]5(C)C[C@@H](O)[C@@H](O)[C@@](C)(CO)C5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(=O)O[C@@H]2O[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](C)[C@@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@H](O)[C@@H](O)[C@H]2O)CC[C@H]1C","InChI=1S/C48H78O19/c1-20-10-13-48(15-14-46(6)23(29(48)21(20)2)8-9-28-44(4)16-24(51)39(60)45(5,19-50)27(44)11-12-47(28,46)7)43(61)67-42-36(58)33(55)31(53)26(65-42)18-62-40-37(59)34(56)38(25(17-49)64-40)66-41-35(57)32(54)30(52)22(3)63-41/h8,20-22,24-42,49-60H,9-19H2,1-7H3/t20-,21+,22-,24-,25-,26+,27?,28?,29+,30-,31+,32+,33-,34-,35-,36-,37-,38-,39-,40-,41+,42+,44+,45+,46-,47-,48+/m1/s1","WYQVAPGDARQUBT-IWROSPCBSA-N"
"CC1OC(OC2C(OC3CC[C@@]4(C)C(CC[C@]5(C)C4CC=C4C6CC(C)(C)CCC6(C(=O)OC6OC(COC7OC(CO)C(O)C(O)C7O)C(O)C(O)C6O)CC[C@]45C)C3(C)C)OCC(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O","InChI=1S/C58H94O25/c1-24-34(62)45(81-48-41(69)35(63)27(60)21-74-48)44(72)50(77-24)82-46-36(64)28(61)22-75-51(46)80-33-12-13-55(6)31(54(33,4)5)11-14-57(8)32(55)10-9-25-26-19-53(2,3)15-17-58(26,18-16-56(25,57)7)52(73)83-49-43(71)40(68)38(66)30(79-49)23-76-47-42(70)39(67)37(65)29(20-59)78-47/h9,24,26-51,59-72H,10-23H2,1-8H3/t24?,26?,27?,28?,29?,30?,31?,32?,33?,34?,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?,47?,48?,49?,50?,51?,55-,56+,57+,58?/m0/s1","BGKLFKHHSFCDKC-KPHKKTKMSA-N"
"CC1O[C@H]2OC3[C@@H](OC[C@H](O)[C@H]3O)OC(=O)[C@]34CCC(C)(C)C[C@H]3C3=CCC5[C@@]6(C)C[C@H](O)[C@H](O[C@@H]7OC(CO)[C@@H](O)[C@@H](O)C7O[C@@H]7OC[C@H](OC(=O)C[C@@](C)(O)CC(=O)O[C@@H]1[C@H](O[C@@H]1OC[C@@H](O)[C@@H](O)C1O)C2O)[C@@H](O)C7O)[C@@](C)(CO)C6CC[C@@]5(C)[C@]3(C)CC4","InChI=1S/C63H98O29/c1-26-46-47(88-51-43(76)38(71)30(67)22-81-51)45(78)53(84-26)90-48-39(72)31(68)23-82-54(48)92-56(79)63-15-13-57(2,3)17-28(63)27-9-10-35-59(5)18-29(66)50(60(6,25-65)34(59)11-12-62(35,8)61(27,7)14-16-63)91-55-49(42(75)40(73)32(21-64)86-55)89-52-44(77)41(74)33(24-83-52)85-36(69)19-58(4,80)20-37(70)87-46/h9,26,28-35,38-55,64-68,71-78,80H,10-25H2,1-8H3/t26?,28-,29-,30+,31-,32?,33-,34?,35?,38+,39+,40+,41+,42+,43?,44?,45?,46-,47+,48?,49?,50-,51-,52-,53-,54-,55-,58+,59-,60-,61+,62+,63-/m0/s1","MCPFEAJYKIXPQF-BCASZIOASA-N"
"COc1c2ccoc2nc2c(OC)c(OCC(O)C(C)(C)OC)ccc12","InChI=1S/C19H23NO6/c1-19(2,24-5)14(21)10-26-13-7-6-11-15(17(13)23-4)20-18-12(8-9-25-18)16(11)22-3/h6-9,14,21H,10H2,1-5H3","UPLMFBXLYYAFTF-UHFFFAOYSA-N"
"C[C@@H]1CCC2[C@](C)(CC[C@H](O)[C@@]2(C)CO)[C@@]12CC1(COC(=O)C1)CO2","InChI=1S/C20H32O5/c1-13-4-5-14-17(2,10-21)15(22)6-7-18(14,3)20(13)9-19(12-25-20)8-16(23)24-11-19/h13-15,21-22H,4-12H2,1-3H3/t13-,14?,15+,17+,18+,19?,20-/m1/s1","QHYFPLAXWXWDJP-GNQMFGHGSA-N"
"CC1C2C(CC3C4CC=C5CC(O)CC[C@]5(C)C4CC[C@@]32C)O[C@]12CC[C@@H](C)CO2","InChI=1S/C27H42O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28H,6-15H2,1-4H3/t16-,17?,19?,20?,21?,22?,23?,24?,25+,26+,27-/m1/s1","WQLVFSAGQJTQCK-LBTHBYAQSA-N"
"OC[C@H]1O[C@@H](n2cnc3c(O)ncnc32)[C@H](O)[C@@H]1O","InChI=1S/C10H12N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)/t4-,6-,7-,10-/m1/s1","UGQMRVRMYYASKQ-KQYNXXCUSA-N"
"CC(=O)OC1CC[C@@]2(C)[C@H](C1)C(=O)C[C@H]1[C@@H]3CCC4C(CN5C[C@@H](C)CC[C@H]5[C@@]4(C)O)[C@@H]3C[C@@H]12","InChI=1S/C29H45NO4/c1-16-5-8-27-29(4,33)23-7-6-19-20(22(23)15-30(27)14-16)12-24-21(19)13-26(32)25-11-18(34-17(2)31)9-10-28(24,25)3/h16,18-25,27,33H,5-15H2,1-4H3/t16-,18?,19+,20+,21-,22?,23?,24-,25+,27-,28+,29-/m0/s1","LCJGVSFMDQXVDC-NQBZMWJKSA-N"
"C[C@@H]1CC[C@H]2[C@@H](C)[C@@H](O)OC3O[C@]4(C)CCC1C32OO4","InChI=1S/C15H24O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-13,16H,4-7H2,1-3H3/t8-,9-,10?,11+,12+,13?,14+,15?/m1/s1","BJDCWCLMFKKGEE-LVSKYXAASA-N"
"CC(C)C(O)(C(=O)OC[C@@H]1CCN2CCC[C@@H]12)C(C)O","InChI=1S/C15H27NO4/c1-10(2)15(19,11(3)17)14(18)20-9-12-6-8-16-7-4-5-13(12)16/h10-13,17,19H,4-9H2,1-3H3/t11?,12-,13-,15?/m0/s1","BWQSLRZZOVFVHJ-FMPXUHTOSA-N"
"CC1(C)CCC[C@@]2(C)C1CC[C@@](C)(O)C2CC(=O)O","InChI=1S/C16H28O3/c1-14(2)7-5-8-15(3)11(14)6-9-16(4,19)12(15)10-13(17)18/h11-12,19H,5-10H2,1-4H3,(H,17,18)/t11?,12?,15-,16+/m0/s1","ASWLRRLLSBVSOH-UQZDFYISSA-N"
"C=C1C(=O)O[C@H]2CC3(C)C(O)CCC(C)(O)C3[C@@H](OC(=O)/C(C)=C/C)C12","InChI=1S/C20H28O6/c1-6-10(2)17(22)26-15-14-11(3)18(23)25-12(14)9-19(4)13(21)7-8-20(5,24)16(15)19/h6,12-16,21,24H,3,7-9H2,1-2,4-5H3/b10-6+/t12-,13?,14?,15-,16?,19?,20?/m0/s1","RDPOODRUMBKGIJ-ROXILYRDSA-N"
"C[C@]12CCC3C(CC=C4CC(O)CC[C@@]43C)C1CCC2O","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-17,20-21H,4-11H2,1-2H3/t13?,14?,15?,16?,17?,18-,19-/m0/s1","QADHLRWLCPCEKT-JRQDRJMYSA-N"
"C=CC1=C(C)/C(=C/c2[nH]c(Cc3[nH]c(/C=C4\N=C(O)C(C)=C4C=C)c(C)c3CCC(=O)O)c(CCC(=O)O)c2C)N=C1O","InChI=1S/C33H36N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,13-14,34-35H,1-2,9-12,15H2,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b26-13-,27-14-","BPYKTIZUTYGOLE-IFADSCNNSA-N"
"C[C@@H]1CCC2[C@](C)(CC[C@H](O)[C@@]2(C)CO)[C@@]12CCC(CO)(CCO)O2.O","InChI=1S/C20H36O5.H2O/c1-14-4-5-15-17(2,12-22)16(24)6-7-18(15,3)20(14)9-8-19(13-23,25-20)10-11-21;/h14-16,21-24H,4-13H2,1-3H3;1H2/t14-,15?,16+,17+,18+,19?,20-;/m1./s1","FMNYIIOAJSNXSS-ZLEPDKQGSA-N"
"CC(C)C(O)(C(=O)OCC1=CCN2CC[C@H](O)[C@@H]12)C(C)O","InChI=1S/C15H25NO5/c1-9(2)15(20,10(3)17)14(19)21-8-11-4-6-16-7-5-12(18)13(11)16/h4,9-10,12-13,17-18,20H,5-8H2,1-3H3/t10?,12-,13+,15?/m0/s1","SFVVQRJOGUKCEG-HFAULKRZSA-N"
"CCC(C)C(=O)O[C@H]1C(O)C2C(CN3C[C@@H](C)CCC3[C@@]2(C)O)C2C[C@]34O[C@]5(O)C(OC(=O)C(C)(O)C(C)O)CCC3(C)C5C[C@@H](O)C4[C@@]21O","InChI=1S/C37H59NO12/c1-8-18(3)30(42)49-29-27(41)26-20(16-38-15-17(2)9-10-24(38)34(26,7)45)21-14-35-28(36(21,29)46)22(40)13-23-32(35,5)12-11-25(37(23,47)50-35)48-31(43)33(6,44)19(4)39/h17-29,39-41,44-47H,8-16H2,1-7H3/t17-,18?,19?,20?,21?,22+,23?,24?,25?,26?,27?,28?,29-,32?,33?,34+,35+,36-,37-/m0/s1","LWSPRPDSPCBAKK-WNERTKKASA-N"
"CC(C)C[C@@H]1N=C(O)[C@H](Cc2ccccc2)N=C1O","InChI=1S/C15H20N2O2/c1-10(2)8-12-14(18)17-13(15(19)16-12)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3,(H,16,19)(H,17,18)/t12-,13-/m0/s1","QPDMOMIYLJMOQJ-STQMWFEESA-N"
"COc1ccc2c(c1OC)CN(C)CCc1cc3c(cc1C(=O)C2)OCO3","InChI=1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(23)8-13-4-5-18(24-2)21(25-3)16(13)11-22/h4-5,9-10H,6-8,11-12H2,1-3H3","HYBRYAPKQCZIAE-UHFFFAOYSA-N"
"COc1ccc2c(c1O)-c1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3","InChI=1S/C20H23NO4/c1-21-8-7-12-10-15(24-3)20(25-4)18-16(12)13(21)9-11-5-6-14(23-2)19(22)17(11)18/h5-6,10,13,22H,7-9H2,1-4H3/t13-/m0/s1","QELDJEKNFOQJOY-ZDUSSCGKSA-N"
"CCN1C[C@]2(C)CCC(OC)C34C2[C@H](OC(C)=O)C2(OCO[C@@]25C[C@H](OC)[C@H]2C[C@]3(O)C5[C@H]2OC)[C@@H]14","InChI=1S/C27H41NO8/c1-7-28-12-23(3)9-8-17(32-5)26-20(23)21(36-14(2)29)27(22(26)28)25(34-13-35-27)11-16(31-4)15-10-24(26,30)19(25)18(15)33-6/h15-22,30H,7-13H2,1-6H3/t15-,16+,17?,18+,19?,20?,21+,22+,23+,24+,25-,26?,27?/m1/s1","DTTPWCNKTMQMTE-ZRAURUGBSA-N"
"COc1cc(CC2c3cc(OC)c(OC)cc3CCN2C)c(Oc2cc3c(cc2OC)-c2c(OC)c(OC)cc4c2C(C3)N(C)CC4)cc1OC","InChI=1S/C41H48N2O8/c1-42-12-10-23-16-32(44-3)34(46-5)20-27(23)29(42)15-26-19-33(45-4)36(48-7)22-31(26)51-37-18-25-14-30-39-24(11-13-43(30)2)17-38(49-8)41(50-9)40(39)28(25)21-35(37)47-6/h16-22,29-30H,10-15H2,1-9H3","ZCTJIMXXSXQXRI-UHFFFAOYSA-N"
"C[C@]1(O)CC(O)C2(O)C=COC(OC3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C21","InChI=1S/C15H24O10/c1-14(21)4-7(17)15(22)2-3-23-13(11(14)15)25-12-10(20)9(19)8(18)6(5-16)24-12/h2-3,6-13,16-22H,4-5H2,1H3/t6-,7?,8-,9+,10-,11?,12?,13?,14+,15?/m1/s1","XUWSHXDEJOOIND-RKYOIMIWSA-N"
"Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O","InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)/t4-,6-,7-,10-/m1/s1","OIRDTQYFTABQOQ-KQYNXXCUSA-N"
"C=C1C[C@]23CC4C5C67C[C@@H](O)C[C@@]5(C)CN4[C@@H]6C2[C@H](O)[C@H]1[C@@H](O)C73","InChI=1S/C20H27NO3/c1-8-3-19-6-10-15-18(2)4-9(22)5-20(15)16(19)14(24)11(8)13(23)12(19)17(20)21(10)7-18/h9-17,22-24H,1,3-7H2,2H3/t9-,10?,11-,12?,13+,14+,15?,16?,17+,18-,19-,20?/m0/s1","PIWJSAMCEMZIDO-BUYRRCERSA-N"
"C=C[C@](C)(O)CC[C@@H]1[C@@]2(C)CCCC(C)(C)C2CC[C@@]1(C)O","InChI=1S/C20H36O2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h7,15-16,21-22H,1,8-14H2,2-6H3/t15?,16-,18+,19+,20-/m1/s1","XVULBTBTFGYVRC-FFADBYAMSA-N"
"OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](CO[C@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O","InChI=1S/C18H32O16/c19-1-5-8(22)11(25)13(27)16(31-5)30-3-7-9(23)12(26)14(28)17(32-7)34-18(4-21)15(29)10(24)6(2-20)33-18/h5-17,19-29H,1-4H2/t5-,6+,7-,8+,9-,10+,11+,12+,13-,14-,15-,16+,17-,18-/m1/s1","MUPFEKGTMRGPLJ-OARNWLFOSA-N"
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"C[C@H]1CC[C@@H]2N(CC3[C@@H]4C[C@]56O[C@]7(O)C(O)CC[C@@]5(C)C7C[C@@H](O)[C@H]6[C@]4(O)[C@@H](O)C(O)[C@@H]3[C@]2(C)O)C1","InChI=1S/C27H43NO8/c1-12-4-5-17-24(3,33)19-13(11-28(17)10-12)14-9-25-21(26(14,34)22(32)20(19)31)15(29)8-16-23(25,2)7-6-18(30)27(16,35)36-25/h12-22,29-35H,4-11H2,1-3H3/t12-,13?,14-,15+,16?,17-,18?,19+,20?,21+,22-,23-,24+,25+,26-,27-/m0/s1","RNPABQVCNAUEIY-WDJXZMKESA-N"
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"C=CC1=C(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5C=C)C(C)=C4CCC(=O)[O-])c(CCC(=O)[O-])c3C.[Na+].[Na+]","InChI=1S/C34H34N4O4.2Na/c1-7-21-17(3)25-13-26-19(5)23(9-11-33(39)40)31(37-26)16-32-24(10-12-34(41)42)20(6)28(38-32)15-30-22(8-2)18(4)27(36-30)14-29(21)35-25;;/h7-8,13-16,36-37H,1-2,9-12H2,3-6H3,(H,39,40)(H,41,42);;/q;2*+1/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;;","JZRNDUPVNXWZDY-HXFTUNQESA-L"
"O=C(O)[C@@H](O)[C@@H](O)C(O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@@H](O)CO","InChI=1S/C12H22O12/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12/h3-10,12-20H,1-2H2,(H,21,22)/t3-,4+,5-,6-,7+,8-,9+,10?,12-/m0/s1","JYTUSYBCFIZPBE-LLTWZBGYSA-N"
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"C/C=C/c1ccc(OC(C)[C@@H](O)c2ccc(O)c(OC)c2)c(OC)c1","InChI=1S/C20H24O5/c1-5-6-14-7-10-17(19(11-14)24-4)25-13(2)20(22)15-8-9-16(21)18(12-15)23-3/h5-13,20-22H,1-4H3/b6-5+/t13?,20-/m1/s1","WCFYXOLUODJLKB-PFAYCKMXSA-N"
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"C[C@@H]1CCC2[C@H](C)C3CCC4C(CC5C4C[C@H](O)[C@H]4C[C@@H](O)CC[C@]54C)C3CN2C1","InChI=1S/C27H45NO2/c1-15-4-7-25-16(2)18-5-6-19-20(22(18)14-28(25)13-15)11-23-21(19)12-26(30)24-10-17(29)8-9-27(23,24)3/h15-26,29-30H,4-14H2,1-3H3/t15-,16-,17+,18?,19?,20?,21?,22?,23?,24-,25?,26+,27-/m1/s1","NEMWYOKGHGSVSC-JDFUPSAOSA-N"
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"CC[C@@]1([C@@H]2O[C@@H]([C@H]3O[C@@](O)(CO)[C@H](C)C[C@@H]3C)C[C@@H]2C)CC[C@H](C2(C)CCC3(C[C@H](O)[C@@H](C)[C@@H]([C@@H](C)[C@H](OC)[C@@H](C)C(=O)[O-])O3)O2)O1.[Na+]","InChI=1S/C36H62O11.Na/c1-10-34(31-20(3)16-26(43-31)28-19(2)15-21(4)36(41,18-37)46-28)12-11-27(44-34)33(8)13-14-35(47-33)17-25(38)22(5)30(45-35)23(6)29(42-9)24(7)32(39)40;/h19-31,37-38,41H,10-18H2,1-9H3,(H,39,40);/q;+1/p-1/t19-,20-,21+,22+,23-,24+,25-,26+,27+,28-,29-,30-,31+,33?,34-,35?,36-;/m0./s1","XOIQMTLWECTKJL-TVQBLREMSA-M"
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"CC1CC[C@@]2(OC1)OC1CC3C4CC[C@H]5CC(O)CC[C@]5(C)C4CC[C@]3(C)C1[C@@H]2C","InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3/t16?,17-,18-,19?,20?,21?,22?,23?,24?,25-,26-,27+/m0/s1","GMBQZIIUCVWOCD-IGLOFRDLSA-N"
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"C[C@H]1O[C@@H](O[C@H]2[C@@H](CO)O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C27H30O16/c1-8-17(33)19(35)21(37)26(39-8)42-24-15(7-28)41-27(22(38)20(24)36)43-25-18(34)16-13(32)5-10(29)6-14(16)40-23(25)9-2-3-11(30)12(31)4-9/h2-6,8,15,17,19-22,24,26-33,35-38H,7H2,1H3/t8-,15-,17+,19-,20-,21-,22-,24+,26+,27+/m1/s1","SKOCCRDVSSOREC-IFHHWCCPSA-N"
"CC(=O)OC1CC[C@]23C[C@]24CC[C@]2(C)C([C@]5(C)CC[C@H](C(C)(C)O)O5)C(O)C[C@@]2(C)C4C[C@H](OC(C)=O)C3C1(C)C","InChI=1S/C34H54O7/c1-19(35)39-22-16-23-31(8)17-21(37)26(32(9)12-10-25(41-32)29(5,6)38)30(31,7)14-15-33(23)18-34(33)13-11-24(40-20(2)36)28(3,4)27(22)34/h21-27,37-38H,10-18H2,1-9H3/t21?,22-,23?,24?,25+,26?,27?,30+,31-,32-,33-,34+/m0/s1","BDQONUUZFOYJFL-PUYXCIJSSA-N"
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"COc1ccc2[nH]cc(C(=O)CN(C)C)c2c1","InChI=1S/C13H16N2O2/c1-15(2)8-13(16)11-7-14-12-5-4-9(17-3)6-10(11)12/h4-7,14H,8H2,1-3H3","LPMKRELFHFSDTK-UHFFFAOYSA-N"
"C[C@H]1CC[C@@H]2N(C1)C[C@H]1[C@@H]3C[C@H]4[C@@H](CC(=O)[C@H]5C[C@@H](O)CC[C@@]54C)[C@@H]3CC[C@H]1[C@]2(C)O","InChI=1S/C27H43NO3/c1-15-4-7-25-27(3,31)21-6-5-17-18(20(21)14-28(25)13-15)11-22-19(17)12-24(30)23-10-16(29)8-9-26(22,23)2/h15-23,25,29,31H,4-14H2,1-3H3/t15-,16-,17+,18+,19-,20-,21+,22-,23+,25-,26+,27-/m0/s1","IQDIERHFZVCNRZ-LRCDAWNTSA-N"
"C/C=C1\C2C=C(C)CC1(N)c1ccc(O)nc1C2","InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+","ZRJBHWIHUMBLCN-QDEBKDIKSA-N"
"CC(=O)O[C@H]1CC(C)=C2C(=O)C=C(C)[C@@H]2[C@H]2OC(=O)[C@@H](C)C12","InChI=1S/C17H20O5/c1-7-5-11(19)13-8(2)6-12(21-10(4)18)15-9(3)17(20)22-16(15)14(7)13/h5,9,12,14-16H,6H2,1-4H3/t9-,12-,14-,15?,16+/m0/s1","QONYNSMAVSRIRD-SHVWVCQGSA-N"
"CCCCC[C@H](O)/C=C/[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)O","InChI=1S/C20H34O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h12,14,16-18,21H,2-11,13,15H2,1H3,(H,23,24)/b14-12+/t16-,17-,18+/m0/s1","DPNOTBLPQOITGU-LDDQNKHRSA-N"
"C[C@]12CCC3C(CCC4=CC(O)CC[C@@]43C=O)C1(O)CCC2C1=CC(=O)OC1","InChI=1S/C23H30O5/c1-21-7-5-18-19(3-2-15-11-16(25)4-8-22(15,18)13-24)23(21,27)9-6-17(21)14-10-20(26)28-12-14/h10-11,13,16-19,25,27H,2-9,12H2,1H3/t16?,17?,18?,19?,21-,22-,23?/m1/s1","JPIDFRQBAGAXJM-NGIHOKHASA-N"
"C[C@]12CCC3C(CCC4CC(O)CC[C@@]43C)C1=CC=C2C1=CC(=O)OC1","InChI=1S/C23H30O3/c1-22-9-7-16(24)12-15(22)3-4-17-19-6-5-18(14-11-21(25)26-13-14)23(19,2)10-8-20(17)22/h5-6,11,15-17,20,24H,3-4,7-10,12-13H2,1-2H3/t15?,16?,17?,20?,22-,23+/m0/s1","CJAOKHQEBDVGKO-CPHGQHJYSA-N"
"C[C@H]1O[C@@H](OC2CC[C@]3(C=O)C4CC[C@]5(C)C(C6=CC(=O)OC6)CCC5(O)C4CCC3(O)C2)C[C@H](O)C1OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O","InChI=1S/C35H52O14/c1-17-30(49-31-29(42)28(41)27(40)24(14-36)48-31)23(38)12-26(46-17)47-19-3-8-33(16-37)21-4-7-32(2)20(18-11-25(39)45-15-18)6-10-35(32,44)22(21)5-9-34(33,43)13-19/h11,16-17,19-24,26-31,36,38,40-44H,3-10,12-15H2,1-2H3/t17-,19?,20?,21?,22?,23+,24-,26+,27-,28+,29-,30?,31?,32-,33+,34?,35?/m1/s1","KQBVSIZPUWODNU-TWBSMWMUSA-N"
"C=C(C)[C@@H]1CCC2(C=O)CC[C@]3(C)C(CCC4[C@@]5(C)CCC(=O)C(C)(C)C5CC[C@]43C)C12","InChI=1S/C30H46O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h18,20-23,25H,1,8-17H2,2-7H3/t20-,21?,22?,23?,25?,27-,28+,29+,30?/m0/s1","MHAVMNJPXLZEIG-YRBIWMMXSA-N"
"CC1(C)COC(=O)C1O","InChI=1S/C6H10O3/c1-6(2)3-9-5(8)4(6)7/h4,7H,3H2,1-2H3","SERHXTVXHNVDKA-UHFFFAOYSA-N"
"COc1ccc2c(c1)C(=O)CC(c1ccc(OC)c(OC)c1)O2","InChI=1S/C18H18O5/c1-20-12-5-7-15-13(9-12)14(19)10-17(23-15)11-4-6-16(21-2)18(8-11)22-3/h4-9,17H,10H2,1-3H3","KYRMOZFTJMQBFZ-UHFFFAOYSA-N"
"O=C(CC(=O)c1ccccc1O)c1ccccc1","InChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-9,16H,10H2","OABFIJGAEVKMJP-UHFFFAOYSA-N"
"CC(C)C1Oc2cc3oc(=O)ccc3cc2C1=O","InChI=1S/C14H12O4/c1-7(2)14-13(16)9-5-8-3-4-12(15)17-10(8)6-11(9)18-14/h3-7,14H,1-2H3","PYTXVUBIYABGPG-UHFFFAOYSA-N"
"C[C@]12CCC3C(CCC4(O)CC(O)CC[C@]34C=O)C1(O)CC(O)[C@H]2C1=CC(=O)OC1","InChI=1S/C23H32O7/c1-20-5-3-15-16(4-7-22(28)9-14(25)2-6-21(15,22)12-24)23(20,29)10-17(26)19(20)13-8-18(27)30-11-13/h8,12,14-17,19,25-26,28-29H,2-7,9-11H2,1H3/t14?,15?,16?,17?,19-,20-,21+,22?,23?/m1/s1","LKRKDJSHACERQF-NBJYSJMPSA-N"
"O=C(O)[C@H]1Cc2c([nH]c3ccccc23)CN1","InChI=1S/C12H12N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-4,10,13-14H,5-6H2,(H,15,16)/t10-/m1/s1","FSNCEEGOMTYXKY-SNVBAGLBSA-N"
"OCC1=CCN2CC[C@@H](O)[C@@H]12","InChI=1S/C8H13NO2/c10-5-6-1-3-9-4-2-7(11)8(6)9/h1,7-8,10-11H,2-5H2/t7-,8-/m1/s1","HJSJELVDQOXCHO-HTQZYQBOSA-N"
"CC(C)(O)CC[C@H](O)[C@](C)(O)C1CC[C@@]2(O)C3=CC(=O)C4CC(O)C(O)C[C@]4(C)C3[C@H](O)C[C@]12C","InChI=1S/C27H44O8/c1-23(2,33)8-7-21(32)26(5,34)20-6-9-27(35)15-11-16(28)14-10-17(29)18(30)12-24(14,3)22(15)19(31)13-25(20,27)4/h11,14,17-22,29-35H,6-10,12-13H2,1-5H3/t14?,17?,18?,19-,20?,21+,22?,24+,25-,26-,27-/m1/s1","WSBAGDDNVWTLOM-ULTQMYNUSA-N"
"CC(=O)O[C@H]1[C@H](OC2CC[C@]34C[C@]35CC[C@]3(C)C([C@@]6(C)CC[C@@H](C(C)(C)O)O6)[C@@H](O)C[C@@]3(C)C5C[C@H](O)C4C2(C)C)OC[C@@H](O)[C@@H]1O","InChI=1S/C37H60O10/c1-19(38)45-27-26(42)22(41)17-44-30(27)46-24-10-12-37-18-36(37)14-13-33(6)29(35(8)11-9-25(47-35)32(4,5)43)21(40)16-34(33,7)23(36)15-20(39)28(37)31(24,2)3/h20-30,39-43H,9-18H2,1-8H3/t20-,21-,22+,23?,24?,25-,26-,27+,28?,29?,30-,33+,34-,35+,36-,37+/m0/s1","KILZIJKCZIGLFJ-KFRJDVSMSA-N"
"COC1C(O)C(C)OC(OC2CC[C@]3(C=O)C4CC[C@]5(C)C(c6ccc(=O)oc6)CCC5(O)C4CC[C@H]3C2)C1O","InChI=1S/C31H44O9/c1-17-25(34)27(37-3)26(35)28(39-17)40-20-8-12-30(16-32)19(14-20)5-6-23-22(30)9-11-29(2)21(10-13-31(23,29)36)18-4-7-24(33)38-15-18/h4,7,15-17,19-23,25-28,34-36H,5-6,8-14H2,1-3H3/t17?,19-,20?,21?,22?,23?,25?,26?,27?,28?,29+,30+,31?/m0/s1","NYOVJCZRJINYSI-MKTHFNAYSA-N"
"CC(C)(O)CC[C@H]1OC(C)(C)O[C@]1(C)[C@H]1CC[C@@]2(O)C3=CC(=O)[C@@H]4C[C@H]5OC(C)(C)O[C@H]5C[C@]4(C)[C@H]3CC[C@]12C","InChI=1S/C33H52O7/c1-27(2,35)13-12-26-32(9,40-29(5,6)39-26)25-11-15-33(36)20-16-22(34)21-17-23-24(38-28(3,4)37-23)18-30(21,7)19(20)10-14-31(25,33)8/h16,19,21,23-26,35-36H,10-15,17-18H2,1-9H3/t19-,21-,23+,24-,25-,26+,30+,31+,32+,33+/m0/s1","WXFMGCVRGSIXOB-APTIWFLNSA-N"
"CC(C)c1cccc(O)c(=O)c1","InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)","FUWUEFKEXZQKKA-UHFFFAOYSA-N"
"O=C1[C@@H](Cc2ccccc2)N=C(O)[C@@H]2CCCN12","InChI=1S/C14H16N2O2/c17-13-12-7-4-8-16(12)14(18)11(15-13)9-10-5-2-1-3-6-10/h1-3,5-6,11-12H,4,7-9H2,(H,15,17)/t11-,12+/m1/s1","QZBUWPVZSXDWSB-NEPJUHHUSA-N"
"CC(=O)OC1CC[C@]2(C)C3=CC(=O)[C@@]4(C)C(CC5O[C@]6(CCC(C)CO6)[C@@H](C)C54)C3CC[C@H]2C1","InChI=1S/C29H42O5/c1-16-8-11-29(32-15-16)17(2)26-24(34-29)13-23-21-7-6-19-12-20(33-18(3)30)9-10-27(19,4)22(21)14-25(31)28(23,26)5/h14,16-17,19-21,23-24,26H,6-13,15H2,1-5H3/t16?,17-,19-,20?,21?,23?,24?,26?,27-,28+,29+/m0/s1","CZWQTXLSOGRWOU-SOAXHMGVSA-N"
"CC(C)(O)C1CC[C@](C)(C2CC[C@]3(C)C2C[C@@H](O)C2[C@@]4(C)CC[C@H](O)C(C)(C)C4CC[C@]23C)O1","InChI=1S/C30H52O4/c1-25(2)21-10-15-29(7)24(27(21,5)13-11-22(25)32)20(31)17-19-18(9-14-28(19,29)6)30(8)16-12-23(34-30)26(3,4)33/h18-24,31-33H,9-17H2,1-8H3/t18?,19?,20-,21?,22+,23?,24?,27+,28-,29-,30-/m1/s1","VGALEQRDKRZJFD-NGJDISLOSA-N"
"CO[C@H]1C[C@H](OC2CC[C@]3(C)C4CC[C@]5(C)C(C6=CC(=O)OC6)CCC5(O)C4CCC3(O)C2)O[C@H](C)C1OC1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O","InChI=1S/C36H56O13/c1-18-31(49-32-30(41)29(40)28(39)25(16-37)48-32)24(44-4)14-27(46-18)47-20-5-9-33(2)22-6-10-34(3)21(19-13-26(38)45-17-19)8-12-36(34,43)23(22)7-11-35(33,42)15-20/h13,18,20-25,27-32,37,39-43H,5-12,14-17H2,1-4H3/t18-,20?,21?,22?,23?,24+,25-,27+,28-,29+,30-,31?,32?,33-,34-,35?,36?/m1/s1","KWBPKUMWVXUSCA-YCUSOVAHSA-N"
"CC1OC(OC2CC[C@]3(C=O)[C@H]4CC[C@]5(C)[C@H](C6=CC(=O)OC6)CCC5(O)C4CCC3(O)C2)CC(O)C1O","InChI=1S/C29H42O9/c1-16-25(33)22(31)12-24(37-16)38-18-3-8-27(15-30)20-4-7-26(2)19(17-11-23(32)36-14-17)6-10-29(26,35)21(20)5-9-28(27,34)13-18/h11,15-16,18-22,24-25,31,33-35H,3-10,12-14H2,1-2H3/t16?,18?,19-,20-,21?,22?,24?,25?,26+,27-,28?,29?/m0/s1","QBILRDAMJUPXCX-FQDFIMLHSA-N"
"O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@](O)(C(=O)O)C[C@@H](O)[C@H]1O","InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1","CWVRJTMFETXNAD-JUHZACGLSA-N"
"O=C(C=Cc1ccc(O)c(O)c1)OC1C(O)CC(O)(C(=O)O)CC1O","InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-14-11(19)6-16(24,15(22)23)7-12(14)20/h1-5,11-12,14,17-20,24H,6-7H2,(H,22,23)","GYFFKZTYYAFCTR-UHFFFAOYSA-N"
"O=C(/C=C/c1ccc(O)c(O)c1)OC1(C(=O)O)C[C@H](O)C(O)[C@@H](O)C1","InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(21)25-16(15(23)24)6-11(19)14(22)12(20)7-16/h1-5,11-12,14,17-20,22H,6-7H2,(H,23,24)/b4-2+/t11-,12-,14?,16?/m0/s1","GWTUHAXUUFROTF-YMQLDNTMSA-N"
"O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@@](OC(=O)/C=C/c2ccc(O)c(O)c2)(C(=O)O)C[C@@H](O)[C@@H]1O","InChI=1S/C25H24O12/c26-15-5-1-13(9-17(15)28)3-7-21(31)36-20-12-25(24(34)35,11-19(30)23(20)33)37-22(32)8-4-14-2-6-16(27)18(29)10-14/h1-10,19-20,23,26-30,33H,11-12H2,(H,34,35)/b7-3+,8-4+/t19-,20-,23+,25-/m1/s1","YDDUMTOHNYZQPO-RVXRWRFUSA-N"
"COc1cc(/C=C/C(=O)O[C@@H]2C[C@](O)(C(=O)O)C[C@@H](O)[C@H]2O)ccc1O","InChI=1S/C17H20O9/c1-25-12-6-9(2-4-10(12)18)3-5-14(20)26-13-8-17(24,16(22)23)7-11(19)15(13)21/h2-6,11,13,15,18-19,21,24H,7-8H2,1H3,(H,22,23)/b5-3+/t11-,13-,15-,17+/m1/s1","RAGZUCNPTLULOL-KJJWLSQTSA-N"
"COc1cc(C=CC(=O)OC2CC(O)(C(=O)O)CC(O)C2O)ccc1O","InChI=1S/C17H20O9/c1-25-12-6-9(2-4-10(12)18)3-5-14(20)26-13-8-17(24,16(22)23)7-11(19)15(13)21/h2-6,11,13,15,18-19,21,24H,7-8H2,1H3,(H,22,23)","RAGZUCNPTLULOL-UHFFFAOYSA-N"
"O=C(/C=C/c1ccc(O)cc1)OC1[C@H](O)CC(O)(C(=O)O)C[C@H]1O","InChI=1S/C16H18O8/c17-10-4-1-9(2-5-10)3-6-13(20)24-14-11(18)7-16(23,15(21)22)8-12(14)19/h1-6,11-12,14,17-19,23H,7-8H2,(H,21,22)/b6-3+/t11-,12-,14?,16?/m1/s1","XWRHBGVVCOSNKO-OPGYGNEESA-N"
"O=C(O)c1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc1","InChI=1S/C13H16O8/c14-5-8-9(15)10(16)11(17)13(21-8)20-7-3-1-6(2-4-7)12(18)19/h1-4,8-11,13-17H,5H2,(H,18,19)/t8-,9-,10+,11-,13-/m1/s1","XSSDYIMYZONMBL-BZNQNGANSA-N"
"O=c1ccc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc2o1","InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2/t10-,12-,13+,14-,15-/m1/s1","XHCADAYNFIFUHF-TVKJYDDYSA-N"
"C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)c(O)c4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C27H30O16/c1-8-17(32)20(35)22(37)26(40-8)39-7-15-18(33)21(36)23(38)27(42-15)43-25-19(34)16-13(31)5-10(28)6-14(16)41-24(25)9-2-3-11(29)12(30)4-9/h2-6,8,15,17-18,20-23,26-33,35-38H,7H2,1H3/t8-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","IKGXIBQEEMLURG-NVPNHPEKSA-N"
"C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(c3)OC(c3ccc(O)c(O)c3)CC4=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C27H32O15/c1-9-20(32)22(34)24(36)26(39-9)38-8-18-21(33)23(35)25(37)27(42-18)40-11-5-14(30)19-15(31)7-16(41-17(19)6-11)10-2-3-12(28)13(29)4-10/h2-6,9,16,18,20-30,32-37H,7-8H2,1H3/t9-,16?,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1","OMQADRGFMLGFJF-GDRLQRQZSA-N"
"O=c1c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15+,17+,18-,21+/m1/s1","OVSQVDMCBVZWGM-DTGCRPNFSA-N"
"C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C27H32O14/c1-10-20(31)22(33)24(35)26(38-10)37-9-18-21(32)23(34)25(36)27(41-18)39-13-6-14(29)19-15(30)8-16(40-17(19)7-13)11-2-4-12(28)5-3-11/h2-7,10,16,18,20-29,31-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1","HXTFHSYLYXVTHC-AJHDJQPGSA-N"
"O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1","OVSQVDMCBVZWGM-QSOFNFLRSA-N"
"C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(-c4ccc(O)cc4)oc4cc(O)cc(O)c4c3=O)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C27H30O15/c1-9-17(31)20(34)22(36)26(39-9)38-8-15-18(32)21(35)23(37)27(41-15)42-25-19(33)16-13(30)6-12(29)7-14(16)40-24(25)10-2-4-11(28)5-3-10/h2-7,9,15,17-18,20-23,26-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,23+,26+,27-/m0/s1","RTATXGUCZHCSNG-QHWHWDPRSA-N"
"O=c1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12","InChI=1S/C21H20O11/c22-7-13-15(26)17(28)18(29)21(31-13)32-20-16(27)14-11(25)5-10(24)6-12(14)30-19(20)8-1-3-9(23)4-2-8/h1-6,13,15,17-18,21-26,28-29H,7H2/t13-,15-,17+,18-,21+/m1/s1","JPUKWEQWGBDDQB-QSOFNFLRSA-N"
"COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO[C@@H]3O[C@@H](C)[C@H](O)[C@@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O","InChI=1S/C28H32O16/c1-9-18(32)21(35)23(37)27(41-9)40-8-16-19(33)22(36)24(38)28(43-16)44-26-20(34)17-13(31)6-11(29)7-15(17)42-25(26)10-3-4-12(30)14(5-10)39-2/h3-7,9,16,18-19,21-24,27-33,35-38H,8H2,1-2H3/t9-,16+,18-,19+,21+,22-,23+,24+,27+,28-/m0/s1","UIDGLYUNOUKLBM-GEBJFKNCSA-N"
"O=C(O)C1OC(Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O","InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)","DUBCCGAQYVUYEU-UHFFFAOYSA-N"
"O=C(O)C1OC(Oc2cc(O)c3c(=O)cc(-c4ccc(O)c(O)c4)oc3c2)C(O)C(O)C1O","InChI=1S/C21H18O12/c22-9-2-1-7(3-10(9)23)13-6-12(25)15-11(24)4-8(5-14(15)32-13)31-21-18(28)16(26)17(27)19(33-21)20(29)30/h1-6,16-19,21-24,26-28H,(H,29,30)","VSUOKLTVXQRUSG-UHFFFAOYSA-N"
"COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2OC2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)ccc1O","InChI=1S/C22H22O12/c1-31-12-4-8(2-3-10(12)25)20-21(17(28)15-11(26)5-9(24)6-13(15)32-20)34-22-19(30)18(29)16(27)14(7-23)33-22/h2-6,14,16,18-19,22-27,29-30H,7H2,1H3/t14-,16-,18+,19+,22?/m1/s1","CQLRUIIRRZYHHS-OMUJUXNISA-N"
"COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)ccc1O","InChI=1S/C22H22O12/c1-31-12-4-8(2-3-10(12)25)20-21(17(28)15-11(26)5-9(24)6-13(15)32-20)34-22-19(30)18(29)16(27)14(7-23)33-22/h2-6,14,16,18-19,22-27,29-30H,7H2,1H3/t14-,16-,18+,19-,22+/m1/s1","CQLRUIIRRZYHHS-LFXZADKFSA-N"
"O=C(O)C1OC(Oc2c(-c3ccc(O)cc3)oc3cc(O)cc(O)c3c2=O)C(O)C(O)C1O","InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)17-18(13(25)12-10(24)5-9(23)6-11(12)31-17)32-21-16(28)14(26)15(27)19(33-21)20(29)30/h1-6,14-16,19,21-24,26-28H,(H,29,30)","FNTJVYCFNVUBOL-UHFFFAOYSA-N"
"COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)ccc1O","InChI=1S/C22H20O13/c1-32-11-4-7(2-3-9(11)24)18-19(14(26)13-10(25)5-8(23)6-12(13)33-18)34-22-17(29)15(27)16(28)20(35-22)21(30)31/h2-6,15-17,20,22-25,27-29H,1H3,(H,30,31)/t15-,16-,17+,20-,22+/m0/s1","VVZWHOMBDMMRSC-NTKSAMNMSA-N"
"O=C(/C=C/c1ccc(O)c(O)c1)O[C@H](Cc1ccc(O)c(O)c1)C(=O)O","InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m1/s1","DOUMFZQKYFQNTF-WUTVXBCWSA-N"
"O=C(O)[C@H]1O[C@H](Oc2cc(O)c3c(=O)cc(-c4ccc(O)cc4)oc3c2)[C@H](O)[C@@H](O)[C@@H]1O","InChI=1S/C21H18O11/c22-9-3-1-8(2-4-9)13-7-12(24)15-11(23)5-10(6-14(15)31-13)30-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21-23,25-27H,(H,28,29)/t16-,17-,18+,19-,21-/m0/s1","JBFOLLJCGUCDQP-UNJWAJPSSA-N"
"COc1ccc(-c2cc(=O)c3c(O)cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)[C@@H](O)[C@H](O)[C@H]4O)cc3o2)cc1","InChI=1S/C28H32O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-9,11,19,21-29,31-36H,10H2,1-2H3/t11-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1","YFVGIJBUXMQFOF-PJOVQGMDSA-N"
"COc1ccc(-c2cc(=O)c3c(O)cc(O)cc3o2)cc1","InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3","DANYIYRPLHHOCZ-UHFFFAOYSA-N"
"O=c1c(O)c(-c2ccc(O)cc2)oc2cc(O)cc(O)c12","InChI=1S/C15H10O6/c16-8-3-1-7(2-4-8)15-14(20)13(19)12-10(18)5-9(17)6-11(12)21-15/h1-6,16-18,20H","IYRMWMYZSQPJKC-UHFFFAOYSA-N"
"COc1cc(-c2oc3cc(O)cc(O)c3c(=O)c2O)ccc1O","InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3","IZQSVPBOUDKVDZ-UHFFFAOYSA-N"
"O=C(O)c1cc(O)c(O)c(O)c1","InChI=1S/C7H6O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,8-10H,(H,11,12)","LNTHITQWFMADLM-UHFFFAOYSA-N"
"O=C(O)c1ccc(O)c(O)c1","InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)","YQUVCSBJEUQKSH-UHFFFAOYSA-N"
"Oc1cc(O)c2c(c1)O[C@H](c1ccc(O)c(O)c1)[C@@H](O)C2","InChI=1S/C15H14O6/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7/h1-5,13,15-20H,6H2/t13-,15+/m0/s1","PFTAWBLQPZVEMU-DZGCQCFKSA-N"
"O=C(O)/C=C/c1ccc(O)c(O)c1","InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+","QAIPRVGONGVQAS-DUXPYHPUSA-N"
"O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12","InChI=1S/C21H20O11/c22-6-14-17(27)19(29)20(30)21(32-14)16-11(26)5-13-15(18(16)28)10(25)4-12(31-13)7-1-2-8(23)9(24)3-7/h1-5,14,17,19-24,26-30H,6H2/t14-,17-,19+,20-,21+/m1/s1","ODBRNZZJSYPIDI-VJXVFPJBSA-N"
"O=c1cc(-c2ccc(O)c(O)c2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12","InChI=1S/C21H20O11/c22-6-14-17(28)18(29)19(30)21(32-14)16-11(26)4-10(25)15-12(27)5-13(31-20(15)16)7-1-2-8(23)9(24)3-7/h1-5,14,17-19,21-26,28-30H,6H2/t14-,17-,18+,19-,21+/m1/s1","PLAPMLGJVGLZOV-VPRICQMDSA-N"
"COc1cc(/C=C/C(=O)O)ccc1O","InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+","KSEBMYQBYZTDHS-HWKANZROSA-N"
"O=c1cc(-c2ccc(O)cc2)oc2c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)cc(O)c12","InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2/t14-,17-,18+,19-,21+/m1/s1","SGEWCQFRYRRZDC-VPRICQMDSA-N"
"O=c1cc(-c2ccc(O)cc2)oc2cc(O)c([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c(O)c12","InChI=1S/C21H20O10/c22-7-14-17(26)19(28)20(29)21(31-14)16-11(25)6-13-15(18(16)27)10(24)5-12(30-13)8-1-3-9(23)4-2-8/h1-6,14,17,19-23,25-29H,7H2/t14-,17-,19+,20-,21+/m1/s1","MYXNWGACZJSMBT-VJXVFPJBSA-N"
"C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc4c3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C27H30O14/c1-10-20(31)22(33)24(35)26(38-10)37-9-18-21(32)23(34)25(36)27(41-18)39-13-6-14(29)19-15(30)8-16(40-17(19)7-13)11-2-4-12(28)5-3-11/h2-8,10,18,20-29,31-36H,9H2,1H3/t10-,18+,20-,21+,22+,23-,24+,25+,26+,27+/m0/s1","FKIYLTVJPDLUDL-SLNHTJRHSA-N"
"O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c21","InChI=1S/C21H22O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-6,14,16,18-24,26-28H,7-8H2/t14-,16+,18+,19-,20+,21+/m0/s1","DLIKSSGEMUFQOK-SFTVRKLSSA-N"
"C[C@@H]1O[C@@H](Oc2c(-c3ccc(O)c(O)c3)oc3cc(O)cc(O)c3c2=O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C21H20O11/c1-7-15(26)17(28)18(29)21(30-7)32-20-16(27)14-12(25)5-9(22)6-13(14)31-19(20)8-2-3-10(23)11(24)4-8/h2-7,15,17-18,21-26,28-29H,1H3/t7-,15-,17+,18+,21-/m0/s1","OXGUCUVFOIWWQJ-HQBVPOQASA-N"
"C[C@@H]1O[C@@H](O[C@H]2[C@H](Oc3cc(O)c4c(c3)O[C@H](c3ccc(O)cc3)CC4=O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O","InChI=1S/C27H32O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-7,10,16,18,20-30,32-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1","DFPMSGMNTNDNHN-ZPHOTFPESA-N"
"C[C@@H]1O[C@@H](O[C@H]2C(Oc3cc(O)c4c(=O)c(O)c(-c5ccc(O)cc5)oc4c3)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)C(O)[C@H]1O","InChI=1S/C27H30O15/c1-9-17(31)20(34)23(37)26(38-9)42-25-21(35)18(32)15(8-28)41-27(25)39-12-6-13(30)16-14(7-12)40-24(22(36)19(16)33)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-21,23,25-32,34-37H,8H2,1H3/t9-,15+,17-,18+,20?,21-,23+,25+,26-,27?/m0/s1","ZEJXENDZTYVXDP-ICERRTQUSA-N"
"O=c1cc(-c2ccc(O)cc2)oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12","InChI=1S/C21H20O10/c22-8-16-18(26)19(27)20(28)21(31-16)29-11-5-12(24)17-13(25)7-14(30-15(17)6-11)9-1-3-10(23)4-2-9/h1-7,16,18-24,26-28H,8H2/t16-,18-,19+,20-,21-/m1/s1","KMOUJOKENFFTPU-QNDFHXLGSA-N"
"O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12","InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H","REFJWTPEDVJJIY-UHFFFAOYSA-N"
"O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12","InChI=1S/C15H10O6/c16-8-4-11(19)15-12(20)6-13(21-14(15)5-8)7-1-2-9(17)10(18)3-7/h1-6,16-19H","IQPNAANSBPBGFQ-UHFFFAOYSA-N"
"O=c1cc(-c2ccc(O)c(-c3c(O)cc(O)c4c(=O)cc(-c5ccc(O)cc5)oc34)c2)oc2cc(O)cc(O)c12","InChI=1S/C30H18O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-12,31-36H","YUSWMAULDXZHPY-UHFFFAOYSA-N"
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"COC(=O)[C@@H]1C[C@@]23C=CCN4CC[C@@]5(c6ccccc6N[C@]15[C@@H]2C)[C@@H]43","InChI=1S/C21H24N2O2/c1-13-19-8-5-10-23-11-9-20(18(19)23)14-6-3-4-7-16(14)22-21(13,20)15(12-19)17(24)25-2/h3-8,13,15,18,22H,9-12H2,1-2H3/t13-,15+,18+,19+,20-,21-/m1/s1","JSLDLCGKZDUQSH-SBDPWIONSA-N"
"CC[C@]1(O)C[C@H]2CN(CCc3c([nH]c4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C=O)[C@H]3[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]5(CC)C=CCN6CC[C@]43[C@@H]65)C2)C1","InChI=1S/C46H56N4O10/c1-7-42(55)22-28-23-45(40(53)58-5,36-30(14-18-48(24-28)25-42)29-12-9-10-13-33(29)47-36)32-20-31-34(21-35(32)57-4)50(26-51)38-44(31)16-19-49-17-11-15-43(8-2,37(44)49)39(60-27(3)52)46(38,56)41(54)59-6/h9-13,15,20-21,26,28,37-39,47,55-56H,7-8,14,16-19,22-25H2,1-6H3/t28-,37+,38-,39-,42+,43-,44-,45+,46+/m1/s1","OGWKCGZFUXNPDA-XQKSVPLYSA-N"
"CC[C@]1(O)C[C@H]2CN(CCc3c([nH]c4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C)[C@H]3[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]5(CC)C=CCN6CC[C@]43[C@@H]65)C2)C1","InChI=1S/C46H58N4O9/c1-8-42(54)23-28-24-45(40(52)57-6,36-30(15-19-49(25-28)26-42)29-13-10-11-14-33(29)47-36)32-21-31-34(22-35(32)56-5)48(4)38-44(31)17-20-50-18-12-16-43(9-2,37(44)50)39(59-27(3)51)46(38,55)41(53)58-7/h10-14,16,21-22,28,37-39,47,54-55H,8-9,15,17-20,23-26H2,1-7H3/t28-,37+,38-,39-,42+,43-,44-,45+,46+/m1/s1","JXLYSJRDGCGARV-XQKSVPLYSA-N"
"C=C1[C@@H](O)CC[C@]2(C)[C@@H]1[C@H](OC(C)=O)[C@@H]1CC(=O)C(C)=C([C@@H](OC(C)=O)[C@@H]2OC(C)=O)C1(C)C","InChI=1S/C26H36O8/c1-12-18(30)9-10-26(8)21(12)22(32-14(3)27)17-11-19(31)13(2)20(25(17,6)7)23(33-15(4)28)24(26)34-16(5)29/h17-18,21-24,30H,1,9-11H2,2-8H3/t17-,18-,21-,22+,23+,24-,26+/m0/s1","OQXJKHGIAZCMBX-SOIIJPRYSA-N"
"C=C1[C@@H](O)C[C@H](OC(C)=O)[C@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C3=C(C)C(=O)C[C@@H]([C@@H](OC(C)=O)[C@H]12)C3(C)C","InChI=1S/C28H38O10/c1-12-19(33)10-18-24(36-15(4)30)23-13(2)20(34)11-21(35-14(3)29)28(23,9)26(38-17(6)32)25(37-16(5)31)22(12)27(18,7)8/h18,20-21,23-26,34H,2,10-11H2,1,3-9H3/t18-,20-,21-,23-,24+,25+,26-,28-/m0/s1","CWMUWKWZNUFEDY-ZIGNNSRASA-N"
"CC(=O)O[C@@]12CO[C@@H]1C[C@H](O)[C@@]1(C)C(=O)[C@H](O)C3=C(C)[C@@H](O)C[C@@](O)([C@@H](OC(=O)c4ccccc4)[C@@H]12)C3(C)C","InChI=1S/C29H36O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,17-19,21-22,24,31-33,36H,11-13H2,1-5H3/t17-,18-,19+,21+,22-,24-,27+,28-,29+/m0/s1","YWLXLRUDGLRYDR-ZHPRIASZSA-N"
"C=C1[C@@H](O)C[C@H](OC(C)=O)[C@]2(C)[C@@H]1[C@H](OC(C)=O)[C@]1(C(C)(C)O)C[C@H](OC(C)=O)C(C)=C1[C@@H](O)[C@@H]2OC(C)=O","InChI=1S/C28H40O11/c1-12-18(33)10-20(37-15(4)30)27(9)22(12)24(38-16(5)31)28(26(7,8)35)11-19(36-14(3)29)13(2)21(28)23(34)25(27)39-17(6)32/h18-20,22-25,33-35H,1,10-11H2,2-9H3/t18-,19-,20-,22-,23+,24-,25-,27+,28-/m0/s1","KKYDBSIOPKKLQL-VZVRQYNNSA-N"
"C=C1[C@@H](O)C[C@H](OC(C)=O)[C@]2(C)[C@@H]1C[C@]1(C(C)(C)O)C[C@H](O)C(C)=C1[C@@H](OC(=O)c1ccccc1)[C@@H]2OC(C)=O","InChI=1S/C31H40O9/c1-16-21-14-31(29(5,6)37)15-23(35)17(2)25(31)26(40-28(36)20-11-9-8-10-12-20)27(39-19(4)33)30(21,7)24(13-22(16)34)38-18(3)32/h8-12,21-24,26-27,34-35,37H,1,13-15H2,2-7H3/t21-,22+,23+,24+,26-,27+,30+,31+/m1/s1","VWGCDYGRSUJYGJ-GPOPEEISSA-N"
"CC(=O)O[C@H]1C(=O)[C@]2(C)[C@@H](O)C[C@H]3OC[C@@]3(OC(C)=O)[C@H]2[C@H](OC(=O)c2ccccc2)[C@]2(O)C[C@H](O)C(C)=C1C2(C)C","InChI=1S/C31H38O11/c1-15-19(34)13-31(38)26(41-27(37)18-10-8-7-9-11-18)24-29(6,20(35)12-21-30(24,14-39-21)42-17(3)33)25(36)23(40-16(2)32)22(15)28(31,4)5/h7-11,19-21,23-24,26,34-35,38H,12-14H2,1-6H3/t19-,20-,21+,23+,24-,26-,29+,30-,31+/m0/s1","OVMSOCFBDVBLFW-VHLOTGQHSA-N"
"C=C1[C@@H](OC(=O)/C=C/c2ccccc2)C[C@H](OC(C)=O)[C@]2(C)[C@@H]1C[C@@H]1CC(=O)C(C)=C([C@@H](OC(C)=O)[C@@H]2OC(C)=O)C1(C)C","InChI=1S/C35H42O9/c1-19-26-16-25-17-27(39)20(2)31(34(25,6)7)32(42-22(4)37)33(43-23(5)38)35(26,8)29(41-21(3)36)18-28(19)44-30(40)15-14-24-12-10-9-11-13-24/h9-15,25-26,28-29,32-33H,1,16-18H2,2-8H3/b15-14+/t25-,26-,28+,29+,32-,33+,35+/m1/s1","OBBKIKZFVSBXJQ-QJKHZRRKSA-N"
"CC(=O)O[C@H]1C[C@H]2OC[C@@]2(OC(C)=O)C2[C@H](OC(=O)c3ccccc3)[C@]3(C(C)(C)O)C[C@H](O)C(C)=C3[C@@H](O)[C@H](OC(C)=O)[C@@]21C","InChI=1S/C33H42O12/c1-16-21(37)14-32(30(5,6)40)24(16)25(38)27(43-18(3)35)31(7)22(42-17(2)34)13-23-33(15-41-23,45-19(4)36)26(31)28(32)44-29(39)20-11-9-8-10-12-20/h8-12,21-23,25-28,37-38,40H,13-15H2,1-7H3/t21-,22-,23+,25+,26?,27-,28-,31+,32-,33-/m0/s1","UNOXUAXKYZZGRD-IKNIGBTRSA-N"
"CC(=O)O[C@H]1C[C@@]2(O)[C@@H](OC(C)=O)[C@@H]3[C@]4(OC(C)=O)CO[C@@H]4C[C@H](OC(C)=O)[C@@]3(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C(=C1C)C2(C)C","InChI=1S/C32H44O14/c1-14-21(41-15(2)33)12-32(39)28(45-19(6)37)26-30(10,22(42-16(3)34)11-23-31(26,13-40-23)46-20(7)38)27(44-18(5)36)25(43-17(4)35)24(14)29(32,8)9/h21-23,25-28,39H,11-13H2,1-10H3/t21-,22-,23+,25+,26-,27-,28-,30+,31-,32+/m0/s1","CCJGGIKEFAWREN-WBPIOOJSSA-N"
"C=C1[C@@H](OC(=O)/C=C/c2ccccc2)C[C@H](OC(C)=O)[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)C3=C(C)C(=O)C[C@@H]([C@@H](OC(C)=O)[C@H]12)C3(C)C","InChI=1S/C37H44O11/c1-19-27(42)17-26-33(45-22(4)39)32-20(2)28(48-30(43)16-15-25-13-11-10-12-14-25)18-29(44-21(3)38)37(32,9)35(47-24(6)41)34(46-23(5)40)31(19)36(26,7)8/h10-16,26,28-29,32-35H,2,17-18H2,1,3-9H3/b16-15+/t26-,28-,29-,32-,33+,34+,35-,37+/m0/s1","SLJNSLIEGINNEE-UWUOQQJISA-N"
"C=C1[C@@H](OC(=O)/C=C/c2ccccc2)C[C@H](OC(C)=O)[C@@]2(C)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@]3(O)C(C)=C(OC(C)=O)C[C@@H]([C@@H](OC(C)=O)[C@H]12)C3(C)C","InChI=1S/C39H48O13/c1-20-29(52-32(45)17-16-27-14-12-11-13-15-27)19-31(48-23(4)41)38(10)33(20)34(49-24(5)42)28-18-30(47-22(3)40)21(2)39(46,37(28,8)9)36(51-26(7)44)35(38)50-25(6)43/h11-17,28-29,31,33-36,46H,1,18-19H2,2-10H3/b17-16+/t28-,29-,31-,33-,34+,35-,36-,38+,39-/m0/s1","YQWATTVJPRZZEE-HWFKHETCSA-N"
"C=C1[C@@H](OC(=O)/C=C/c2ccccc2)C[C@H](OC(C)=O)[C@]2(C)[C@@H]1C[C@]1(C(C)(C)O)C[C@H](OC(C)=O)C(C)=C1[C@@H](OC(=O)c1ccccc1)[C@@H]2OC(C)=O","InChI=1S/C42H48O11/c1-24-31-22-42(40(6,7)48)23-33(49-26(3)43)25(2)36(42)37(53-39(47)30-17-13-10-14-18-30)38(51-28(5)45)41(31,8)34(50-27(4)44)21-32(24)52-35(46)20-19-29-15-11-9-12-16-29/h9-20,31-34,37-38,48H,1,21-23H2,2-8H3/b20-19+/t31-,32+,33+,34+,37-,38+,41+,42+/m1/s1","MWIQLLBFLJOMOS-MHXMLUCXSA-N"
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"N=C(O)NCCCC[C@H](N)C(=O)O","InChI=1S/C7H15N3O3/c8-5(6(11)12)3-1-2-4-10-7(9)13/h5H,1-4,8H2,(H,11,12)(H3,9,10,13)/t5-/m0/s1","XIGSAGMEBXLVJJ-YFKPBYRVSA-N"
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"O=C1C[C@@H](c2ccc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[C@@H]3OC[C@](O)(CO)[C@H]3O)cc2)Oc2cc(O)ccc21","InChI=1S/C26H30O13/c27-9-19-20(31)21(32)22(39-25-23(33)26(34,10-28)11-35-25)24(38-19)36-14-4-1-12(2-5-14)17-8-16(30)15-6-3-13(29)7-18(15)37-17/h1-7,17,19-25,27-29,31-34H,8-11H2/t17-,19+,20+,21-,22+,23-,24+,25-,26+/m0/s1","FTVKHUHJWDMWIR-DWMQJYMWSA-N"
"CC1(C)C=Cc2c(O)ccc(C3=Cc4ccc(O)cc4OC3)c2O1","InChI=1S/C20H18O4/c1-20(2)8-7-16-17(22)6-5-15(19(16)24-20)13-9-12-3-4-14(21)10-18(12)23-11-13/h3-10,21-22H,11H2,1-2H3","NGGYSPUAKQMTNP-UHFFFAOYSA-N"
"CC1(C)C=Cc2c(ccc(-c3coc4cc(O)ccc4c3=O)c2O)O1","InChI=1S/C20H16O5/c1-20(2)8-7-14-16(25-20)6-5-12(18(14)22)15-10-24-17-9-11(21)3-4-13(17)19(15)23/h3-10,21-22H,1-2H3","COLMVFWKLOZOOP-UHFFFAOYSA-N"
"CC1(C)C=Cc2c(ccc3c2OC[C@@H](c2ccc(O)cc2O)C3)O1","InChI=1S/C20H20O4/c1-20(2)8-7-16-18(24-20)6-3-12-9-13(11-23-19(12)16)15-5-4-14(21)10-17(15)22/h3-8,10,13,21-22H,9,11H2,1-2H3/t13-/m0/s1","LBQIJVLKGVZRIW-ZDUSSCGKSA-N"
"CC(C)=CCc1cc([C@@H]2CC(=O)c3ccc(O)c(CC=C(C)C)c3O2)ccc1O","InChI=1S/C25H28O4/c1-15(2)5-7-17-13-18(8-11-21(17)26)24-14-23(28)20-10-12-22(27)19(25(20)29-24)9-6-16(3)4/h5-6,8,10-13,24,26-27H,7,9,14H2,1-4H3/t24-/m0/s1","CUFAXDWQDQQKFF-DEOSSOPVSA-N"
"CC(C)=CCc1c(O)ccc([C@@H]2COc3c(ccc4c3C=CC(C)(C)O4)C2)c1O","InChI=1S/C25H28O4/c1-15(2)5-7-19-21(26)9-8-18(23(19)27)17-13-16-6-10-22-20(24(16)28-14-17)11-12-25(3,4)29-22/h5-6,8-12,17,26-27H,7,13-14H2,1-4H3/t17-/m0/s1","HZHXMXSXYQCAIG-KRWDZBQOSA-N"
"CC(C)=CCc1cc([C@H]2Oc3c(ccc(O)c3CC=C(C)C)C(=O)[C@@H]2O)ccc1O","InChI=1S/C25H28O5/c1-14(2)5-7-16-13-17(8-11-20(16)26)24-23(29)22(28)19-10-12-21(27)18(25(19)30-24)9-6-15(3)4/h5-6,8,10-13,23-24,26-27,29H,7,9H2,1-4H3/t23-,24+/m0/s1","LAQLCZKPJGMFRM-BJKOFHAPSA-N"
"C(CN)CN","InChI=1S/C3H10N2/c4-2-1-3-5/h1-5H2","XFNJVJPLKCPIBV-UHFFFAOYSA-N"
"C1C(OCC(O1)(CO)O)(CO)O","InChI=1S/C6H12O6/c7-1-5(9)3-12-6(10,2-8)4-11-5/h7-10H,1-4H2","KEQUNHIAUQQPAC-UHFFFAOYSA-N"
"C1CCC(C1)(C(=O)O)N","InChI=1S/C6H11NO2/c7-6(5(8)9)3-1-2-4-6/h1-4,7H2,(H,8,9)","NILQLFBWTXNUOE-UHFFFAOYSA-N"
"C1=CC(=C(N=C1)C(=O)O)C(=O)O","InChI=1S/C7H5NO4/c9-6(10)4-2-1-3-8-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)","GJAWHXHKYYXBSV-UHFFFAOYSA-N"
"COC1=C(C=CC(=C1)C=CC=O)O","InChI=1S/C10H10O3/c1-13-10-7-8(3-2-6-11)4-5-9(10)12/h2-7,12H,1H3","DKZBBWMURDFHNE-UHFFFAOYSA-N"
"C1=CC(=CC=C1CC(=O)C(=O)O)O","InChI=1S/C9H8O4/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,10H,5H2,(H,12,13)","KKADPXVIOXHVKN-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C=O","InChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H","HUMNYLRZRPPJDN-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C=CCO","InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-7,10H,8H2","OOCCDEMITAIZTP-UHFFFAOYSA-N"
"C(C(=O)O)C(CC(=O)O)(C(=O)O)O","InChI=1S/C6H8O7/c7-3(8)1-6(13,5(11)12)2-4(9)10/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)","KRKNYBCHXYNGOX-UHFFFAOYSA-N"
"COC1=C(C=CC(=C1)C=CC(=O)O)O","InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)","KSEBMYQBYZTDHS-UHFFFAOYSA-N"
"C(C(C(C(C(CO)O)O)O)O)O","InChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2","FBPFZTCFMRRESA-UHFFFAOYSA-N"
"CC(=CCNC1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)C","InChI=1S/C15H21N5O4/c1-8(2)3-4-16-13-10-14(18-6-17-13)20(7-19-10)15-12(23)11(22)9(5-21)24-15/h3,6-7,9,11-12,15,21-23H,4-5H2,1-2H3,(H,16,17,18)","USVMJSALORZVDV-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C(CN)O)O)O","InChI=1S/C8H11NO3/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,10-12H,4,9H2","SFLSHLFXELFNJZ-UHFFFAOYSA-N"
"C1C(C(C(C=C1C(=O)O)O)O)O","InChI=1S/C7H10O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,4-6,8-10H,2H2,(H,11,12)","JXOHGGNKMLTUBP-UHFFFAOYSA-N"
"C1=CC(=CC=C1C(CC(=O)O)CN)Cl","InChI=1S/C10H12ClNO2/c11-9-3-1-7(2-4-9)8(6-12)5-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)","KPYSYYIEGFHWSV-UHFFFAOYSA-N"
"CC1=C(C(=C2CCC(OC2=C1C)(C)CCCC(C)CCCC(C)CCCC(C)C)C)O","InChI=1S/C29H50O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h20-22,30H,9-19H2,1-8H3","GVJHHUAWPYXKBD-UHFFFAOYSA-N"
"CNCC(C1=CC(=CC=C1)O)O","InChI=1S/C9H13NO2/c1-10-6-9(12)7-3-2-4-8(11)5-7/h2-5,9-12H,6H2,1H3","SONNWYBIRXJNDC-UHFFFAOYSA-N"
"C1=CC2=C(C3=C(C=CC=N3)C=C2)N=C1","InChI=1S/C12H8N2/c1-3-9-5-6-10-4-2-8-14-12(10)11(9)13-7-1/h1-8H","DGEZNRSVGBDHLK-UHFFFAOYSA-N"
"C(CCCCCCCC(=O)O)CCCCCCCO","InChI=1S/C16H32O3/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16(18)19/h17H,1-15H2,(H,18,19)","UGAGPNKCDRTDHP-UHFFFAOYSA-N"
"C1CC1(C(=O)O)N","InChI=1S/C4H7NO2/c5-4(1-2-4)3(6)7/h1-2,5H2,(H,6,7)","PAJPWUMXBYXFCZ-UHFFFAOYSA-N"
"C1C(C(OC1N2C=CC(=NC2=O)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O","InChI=1S/C9H16N3O13P3/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(23-8)4-22-27(18,19)25-28(20,21)24-26(15,16)17/h1-2,5-6,8,13H,3-4H2,(H,18,19)(H,20,21)(H2,10,11,14)(H2,15,16,17)","RGWHQCVHVJXOKC-UHFFFAOYSA-N"
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"C1=CC(=CC=C1CC(=O)O)O","InChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)","XQXPVVBIMDBYFF-UHFFFAOYSA-N"
"CC1=CC(=O)OC2=C1C=CC(=C2)O","InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3","HSHNITRMYYLLCV-UHFFFAOYSA-N"
"CC1=C(NC(=O)N=C1)N","InChI=1S/C5H7N3O/c1-3-2-7-5(9)8-4(3)6/h2H,1H3,(H3,6,7,8,9)","LRSASMSXMSNRBT-UHFFFAOYSA-N"
"CN1C(CNC2=C1C(=O)N=C(N2)N)CNC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O","InChI=1S/C20H25N7O6/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31)","ZNOVTXRBGFNYRX-UHFFFAOYSA-N"
"C(C(C(C(C(C(=O)O)O)O)O)O)OP(=O)(O)O","InChI=1S/C6H13O10P/c7-2(1-16-17(13,14)15)3(8)4(9)5(10)6(11)12/h2-5,7-10H,1H2,(H,11,12)(H2,13,14,15)","BIRSGZKFKXLSJQ-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)O)O","InChI=1S/C10H13N5O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2,(H2,11,12,13)","OIRDTQYFTABQOQ-UHFFFAOYSA-N"
"C1=CC=C(C(=C1)C(=O)O)N","InChI=1S/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10)","RWZYAGGXGHYGMB-UHFFFAOYSA-N"
"C(CCN)CCN","InChI=1S/C5H14N2/c6-4-2-1-3-5-7/h1-7H2","VHRGRCVQAFMJIZ-UHFFFAOYSA-N"
"C(C(=CC(=O)O)C(=O)O)C(=O)O","InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)","GTZCVFVGUGFEME-UHFFFAOYSA-N"
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"C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)O)CO)O)O)O)O","InChI=1S/C12H22O11/c13-1-3-5(15)6(16)9(19)12(22-3)23-10-4(2-14)21-11(20)8(18)7(10)17/h3-20H,1-2H2","GUBGYTABKSRVRQ-UHFFFAOYSA-N"
"C1(C(C(C(C(C1O)O)O)O)O)O","InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H","CDAISMWEOUEBRE-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)CO)O)O)O)O","InChI=1S/C12H22O11/c13-1-4-6(16)8(18)9(19)11(21-4)23-12(3-15)10(20)7(17)5(2-14)22-12/h4-11,13-20H,1-3H2","CZMRCDWAGMRECN-UHFFFAOYSA-N"
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"C(CCN)CN","InChI=1S/C4H12N2/c5-3-1-2-4-6/h1-6H2","KIDHWZJUCRJVML-UHFFFAOYSA-N"
"CC(C)(CO)C(C(=O)NCCC(=O)O)O","InChI=1S/C9H17NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h7,11,14H,3-5H2,1-2H3,(H,10,15)(H,12,13)","GHOKWGTUZJEAQD-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C=CC(=O)C2=CC=CC=C2","InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H","DQFBYFPFKXHELB-UHFFFAOYSA-N"
"C1(C(C(OC(C1O)O)C(=O)O)O)O","InChI=1S/C6H10O7/c7-1-2(8)4(5(10)11)13-6(12)3(1)9/h1-4,6-9,12H,(H,10,11)","AEMOLEFTQBMNLQ-UHFFFAOYSA-N"
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"C1=CC(=CN=C1)C(=O)O","InChI=1S/C6H5NO2/c8-6(9)5-2-1-3-7-4-5/h1-4H,(H,8,9)","PVNIIMVLHYAWGP-UHFFFAOYSA-N"
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"CC(C)(C(=O)O)O","InChI=1S/C4H8O3/c1-4(2,7)3(5)6/h7H,1-2H3,(H,5,6)","BWLBGMIXKSTLSX-UHFFFAOYSA-N"
"C1=CC(=O)NC=C1","InChI=1S/C5H5NO/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)","UBQKCCHYAOITMY-UHFFFAOYSA-N"
"CC(=O)CC(=O)O","InChI=1S/C4H6O3/c1-3(5)2-4(6)7/h2H2,1H3,(H,6,7)","WDJHALXBUFZDSR-UHFFFAOYSA-N"
"C=CC(=O)O","InChI=1S/C3H4O2/c1-2-3(4)5/h2H,1H2,(H,4,5)","NIXOWILDQLNWCW-UHFFFAOYSA-N"
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"C1C(OCC(O1)O)O","InChI=1S/C4H8O4/c5-3-1-7-4(6)2-8-3/h3-6H,1-2H2","ATFVTAOSZBVGHC-UHFFFAOYSA-N"
"CC(=CC(=O)O)C(=O)O","InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)","HNEGQIOMVPPMNR-UHFFFAOYSA-N"
"CC(C(=O)O)C(=O)O","InChI=1S/C4H6O4/c1-2(3(5)6)4(7)8/h2H,1H3,(H,5,6)(H,7,8)","ZIYVHBGGAOATLY-UHFFFAOYSA-N"
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"C1CNCCN1","InChI=1S/C4H10N2/c1-2-6-4-3-5-1/h5-6H,1-4H2","GLUUGHFHXGJENI-UHFFFAOYSA-N"
"CC1=NC=C(C(=C1O)CN)CO","InChI=1S/C8H12N2O2/c1-5-8(12)7(2-9)6(4-11)3-10-5/h3,11-12H,2,4,9H2,1H3","NHZMQXZHNVQTQA-UHFFFAOYSA-N"
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"C1=CC=C(C=C1)C=CC(=O)O","InChI=1S/C9H8O2/c10-9(11)7-6-8-4-2-1-3-5-8/h1-7H,(H,10,11)","WBYWAXJHAXSJNI-UHFFFAOYSA-N"
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"C1=CC(=CC=C1C(=O)O)N","InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10)","ALYNCZNDIQEVRV-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O","InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)","XTWYTFMLZFPYCI-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)O)O)O","InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(22-10)1-21-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)","UDMBCSSLTHHNCD-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)OS(=O)(=O)O)O)O","InChI=1S/C10H14N5O10PS/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-26(18,19)25-27(20,21)22/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H2,11,12,13)(H,20,21,22)","IRLPACMLTUPBCL-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)O)OP(=O)(O)O)O","InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(25-27(20,21)22)4(24-10)1-23-26(17,18)19/h2-4,6-7,10,16H,1H2,(H2,11,12,13)(H2,17,18,19)(H2,20,21,22)","WHTCPDAXWFLDIH-UHFFFAOYSA-N"
"C(CCN=C(N)N)CN","InChI=1S/C5H14N4/c6-3-1-2-4-9-5(7)8/h1-4,6H2,(H4,7,8,9)","QYPPJABKJHAVHS-UHFFFAOYSA-N"
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"C(C1C(C(C(C(O1)O)N)O)O)OP(=O)(O)O","InChI=1S/C6H14NO8P/c7-3-5(9)4(8)2(15-6(3)10)1-14-16(11,12)13/h2-6,8-10H,1,7H2,(H2,11,12,13)","XHMJOUIAFHJHBW-UHFFFAOYSA-N"
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"C1=CN=C2C(=N1)C(=O)N=C(N2)N","InChI=1S/C6H5N5O/c7-6-10-4-3(5(12)11-6)8-1-2-9-4/h1-2H,(H3,7,9,10,11,12)","HNXQXTQTPAJEJL-UHFFFAOYSA-N"
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"C(CP(=O)(O)O)N","InChI=1S/C2H8NO3P/c3-1-2-7(4,5)6/h1-3H2,(H2,4,5,6)","QQVDJLLNRSOCEL-UHFFFAOYSA-N"
"C1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)O","InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)","OLXZPDWKRNYJJZ-UHFFFAOYSA-N"
"C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=O)(O)OP(=O)(O)O)O","InChI=1S/C10H15N5O9P2/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(23-7)2-22-26(20,21)24-25(17,18)19/h3-7,16H,1-2H2,(H,20,21)(H2,11,12,13)(H2,17,18,19)","DAEAPNUQQAICNR-UHFFFAOYSA-N"
"C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=O)(O)O)O","InChI=1S/C10H14N5O6P/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(21-7)2-20-22(17,18)19/h3-7,16H,1-2H2,(H2,11,12,13)(H2,17,18,19)","KHWCHTKSEGGWEX-UHFFFAOYSA-N"
"C1C(C(OC1N2C=CC(=NC2=O)N)CO)O","InChI=1S/C9H13N3O4/c10-7-1-2-12(9(15)11-7)8-3-5(14)6(4-13)16-8/h1-2,5-6,8,13-14H,3-4H2,(H2,10,11,15)","CKTSBUTUHBMZGZ-UHFFFAOYSA-N"
"C1C(C(OC1N2C=CC(=NC2=O)N)COP(=O)(O)OP(=O)(O)O)O","InChI=1S/C9H15N3O10P2/c10-7-1-2-12(9(14)11-7)8-3-5(13)6(21-8)4-20-24(18,19)22-23(15,16)17/h1-2,5-6,8,13H,3-4H2,(H,18,19)(H2,10,11,14)(H2,15,16,17)","FTDHDKPUHBLBTL-UHFFFAOYSA-N"
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"C1C(C(OC1N2C=NC3=C2NC=NC3=O)CO)O","InChI=1S/C10H12N4O4/c15-2-6-5(16)1-7(18-6)14-4-13-8-9(14)11-3-12-10(8)17/h3-7,15-16H,1-2H2,(H,11,12,17)","VGONTNSXDCQUGY-UHFFFAOYSA-N"
"C1C(C(OC1N2C=NC3=C2NC=NC3=O)COP(=O)(O)O)O","InChI=1S/C10H13N4O7P/c15-5-1-7(21-6(5)2-20-22(17,18)19)14-4-13-8-9(14)11-3-12-10(8)16/h3-7,15H,1-2H2,(H,11,12,16)(H2,17,18,19)","PHNGFPPXDJJADG-UHFFFAOYSA-N"
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"C1C(C(OC1N2C=CC(=O)NC2=O)COP(=O)(O)O)O","InChI=1S/C9H13N2O8P/c12-5-3-8(11-2-1-7(13)10-9(11)14)19-6(5)4-18-20(15,16)17/h1-2,5-6,8,12H,3-4H2,(H,10,13,14)(H2,15,16,17)","JSRLJPSBLDHEIO-UHFFFAOYSA-N"
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"C1=CC(=C(C=C1CC(C(=O)O)N)O)O","InChI=1S/C9H11NO4/c10-6(9(13)14)3-5-1-2-7(11)8(12)4-5/h1-2,4,6,11-12H,3,10H2,(H,13,14)","WTDRDQBEARUVNC-UHFFFAOYSA-N"
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"C1C2C(C(C(O2)N3C=NC4=C3N=CN=C4N)O)OP(=O)(O1)O","InChI=1S/C10H12N5O6P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7-4(20-10)1-19-22(17,18)21-7/h2-4,6-7,10,16H,1H2,(H,17,18)(H2,11,12,13)","IVOMOUWHDPKRLL-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OC4C(C(C(C(O4)CO)O)O)O)O)O","InChI=1S/C16H25N5O15P2/c17-13-7-14(19-3-18-13)21(4-20-7)15-11(26)9(24)6(33-15)2-32-37(28,29)36-38(30,31)35-16-12(27)10(25)8(23)5(1-22)34-16/h3-6,8-12,15-16,22-27H,1-2H2,(H,28,29)(H,30,31)(H2,17,18,19)","WFPZSXYXPSUOPY-UHFFFAOYSA-N"
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"C1(C(=O)NC(=O)N1)NC(=O)N","InChI=1S/C4H6N4O3/c5-3(10)6-1-2(9)8-4(11)7-1/h1H,(H3,5,6,10)(H2,7,8,9,11)","POJWUDADGALRAB-UHFFFAOYSA-N"
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"C(CC(C(=O)O)N)CN=C(N)NC(CC(=O)O)C(=O)O","InChI=1S/C10H18N4O6/c11-5(8(17)18)2-1-3-13-10(12)14-6(9(19)20)4-7(15)16/h5-6H,1-4,11H2,(H,15,16)(H,17,18)(H,19,20)(H3,12,13,14)","KDZOASGQNOPSCU-UHFFFAOYSA-N"
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"CCOC(=O)C1=CC=C(C=C1)N","InChI=1S/C9H11NO2/c1-2-12-9(11)7-3-5-8(10)6-4-7/h3-6H,2,10H2,1H3","BLFLLBZGZJTVJG-UHFFFAOYSA-N"
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"C1C2C(C(C(O2)N3C=CC(=NC3=O)N)O)OP(=O)(O1)O","InChI=1S/C9H12N3O7P/c10-5-1-2-12(9(14)11-5)8-6(13)7-4(18-8)3-17-20(15,16)19-7/h1-2,4,6-8,13H,3H2,(H,15,16)(H2,10,11,14)","WCPTXJJVVDAEMW-UHFFFAOYSA-N"
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"C[N+](C)(C)CCOP(=O)([O-])OP(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O","InChI=1S/C14H26N4O11P2/c1-18(2,3)6-7-26-30(22,23)29-31(24,25)27-8-9-11(19)12(20)13(28-9)17-5-4-10(15)16-14(17)21/h4-5,9,11-13,19-20H,6-8H2,1-3H3,(H3-,15,16,21,22,23,24,25)","RZZPDXZPRHQOCG-UHFFFAOYSA-N"
"C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=O)(O)O)O)O","InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)","IERHLVCPSMICTF-UHFFFAOYSA-N"
"C1=C(NC(=O)N=C1)N","InChI=1S/C4H5N3O/c5-3-1-2-6-4(8)7-3/h1-2H,(H3,5,6,7,8)","OPTASPLRGRRNAP-UHFFFAOYSA-N"
"C1C(C(C(C(O1)O)O)O)O","InChI=1S/C5H10O5/c6-2-1-10-5(9)4(8)3(2)7/h2-9H,1H2","SRBFZHDQGSBBOR-UHFFFAOYSA-N"
"C(C1C(C(C(O1)(CO)O)O)O)O","InChI=1S/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2","RFSUNEUAIZKAJO-UHFFFAOYSA-N"
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"C(C1C(C(C(O1)O)O)O)O","InChI=1S/C5H10O5/c6-1-2-3(7)4(8)5(9)10-2/h2-9H,1H2","HMFHBZSHGGEWLO-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)O)O)O)O)O","InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2","WQZGKKKJIJFFOK-UHFFFAOYSA-N"
"C(C(C(=O)O)O)C(=O)O","InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)","BJEPYKJPYRNKOW-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2C(C(C(C(O2)CO)O)O)O)O)O)O)O","InChI=1S/C12H22O11/c13-1-3-5(15)7(17)9(19)11(21-3)23-12-10(20)8(18)6(16)4(2-14)22-12/h3-20H,1-2H2","HDTRYLNUVZCQOY-UHFFFAOYSA-N"
"C(CC(C(=O)O)N)CC(C(=O)O)N","InChI=1S/C7H14N2O4/c8-4(6(10)11)2-1-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)","GMKMEZVLHJARHF-UHFFFAOYSA-N"
"C(C(C(C(C=O)O)O)O)OP(=O)(O)O","InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h1,3-5,7-9H,2H2,(H2,10,11,12)","PPQRONHOSHZGFQ-UHFFFAOYSA-N"
"C(C1C(C(C(O1)(CO)O)O)O)OP(=O)(O)O","InChI=1S/C6H13O9P/c7-2-6(10)5(9)4(8)3(15-6)1-14-16(11,12)13/h3-5,7-10H,1-2H2,(H2,11,12,13)","BGWGXPAPYGQALX-UHFFFAOYSA-N"
"C(C1C(C(C(C(=O)O1)O)O)O)O","InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-5,7-10H,1H2","PHOQVHQSTUBQQK-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)O)O)O)O)OP(=O)(O)O","InChI=1S/C6H13O9P/c7-3-2(1-14-16(11,12)13)15-6(10)5(9)4(3)8/h2-10H,1H2,(H2,11,12,13)","NBSCHQHZLSJFNQ-UHFFFAOYSA-N"
"C(CO)NCCO","InChI=1S/C4H11NO2/c6-3-1-5-2-4-7/h5-7H,1-4H2","ZBCBWPMODOFKDW-UHFFFAOYSA-N"
"C1CNC(=O)NC1=O","InChI=1S/C4H6N2O2/c7-3-1-2-5-4(8)6-3/h1-2H2,(H2,5,6,7,8)","OIVLITBTBDPEFK-UHFFFAOYSA-N"
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"C1CSSC1CCCCC(=O)O","InChI=1S/C8H14O2S2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H,9,10)","AGBQKNBQESQNJD-UHFFFAOYSA-N"
"C1CSSC1CCCCC(=O)N","InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10)","FCCDDURTIIUXBY-UHFFFAOYSA-N"
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"C(C(C(C(=O)O)O)C(=O)O)C(=O)O","InChI=1S/C6H8O7/c7-3(8)1-2(5(10)11)4(9)6(12)13/h2,4,9H,1H2,(H,7,8)(H,10,11)(H,12,13)","ODBLHEXUDAPZAU-UHFFFAOYSA-N"
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"CC(CC(=O)O)O","InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)","WHBMMWSBFZVSSR-UHFFFAOYSA-N"
"C(C1C(C(C(O1)O)O)O)OP(=O)(O)O","InChI=1S/C5H11O8P/c6-3-2(1-12-14(9,10)11)13-5(8)4(3)7/h2-8H,1H2,(H2,9,10,11)","KTVPXOYAKDPRHY-UHFFFAOYSA-N"
"C1C(C(C(O1)(CO)O)O)O","InChI=1S/C5H10O5/c6-2-5(9)4(8)3(7)1-10-5/h3-4,6-9H,1-2H2","LQXVFWRQNMEDEE-UHFFFAOYSA-N"
"CC(O)(P(=O)(O)O)P(=O)(O)O","InChI=1S/C2H8O7P2/c1-2(3,10(4,5)6)11(7,8)9/h3H,1H3,(H2,4,5,6)(H2,7,8,9)","DBVJJBKOTRCVKF-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)O)O)O)O","InChI=1S/C17H21N4O9P/c1-7-3-9-10(4-8(7)2)21(15-13(18-9)16(25)20-17(26)19-15)5-11(22)14(24)12(23)6-30-31(27,28)29/h3-4,11-12,14,22-24H,5-6H2,1-2H3,(H,20,25,26)(H2,27,28,29)","FVTCRASFADXXNN-UHFFFAOYSA-N"
"CC12C(CCC3(C1C(C45C3CCC(C4)C(=C)C5)C(=O)O)OC2=O)O","InChI=1S/C19H24O5/c1-9-7-18-8-10(9)3-4-11(18)19-6-5-12(20)17(2,16(23)24-19)14(19)13(18)15(21)22/h10-14,20H,1,3-8H2,2H3,(H,21,22)","RSQSQJNRHICNNH-UHFFFAOYSA-N"
"C(CC(=O)O)CC(=O)O","InChI=1S/C5H8O4/c6-4(7)2-1-3-5(8)9/h1-3H2,(H,6,7)(H,8,9)","JFCQEDHGNNZCLN-UHFFFAOYSA-N"
"C(CC(=O)NC(CSSCC(C(=O)NCC(=O)O)NC(=O)CCC(C(=O)O)N)C(=O)NCC(=O)O)C(C(=O)O)N","InChI=1S/C20H32N6O12S2/c21-9(19(35)36)1-3-13(27)25-11(17(33)23-5-15(29)30)7-39-40-8-12(18(34)24-6-16(31)32)26-14(28)4-2-10(22)20(37)38/h9-12H,1-8,21-22H2,(H,23,33)(H,24,34)(H,25,27)(H,26,28)(H,29,30)(H,31,32)(H,35,36)(H,37,38)","YPZRWBKMTBYPTK-UHFFFAOYSA-N"
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"CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C","InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)","LPLVUJXQOOQHMX-UHFFFAOYSA-N"
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"C1C2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)OP(=O)(O1)O","InChI=1S/C10H12N5O7P/c11-10-13-7-4(8(17)14-10)12-2-15(7)9-5(16)6-3(21-9)1-20-23(18,19)22-6/h2-3,5-6,9,16H,1H2,(H,18,19)(H3,11,13,14,17)","ZOOGRGPOEVQQDX-UHFFFAOYSA-N"
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"CC1C(C(C(C(O1)OP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=NC4=C3NC(=NC4=O)N)O)O)O)O)O","InChI=1S/C16H25N5O15P2/c1-4-7(22)9(24)11(26)15(33-4)35-38(30,31)36-37(28,29)32-2-5-8(23)10(25)14(34-5)21-3-18-6-12(21)19-16(17)20-13(6)27/h3-5,7-11,14-15,22-26H,2H2,1H3,(H,28,29)(H,30,31)(H3,17,19,20,27)","LQEBEXMHBLQMDB-UHFFFAOYSA-N"
"C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)O)O)O)NC(=NC2=O)N","InChI=1S/C10H14N5O8P/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18)","RQFCJASXJCIDSX-UHFFFAOYSA-N"
"C1=NC2=C(N1C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)NC(=NC2=O)N","InChI=1S/C10H16N5O14P3/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(27-9)1-26-31(22,23)29-32(24,25)28-30(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H,24,25)(H2,19,20,21)(H3,11,13,14,18)","XKMLYUALXHKNFT-UHFFFAOYSA-N"
"CCCCCCC(=O)O","InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)","MNWFXJYAOYHMED-UHFFFAOYSA-N"
"CCCCCC(=O)O","InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)","FUZZWVXGSFPDMH-UHFFFAOYSA-N"
"C(CS(=O)O)N","InChI=1S/C2H7NO2S/c3-1-2-6(4)5/h1-3H2,(H,4,5)","VVIUBCNYACGLLV-UHFFFAOYSA-N"
"CC(C)CC1=CC=C(C=C1)C(C)C(=O)O","InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)","HEFNNWSXXWATRW-UHFFFAOYSA-N"
"C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)CO)O)O","InChI=1S/C10H12N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)","UGQMRVRMYYASKQ-UHFFFAOYSA-N"
"C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O","InChI=1S/C10H14N4O11P2/c15-6-4(1-23-27(21,22)25-26(18,19)20)24-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,21,22)(H,11,12,17)(H2,18,19,20)","JPXZQMKKFWMMGK-UHFFFAOYSA-N"
"C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O","InChI=1S/C10H13N4O8P/c15-6-4(1-21-23(18,19)20)22-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,11,12,17)(H2,18,19,20)","GRSZFWQUAKGDAV-UHFFFAOYSA-N"
"C1=NC(=O)C2=C(N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O","InChI=1S/C10H15N4O14P3/c15-6-4(1-25-30(21,22)28-31(23,24)27-29(18,19)20)26-10(7(6)16)14-3-13-5-8(14)11-2-12-9(5)17/h2-4,6-7,10,15-16H,1H2,(H,21,22)(H,23,24)(H,11,12,17)(H2,18,19,20)","HAEJPQIATWHALX-UHFFFAOYSA-N"
"CC(C)C(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)O","InChI=1S/C25H42N7O17P3S/c1-13(2)24(37)53-8-7-27-15(33)5-6-28-22(36)19(35)25(3,4)10-46-52(43,44)49-51(41,42)45-9-14-18(48-50(38,39)40)17(34)23(47-14)32-12-31-16-20(26)29-11-30-21(16)32/h11-14,17-19,23,34-35H,5-10H2,1-4H3,(H,27,33)(H,28,36)(H,41,42)(H,43,44)(H2,26,29,30)(H2,38,39,40)","AEWHYWSPVRZHCT-UHFFFAOYSA-N"
"C1CNCC=C1C(=O)O","InChI=1S/C6H9NO2/c8-6(9)5-1-3-7-4-2-5/h1,7H,2-4H2,(H,8,9)","KRVDMABBKYMBHG-UHFFFAOYSA-N"
"C1=CN=CC=C1C(=O)O","InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)","TWBYWOBDOCUKOW-UHFFFAOYSA-N"
"CC(C)CC(C(=O)NC(CC(C)C)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)O)N","InChI=1S/C21H33N3O5/c1-12(2)9-16(22)19(26)23-17(10-13(3)4)20(27)24-18(21(28)29)11-14-5-7-15(25)8-6-14/h5-8,12-13,16-18,25H,9-11,22H2,1-4H3,(H,23,26)(H,24,27)(H,28,29)","UCNNZELZXFXXJQ-UHFFFAOYSA-N"
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"C1=C(NC=N1)CC(C(=O)O)NC(=O)CCCN","InChI=1S/C10H16N4O3/c11-3-1-2-9(15)14-8(10(16)17)4-7-5-12-6-13-7/h5-6,8H,1-4,11H2,(H,12,13)(H,14,15)(H,16,17)","CCLQKVKJOGVQLU-UHFFFAOYSA-N"
"C(CSSCCC(C(=O)O)N)C(C(=O)O)N","InChI=1S/C8H16N2O4S2/c9-5(7(11)12)1-3-15-16-4-2-6(10)8(13)14/h5-6H,1-4,9-10H2,(H,11,12)(H,13,14)","ZTVZLYBCZNMWCF-UHFFFAOYSA-N"
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"C(CC(C(=O)O)N)CN","InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)","AHLPHDHHMVZTML-UHFFFAOYSA-N"
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"CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCSC(=O)CC(=O)O)O","InChI=1S/C24H38N7O19P3S/c1-24(2,19(37)22(38)27-4-3-13(32)26-5-6-54-15(35)7-14(33)34)9-47-53(44,45)50-52(42,43)46-8-12-18(49-51(39,40)41)17(36)23(48-12)31-11-30-16-20(25)28-10-29-21(16)31/h10-12,17-19,23,36-37H,3-9H2,1-2H3,(H,26,32)(H,27,38)(H,33,34)(H,42,43)(H,44,45)(H2,25,28,29)(H2,39,40,41)","LTYOQGRJFJAKNA-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2C(OC(C(C2O)O)OC3C(OC(C(C3O)O)O)CO)CO)O)O)O)O","InChI=1S/C18H32O16/c19-1-4-7(22)8(23)12(27)17(31-4)34-15-6(3-21)32-18(13(28)10(15)25)33-14-5(2-20)30-16(29)11(26)9(14)24/h4-29H,1-3H2","FYGDTMLNYKFZSV-UHFFFAOYSA-N"
"CC1(C2CCC(C2)C1(C)NC)C","InChI=1S/C11H21N/c1-10(2)8-5-6-9(7-8)11(10,3)12-4/h8-9,12H,5-7H2,1-4H3","IMYZQPCYWPFTAG-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)O)O)O)O)O)O)O)O","InChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2","DLRVVLDZNNYCBX-UHFFFAOYSA-N"
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"C1CN(CCN1CCS(=O)(=O)O)CCS(=O)(=O)O","InChI=1S/C8H18N2O6S2/c11-17(12,13)7-5-9-1-2-10(4-3-9)6-8-18(14,15)16/h1-8H2,(H,11,12,13)(H,14,15,16)","IHPYMWDTONKSCO-UHFFFAOYSA-N"
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"C1=CC(=CC=C1[N+](=O)[O-])OP(=O)(O)O","InChI=1S/C6H6NO6P/c8-7(9)5-1-3-6(4-2-5)13-14(10,11)12/h1-4H,(H2,10,11,12)","XZKIHKMTEMTJQX-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C(=O)O)O)O","InChI=1S/C7H6O4/c8-5-2-1-4(7(10)11)3-6(5)9/h1-3,8-9H,(H,10,11)","YQUVCSBJEUQKSH-UHFFFAOYSA-N"
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"C(C(C(=O)O)N)N1C(=O)NC(=O)O1","InChI=1S/C5H7N3O5/c6-2(3(9)10)1-8-4(11)7-5(12)13-8/h2H,1,6H2,(H,9,10)(H,7,11,12)","ASNFTDCKZKHJSW-UHFFFAOYSA-N"
"CC(CN)O","InChI=1S/C3H9NO/c1-3(5)2-4/h3,5H,2,4H2,1H3","HXKKHQJGJAFBHI-UHFFFAOYSA-N"
"C(C(COP(=O)(O)O)O)O","InChI=1S/C3H9O6P/c4-1-3(5)2-9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)","AWUCVROLDVIAJX-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CSCCC(C(=O)O)N)O)O","InChI=1S/C14H20N6O5S/c15-6(14(23)24)1-2-26-3-7-9(21)10(22)13(25-7)20-5-19-8-11(16)17-4-18-12(8)20/h4-7,9-10,13,21-22H,1-3,15H2,(H,23,24)(H2,16,17,18)","ZJUKTBDSGOFHSH-UHFFFAOYSA-N"
"CNCC(=O)O","InChI=1S/C3H7NO2/c1-4-2-3(5)6/h4H,2H2,1H3,(H,5,6)","FSYKKLYZXJSNPZ-UHFFFAOYSA-N"
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"CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OP(=O)(O)O)O","InChI=1S/C10H16N2O11P2/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(22-8)4-21-25(19,20)23-24(16,17)18/h3,6-8,13H,2,4H2,1H3,(H,19,20)(H,11,14,15)(H2,16,17,18)","UJLXYODCHAELLY-UHFFFAOYSA-N"
"CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)O)O","InChI=1S/C10H15N2O8P/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(20-8)4-19-21(16,17)18/h3,6-8,13H,2,4H2,1H3,(H,11,14,15)(H2,16,17,18)","GYOZYWVXFNDGLU-UHFFFAOYSA-N"
"CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O","InChI=1S/C10H17N2O14P3/c1-5-3-12(10(15)11-9(5)14)8-2-6(13)7(24-8)4-23-28(19,20)26-29(21,22)25-27(16,17)18/h3,6-8,13H,2,4H2,1H3,(H,19,20)(H,21,22)(H,11,14,15)(H2,16,17,18)","NHVNXKFIZYSCEB-UHFFFAOYSA-N"
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"CC(=CCNC1=NC=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)CO","InChI=1S/C15H21N5O5/c1-8(4-21)2-3-16-13-10-14(18-6-17-13)20(7-19-10)15-12(24)11(23)9(5-22)25-15/h2,6-7,9,11-12,15,21-24H,3-5H2,1H3,(H,16,17,18)","GOSWTRUMMSCNCW-UHFFFAOYSA-N"
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"CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O","InChI=1S/C21H20O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-18,21-25,27-28H,1H3","SOSLMHZOJATCCP-UHFFFAOYSA-N"
"CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)OC4C(C(C(C(O4)C)O)O)O)C5=CC=C(C=C5)O)O)O)O)O","InChI=1S/C27H30O14/c1-9-17(30)20(33)22(35)26(37-9)39-13-7-14(29)16-15(8-13)40-24(11-3-5-12(28)6-4-11)25(19(16)32)41-27-23(36)21(34)18(31)10(2)38-27/h3-10,17-18,20-23,26-31,33-36H,1-2H3","PUPKKEQDLNREIM-UHFFFAOYSA-N"
"C1=CC(=C(C=C1CC(=O)O)O)O","InChI=1S/C8H8O4/c9-6-2-1-5(3-7(6)10)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)","CFFZDZCDUFSOFZ-UHFFFAOYSA-N"
"C1CC(NC1)CNC2=CC=CC=C2","InChI=1S/C11H16N2/c1-2-5-10(6-3-1)13-9-11-7-4-8-12-11/h1-3,5-6,11-13H,4,7-9H2","MCHWKJRTMPIHRA-UHFFFAOYSA-N"
"C1=CC(=CN=C1)C#N","InChI=1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H","GZPHSAQLYPIAIN-UHFFFAOYSA-N"
"C1C=CN(C=C1C(=O)N)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O)O)O","InChI=1S/C21H29N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1,3-4,7-8,10-11,13-16,20-21,29-32H,2,5-6H2,(H2,23,33)(H,34,35)(H,36,37)(H2,22,24,25)","BOPGDPNILDQYTO-UHFFFAOYSA-N"
"C1=C(NC=N1)C=CC(=O)O","InChI=1S/C6H6N2O2/c9-6(10)2-1-5-3-7-4-8-5/h1-4H,(H,7,8)(H,9,10)","LOIYMIARKYCTBW-UHFFFAOYSA-N"
"CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)O)O","InChI=1S/C11H19NO9/c1-4(14)12-7-5(15)2-11(20,10(18)19)21-9(7)8(17)6(16)3-13/h5-9,13,15-17,20H,2-3H2,1H3,(H,12,14)(H,18,19)","SQVRNKJHWKZAKO-UHFFFAOYSA-N"
"CC(=O)NC1C(C(C(OC1O)CO)O)O","InChI=1S/C8H15NO6/c1-3(11)9-5-7(13)6(12)4(2-10)15-8(5)14/h4-8,10,12-14H,2H2,1H3,(H,9,11)","OVRNDRQMDRJTHS-UHFFFAOYSA-N"
"CC(=O)OCC(C(=O)O)N","InChI=1S/C5H9NO4/c1-3(7)10-2-4(6)5(8)9/h4H,2,6H2,1H3,(H,8,9)","VZXPDPZARILFQX-UHFFFAOYSA-N"
"C1C(C(OC1N2C=NC3=C2NC(=NC3=O)N)COP(=O)(O)O)O","InChI=1S/C10H14N5O7P/c11-10-13-8-7(9(17)14-10)12-3-15(8)6-1-4(16)5(22-6)2-21-23(18,19)20/h3-6,16H,1-2H2,(H2,18,19,20)(H3,11,13,14,17)","LTFMZDNNPPEQNG-UHFFFAOYSA-N"
"CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C","InChI=1S/C12H10O4/c1-7-5-12(14)16-11-6-9(15-8(2)13)3-4-10(7)11/h3-6H,1-2H3","HXVZGASCDAGAPS-UHFFFAOYSA-N"
"C(C(=O)C(=O)O)C(=O)O","InChI=1S/C4H4O5/c5-2(4(8)9)1-3(6)7/h1H2,(H,6,7)(H,8,9)","KHPXUQMNIQBQEV-UHFFFAOYSA-N"
"CC1=NC=C(C(=C1O)C=O)COP(=O)(O)O","InChI=1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14)","NGVDGCNFYWLIFO-UHFFFAOYSA-N"
"CC1=NC=C(C(=C1O)C=O)CO","InChI=1S/C8H9NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,4,10,12H,3H2,1H3","RADKZDMFGJYCBB-UHFFFAOYSA-N"
"CC(C)[N+](=O)[O-]","InChI=1S/C3H7NO2/c1-3(2)4(5)6/h3H,1-2H3","FGLBSLMDCBOPQK-UHFFFAOYSA-N"
"CC(=CC=O)C","InChI=1S/C5H8O/c1-5(2)3-4-6/h3-4H,1-2H3","SEPQTYODOKLVSB-UHFFFAOYSA-N"
"CC(=O)NCCCCN","InChI=1S/C6H14N2O/c1-6(9)8-5-3-2-4-7/h2-5,7H2,1H3,(H,8,9)","KLZGKIDSEJWEDW-UHFFFAOYSA-N"
"C(CCNC(CCC(=O)O)C(=O)O)CC(C(=O)O)N","InChI=1S/C11H20N2O6/c12-7(10(16)17)3-1-2-6-13-8(11(18)19)4-5-9(14)15/h7-8,13H,1-6,12H2,(H,14,15)(H,16,17)(H,18,19)","ZDGJAHTZVHVLOT-UHFFFAOYSA-N"
"CSCCCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O","InChI=1S/C12H23NO9S3/c1-23-5-3-2-4-8(13-22-25(18,19)20)24-12-11(17)10(16)9(15)7(6-14)21-12/h7,9-12,14-17H,2-6H2,1H3,(H,18,19,20)","GKUMMDFLKGFCKH-UHFFFAOYSA-N"
"CS(=O)CCCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O","InChI=1S/C12H23NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21)","GMMLNKINDDUDCF-UHFFFAOYSA-N"
"C=CCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O","InChI=1S/C11H19NO9S2/c1-2-3-4-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(5-13)20-11/h2,6,8-11,13-16H,1,3-5H2,(H,17,18,19)","PLYQBXHVYUJNQB-UHFFFAOYSA-N"
"C=CC(CC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O)O","InChI=1S/C11H19NO10S2/c1-2-5(14)3-7(12-22-24(18,19)20)23-11-10(17)9(16)8(15)6(4-13)21-11/h2,5-6,8-11,13-17H,1,3-4H2,(H,18,19,20)","MYHSVHWQEVDFQT-UHFFFAOYSA-N"
"CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(CO)O)OC(=O)CCCCCCCCCCCCCCC","InChI=1S/C38H75O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(41)45-33-36(34-47-49(43,44)46-32-35(40)31-39)48-38(42)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,39-40H,3-34H2,1-2H3,(H,43,44)","BIABMEZBCHDPBV-UHFFFAOYSA-N"
"C1C(C(C(OC1O)CO)O)O","InChI=1S/C6H12O5/c7-2-4-6(10)3(8)1-5(9)11-4/h3-10H,1-2H2","PMMURAAUARKVCB-UHFFFAOYSA-N"
"C1C(C(OC1O)CO)O","InChI=1S/C5H10O4/c6-2-4-3(7)1-5(8)9-4/h3-8H,1-2H2","PDWIQYODPROSQH-UHFFFAOYSA-N"
"C1C(C(C(C(O1)(CO)O)O)O)O","InChI=1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2","LKDRXBCSQODPBY-UHFFFAOYSA-N"
"C1C(C(C(C(O1)(CO)O)OC2C(C(C(C(O2)CO)O)O)O)O)O","InChI=1S/C12H22O11/c13-1-5-7(17)8(18)9(19)11(22-5)23-10-6(16)4(15)2-21-12(10,20)3-14/h4-11,13-20H,1-3H2","SEWFWJUQVJHATO-UHFFFAOYSA-N"
"C1C(C(C(O1)O)O)O","InChI=1S/C4H8O4/c5-2-1-8-4(7)3(2)6/h2-7H,1H2","FMAORJIQYMIRHF-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2C(OC(C2O)(CO)O)CO)O)O)O)O","InChI=1S/C12H22O11/c13-1-4-6(16)7(17)8(18)11(21-4)22-9-5(2-14)23-12(20,3-15)10(9)19/h4-11,13-20H,1-3H2","JCQLYHFGKNRPGE-UHFFFAOYSA-N"
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"C1C(C(C(C(O1)OC2COC(C(C2O)O)O)O)O)O","InChI=1S/C10H18O9/c11-3-1-18-10(8(15)5(3)12)19-4-2-17-9(16)7(14)6(4)13/h3-16H,1-2H2","LGQKSQQRKHFMLI-UHFFFAOYSA-N"
"C1=CC(=C(C=C1O)CC(=O)O)O","InChI=1S/C8H8O4/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)","IGMNYECMUMZDDF-UHFFFAOYSA-N"
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"CCCCCCC=CCCCCCCCC(=O)O","InChI=1S/C16H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h7-8H,2-6,9-15H2,1H3,(H,17,18)","SECPZKHBENQXJG-UHFFFAOYSA-N"
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"CC1C(C(C(C(O1)OP(=O)(O)OP(=O)(O)OCC2C(C(C(O2)N3C=CC(=O)NC3=O)O)O)O)O)O","InChI=1S/C15H24N2O16P2/c1-5-8(19)10(21)12(23)14(30-5)32-35(27,28)33-34(25,26)29-4-6-9(20)11(22)13(31-6)17-3-2-7(18)16-15(17)24/h2-3,5-6,8-14,19-23H,4H2,1H3,(H,25,26)(H,27,28)(H,16,18,24)","DRDCJEIZVLVWNC-UHFFFAOYSA-N"
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"CSCCC(CC(=O)O)N","InChI=1S/C6H13NO2S/c1-10-3-2-5(7)4-6(8)9/h5H,2-4,7H2,1H3,(H,8,9)","QWVNCDVONVDGDV-UHFFFAOYSA-N"
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"C1=CC=C2C(=C1)C(=CN2)CC(CC(=O)O)N","InChI=1S/C12H14N2O2/c13-9(6-12(15)16)5-8-7-14-11-4-2-1-3-10(8)11/h1-4,7,9,14H,5-6,13H2,(H,15,16)","DUVVFMLAHWNDJD-UHFFFAOYSA-N"
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"C=C(C(=O)O)OP(=O)(O)O","InChI=1S/C3H5O6P/c1-2(3(4)5)9-10(6,7)8/h1H2,(H,4,5)(H2,6,7,8)","DTBNBXWJWCWCIK-UHFFFAOYSA-N"
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"C(CC(=O)O)C=O","InChI=1S/C4H6O3/c5-3-1-2-4(6)7/h3H,1-2H2,(H,6,7)","UIUJIQZEACWQSV-UHFFFAOYSA-N"
"C(CO)C(C(=O)O)N","InChI=1S/C4H9NO3/c5-3(1-2-6)4(7)8/h3,6H,1-2,5H2,(H,7,8)","UKAUYVFTDYCKQA-UHFFFAOYSA-N"
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"C1C(NC(=O)NC1=O)C(=O)O","InChI=1S/C5H6N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h2H,1H2,(H,9,10)(H2,6,7,8,11)","UFIVEPVSAGBUSI-UHFFFAOYSA-N"
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"C1=CC(=O)C=CC1=O","InChI=1S/C6H4O2/c7-5-1-2-6(8)4-3-5/h1-4H","AZQWKYJCGOJGHM-UHFFFAOYSA-N"
"C1C(C(OC1N2C=CC(=O)NC2=O)CO)O","InChI=1S/C9H12N2O5/c12-4-6-5(13)3-8(16-6)11-2-1-7(14)10-9(11)15/h1-2,5-6,8,12-13H,3-4H2,(H,10,14,15)","MXHRCPNRJAMMIM-UHFFFAOYSA-N"
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"C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O","InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)","CWVRJTMFETXNAD-UHFFFAOYSA-N"
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"C1=CC(=O)NC=C1C(=O)O","InChI=1S/C6H5NO3/c8-5-2-1-4(3-7-5)6(9)10/h1-3H,(H,7,8)(H,9,10)","BLHCMGRVFXRYRN-UHFFFAOYSA-N"
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"C1C(C(OC1N2C=CC(=O)NC2=O)COP(=O)(O)OP(=O)(O)O)O","InChI=1S/C9H14N2O11P2/c12-5-3-8(11-2-1-7(13)10-9(11)14)21-6(5)4-20-24(18,19)22-23(15,16)17/h1-2,5-6,8,12H,3-4H2,(H,18,19)(H,10,13,14)(H2,15,16,17)","QHWZTVCCBMIIKE-UHFFFAOYSA-N"
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"CC(C)(COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C2N=CN=C3N)O)OP(=O)(O)O)C(C(=O)NCCC(=O)NCCS)O","InChI=1S/C21H36N7O16P3S/c1-21(2,16(31)19(32)24-4-3-12(29)23-5-6-48)8-41-47(38,39)44-46(36,37)40-7-11-15(43-45(33,34)35)14(30)20(42-11)28-10-27-13-17(22)25-9-26-18(13)28/h9-11,14-16,20,30-31,48H,3-8H2,1-2H3,(H,23,29)(H,24,32)(H,36,37)(H,38,39)(H2,22,25,26)(H2,33,34,35)","RGJOEKWQDUBAIZ-UHFFFAOYSA-N"
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"CC1=C2C(=CC(=C1)O)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C","InChI=1S/C27H46O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h18-22,28H,7-17H2,1-6H3","GZIFEOYASATJEH-UHFFFAOYSA-N"
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"C(CCCCCCCCO)CCCCCCCO","InChI=1S/C16H34O2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h17-18H,1-16H2","GJBXIPOYHVMPQJ-UHFFFAOYSA-N"
"C(CC(=O)NC(CS)C(=O)O)C(C(=O)O)N","InChI=1S/C8H14N2O5S/c9-4(7(12)13)1-2-6(11)10-5(3-16)8(14)15/h4-5,16H,1-3,9H2,(H,10,11)(H,12,13)(H,14,15)","RITKHVBHSGLULN-UHFFFAOYSA-N"
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"CC(=CCNC1=NC=NC2=C1N=CN2C3C(C(C(C(O3)CO)O)O)O)CO","InChI=1S/C16H23N5O6/c1-8(4-22)2-3-17-14-10-15(19-6-18-14)21(7-20-10)16-13(26)12(25)11(24)9(5-23)27-16/h2,6-7,9,11-13,16,22-26H,3-5H2,1H3,(H,17,18,19)","VYRAJOITMBSQSE-UHFFFAOYSA-N"
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"COC1=CC=CC(=C1)C=CC(=O)O","InChI=1S/C10H10O3/c1-13-9-4-2-3-8(7-9)5-6-10(11)12/h2-7H,1H3,(H,11,12)","LZPNXAULYJPXEH-UHFFFAOYSA-N"
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"CC1=C2C(=C(C(=C1C)OC(=O)C)C)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C","InChI=1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3","ZAKOWWREFLAJOT-UHFFFAOYSA-N"
"C(C(=O)O)ON","InChI=1S/C2H5NO3/c3-6-1-2(4)5/h1,3H2,(H,4,5)","NQRKYASMKDDGHT-UHFFFAOYSA-N"
"CC1=CC(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)O","InChI=1S/C28H48O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-24(6)26(29)19-23(5)27(25)30-28/h19-22,29H,8-18H2,1-7H3","WGVKWNUPNGFDFJ-UHFFFAOYSA-N"
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"COC1=C(C=C(C=C1)C2CC(=O)C3=C(C=C(C=C3O2)O)O)O","InChI=1S/C16H14O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-6,14,17-19H,7H2,1H3","AIONOLUJZLIMTK-UHFFFAOYSA-N"
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"C(C(CO)OP(=O)(O)O)O","InChI=1S/C3H9O6P/c4-1-3(2-5)9-10(6,7)8/h3-5H,1-2H2,(H2,6,7,8)","DHCLVCXQIBBOPH-UHFFFAOYSA-N"
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"COC1=CC(=CC(=C1O)OC)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O","InChI=1S/C23H24O13/c1-32-12-3-8(4-13(33-2)16(12)27)21-22(18(29)15-10(26)5-9(25)6-11(15)34-21)36-23-20(31)19(30)17(28)14(7-24)35-23/h3-6,14,17,19-20,23-28,30-31H,7H2,1-2H3","JMFWYRWPJVEZPV-UHFFFAOYSA-N"
"C1=CC(=CC=C1C=CC(=O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O","InChI=1S/C30H26O13/c31-16-6-1-14(2-7-16)3-10-22(35)40-13-21-24(36)26(38)27(39)30(42-21)43-29-25(37)23-19(34)11-18(33)12-20(23)41-28(29)15-4-8-17(32)9-5-15/h1-12,21,24,26-27,30-34,36,38-39H,13H2","DVGGLGXQSFURLP-UHFFFAOYSA-N"
"CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C)NC1","InChI=1S/C27H43NO2/c1-16-7-12-27(28-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(29)8-10-25(18,3)21(20)9-11-26(22,24)4/h5,16-17,19-24,28-29H,6-15H2,1-4H3","KWVISVAMQJWJSZ-UHFFFAOYSA-N"
"C1=CC(=CC=C1C2=CC(=O)C3=C(O2)C(=C(C=C3O)O)C4C(C(C(C(O4)CO)O)O)O)O","InChI=1S/C21H20O10/c22-7-14-17(27)18(28)19(29)21(31-14)16-11(25)5-10(24)15-12(26)6-13(30-20(15)16)8-1-3-9(23)4-2-8/h1-6,14,17-19,21-25,27-29H,7H2","SGEWCQFRYRRZDC-UHFFFAOYSA-N"
"CC1C(C(C(C(O1)OC2C(C(C(OC2C3=C(C=C(C4=C3OC(=CC4=O)C5=CC=C(C=C5)O)O)O)CO)O)O)O)O)O","InChI=1S/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3","LYGPBZVKGHHTIE-UHFFFAOYSA-N"
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"CC1=CCC(CC1)C(C)(CCC=C(C)C)O","InChI=1S/C15H26O/c1-12(2)6-5-11-15(4,16)14-9-7-13(3)8-10-14/h6-7,14,16H,5,8-11H2,1-4H3","RGZSQWQPBWRIAQ-UHFFFAOYSA-N"
"CC(C)C1=CC(=O)C(=CC=C1)O","InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)","FUWUEFKEXZQKKA-UHFFFAOYSA-N"
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"CC1=CCC2CC1C2(C)C","InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4,8-9H,5-6H2,1-3H3","GRWFGVWFFZKLTI-UHFFFAOYSA-N"
"CC1(C2CCC(C2)C1=C)C","InChI=1S/C10H16/c1-7-8-4-5-9(6-8)10(7,2)3/h8-9H,1,4-6H2,2-3H3","CRPUJAZIXJMDBK-UHFFFAOYSA-N"
"CC1=CCC(=CC1)C(C)C","InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,7-8H,5-6H2,1-3H3","YKFLAYDHMOASIY-UHFFFAOYSA-N"
"CCCCCC1CCC(=O)O1","InChI=1S/C9H16O2/c1-2-3-4-5-8-6-7-9(10)11-8/h8H,2-7H2,1H3","OALYTRUKMRCXNH-UHFFFAOYSA-N"
"CC(=CCCC(=CCCC(=O)C)C)C","InChI=1S/C13H22O/c1-11(2)7-5-8-12(3)9-6-10-13(4)14/h7,9H,5-6,8,10H2,1-4H3","HNZUNIKWNYHEJJ-UHFFFAOYSA-N"
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"CC(=CCCC(=CCCC(=CCOC(=O)C)C)C)C","InChI=1S/C17H28O2/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-19-17(5)18/h8,10,12H,6-7,9,11,13H2,1-5H3","ZGIGZINMAOQWLX-UHFFFAOYSA-N"
"CC1CCC2(C(C3C(O2)CC4C3(CCC5C4CCC6C5(CCC(C6)O)C)C)C)OC1","InChI=1S/C27H44O3/c1-16-7-12-27(29-15-16)17(2)24-23(30-27)14-22-20-6-5-18-13-19(28)8-10-25(18,3)21(20)9-11-26(22,24)4/h16-24,28H,5-15H2,1-4H3","GMBQZIIUCVWOCD-UHFFFAOYSA-N"
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"C(C#N)C(C(=O)O)N","InChI=1S/C4H6N2O2/c5-2-1-3(6)4(7)8/h3H,1,6H2,(H,7,8)","BXRLWGXPSRYJDZ-UHFFFAOYSA-N"
"C(C(C(=O)NCC(=O)O)N)S","InChI=1S/C5H10N2O3S/c6-3(2-11)5(10)7-1-4(8)9/h3,11H,1-2,6H2,(H,7,10)(H,8,9)","ZUKPVRWZDMRIEO-UHFFFAOYSA-N"
"C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O","InChI=1S/C20H18O10/c21-9-3-1-8(2-4-9)18-19(30-20-17(27)15(25)12(24)7-28-20)16(26)14-11(23)5-10(22)6-13(14)29-18/h1-6,12,15,17,20-25,27H,7H2","RNVUDWOQYYWXBJ-UHFFFAOYSA-N"
"C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O","InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)17-18(13(25)12-10(24)5-9(23)6-11(12)31-17)32-21-16(28)14(26)15(27)19(33-21)20(29)30/h1-6,14-16,19,21-24,26-28H,(H,29,30)","FNTJVYCFNVUBOL-UHFFFAOYSA-N"
"C1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC(=C(C=C4)O)O)O)O)O","InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2","PZZRDJXEMZMZFD-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O","InChI=1S/C21H18O13/c22-7-4-10(25)12-11(5-7)32-17(6-1-2-8(23)9(24)3-6)18(13(12)26)33-21-16(29)14(27)15(28)19(34-21)20(30)31/h1-5,14-16,19,21-25,27-29H,(H,30,31)","DUBCCGAQYVUYEU-UHFFFAOYSA-N"
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"C(CCC(=O)O)CC(=O)O","InChI=1S/C6H10O4/c7-5(8)3-1-2-4-6(9)10/h1-4H2,(H,7,8)(H,9,10)","WNLRTRBMVRJNCN-UHFFFAOYSA-N"
"C1CC(=O)N(C1=O)OC(=O)CCCCCCC(=O)ON2C(=O)CCC2=O","InChI=1S/C16H20N2O8/c19-11-7-8-12(20)17(11)25-15(23)5-3-1-2-4-6-16(24)26-18-13(21)9-10-14(18)22/h1-10H2","ZWIBGKZDAWNIFC-UHFFFAOYSA-N"
"C1=CC(=C(C=C1O)C(=O)O)O","InChI=1S/C7H6O4/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3,8-9H,(H,10,11)","WXTMDXOMEHJXQO-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C(=O)NCC(=O)O","InChI=1S/C9H9NO3/c11-8(12)6-10-9(13)7-4-2-1-3-5-7/h1-5H,6H2,(H,10,13)(H,11,12)","QIAFMBKCNZACKA-UHFFFAOYSA-N"
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"C[N+](C)(C)[O-]","InChI=1S/C3H9NO/c1-4(2,3)5/h1-3H3","UYPYRKYUKCHHIB-UHFFFAOYSA-N"
"CC(CC(=O)O)C(=O)O","InChI=1S/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)","WXUAQHNMJWJLTG-UHFFFAOYSA-N"
"CC(C1=CC=CC=C1)C(=O)O","InChI=1S/C9H10O2/c1-7(9(10)11)8-5-3-2-4-6-8/h2-7H,1H3,(H,10,11)","YPGCWEMNNLXISK-UHFFFAOYSA-N"
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"CN1C=NC=C1CC(C(=O)O)NC(=O)CCN","InChI=1S/C10H16N4O3/c1-14-6-12-5-7(14)4-8(10(16)17)13-9(15)2-3-11/h5-6,8H,2-4,11H2,1H3,(H,13,15)(H,16,17)","MYYIAHXIVFADCU-UHFFFAOYSA-N"
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"COC1=C(C=CC(=C1)CC(=O)O)O","InChI=1S/C9H10O4/c1-13-8-4-6(5-9(11)12)2-3-7(8)10/h2-4,10H,5H2,1H3,(H,11,12)","QRMZSPFSDQBLIX-UHFFFAOYSA-N"
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"C1=CC=C(C=C1)CC(=O)NCC(=O)O","InChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)","UTYVDVLMYQPLQB-UHFFFAOYSA-N"
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"CCC(=O)C","InChI=1S/C4H8O/c1-3-4(2)5/h3H2,1-2H3","ZWEHNKRNPOVVGH-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C(C(=O)O)O)O)O","InChI=1S/C8H8O5/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7,9-11H,(H,12,13)","RGHMISIYKIHAJW-UHFFFAOYSA-N"
"C1=CC(=CC(=C1)O)C(C(=O)O)O","InChI=1S/C8H8O4/c9-6-3-1-2-5(4-6)7(10)8(11)12/h1-4,7,9-10H,(H,11,12)","OLSDAJRAVOVKLG-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C(C(=O)O)O","InChI=1S/C8H8O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7,9H,(H,10,11)","IWYDHOAUDWTVEP-UHFFFAOYSA-N"
"CC1=NC=C(C(=C1O)C(=O)O)CO","InChI=1S/C8H9NO4/c1-4-7(11)6(8(12)13)5(3-10)2-9-4/h2,10-11H,3H2,1H3,(H,12,13)","HXACOUQIXZGNBF-UHFFFAOYSA-N"
"COC1=CC(=C(C=C1)O)C(=O)O","InChI=1S/C8H8O4/c1-12-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3,(H,10,11)","IZZIWIAOVZOBLF-UHFFFAOYSA-N"
"CCC(C(=O)O)C(=O)O","InChI=1S/C5H8O4/c1-2-3(4(6)7)5(8)9/h3H,2H2,1H3,(H,6,7)(H,8,9)","UKFXDFUAPNAMPJ-UHFFFAOYSA-N"
"C(C(C(C(=O)O)O)O)(C(C(=O)O)O)O","InChI=1S/C6H10O8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14/h1-4,7-10H,(H,11,12)(H,13,14)","DSLZVSRJTYRBFB-UHFFFAOYSA-N"
"CC(C)C(=O)O","InChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)","KQNPFQTWMSNSAP-UHFFFAOYSA-N"
"CC(=O)NC(CCC(=O)O)C(=O)O","InChI=1S/C7H11NO5/c1-4(9)8-5(7(12)13)2-3-6(10)11/h5H,2-3H2,1H3,(H,8,9)(H,10,11)(H,12,13)","RFMMMVDNIPUKGG-UHFFFAOYSA-N"
"C(C(C(=O)O)NC(=O)N)C(=O)O","InChI=1S/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)","HLKXYZVTANABHZ-UHFFFAOYSA-N"
"CC1=CC(=C(C=C1)C(C)C)O","InChI=1S/C10H14O/c1-7(2)9-5-4-8(3)6-10(9)11/h4-7,11H,1-3H3","MGSRCZKZVOBKFT-UHFFFAOYSA-N"
"C1=C(C=C(C(=C1Br)O)Br)CC(C(=O)O)N","InChI=1S/C9H9Br2NO3/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,7,13H,3,12H2,(H,14,15)","COESHZUDRKCEPA-UHFFFAOYSA-N"
"C1=CC(=C(C=C1CC(C(=O)O)N)Cl)O","InChI=1S/C9H10ClNO3/c10-6-3-5(1-2-8(6)12)4-7(11)9(13)14/h1-3,7,12H,4,11H2,(H,13,14)","ACWBBAGYTKWBCD-UHFFFAOYSA-N"
"CN(C)C=O","InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3","ZMXDDKWLCZADIW-UHFFFAOYSA-N"
"CS(=O)CCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O","InChI=1S/C11H21NO10S3/c1-24(17)4-2-3-7(12-22-25(18,19)20)23-11-10(16)9(15)8(14)6(5-13)21-11/h6,8-11,13-16H,2-5H2,1H3,(H,18,19,20)","PHYYADMVYQURSX-UHFFFAOYSA-N"
"CS(=O)C=CCCC(=NOS(=O)(=O)O)SC1C(C(C(C(O1)CO)O)O)O","InChI=1S/C12H21NO10S3/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12/h3,5,7,9-12,14-17H,2,4,6H2,1H3,(H,19,20,21)","ZFLXCZJBYSPSKU-UHFFFAOYSA-N"
"C1=CC=C(C=C1)CC(=NOS(=O)(=O)O)SC2C(C(C(C(O2)CO)O)O)O","InChI=1S/C14H19NO9S2/c16-7-9-11(17)12(18)13(19)14(23-9)25-10(15-24-26(20,21)22)6-8-4-2-1-3-5-8/h1-5,9,11-14,16-19H,6-7H2,(H,20,21,22)","QQGLQYQXUKHWPX-UHFFFAOYSA-N"
"C1=CC=C(C=C1)CCC(=NOS(=O)(=O)O)SC2C(C(C(C(O2)CO)O)O)O","InChI=1S/C15H21NO9S2/c17-8-10-12(18)13(19)14(20)15(24-10)26-11(16-25-27(21,22)23)7-6-9-4-2-1-3-5-9/h1-5,10,12-15,17-20H,6-8H2,(H,21,22,23)","CKIJIGYDFNXSET-UHFFFAOYSA-N"
"C1=CC(=CC=C1CC(=NOS(=O)(=O)O)SC2C(C(C(C(O2)CO)O)O)O)O","InChI=1S/C14H19NO10S2/c16-6-9-11(18)12(19)13(20)14(24-9)26-10(15-25-27(21,22)23)5-7-1-3-8(17)4-2-7/h1-4,9,11-14,16-20H,5-6H2,(H,21,22,23)","WWBNBPSEKLOHJU-UHFFFAOYSA-N"
"C1CCNC(C1)C(=O)O","InChI=1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)","HXEACLLIILLPRG-UHFFFAOYSA-N"
"C(=CC(=O)O)C(=O)O","InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)","VZCYOOQTPOCHFL-UHFFFAOYSA-N"
"CC=CCC=CCCC(=O)C1C(O1)C(=O)N","InChI=1S/C12H17NO3/c1-2-3-4-5-6-7-8-9(14)10-11(16-10)12(13)15/h2-3,5-6,10-11H,4,7-8H2,1H3,(H2,13,15)","GVEZIHKRYBHEFX-UHFFFAOYSA-N"
"CC1CCCC(=O)CCCC=CC2=CC(=CC(=C2C(=O)O1)O)O","InChI=1S/C18H22O5/c1-12-6-5-9-14(19)8-4-2-3-7-13-10-15(20)11-16(21)17(13)18(22)23-12/h3,7,10-12,20-21H,2,4-6,8-9H2,1H3","MBMQEIFVQACCCH-UHFFFAOYSA-N"
"COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO","InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3","QJVXKWHHAMZTBY-UHFFFAOYSA-N"
"CSCC(C(=O)O)N","InChI=1S/C4H9NO2S/c1-8-2-3(5)4(6)7/h3H,2,5H2,1H3,(H,6,7)","IDIDJDIHTAOVLG-UHFFFAOYSA-N"
"C12=C(NC(=O)N1)NC(=O)NC2=O","InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)","LEHOTFFKMJEONL-UHFFFAOYSA-N"
"C1=CC(=CC=C1CCC(=O)O)O","InChI=1S/C9H10O3/c10-8-4-1-7(2-5-8)3-6-9(11)12/h1-2,4-5,10H,3,6H2,(H,11,12)","NMHMNPHRMNGLLB-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)OP(=O)(O)O)O","InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(4(1-16)21-10)22-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)","LNQVTSROQXJCDD-UHFFFAOYSA-N"
"CC1C(C(C(C(O1)OC2=CC(=C3C(=C2)OC(=C(C3=O)O)C4=CC(=C(C=C4)O)O)O)O)O)O","InChI=1S/C21H20O11/c1-7-15(25)17(27)19(29)21(30-7)31-9-5-12(24)14-13(6-9)32-20(18(28)16(14)26)8-2-3-10(22)11(23)4-8/h2-7,15,17,19,21-25,27-29H,1H3","QPHXPNUXTNHJOF-UHFFFAOYSA-N"
"COC1=CC(=CC(=C1O)OC)C=CC(=O)OC(CC(=O)O)C(=O)O","InChI=1S/C15H16O9/c1-22-9-5-8(6-10(23-2)14(9)19)3-4-13(18)24-11(15(20)21)7-12(16)17/h3-6,11,19H,7H2,1-2H3,(H,16,17)(H,20,21)","DUDGAPSRYCQPBG-UHFFFAOYSA-N"
"COC1=CC(=CC(=C1O)OC)C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O","InChI=1S/C17H22O10/c1-24-9-5-8(6-10(25-2)13(9)20)3-4-12(19)27-17-16(23)15(22)14(21)11(7-18)26-17/h3-6,11,14-18,20-23H,7H2,1-2H3","XRKBRPFTFKKHEF-UHFFFAOYSA-N"
"C1C(C(C(=O)O1)O)O","InChI=1S/C4H6O4/c5-2-1-8-4(7)3(2)6/h2-3,5-6H,1H2","SGMJBNSHAZVGMC-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2C(C(C(C(C2O)O)O)O)O)O)O)O)O","InChI=1S/C12H22O11/c13-1-2-3(14)4(15)10(21)12(22-2)23-11-8(19)6(17)5(16)7(18)9(11)20/h2-21H,1H2","VCWMRQDBPZKXKG-UHFFFAOYSA-N"
"C1=CC(=CC=C1C(=O)NC(CCC(=O)O)C(=O)O)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N","InChI=1S/C19H19N7O6/c20-19-25-15-14(17(30)26-19)23-11(8-22-15)7-21-10-3-1-9(2-4-10)16(29)24-12(18(31)32)5-6-13(27)28/h1-4,8,12,21H,5-7H2,(H,24,29)(H,27,28)(H,31,32)(H3,20,22,25,26,30)","OVBPIULPVIDEAO-UHFFFAOYSA-N"
"C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C(C(=CC(=C34)O)O)C5C(C(OC6=CC(=CC(=C56)O)O)C7=CC(=C(C=C7)O)O)O)C8=CC(=C(C=C8)O)O)O)O)O)C9=CC(=C(C=C9)O)O)O","InChI=1S/C45H38O18/c46-18-10-27(54)33-32(11-18)61-42(16-2-5-21(48)25(52)8-16)39(59)37(33)35-29(56)14-30(57)36-38(40(60)43(63-45(35)36)17-3-6-22(49)26(53)9-17)34-28(55)13-23(50)19-12-31(58)41(62-44(19)34)15-1-4-20(47)24(51)7-15/h1-11,13-14,31,37-43,46-60H,12H2","MOJZMWJRUKIQGL-UHFFFAOYSA-N"
"CCCCCC(C=CC1C(CC(=O)C1CCCCCCC(=O)O)O)O","InChI=1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)","GMVPRGQOIOIIMI-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O","InChI=1S/C27H30O17/c28-6-14-17(33)20(36)22(38)26(42-14)41-12-2-1-8(3-10(12)31)24-25(19(35)16-11(32)4-9(30)5-13(16)40-24)44-27-23(39)21(37)18(34)15(7-29)43-27/h1-5,14-15,17-18,20-23,26-34,36-39H,6-7H2","RPVIQWDFJPYNJM-UHFFFAOYSA-N"
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"CC1C(C(C(C(O1)OP(=O)(O)O)O)O)O","InChI=1S/C6H13O8P/c1-2-3(7)4(8)5(9)6(13-2)14-15(10,11)12/h2-9H,1H3,(H2,10,11,12)","PTVXQARCLQPGIR-UHFFFAOYSA-N"
"COC(=O)C1=CC=CC=C1O","InChI=1S/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H3","OSWPMRLSEDHDFF-UHFFFAOYSA-N"
"CCSCCC(C(=O)O)N","InChI=1S/C6H13NO2S/c1-2-10-4-3-5(7)6(8)9/h5H,2-4,7H2,1H3,(H,8,9)","GGLZPLKKBSSKCX-UHFFFAOYSA-N"
"CC(CCC(=O)O)C1CCC2C1(C(CC3C2CCC4C3(CCC(C4)O)C)O)C","InChI=1S/C24H40O4/c1-14(4-9-22(27)28)18-7-8-19-17-6-5-15-12-16(25)10-11-23(15,2)20(17)13-21(26)24(18,19)3/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)","KXGVEGMKQFWNSR-UHFFFAOYSA-N"
"CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)O)C)C","InChI=1S/C20H28O2/c1-15(8-6-9-16(2)14-19(21)22)11-12-18-17(3)10-7-13-20(18,4)5/h6,8-9,11-12,14H,7,10,13H2,1-5H3,(H,21,22)","SHGAZHPCJJPHSC-UHFFFAOYSA-N"
"CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CCO)C)C","InChI=1S/C20H30O/c1-16(8-6-9-17(2)13-15-21)11-12-19-18(3)10-7-14-20(19,4)5/h6,8-9,11-13,21H,7,10,14-15H2,1-5H3","FPIPGXGPPPQFEQ-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OCC2C(C(C(O2)(CO)O)O)O)O)O)O)O","InChI=1S/C12H22O11/c13-1-4-6(15)8(17)9(18)11(22-4)21-2-5-7(16)10(19)12(20,3-14)23-5/h4-11,13-20H,1-3H2","PVXPPJIGRGXGCY-UHFFFAOYSA-N"
"C1=CC(=C(C2=C1C=CC(=O)O2)O)O","InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H","ATEFPOUAMCWAQS-UHFFFAOYSA-N"
"C1=CC(=O)OC2=CC(=C(C=C21)O)O","InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H","ILEDWLMCKZNDJK-UHFFFAOYSA-N"
"C1=CC(=O)OC2=CC(=C(C=C21)OC3C(C(C(C(O3)CO)O)O)O)O","InChI=1S/C15H16O9/c16-5-10-12(19)13(20)14(21)15(24-10)23-9-3-6-1-2-11(18)22-8(6)4-7(9)17/h1-4,10,12-17,19-21H,5H2","XHCADAYNFIFUHF-UHFFFAOYSA-N"
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"CC1=CC(=O)C2=CC=CC=C2C1=O","InChI=1S/C11H8O2/c1-7-6-10(12)8-4-2-3-5-9(8)11(7)13/h2-6H,1H3","MJVAVZPDRWSRRC-UHFFFAOYSA-N"
"CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C","InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-26,28H,3,6-11,14-18H2,1-2,4-5H3","QYSXJUFSXHHAJI-UHFFFAOYSA-N"
"CC1=C(C(=C2CCC(OC2=C1C)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)C)O","InChI=1S/C29H44O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h12,14,16,30H,9-11,13,15,17-19H2,1-8H3","RZFHLOLGZPDCHJ-UHFFFAOYSA-N"
"CC1=C(C=C2CCC(OC2=C1C)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)O","InChI=1S/C28H42O2/c1-20(2)11-8-12-21(3)13-9-14-22(4)15-10-17-28(7)18-16-25-19-26(29)23(5)24(6)27(25)30-28/h11,13,15,19,29H,8-10,12,14,16-18H2,1-7H3","OTXNTMVVOOBZCV-UHFFFAOYSA-N"
"CC1=C2C(=CC(=C1)O)CCC(O2)(C)CCC=C(C)CCC=C(C)CCC=C(C)C","InChI=1S/C27H40O2/c1-20(2)10-7-11-21(3)12-8-13-22(4)14-9-16-27(6)17-15-24-19-25(28)18-23(5)26(24)29-27/h10,12,14,18-19,28H,7-9,11,13,15-17H2,1-6H3","ODADKLYLWWCHNB-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3C(OC(C(C3O)O)O)CO)O)O)O)O)O)O)O","InChI=1S/C18H32O16/c19-1-4-7(21)9(23)13(27)17(32-4)30-3-6-8(22)10(24)14(28)18(33-6)34-15-5(2-20)31-16(29)12(26)11(15)25/h4-29H,1-3H2","OWEGMIWEEQEYGQ-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)COC3(C(C(C(O3)CO)O)O)CO)O)O)O)O","InChI=1S/C18H32O16/c19-1-6-9(23)12(26)13(27)16(31-6)34-18(15(29)11(25)8(3-21)33-18)5-30-17(4-22)14(28)10(24)7(2-20)32-17/h6-16,19-29H,1-5H2","VAWYEUIPHLMNNF-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OC2(C(C(C(O2)CO)O)O)COC3(C(C(C(O3)CO)O)O)COC4(C(C(C(O4)CO)O)O)CO)O)O)O)O","InChI=1S/C24H42O21/c25-1-8-12(30)16(34)17(35)21(41-8)45-24(20(38)15(33)11(4-28)44-24)7-40-23(19(37)14(32)10(3-27)43-23)6-39-22(5-29)18(36)13(31)9(2-26)42-22/h8-21,25-38H,1-7H2","FLDFNEBHEXLZRX-UHFFFAOYSA-N"
"C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC3C(C(C(C(O3)OC4(C(C(C(O4)CO)O)O)CO)O)O)O)O)O)O)O)O)O)O","InChI=1S/C24H42O21/c25-1-6-10(28)14(32)17(35)21(41-6)39-3-8-11(29)15(33)18(36)22(42-8)40-4-9-12(30)16(34)19(37)23(43-9)45-24(5-27)20(38)13(31)7(2-26)44-24/h6-23,25-38H,1-5H2","UQZIYBXSHAGNOE-UHFFFAOYSA-N"
"C(CON=C(N)N)C(C(=O)O)N","InChI=1S/C5H12N4O3/c6-3(4(10)11)1-2-12-9-5(7)8/h3H,1-2,6H2,(H,10,11)(H4,7,8,9)","FSBIGDSBMBYOPN-UHFFFAOYSA-N"
"C(CC(=O)NC(CS)C(=O)NCCC(=O)O)C(C(=O)O)N","InChI=1S/C11H19N3O6S/c12-6(11(19)20)1-2-8(15)14-7(5-21)10(18)13-4-3-9(16)17/h6-7,21H,1-5,12H2,(H,13,18)(H,14,15)(H,16,17)(H,19,20)","HKBNQXMLSMKLJV-UHFFFAOYSA-N"
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"CN1C=CC=CC1=C[NH+]=O","InChI=1S/C7H8N2O/c1-9-5-3-2-4-7(9)6-8-10/h2-6H,1H3/p+1","JBKPUQTUERUYQE-UHFFFAOYSA-O"
"CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCO","InChI=1S/C12H17N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15)/q+1","JZRWCGZRTZMZEH-UHFFFAOYSA-N"
"CC1=C(SC=[N+]1CC2=CN=C(N=C2N)C)CCOP(=O)(O)O","InChI=1S/C12H17N4O4PS/c1-8-11(3-4-20-21(17,18)19)22-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,7H,3-4,6H2,1-2H3,(H3-,13,14,15,17,18,19)/p+1","HZSAJDVWZRBGIF-UHFFFAOYSA-O"
"C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O)O)O)C(=O)N","InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/p+1","BAWFJGJZGIEFAR-UHFFFAOYSA-O"
"C1=CC(=CC=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O","InChI=1S/C27H30O15/c28-8-17-19(32)21(34)23(36)26(41-17)39-15-6-12(31)5-14-13(15)7-16(25(38-14)10-1-3-11(30)4-2-10)40-27-24(37)22(35)20(33)18(9-29)42-27/h1-7,17-24,26-29,32-37H,8-9H2,(H-,30,31)/p+1","SLCKJKWFULXZBD-UHFFFAOYSA-O"
"CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C([O+]=C4C=C(C=C(C4=C3)O)O)C5=CC(=C(C=C5)O)O)O)O)O)O)O)O","InChI=1S/C27H30O15/c1-9-19(32)21(34)23(36)26(39-9)38-8-18-20(33)22(35)24(37)27(42-18)41-17-7-12-14(30)5-11(28)6-16(12)40-25(17)10-2-3-13(29)15(31)4-10/h2-7,9,18-24,26-27,32-37H,8H2,1H3,(H3-,28,29,30,31)/p+1","USNPULRDBDVJAO-UHFFFAOYSA-O"
"C1=CC(=CC=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O","InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-7-12-13(25)5-11(24)6-14(12)29-20(15)9-1-3-10(23)4-2-9/h1-7,16-19,21-22,26-28H,8H2,(H2-,23,24,25)/p+1","ABVCUBUIXWJYSE-UHFFFAOYSA-O"
"C[N+](C)(C)CCOP(=O)(O)OCC(CO)O","InChI=1S/C8H20NO6P/c1-9(2,3)4-5-14-16(12,13)15-7-8(11)6-10/h8,10-11H,4-7H2,1-3H3/p+1","SUHOQUVVVLNYQR-UHFFFAOYSA-O"
"C1C2C(C(C(C(O1)O2)O)O)O","InChI=1S/C6H10O5/c7-3-2-1-10-6(11-2)5(9)4(3)8/h2-9H,1H2","TWNIBLMWSKIRAT-UHFFFAOYSA-N"
"CC(CC(=O)O)N","InChI=1S/C4H9NO2/c1-3(5)2-4(6)7/h3H,2,5H2,1H3,(H,6,7)","OQEBBZSWEGYTPG-UHFFFAOYSA-N"
"C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O","InChI=1S/C27H30O16/c28-7-17-19(33)21(35)23(37)26(42-17)40-15-5-10(30)4-14-11(15)6-16(25(39-14)9-1-2-12(31)13(32)3-9)41-27-24(38)22(36)20(34)18(8-29)43-27/h1-6,17-24,26-29,33-38H,7-8H2,(H2-,30,31,32)/p+1","RDFLLVCQYHQOBU-UHFFFAOYSA-O"
"C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O)O","InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-15-6-10-12(25)4-9(23)5-14(10)30-20(15)8-1-2-11(24)13(26)3-8/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1","RKWHWFONKJEUEF-UHFFFAOYSA-O"
"COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O","InChI=1S/C23H24O12/c1-31-14-3-9(4-15(32-2)18(14)27)22-16(7-11-12(26)5-10(25)6-13(11)33-22)34-23-21(30)20(29)19(28)17(8-24)35-23/h3-7,17,19-21,23-24,28-30H,8H2,1-2H3,(H2-,25,26,27)/p+1","PXUQTDZNOHRWLI-UHFFFAOYSA-O"
"COC1=CC(=CC(=C1O)OC)C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O","InChI=1S/C29H34O17/c1-40-15-3-10(4-16(41-2)20(15)33)27-17(44-29-26(39)24(37)22(35)19(9-31)46-29)7-12-13(42-27)5-11(32)6-14(12)43-28-25(38)23(36)21(34)18(8-30)45-28/h3-7,18-19,21-26,28-31,34-39H,8-9H2,1-2H3,(H-,32,33)/p+1","CILLXFBAACIQNS-UHFFFAOYSA-O"
"COC1=C(C=CC(=C1)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O","InChI=1S/C22H22O11/c1-30-15-4-9(2-3-12(15)25)21-16(7-11-13(26)5-10(24)6-14(11)31-21)32-22-20(29)19(28)18(27)17(8-23)33-22/h2-7,17-20,22-23,27-29H,8H2,1H3,(H2-,24,25,26)/p+1","ZZWPMFROUHHAKY-UHFFFAOYSA-O"
"CC(CN)C(=O)O","InChI=1S/C4H9NO2/c1-3(2-5)4(6)7/h3H,2,5H2,1H3,(H,6,7)","QCHPKSFMDHPSNR-UHFFFAOYSA-N"
"CC(=O)OC(CC(=O)O)C[N+](C)(C)C","InChI=1S/C9H17NO4/c1-7(11)14-8(5-9(12)13)6-10(2,3)4/h8H,5-6H2,1-4H3/p+1","RDHQFKQIGNGIED-UHFFFAOYSA-O"
"C[N+](C)(C)CCOP(=O)(O)O","InChI=1S/C5H14NO4P/c1-6(2,3)4-5-10-11(7,8)9/h4-5H2,1-3H3,(H-,7,8,9)/p+1","YHHSONZFOIEMCP-UHFFFAOYSA-O"
"C[N+]1=CC=CC(=C1)C(=O)N","InChI=1S/C7H8N2O/c1-9-4-2-3-6(5-9)7(8)10/h2-5H,1H3,(H-,8,10)/p+1","LDHMAVIPBRSVRG-UHFFFAOYSA-O"
"COC1=CC(=CC(=C1O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O","InChI=1S/C16H12O7/c1-22-14-3-7(2-11(19)15(14)21)16-12(20)6-9-10(18)4-8(17)5-13(9)23-16/h2-6H,1H3,(H4-,17,18,19,20,21)/p+1","AFOLOMGWVXKIQL-UHFFFAOYSA-O"
"C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O","InChI=1S/C21H20O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-22,28-30H,6H2,(H4-,23,24,25,26,27)/p+1","XENHPQQLDPAYIJ-UHFFFAOYSA-O"
"COC1=CC(=CC(=C1O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)O","InChI=1S/C22H22O12/c1-31-14-3-8(2-12(26)17(14)27)21-15(6-10-11(25)4-9(24)5-13(10)32-21)33-22-20(30)19(29)18(28)16(7-23)34-22/h2-6,16,18-20,22-23,28-30H,7H2,1H3,(H3-,24,25,26,27)/p+1","CCQDWIRWKWIUKK-UHFFFAOYSA-O"
"C1C(C(C(C(O1)OC2C(C(C(OC2OC3=C([O+]=C4C=C(C=C(C4=C3)O)O)C5=CC(=C(C=C5)O)O)CO)O)O)O)O)O","InChI=1S/C26H28O15/c27-7-18-20(34)21(35)24(41-25-22(36)19(33)15(32)8-37-25)26(40-18)39-17-6-11-13(30)4-10(28)5-16(11)38-23(17)9-1-2-12(29)14(31)3-9/h1-6,15,18-22,24-27,32-36H,7-8H2,(H3-,28,29,30,31)/p+1","ZPPQIOUITZSYAO-UHFFFAOYSA-O"
"C1=CC(=C(C=C1C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)OC4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O","InChI=1S/C27H30O16/c28-7-17-19(34)21(36)23(38)26(41-17)43-25-22(37)20(35)18(8-29)42-27(25)40-16-6-11-13(32)4-10(30)5-15(11)39-24(16)9-1-2-12(31)14(33)3-9/h1-6,17-23,25-29,34-38H,7-8H2,(H3-,30,31,32,33)/p+1","SXYMMDGPXYVCER-UHFFFAOYSA-O"
"COC1=C(C=CC(=C1)C2=C(C=C3C(=CC(=CC3=[O+]2)O)OC4C(C(C(C(O4)CO)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O","InChI=1S/C28H32O16/c1-39-16-4-10(2-3-13(16)32)26-17(42-28-25(38)23(36)21(34)19(9-30)44-28)7-12-14(40-26)5-11(31)6-15(12)41-27-24(37)22(35)20(33)18(8-29)43-27/h2-7,18-25,27-30,33-38H,8-9H2,1H3,(H-,31,32)/p+1","IPVSUYLZIAYTOK-UHFFFAOYSA-O"
"CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C([O+]=C4C=C(C=C(C4=C3)O)O)C5=CC(=C(C(=C5)O)O)O)O)O)O)O)O)O","InChI=1S/C27H30O16/c1-8-18(32)21(35)23(37)26(40-8)39-7-17-20(34)22(36)24(38)27(43-17)42-16-6-11-12(29)4-10(28)5-15(11)41-25(16)9-2-13(30)19(33)14(31)3-9/h2-6,8,17-18,20-24,26-27,32,34-38H,7H2,1H3,(H4-,28,29,30,31,33)/p+1","PLKUTZNSKRWCCA-UHFFFAOYSA-O"
"C1C(C(C(C(O1)OC2C(C(C(OC2OC3=C([O+]=C4C=C(C=C(C4=C3)OC5C(C(C(C(O5)CO)O)O)O)O)C6=CC(=C(C=C6)O)O)COC(=O)C=CC7=CC=C(C=C7)O)O)O)O)O)O","InChI=1S/C41H44O22/c42-13-27-31(50)33(52)36(55)40(61-27)59-25-11-19(44)10-24-20(25)12-26(37(58-24)17-4-7-21(45)22(46)9-17)60-41-38(63-39-35(54)30(49)23(47)14-57-39)34(53)32(51)28(62-41)15-56-29(48)8-3-16-1-5-18(43)6-2-16/h1-12,23,27-28,30-36,38-42,47,49-55H,13-15H2,(H3-,43,44,45,46,48)/p+1","JSYDBTWJIIAZPU-UHFFFAOYSA-O"
"CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C([O+]=C4C=C(C=C(C4=C3)OC5C(C(C(C(O5)CO)O)O)O)O)C6=CC(=C(C(=C6)OC)O)O)O)O)O)O)O)OC(=O)C=CC7=CC=C(C=C7)O","InChI=1S/C43H48O23/c1-16-39(66-29(48)8-5-17-3-6-19(45)7-4-17)35(54)38(57)41(60-16)59-15-28-32(51)34(53)37(56)43(65-28)63-26-13-21-23(61-40(26)18-9-22(47)30(49)25(10-18)58-2)11-20(46)12-24(21)62-42-36(55)33(52)31(50)27(14-44)64-42/h3-13,16,27-28,31-39,41-44,50-57H,14-15H2,1-2H3,(H3-,45,46,47,48,49)/p+1","BXEZTCOKOLHMKY-UHFFFAOYSA-O"
"C(C(C(C=O)O)O)OP(=O)(O)O","InChI=1S/C4H9O7P/c5-1-3(6)4(7)2-11-12(8,9)10/h1,3-4,6-7H,2H2,(H2,8,9,10)","NGHMDNPXVRFFGS-UHFFFAOYSA-N"
"C(C(C(C(=O)CO)O)O)OP(=O)(O)O","InChI=1S/C5H11O8P/c6-1-3(7)5(9)4(8)2-13-14(10,11)12/h4-6,8-9H,1-2H2,(H2,10,11,12)","FNZLKVNUWIIPSJ-UHFFFAOYSA-N"
"CCCCCC=CCC=CCC=CCCCCC(=O)O","InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)","VZCCETWTMQHEPK-UHFFFAOYSA-N"
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"CC1=CC(=C2C(=C1)C3=C(CC[C@]3(C(=O)OC)O)OC2=O)O","InChI=1S/C15H14O6/c1-7-5-8-11(9(16)6-7)13(17)21-10-3-4-15(19,12(8)10)14(18)20-2/h5-6,16,19H,3-4H2,1-2H3/t15-/m0/s1","MWJQDTTVNPGMAY-HNNXBMFYSA-N"
"CC1=CC(=C2C(=C1)C3=C(CC[C@@H]3O)OC2=O)O","InChI=1S/C13H12O4/c1-6-4-7-11-8(14)2-3-10(11)17-13(16)12(7)9(15)5-6/h4-5,8,14-15H,2-3H2,1H3/t8-/m0/s1","DMYRPFPADKEUEO-QMMMGPOBSA-N"
"C[C@H]1[C@H](OC(=O)C2=C(C(=C(C=C12)O)C)O)C","InChI=1S/C12H14O4/c1-5-7(3)16-12(15)10-8(5)4-9(13)6(2)11(10)14/h4-5,7,13-14H,1-3H3/t5-,7+/m0/s1","WWSWVMRYHCEPFK-CAHLUQPWSA-N"
"CC(C)C[C@@H]1C(=O)N[C@H](C(=O)N1)CC2=CNC3=CC=CC=C32","InChI=1S/C17H21N3O2/c1-10(2)7-14-16(21)20-15(17(22)19-14)8-11-9-18-13-6-4-3-5-12(11)13/h3-6,9-10,14-15,18H,7-8H2,1-2H3,(H,19,22)(H,20,21)/t14-,15+/m1/s1","BZUNCDPEEKFTCX-CABCVRRESA-N"
"CCC(C)[C@@H]1C(=O)N[C@H](C(=O)N1)CC2=CNC3=CC=CC=C32","InChI=1S/C17H21N3O2/c1-3-10(2)15-17(22)19-14(16(21)20-15)8-11-9-18-13-7-5-4-6-12(11)13/h4-7,9-10,14-15,18H,3,8H2,1-2H3,(H,19,22)(H,20,21)/t10?,14-,15+/m0/s1","PGCNHGBQEYFZEX-XVDHHWJWSA-N"
"C[C@H]1CC/C=C/CC(=O)C2=C(C=C(C=C2CC(=O)O1)O)O","InChI=1S/C16H18O5/c1-10-5-3-2-4-6-13(18)16-11(8-15(20)21-10)7-12(17)9-14(16)19/h2,4,7,9-10,17,19H,3,5-6,8H2,1H3/b4-2+/t10-/m0/s1","ZWRCIODUEDCNMZ-YWNRKNDBSA-N"
"C[C@H]1CCC(=O)[C@H](CC(=O)C2=C(C=C(C=C2CC(=O)O1)O)O)O","InChI=1S/C16H18O7/c1-8-2-3-11(18)12(19)7-14(21)16-9(5-15(22)23-8)4-10(17)6-13(16)20/h4,6,8,12,17,19-20H,2-3,5,7H2,1H3/t8-,12-/m0/s1","PCSBVPMYIHSHPB-UFBFGSQYSA-N"
"C[C@H]1CCC(=O)CCC(=O)C2=C(C=C(C=C2CC(=O)O1)O)O","InChI=1S/C16H18O6/c1-9-2-3-11(17)4-5-13(19)16-10(7-15(21)22-9)6-12(18)8-14(16)20/h6,8-9,18,20H,2-5,7H2,1H3/t9-/m0/s1","MFGVWPFVDDUSLL-VIFPVBQESA-N"
"C[C@H]1CCC/C=C/C(=O)C2=C(C=C(C=C2CC(=O)O1)O)O","InChI=1S/C16H18O5/c1-10-5-3-2-4-6-13(18)16-11(8-15(20)21-10)7-12(17)9-14(16)19/h4,6-7,9-10,17,19H,2-3,5,8H2,1H3/b6-4+/t10-/m0/s1","AVIRMQMUBGNCKS-RWCYGVJQSA-N"
"CC(C)[C@@H]1C(=O)N2[C@@H](C[C@@]3([C@H]2NC4=CC=CC=C43)C(C)(C)C=C)C(=O)N1","InChI=1S/C21H27N3O2/c1-6-20(4,5)21-11-15-17(25)23-16(12(2)3)18(26)24(15)19(21)22-14-10-8-7-9-13(14)21/h6-10,12,15-16,19,22H,1,11H2,2-5H3,(H,23,25)/t15-,16+,19-,21+/m0/s1","GFKUCJKLCHSSJN-JRYVEOFUSA-N"
"c1ccc2c(c1)c1ccccc1[nH]2","InChI=1S/C12H9N/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11/h1-8,13H","UJOBWOGCFQCDNV-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)NN=N2","InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)","QRUDEWIWKLJBPS-UHFFFAOYSA-N"
"c1ccc2c(c1)cc1ccccc1n2","InChI=1S/C13H9N/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-9H","DZBUGLKDJFMEHC-UHFFFAOYSA-N"
"c1ccc2c(c1)cnc1ccccc21","InChI=1S/C13H9N/c1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13/h1-9H","RDOWQLZANAYVLL-UHFFFAOYSA-N"
"Cn1c2c(c3c(cc2)nccc3)nc1N","InChI=1S/C11H10N4/c1-15-9-5-4-8-7(3-2-6-13-8)10(9)14-11(15)12/h2-6H,1H3,(H2,12,14)","ARZWATDYIYAUTA-UHFFFAOYSA-N"
"Cc1cnc2ccc3c(c2n1)nc(n3C)N","InChI=1S/C11H11N5/c1-6-5-13-7-3-4-8-10(9(7)14-6)15-11(12)16(8)2/h3-5H,1-2H3,(H2,12,15)","DVCCCQNKIYNAKB-UHFFFAOYSA-N"
"Cc1nccc2c1[nH]c1ccccc21","InChI=1S/C12H10N2/c1-8-12-10(6-7-13-8)9-4-2-3-5-11(9)14-12/h2-7,14H,1H3","PSFDQSOCUJVVGF-UHFFFAOYSA-N"
"c1ccc2c(c1)c1c([nH]2)nc(cc1)N","InChI=1S/C11H9N3/c12-10-6-5-8-7-3-1-2-4-9(7)13-11(8)14-10/h1-6H,(H3,12,13,14)","FJTNLJLPLJDTRM-UHFFFAOYSA-N"
"Cn1c2c(ncc(c2)c2ccccc2)nc1N","InChI=1S/C13H12N4/c1-17-11-7-10(9-5-3-2-4-6-9)8-15-12(11)16-13(17)14/h2-8H,1H3,(H2,14,15,16)","UQVKZNNCIHJZLS-UHFFFAOYSA-N"
"c1ccc2c(c1)ccc1nc3ccccc3cc21","InChI=1S/C17H11N/c1-3-7-14-12(5-1)9-10-17-15(14)11-13-6-2-4-8-16(13)18-17/h1-11H","JEGZRTMZYUDVBF-UHFFFAOYSA-N"
"c1ccc2c(c1)c1ccccc1C2=O","InChI=1S/C13H8O/c14-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)13/h1-8H","YLQWCDOCJODRMT-UHFFFAOYSA-N"
"c1ccc2c(c1)c1cccc3c1c(ccc3)C2=O","InChI=1S/C17H10O/c18-17-14-8-2-1-7-12(14)13-9-3-5-11-6-4-10-15(17)16(11)13/h1-10H","HUKPVYBUJRAUAG-UHFFFAOYSA-N"
"c1ccc2c(c1)ccc(c2C=O)O","InChI=1S/C11H8O2/c12-7-10-9-4-2-1-3-8(9)5-6-11(10)13/h1-7,13H","NTCCNERMXRIPTR-UHFFFAOYSA-N"
"O=C4c2cccc1ccc3c(c12)c4ccc3","InChI=1S/C15H8O/c16-15-11-5-1-3-9-7-8-10-4-2-6-12(15)14(10)13(9)11/h1-8H","IFCBMPOMNSORDG-UHFFFAOYSA-N"
"O=C(c1ccccc1)c2ccccc2","InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H","RWCCWEUUXYIKHB-UHFFFAOYSA-N"
"c1ccc2c(c1)c1c3c(c(cc1)[N+](=O)[O-])cccc3C2=O","InChI=1S/C17H9NO3/c19-17-12-5-2-1-4-10(12)11-8-9-15(18(20)21)13-6-3-7-14(17)16(11)13/h1-9H","QAJOWHGESRCVLY-UHFFFAOYSA-N"
"c1ccc2c(c1)c1c(C2=O)cc(cc1)[N+](=O)[O-]","InChI=1S/C13H7NO3/c15-13-11-4-2-1-3-9(11)10-6-5-8(14(16)17)7-12(10)13/h1-7H","AJEAHBZZHSLIQP-UHFFFAOYSA-N"
"O=C\2c1c(cccc1)C(=O)/C=C/2","InChI=1S/C10H6O2/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6H","FRASJONUBLZVQX-UHFFFAOYSA-N"
"c1ccc2c(c1)c1ccccc1C(=O)C2=O","InChI=1S/C14H8O2/c15-13-11-7-3-1-5-9(11)10-6-2-4-8-12(10)14(13)16/h1-8H","YYVYAPXYZVYDHN-UHFFFAOYSA-N"
"c1ccc2c(c1)C(=O)NC2=O","InChI=1S/C8H5NO2/c10-7-5-3-1-2-4-6(5)8(11)9-7/h1-4H,(H,9,10,11)","XKJCHHZQLQNZHY-UHFFFAOYSA-N"
"O=C\4c3c(ccc2c1ccccc1ccc23)C(=O)/C=C/4","InChI=1S/C18H10O2/c19-16-9-10-17(20)18-14-6-5-11-3-1-2-4-12(11)13(14)7-8-15(16)18/h1-10H","UORKIKBNUWJNJF-UHFFFAOYSA-N"
"O=C3c4c(c2c(c1ccccc1cc2)C3=O)cccc4","InChI=1S/C18H10O2/c19-17-15-8-4-3-7-13(15)14-10-9-11-5-1-2-6-12(11)16(14)18(17)20/h1-10H","HZGMNNQOPOLCIG-UHFFFAOYSA-N"
"O=C2c1c(cccc1O)C(=O)c3c2cccc3O","InChI=1S/C14H8O4/c15-9-5-1-3-7-11(9)14(18)8-4-2-6-10(16)12(8)13(7)17/h1-6,15-16H","JPICKYUTICNNNJ-UHFFFAOYSA-N"
"c1ccc2c(c1)C(=O)c1c(C2=O)cc(cc1)O","InChI=1S/C14H8O3/c15-8-5-6-11-12(7-8)14(17)10-4-2-1-3-9(10)13(11)16/h1-7,15H","GCDBEYOJCZLKMC-UHFFFAOYSA-N"
"c1ccc2c(c1)C(=O)c1c(C2=O)c(ccc1)O","InChI=1S/C14H8O3/c15-11-7-3-6-10-12(11)14(17)9-5-2-1-4-8(9)13(10)16/h1-7,15H","BTLXPCBPYBNQNR-UHFFFAOYSA-N"
"c1cc2ccc3c(cc(c4c3c2c(c1)cc4)N)N","InChI=1S/C16H12N2/c17-13-8-14(18)12-7-5-10-3-1-2-9-4-6-11(13)16(12)15(9)10/h1-8H,17-18H2","WOFKFNZIJZWWPZ-UHFFFAOYSA-N"
"c4cc2ccc1ccc(N)c3c1c2c(cc3)c4N","InChI=1S/C16H12N2/c17-13-7-3-9-1-2-10-4-8-14(18)12-6-5-11(13)15(9)16(10)12/h1-8H,17-18H2","BLYOXQBERINFDU-UHFFFAOYSA-N"
"c3c(Nc1ccccc1)cc2ccccc2c3","InChI=1S/C16H13N/c1-2-8-15(9-3-1)17-16-11-10-13-6-4-5-7-14(13)12-16/h1-12,17H","KEQFTVQCIQJIQW-UHFFFAOYSA-N"
"CCNc1nc(nc(n1)Cl)NC(C)C","InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)","MXWJVTOOROXGIU-UHFFFAOYSA-N"
"c1ccc2c(c1)C=Cc1ccccc1N2C(=O)N","InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)","FFGPTBGBLSHEPO-UHFFFAOYSA-N"
"Cc1c(c(ccc1)C)N(Cn1cccn1)C(=O)CCl","InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3","STEPQTYSZVCJPV-UHFFFAOYSA-N"
"O=C(N(c1ccccc1)C)N(c2ccccc2)C","InChI=1S/C15H16N2O/c1-16(13-9-5-3-6-10-13)15(18)17(2)14-11-7-4-8-12-14/h3-12H,1-2H3","ADCBKYIHQQCFHE-UHFFFAOYSA-N"
"[O-][N+](=O)c4ccc2ccc1cccc3c1c2c4cc3","InChI=1S/C16H9NO2/c18-17(19)14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9H","ALRLPDGCPYIVHP-UHFFFAOYSA-N"
"[O-][N+](=O)c4ccc2ccc1ccc([N+]([O-])=O)c3c1c2c4cc3","InChI=1S/C16H8N2O4/c19-17(20)13-7-3-9-1-2-10-4-8-14(18(21)22)12-6-5-11(13)15(9)16(10)12/h1-8H","BLYXNIHKOMELAP-UHFFFAOYSA-N"
"Cc1cc(c(cc1)O)[N+](=O)[O-]","InChI=1S/C7H7NO3/c1-5-2-3-7(9)6(4-5)8(10)11/h2-4,9H,1H3","SYDNSSSQVSOXTN-UHFFFAOYSA-N"
"c1ccc2c(c1)c(cc[n+]2[O-])[N+](=O)[O-]","InChI=1S/C9H6N2O3/c12-10-6-5-9(11(13)14)7-3-1-2-4-8(7)10/h1-6H","YHQDZJICGQWFHK-UHFFFAOYSA-N"
"c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]","InChI=1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H","WDCYWAQPCXBPJA-UHFFFAOYSA-N"
"Cc1c(cc(cc1)[N+](=O)[O-])[N+](=O)[O-]","InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)4-7(5)9(12)13/h2-4H,1H3","RMBFBMJGBANMMK-UHFFFAOYSA-N"
"O=[N+]([O-])c1cc(ccc1Cl)[N+]([O-])=O","InChI=1S/C6H3ClN2O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H","VYZAHLCBVHPDDF-UHFFFAOYSA-N"
"CC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]","InChI=1S/C7H5N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3","SPSSULHKWOKEEL-UHFFFAOYSA-N"
"C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2)Cl)Cl","InChI=1S/C12H7Cl2NO3/c13-8-1-6-12(11(14)7-8)18-10-4-2-9(3-5-10)15(16)17/h1-7H","XITQUSLLOSKDTB-UHFFFAOYSA-N"
"Oc4ccc2ccc1cccc3c1c2c4cc3","InChI=1S/C16H10O/c17-14-9-7-12-5-4-10-2-1-3-11-6-8-13(14)16(12)15(10)11/h1-9,17H","BIJNHUAPTJVVNQ-UHFFFAOYSA-N"
"Oc5ccc3ccc2c1ccccc1cc4c2c3c5cc4","InChI=1S/C20H12O/c21-18-10-7-12-5-8-16-15-4-2-1-3-13(15)11-14-6-9-17(18)19(12)20(14)16/h1-11,21H","SPUUWWRWIAEPDB-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C=CC=C2O","InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H","KJCVRFUGPWSIIH-UHFFFAOYSA-N"
"C1=CC=C2C=C(C=CC2=C1)C(=O)O","InChI=1S/C11H8O2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,12,13)","UOBYKYZJUGYBDK-UHFFFAOYSA-N"
"Clc2cc(c1ccc(N)c(Cl)c1)ccc2N","InChI=1S/C12H10Cl2N2/c13-9-5-7(1-3-11(9)15)8-2-4-12(16)10(14)6-8/h1-6H,15-16H2","HUWXDEQWWKGHRV-UHFFFAOYSA-N"
"Cn1cnc2c1c(=O)n(c(=O)n2C)C","InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3","RYYVLZVUVIJVGH-UHFFFAOYSA-N"
"c1ccc2c(c1)c(c[nH]2)C=O","InChI=1S/C9H7NO/c11-6-7-5-10-9-4-2-1-3-8(7)9/h1-6,10H","OLNJUISKUQQNIM-UHFFFAOYSA-N"
"c1ccc2c(c1)ccc(n2)O","InChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11)","LISFMEBWQUVKPJ-UHFFFAOYSA-N"
"c1ccc2c(c1)c(ccn2)O","InChI=1S/C9H7NO/c11-9-5-6-10-8-4-2-1-3-7(8)9/h1-6H,(H,10,11)","PMZDQRJGMBOQBF-UHFFFAOYSA-N"
"c1[nH]c2c(=O)[nH]c(nc2n1)N","InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)","UYTPUPDQBNUYGX-UHFFFAOYSA-N"
"c1ccc2c(c1)nc3cc(c(cc3n2)N)N","InChI=1S/C12H10N4/c13-7-5-11-12(6-8(7)14)16-10-4-2-1-3-9(10)15-11/h1-6H,13-14H2","VZPGINJWPPHRLS-UHFFFAOYSA-N"
"c1cc2c(cc1N)nc3cc(ccc3n2)N","InChI=1S/C12H10N4/c13-7-1-3-9-11(5-7)16-12-6-8(14)2-4-10(12)15-9/h1-6H,13-14H2","CCBDBWAKDHGKNI-UHFFFAOYSA-N"
"C[N+](C)(C)[C@@H](Cc1c[nH]c(n1)S)C(=O)[O-]","InChI=1S/C9H15N3O2S/c1-12(2,3)7(8(13)14)4-6-5-10-9(15)11-6/h5,7H,4H2,1-3H3,(H2-,10,11,13,14,15)/t7-/m0/s1","SSISHJJTAXXQAX-ZETCQYMHSA-N"
"CC(C)NCC(COc1cccc2c1cccc2)O","InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3","AQHHHDLHHXJYJD-UHFFFAOYSA-N"
"COc1cc2c(cc1OC)nc(nc2N)N3CCNCC3","InChI=1S/C14H19N5O2/c1-20-11-7-9-10(8-12(11)21-2)17-14(18-13(9)15)19-5-3-16-4-6-19/h7-8,16H,3-6H2,1-2H3,(H2,15,17,18)","APKHJGDGWQDBGM-UHFFFAOYSA-N"
"CCN(CC)c1ccc2c(cc(=O)oc2c1)C","InChI=1S/C14H17NO2/c1-4-15(5-2)11-6-7-12-10(3)8-14(16)17-13(12)9-11/h6-9H,4-5H2,1-3H3","AFYCEAFSNDLKSX-UHFFFAOYSA-N"
"CCNc1ccc2c(cc(=O)oc2c1)C","InChI=1S/C12H13NO2/c1-3-13-9-4-5-10-8(2)6-12(14)15-11(10)7-9/h4-7,13H,3H2,1-2H3","OTNIKUTWXUODJZ-UHFFFAOYSA-N"
"Cc1cc(=O)oc2c1ccc(c2)N","InChI=1S/C10H9NO2/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5H,11H2,1H3","GLNDAGDHSLMOKX-UHFFFAOYSA-N"
"CN(C)c1ccncc1","InChI=1S/C7H10N2/c1-9(2)7-3-5-8-6-4-7/h3-6H,1-2H3","VHYFNPMBLIVWCW-UHFFFAOYSA-N"
"c1cc2cc(ccc2nc1)O","InChI=1S/C9H7NO/c11-8-3-4-9-7(6-8)2-1-5-10-9/h1-6,11H","OVYWMEWYEJLIER-UHFFFAOYSA-N"
"c1ccc2c(c1)ccnc2O","InChI=1S/C9H7NO/c11-9-8-4-2-1-3-7(8)5-6-10-9/h1-6H,(H,10,11)","VDBNYAPERZTOOF-UHFFFAOYSA-N"
"c1ccc2c(c1)c3cnccc3[nH]2","InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-7,13H","RDMFHRSPDKWERA-UHFFFAOYSA-N"
"Cc1ccccc1N","InChI=1S/C7H9N/c1-6-4-2-3-5-7(6)8/h2-5H,8H2,1H3","RNVCVTLRINQCPJ-UHFFFAOYSA-N"
"CC(=CCNc1c2c(nc[nH]2)ncn1)C","InChI=1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h3,5-6H,4H2,1-2H3,(H2,11,12,13,14,15)","HYVABZIGRDEKCD-UHFFFAOYSA-N"
"c1ccc2c(c1)c3ccncc3[nH]2","InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-7,13H","AIFRHYZBTHREPW-UHFFFAOYSA-N"
"c1ccc2c(c1)c3cccnc3[nH]2","InChI=1S/C11H8N2/c1-2-6-10-8(4-1)9-5-3-7-12-11(9)13-10/h1-7H,(H,12,13)","BPMFPOGUJAAYHL-UHFFFAOYSA-N"
"c1ccc(cc1)c2ccncc2","InChI=1S/C11H9N/c1-2-4-10(5-3-1)11-6-8-12-9-7-11/h1-9H","JVZRCNQLWOELDU-UHFFFAOYSA-N"
"c1ccc(cc1)c2ccccn2","InChI=1S/C11H9N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-9H","VQGHOUODWALEFC-UHFFFAOYSA-N"
"CCOc1nc2cccc(c2n1Cc3ccc(cc3)c4ccccc4c5[nH]nnn5)C(=O)O","InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)","HTQMVQVXFRQIKW-UHFFFAOYSA-N"
"Cc1c(c(=O)n(n1C)c2ccccc2)N","InChI=1S/C11H13N3O/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,12H2,1-2H3","RLFWWDJHLFCNIJ-UHFFFAOYSA-N"
"Cc1nc(c(nn1)c2ccccc2)O","InChI=1S/C10H9N3O/c1-7-11-10(14)9(13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,12,14)","OUSYWCQYMPDAEO-UHFFFAOYSA-N"
"Cc1nnc(c(=O)n1N)c2ccccc2","InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3","VHCNQEUWZYOAEV-UHFFFAOYSA-N"
"c1cc(c(c(c1)Cl)Cl)c2c(nc(nn2)N)N","InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)","PYZRQGJRPPTADH-UHFFFAOYSA-N"
"CO\N=C(\C(=O)OC)C1=CC=CC=C1CO\N=C(/C)C1=CC(=CC=C1)C(F)(F)F","InChI=1S/C20H19F3N2O4/c1-13(14-8-6-9-16(11-14)20(21,22)23)24-29-12-15-7-4-5-10-17(15)18(25-28-3)19(26)27-2/h4-11H,12H2,1-3H3/b24-13+,25-18+","ONCZDRURRATYFI-TVJDWZFNSA-N"
"CC(CN1CC(C)OC(C)C1)CC1=CC=C(C=C1)C(C)(C)C","InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3","RYAUSSKQMZRMAI-UHFFFAOYSA-N"
"CCCC1COC(CN2C=NC=N2)(O1)C1=CC=C(Cl)C=C1Cl","InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3","STJLVHWMYQXCPB-UHFFFAOYSA-N"
"CCOP(=O)(OCC)OC(=CCl)C1=CC=C(Cl)C=C1Cl","InChI=1S/C12H14Cl3O4P/c1-3-17-20(16,18-4-2)19-12(8-13)10-6-5-9(14)7-11(10)15/h5-8H,3-4H2,1-2H3","FSAVDKDHPDSCTO-UHFFFAOYSA-N"
"CN(C)C(=O)OC1=NC(=NC(C)=C1C)N(C)C","InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3","YFGYUFNIOHWBOB-UHFFFAOYSA-N"
"CCNC1=NC(NC(C)C)=NC(SC)=N1","InChI=1S/C9H17N5S/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)","RQVYBGPQFYCBGX-UHFFFAOYSA-N"
"CCC(CC)NC1=C(C=C(C)C(C)=C1[N+]([O-])=O)[N+]([O-])=O","InChI=1S/C13H19N3O4/c1-5-10(6-2)14-12-11(15(17)18)7-8(3)9(4)13(12)16(19)20/h7,10,14H,5-6H2,1-4H3","CHIFOSRWCNZCFN-UHFFFAOYSA-N"
"OCC(NC(=O)C(Cl)Cl)C(O)C1=CC=C(C=C1)N(=O)=O","InChI=1S/C11H12Cl2N2O5/c12-10(13)11(18)14-8(5-16)9(17)6-1-3-7(4-2-6)15(19)20/h1-4,8-10,16-17H,5H2,(H,14,18)","WIIZWVCIJKGZOK-UHFFFAOYSA-N"
"CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(C)(O)CC(C)C(=O)C(C)C(O)C1(C)O","InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3","ULGZDMOVFRHVEP-UHFFFAOYSA-N"
"CC(C)NCC(O)COC1=CC=C(CC(N)=O)C=C1","InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)","METKIMKYRPQLGS-UHFFFAOYSA-N"
"CN1C2=CC=C(Cl)C=C2C(=NCC1=O)C1=CC=CC=C1","InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3","AAOVKJBEBIDNHE-UHFFFAOYSA-N"
"CCC1OC(=O)C(C)C(OC2CC(C)(OC)C(O)C(C)O2)C(C)C(OC2OC(C)CC(C2O)N(C)C)C(C)(CC(C)C(=O)C(C)C(O)C1(C)O)OC","InChI=1S/C38H69NO13/c1-15-26-38(10,45)31(42)21(4)28(40)19(2)17-37(9,47-14)33(52-35-29(41)25(39(11)12)16-20(3)48-35)22(5)30(23(6)34(44)50-26)51-27-18-36(8,46-13)32(43)24(7)49-27/h19-27,29-33,35,41-43,45H,15-18H2,1-14H3","AGOYDEPGAOXOCK-UHFFFAOYSA-N"
"OC(=O)CC1=CC=CC=C1NC1=C(Cl)C=CC=C1Cl","InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)","DCOPUUMXTXDBNB-UHFFFAOYSA-N"
"COC1=CC(CC2=CN=C(N)N=C2N)=CC(OC)=C1OC","InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)","IEDVJHCEMCRBQM-UHFFFAOYSA-N"
"OC1C(O)C2=CC=CC=C2N(C(O)=N)C2=CC=CC=C12","InChI=1S/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)","PRGQOPPDPVELEG-UHFFFAOYSA-N"
"[H]C(=O)NC1=C(C)N(C)N(C1=O)C1=CC=CC=C1","InChI=1S/C12H13N3O2/c1-9-11(13-8-16)12(17)15(14(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)","WSJBSKRPKADYRQ-UHFFFAOYSA-N"
"CN\C(NCCSCC1=CC=C(CN(C)C)O1)=C/N(=O)=O","InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+","VMXUWOKSQNHOCA-UKTHLTGXSA-N"
"CN1[C@@H](CCC1=O)C1=CC=CN=C1","InChI=1S/C10H12N2O/c1-12-9(4-5-10(12)13)8-3-2-6-11-7-8/h2-3,6-7,9H,4-5H2,1H3/t9-/m0/s1","UIKROCXWUNQSPJ-VIFPVBQESA-N"
"C[N+](C)(C)CCCl","InChI=1S/C5H13ClN/c1-7(2,3)5-4-6/h4-5H2,1-3H3/q+1","JUZXDNPBRPUIOR-UHFFFAOYSA-N"
"CC(C)Nc1ccc(Nc2ccccc2)cc1","InChI=1S/C15H18N2/c1-12(2)16-14-8-10-15(11-9-14)17-13-6-4-3-5-7-13/h3-12,16-17H,1-2H3","OUBMGJOQLXMSNT-UHFFFAOYSA-N"
"N(C1=CC=CC=C1)C1=CC=CC2=CC=CC=C12","InChI=1S/C16H13N/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12,17H","XQVWYOYUZDUNRW-UHFFFAOYSA-N"
"COc1cc(ccc1N)-c1ccc(N)c(OC)c1","InChI=1S/C14H16N2O2/c1-17-13-7-9(3-5-11(13)15)10-4-6-12(16)14(8-10)18-2/h3-8H,15-16H2,1-2H3","JRBJSXQPQWSCCF-UHFFFAOYSA-N"
"Cc1cc(Cc2ccc(N)c(C)c2)ccc1N","InChI=1S/C15H18N2/c1-10-7-12(3-5-14(10)16)9-13-4-6-15(17)11(2)8-13/h3-8H,9,16-17H2,1-2H3","WECDUOXQLAIPQW-UHFFFAOYSA-N"
"C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@@H]4C[C@H](O)CC[C@]4(C)[C@H]3C[C@H](O)[C@]12C","InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1","BHQCQFFYRZLCQQ-OELDTZBJSA-N"
"CC\C(=C(\CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1","InChI=1S/C18H20O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,19-20H,3-4H2,1-2H3/b18-17+","RGLYKWWBQGJZGM-ISLYRVAYSA-N"
"C[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@@]21CCC(=O)O1","InChI=1S/C22H28O3/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21)12-8-19(24)25-22/h3-4,13,16-18H,5-12H2,1-2H3/t16-,17+,18+,20+,21+,22-/m1/s1","UJVLDDZCTMKXJK-WNHSNXHDSA-N"
"O=C2[C@]1(CC[C@H]3[C@H]([C@@H]1CC2)CC[C@H]4C[C@@H](O)CC[C@]34C)C","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3/t12-,13-,14-,15-,16-,18-,19-/m0/s1","QGXBDMJGAMFCBF-LUJOEAJASA-N"
"C1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)O","InChI=1S/C13H10N2O3S/c16-19(17,18)10-6-7-11-12(8-10)15-13(14-11)9-4-2-1-3-5-9/h1-8H,(H,14,15)(H,16,17,18)","UVCJGUGAGLDPAA-UHFFFAOYSA-N"
"CC(C)C1=C2C(SC3=C(C=CC=C3)C2=O)=CC=C1","InChI=1S/C16H14OS/c1-10(2)11-7-5-9-14-15(11)16(17)12-6-3-4-8-13(12)18-14/h3-10H,1-2H3","YIKSHDNOAYSSPX-UHFFFAOYSA-N"
"CCCCOC(C)OP(=O)(OC(C)OCCCC)OC(C)OCCCC","InChI=1S/C18H39O7P/c1-7-10-13-20-16(4)23-26(19,24-17(5)21-14-11-8-2)25-18(6)22-15-12-9-3/h16-18H,7-15H2,1-6H3","BGNTUSKZDOUZCZ-UHFFFAOYSA-N"
"O=P(OCC(C)C)(OCC(C)C)OCC(C)C","InChI=1S/C12H27O4P/c1-10(2)7-14-17(13,15-8-11(3)4)16-9-12(5)6/h10-12H,7-9H2,1-6H3","HRKAMJBPFPHCSD-UHFFFAOYSA-N"
"CC1=CC(=O)OC2=CC(O)=CC=C12","InChI=1S/C10H8O3/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5,11H,1H3","HSHNITRMYYLLCV-UHFFFAOYSA-N"
"O=S(=O)(c1ccc(cc1)C)NCC","InChI=1S/C9H13NO2S/c1-3-10-13(11,12)9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3","OHPZPBNDOVQJMH-UHFFFAOYSA-N"
"CC(C)CC1=CC=CC(C(O)=O)=C1C(O)=O","InChI=1S/C12H14O4/c1-7(2)6-8-4-3-5-9(11(13)14)10(8)12(15)16/h3-5,7H,6H2,1-2H3,(H,13,14)(H,15,16)","WXVFMRKUWGIPRB-UHFFFAOYSA-N"
"O=C(OC(C)CC)N1C(CCO)CCCC1","InChI=1S/C12H23NO3/c1-3-10(2)16-12(15)13-8-5-4-6-11(13)7-9-14/h10-11,14H,3-9H2,1-2H3","QLHULAHOXSSASE-UHFFFAOYSA-N"
"O=S(=O)(O)c1nc2ccccc2s1","InChI=1S/C7H5NO3S2/c9-13(10,11)7-8-5-3-1-2-4-6(5)12-7/h1-4H,(H,9,10,11)","ZCXGMSGCBDSEOY-UHFFFAOYSA-N"
"CCCCCCCCCCCC(=O)NCCO","InChI=1S/C14H29NO2/c1-2-3-4-5-6-7-8-9-10-11-14(17)15-12-13-16/h16H,2-13H2,1H3,(H,15,17)","QZXSMBBFBXPQHI-UHFFFAOYSA-N"
"COC1=C(OCC(O)COC(N)=O)C=CC=C1","InChI=1S/C11H15NO5/c1-15-9-4-2-3-5-10(9)16-6-8(13)7-17-11(12)14/h2-5,8,13H,6-7H2,1H3,(H2,12,14)","GNXFOGHNGIVQEH-UHFFFAOYSA-N"
"CCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(O)=O","InChI=1S/C21H42N2O3/c1-4-5-6-7-8-9-10-11-12-13-14-16-20(24)22-17-15-18-23(2,3)19-21(25)26/h4-19H2,1-3H3,(H-,22,24,25,26)/p+1","QGCUAFIULMNFPJ-UHFFFAOYSA-O"
"OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO","InChI=1S/C20H42O11/c21-1-3-23-5-7-25-9-11-27-13-15-29-17-19-31-20-18-30-16-14-28-12-10-26-8-6-24-4-2-22/h21-22H,1-20H2","DTPCFIHYWYONMD-UHFFFAOYSA-N"
"OCCOCCOCCOCCOCCOCCOCCOCCOCCO","InChI=1S/C18H38O10/c19-1-3-21-5-7-23-9-11-25-13-15-27-17-18-28-16-14-26-12-10-24-8-6-22-4-2-20/h19-20H,1-18H2","YZUUTMGDONTGTN-UHFFFAOYSA-N"
"OCCOCCOCCOCCOCCOCCOCCOCCO","InChI=1S/C16H34O9/c17-1-3-19-5-7-21-9-11-23-13-15-25-16-14-24-12-10-22-8-6-20-4-2-18/h17-18H,1-16H2","GLZWNFNQMJAZGY-UHFFFAOYSA-N"
"C(COCCOCCOCCOCCOCCO)O","InChI=1S/C12H26O7/c13-1-3-15-5-7-17-9-11-19-12-10-18-8-6-16-4-2-14/h13-14H,1-12H2","IIRDTKBZINWQAW-UHFFFAOYSA-N"
"[H]N([H])C(C(=O)1)=C(C([H])([H])[H])N(C([H])([H])[H])N1c(c([H])2)c([H])c([H])c([H])c([H])2","InChI=1S/C11H13N3O/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,12H2,1-2H3","RLFWWDJHLFCNIJ-UHFFFAOYSA-N"
"[H]OC([H])([H])C(=O)C(O[H])(C([H])([H])4)C(C([H])([H])[H])(C([H])([H])3)C([H])(C([H])([H])4)C([H])(C([H])([H])1)C([H])(C([H])(O[H])3)C(C([H])=2)(C([H])([H])[H])C(=C([H])C(=O)C([H])2)C([H])(C([H])([H])[H])1","InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3","VHRSUDSXCMQTMA-UHFFFAOYSA-N"
"[H]C([H])([H])C(=O)c(c([H])3)c([H])c(c1c([H])3)N(C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c(c([H])2)c(c([H])c([H])c([H])2)S1","InChI=1S/C19H22N2OS/c1-14(22)15-9-10-19-17(13-15)21(12-6-11-20(2)3)16-7-4-5-8-18(16)23-19/h4-5,7-10,13H,6,11-12H2,1-3H3","NOSIYYJFMPDDSA-UHFFFAOYSA-N"
"[H]OC([H])([H])C([H])([H])N(C([H])([H])4)C([H])([H])C([H])([H])N(C([H])([H])4)C([H])([H])C([H])([H])C([H])([H])N(c32)c(c([H])1)c(Sc(c([H])c([H])c([H])c([H])3)2)c([H])c(C(=O)C([H])([H])[H])c([H])1","InChI=1S/C23H29N3O2S/c1-18(28)19-7-8-21-23(17-19)29-22-6-3-2-5-20(22)26(21)10-4-9-24-11-13-25(14-12-24)15-16-27/h2-3,5-8,17,27H,4,9-16H2,1H3","FVHDZPDLOWZOOV-UHFFFAOYSA-N"
"[H]OC([H])(C([H])(O[H])1)C([H])(OC([H])(n(c([H])3)c(n2)c(n3)c(N([H])[H])nc([H])2)1)C([H])([H])OP(=O)(O[H])OP(=O)(O[H])O[H]","InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)","XTWYTFMLZFPYCI-UHFFFAOYSA-N"
"[H]c(c([H])2)c([H])c([H])c(c([H])2)C([H])(C(=O)OC([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C20H25NO2/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5-14,19H,3-4,15-16H2,1-2H3","JGOAIQNSOGZNBX-UHFFFAOYSA-N"
"[H]OC([H])([H])c(c(O[H])1)c([H])c(c([H])c([H])1)C([H])(O[H])C([H])([H])N([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]","InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3","NDAUXUAQIAJITI-UHFFFAOYSA-N"
"[H]C([H])([H])OC([H])([H])C(N(C(=O)C([H])([H])C([H])([H])[H])c(c([H])3)c([H])c([H])c([H])c([H])3)(C([H])([H])1)C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])N(N=2)C(=O)N(N2)C([H])([H])C([H])([H])[H])C([H])([H])1","InChI=1S/C21H32N6O3/c1-4-19(28)27(18-9-7-6-8-10-18)21(17-30-3)11-13-24(14-12-21)15-16-26-20(29)25(5-2)22-23-26/h6-10H,4-5,11-17H2,1-3H3","IDBPHNDTYPBSNI-UHFFFAOYSA-N"
"[H]OC(=O)C([H])([H])c(c([H])2)c(N([H])[H])c(c([H])c([H])2)C(=O)c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C15H13NO3/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10/h1-8H,9,16H2,(H,17,18)","SOYCMDCMZDHQFP-UHFFFAOYSA-N"
"[H]C([H])([H])N(C(=O)1)C(=O)c(n([H])2)c(nc([H])2)N(C([H])([H])[H])1","InChI=1S/C7H8N4O2/c1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h3H,1-2H3,(H,8,9)","ZFXYFBGIUFBOJW-UHFFFAOYSA-N"
"[H]OC(=O)C([H])(N21)C(C([H])([H])[H])(C([H])([H])[H])SC([H])(C([H])(N([H])C(=O)C([H])(N([H])[H])c(c([H])3)c([H])c([H])c([H])c([H])3)C(=O)2)1","InChI=1S/C16H19N3O4S/c1-16(2)11(15(22)23)19-13(21)10(14(19)24-16)18-12(20)9(17)8-6-4-3-5-7-8/h3-7,9-11,14H,17H2,1-2H3,(H,18,20)(H,22,23)","AVKUERGKIZMTKX-UHFFFAOYSA-N"
"[H]N([H])c(c([H])3)c([H])c([H])c(c([H])3)C([H])([H])C([H])([H])N(C([H])([H])1)C([H])([H])C([H])([H])C(C(=O)OC([H])([H])C([H])([H])[H])(c(c([H])2)c([H])c([H])c([H])c([H])2)C([H])([H])1","InChI=1S/C22H28N2O2/c1-2-26-21(25)22(19-6-4-3-5-7-19)13-16-24(17-14-22)15-12-18-8-10-20(23)11-9-18/h3-11H,2,12-17,23H2,1H3","LKYQLAWMNBFNJT-UHFFFAOYSA-N"
"[H]C([H])([H])C(=C([H])2)N(C([H])([H])[H])N(C(=O)2)c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3","VEQOALNAAJBPNY-UHFFFAOYSA-N"
"[H]Oc(c([H])4)c(O[H])c(c(c([H])4)1)c(c([H])3)c(c(c([H])c([H])3)2)C([H])(N(C([H])([H])[H])C([H])([H])C([H])([H])2)C([H])([H])1","InChI=1S/C17H17NO2/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12/h2-6,13,19-20H,7-9H2,1H3","VMWNQDUVQKEIOC-UHFFFAOYSA-N"
"[H]OC([H])([H])C([H])(O1)C([H])(N([H])[H])C([H])(O[H])C([H])(O[H])C([H])1OC([H])(O2)C([H])(N([H])C([H])([H])[H])C([H])(O[H])C([H])(O3)C([H])2C([H])([H])C([H])(N([H])[H])C([H])(OC([H])(C([H])(O[H])4)C([H])(N([H])[H])C([H])([H])C([H])(N([H])[H])C([H])(O[H])4)3","InChI=1S/C21H41N5O11/c1-26-11-14(30)18-8(33-20(11)37-21-16(32)13(29)10(25)9(4-27)34-21)3-7(24)19(36-18)35-17-6(23)2-5(22)12(28)15(17)31/h5-21,26-32H,2-4,22-25H2,1H3/t5-,6+,7-,8+,9-,10-,11+,12+,13+,14-,15-,16-,17-,18+,19?,20-,21-/m1/s1","XZNUGFQTQHRASN-XZEBHBPDSA-N"
"[H]OC([H])(C([H])([H])Oc(c([H])2)c([H])c([H])c(c([H])2)C([H])([H])C([H])([H])OC([H])([H])C([H])(C([H])([H])1)C([H])([H])1)C([H])([H])N([H])C([H])(C([H])([H])[H])C([H])([H])[H]","InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3","NWIUTZDMDHAVTP-UHFFFAOYSA-N"
"[H]C(C(C([H])([H])[H])14)(C(C([H])(C([H])([H])C4([H])[H])2)([H])C(C([H])([H])C(=C([H])3)C2(C([H])([H])[H])C(=C(C(=O)3)[H])[H])([H])[H])C(C(C1(OC(C(C(C([H])([H])C([H])([H])C([H])([H])C(C(C(C([H])=C([H])[H])([H])[H])([H])[H])([H])[H])([H])[H])([H])[H])=O)[H])([H])[H])([H])[H]","InChI=1S/C30H44O3/c1-4-5-6-7-8-9-10-11-12-28(32)33-27-16-15-25-24-14-13-22-21-23(31)17-19-29(22,2)26(24)18-20-30(25,27)3/h4,17,19,21,24-27H,1,5-16,18,20H2,2-3H3/t24?,25-,26-,27-,29?,30?/m0/s1","AHMMSNQYOPMLSX-KEZAGTACSA-N"
"[H]OC(=O)c(c([H])1)c([H])c(S(=O)(=O)N([H])[H])c(Oc(c([H])2)c([H])c([H])c([H])c([H])2)c(N([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])1","InChI=1S/C17H20N2O5S/c1-2-3-9-19-14-10-12(17(20)21)11-15(25(18,22)23)16(14)24-13-7-5-4-6-8-13/h4-8,10-11,19H,2-3,9H2,1H3,(H,20,21)(H2,18,22,23)","MAEIEVLCKWDQJH-UHFFFAOYSA-N"
"C(O[H])(C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])(C(C([H])([H])6)([H])C(C([H])([H])7)(C(C514)(Oc(c(O[H])2)c1c(C(C(C56C7([H])[H])([H])N(C([H])([H])C4([H])[H])C([H])([H])C(C3([H])[H])(C3([H])[H])[H])([H])[H])c([H])c([H])2)[H])OC([H])([H])[H])C([H])([H])[H]","InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3","RMRJXGBAOAMLHD-UHFFFAOYSA-N"
"[H]c(c([H])4)c([H])nc(n4)N(C([H])([H])1)C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])C([H])([H])C([H])([H])N(C(=O)3)C(=O)C([H])([H])C(C([H])([H])3)(C([H])([H])2)C([H])([H])C([H])([H])C([H])([H])2)C([H])([H])1","InChI=1S/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2","QWCRAEMEVRGPNT-UHFFFAOYSA-N"
"[H]C(C([H])([H])C([H])([H])C([H])([H])C(C(C4([H])[H])([H])C(C([H])([H])[H])(C3([H])[H])C(C4([H])[H])([H])C([H])(C([H])(C3([H])[H])1)C([H])([H])C([H])=C(C([H])([H])2)C1(C([H])([H])C([H])([H])C([H])(O[H])2)C([H])([H])[H])(C([H])([H])[H])[H])(C([H])([H])[H])C([H])([H])[H]","InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3","HVYWMOMLDIMFJA-UHFFFAOYSA-N"
"[H]OC(=O)C(O4)=C([H])C(=O)c(c41)c(OC([H])([H])C([H])(O[H])C([H])([H])Oc(c([H])2)c(C(=O)3)c(OC(C(=O)O[H])=C([H])3)c([H])c([H])2)c([H])c([H])c([H])1","InChI=1S/C23H16O11/c24-11(9-31-14-3-1-5-16-20(14)12(25)7-18(33-16)22(27)28)10-32-15-4-2-6-17-21(15)13(26)8-19(34-17)23(29)30/h1-8,11,24H,9-10H2,(H,27,28)(H,29,30)","IMZMKUWMOSJXDT-UHFFFAOYSA-N"
"","InChI=1S/C30H44O9/c1-17-26(33)23(36-3)13-25(38-17)39-19-4-9-28(16-31)21-5-8-27(2)20(18-12-24(32)37-15-18)7-11-30(27,35)22(21)6-10-29(28,34)14-19/h12,16-17,19-23,25-26,33-35H,4-11,13-15H2,1-3H3","XQCGNURMLWFQJR-UHFFFAOYSA-N"
"c(=O)(c12)c(c5O[H])c(c(O[H])c(c35)C(C(C(C3(OC([H])(C([H])([H])4)OC([H])(C([H])(O[H])C([H])(N([H])[H])4)C([H])([H])[H])[H])([H])[H])(O[H])C(=O)C([H])([H])[H])([H])[H])c(c1c(c(c(c2OC([H])([H])[H])[H])[H])[H])=O","InChI=1S/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3","STQGQHZAVUOBTE-UHFFFAOYSA-N"
"[H]C([H])([H])Oc(c([H])4)c([H])c(c(c([H])4)1)C(C([H])([H])3)(C([H])([H])2)C([H])(C([H])([H])C([H])([H])C([H])([H])3)C([H])(N(C([H])([H])[H])C([H])([H])2)C([H])([H])1","InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3","MKXZASYAUGDDCJ-UHFFFAOYSA-N"
"[H]C(N13)(C(O4)(N(C(C(N([H])C(=O)C([H])(C([H])([H])5)C(N(C([H])(C8([H])[H])C5([H])c(c([H])7)c(c86)c(c([H])c7[H])n([H])c([H])6)C([H])([H])[H])([H])[H])4C([H])([H])[H])=O)C(C3=O)([H])C([H])([H])c(c2[H])c(c(c(c([H])2)[H])[H])[H])O[H])C([H])([H])C([H])([H])C1([H])[H]","InChI=1S/C33H37N5O5/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39)","LUZRJRNZXALNLM-UHFFFAOYSA-N"
"[H]C([H])([H])Oc(c([H])3)c(C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c(O1)c(c([H])3)C(=O)C(C([H])([H])[H])=C1c(c([H])2)c([H])c([H])c([H])c([H])2","InChI=1S/C20H21NO3/c1-13-18(22)15-10-11-17(23-4)16(12-21(2)3)20(15)24-19(13)14-8-6-5-7-9-14/h5-11H,12H2,1-4H3","ZXFQRFXLFWWKLX-UHFFFAOYSA-N"
"[H]C([H])([H])C([H])([H])OC(C(c(c4[H])c(c([H])c(c4[H])[H])[H])(C([H])([H])1)C([H])([H])C([H])([H])N(C(C(C(C#N)(c(c3[H])c(c([H])c(c([H])3)[H])[H])c(c2[H])c(c([H])c(c([H])2)[H])[H])([H])[H])([H])[H])C([H])([H])1)=O","InChI=1S/C30H32N2O2/c1-2-34-28(33)29(25-12-6-3-7-13-25)18-21-32(22-19-29)23-20-30(24-31,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-17H,2,18-23H2,1H3","HYPPXZBJBPSRLK-UHFFFAOYSA-N"
"[H]Oc(c([H])2)c([H])c([H])c(c([H])2)C([H])([H])C([H])([H])C([H])(C([H])([H])[H])N([H])C([H])([H])C([H])([H])c(c([H])1)c([H])c(O[H])c(O[H])c([H])1","InChI=1S/C18H23NO3/c1-13(2-3-14-4-7-16(20)8-5-14)19-11-10-15-6-9-17(21)18(22)12-15/h4-9,12-13,19-22H,2-3,10-11H2,1H3","JRWZLRBJNMZMFE-UHFFFAOYSA-N"
"c(=O)(c12)c(c5O[H])c(c(O[H])c(c35)C(C(C(=O)C([H])([H])O[H])(C(C3(OC([H])(C([H])([H])4)OC([H])(C([H])(O[H])C([H])(N([H])[H])4)C([H])([H])[H])[H])([H])[H])O[H])([H])[H])c(c1c(c(c(c2OC([H])([H])[H])[H])[H])[H])=O","InChI=1S/C27H29NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3","AOJJSUZBOXZQNB-UHFFFAOYSA-N"
"[H]c(c([H])2)c([H])c([H])c(c([H])2)C([H])(C(=O)OC([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])C([H])(C([H])([H])1)C([H])([H])C([H])([H])C([H])([H])C([H])([H])1","InChI=1S/C20H31NO2/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18/h5,7-8,11-12,18-19H,3-4,6,9-10,13-16H2,1-2H3","AGJBLWCLQCKRJP-UHFFFAOYSA-N"
"[H]OC(=O)C([H])(C([H])([H])1)N(C(=O)C([H])(C([H])([H])[H])N([H])C([H])(C(=O)OC([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])c(c([H])2)c([H])c([H])c([H])c([H])2)C([H])([H])C([H])([H])1","InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)","GBXSMTUPTTWBMN-UHFFFAOYSA-N"
"[H]OC(=O)C([H])(N([H])C([H])(C([H])([H])[H])C(=O)N(C([H])([H])2)C([H])(C(=O)O[H])C([H])([H])C([H])([H])2)C([H])([H])C([H])([H])c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C18H24N2O5/c1-12(16(21)20-11-5-8-15(20)18(24)25)19-14(17(22)23)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15,19H,5,8-11H2,1H3,(H,22,23)(H,24,25)/t12-,14+,15+/m0/s1","LZFZMUMEGBBDTC-NWANDNLSSA-N"
"[H]OC([H])(c(c([H])1)c([H])c([H])c([H])c([H])1)C([H])(C([H])([H])[H])N([H])C([H])([H])[H]","InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3","KWGRBVOPPLSCSI-UHFFFAOYSA-N"
"C(C8=O)([H])(N(C2=O)C(C(N87)(C([H])([H])C([H])([H])C7([H])[H])[H])(OC2(N([H])C(C([H])(C([H])=3)C(N(C(C([H])([H])6)([H])C(c(c5[H])c(c64)c(c(c5[H])[H])n(c4[H])[H])3)C([H])([H])[H])([H])[H])=O)C(C([H])([H])[H])(C([H])([H])[H])[H])O[H])C(c(c([H])1)c([H])c([H])c([H])c([H])1)([H])[H]","InChI=1S/C35H39N5O5/c1-20(2)34(37-31(41)23-16-25-24-11-7-12-26-30(24)22(18-36-26)17-27(25)38(3)19-23)33(43)40-28(15-21-9-5-4-6-10-21)32(42)39-14-8-13-29(39)35(40,44)45-34/h4-7,9-12,16,18,20,23,27-29,36,44H,8,13-15,17,19H2,1-3H3,(H,37,41)","HEFIYUQVAZFDEE-UHFFFAOYSA-N"
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"[H]C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])n(c([H])2)c(C(=O)1)c(n2)N(C([H])([H])[H])C(=O)N(C([H])([H])[H])1","InChI=1S/C13H21N5O2/c1-5-17(6-2)7-8-18-9-14-11-10(18)12(19)16(4)13(20)15(11)3/h9H,5-8H2,1-4H3","AWKLBIOQCIORSB-UHFFFAOYSA-N"
"[H]OC(=O)C([H])([H])C(O3)(C([H])([H])C([H])([H])[H])c(n([H])1)c(C([H])([H])C([H])([H])3)c(c([H])2)c(c(c([H])c([H])2)C([H])([H])C([H])([H])[H])1","InChI=1S/C17H21NO3/c1-3-11-6-5-7-12-13-8-9-21-17(4-2,10-14(19)20)16(13)18-15(11)12/h5-7,18H,3-4,8-10H2,1-2H3,(H,19,20)","NNYBQONXHNTVIJ-UHFFFAOYSA-N"
"[H]C([H])([H])OC(=O)N([H])c(n1)n([H])c(c([H])2)c1c([H])c([H])c(Sc(c([H])3)c([H])c([H])c([H])c([H])3)2","InChI=1S/C15H13N3O2S/c1-20-15(19)18-14-16-12-8-7-11(9-13(12)17-14)21-10-5-3-2-4-6-10/h2-9H,1H3,(H2,16,17,18,19)","HDDSHPAODJUKPD-UHFFFAOYSA-N"
"[H]Oc(c([H])2)c([H])c([H])c(c([H])2)C([H])([H])C([H])(C([H])([H])[H])N([H])C([H])([H])C([H])(O[H])c(c([H])1)c([H])c(O[H])c([H])c(O[H])1","InChI=1S/C17H21NO4/c1-11(6-12-2-4-14(19)5-3-12)18-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17-22H,6,10H2,1H3","LSLYOANBFKQKPT-UHFFFAOYSA-N"
"CC[N+](CC)(CC)CCOC1=C(C(=CC=C1)OCC[N+](CC)(CC)CC)OCC[N+](CC)(CC)CC","InChI=1S/C30H60N3O3/c1-10-31(11-2,12-3)22-25-34-28-20-19-21-29(35-26-23-32(13-4,14-5)15-6)30(28)36-27-24-33(16-7,17-8)18-9/h19-21H,10-18,22-27H2,1-9H3/q+3","OZLPUNFFCJDMJD-UHFFFAOYSA-N"
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"[H]Oc(c([H])5)c([H])c(c(c([H])5)3)C(C([H])([H])4)(C([H])([H])1)C(O[H])(C([H])([H])C([H])([H])C([H])([H])4)C([H])(C([H])([H])3)N(C([H])([H])C([H])(C([H])([H])2)C([H])([H])C([H])(O[H])2)C([H])([H])1","InChI=1S/C21H29NO3/c23-16-4-3-15-11-19-21(25)6-2-1-5-20(21,18(15)12-16)7-8-22(19)13-14-9-17(24)10-14/h3-4,12,14,17,19,23-25H,1-2,5-11,13H2","NCMXKIHJYUFTRL-UHFFFAOYSA-N"
"[H]Oc(c([H])1)c([H])c([H])c(c([H])1)C([H])([H])C([H])([H])N([H])[H]","InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2","DZGWFCGJZKJUFP-UHFFFAOYSA-N"
"[H]Oc(c([H])2)c([H])c([H])c(c([H])2)C([H])(O[H])C([H])(C([H])([H])[H])N([H])C([H])(C([H])([H])[H])C([H])([H])Oc(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C18H23NO3/c1-13(12-22-17-6-4-3-5-7-17)19-14(2)18(21)15-8-10-16(20)11-9-15/h3-11,13-14,18-21H,12H2,1-2H3","BMUKKTUHUDJSNZ-UHFFFAOYSA-N"
"[H]OC(=O)C([H])(C([H])([H])1)c(c([H])3)n(c(c([H])3)C(=O)c(c([H])2)c([H])c([H])c([H])c([H])2)C([H])([H])1","InChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)","OZWKMVRBQXNZKK-UHFFFAOYSA-N"
"[H]OC(C(N([H])C(=O)C(C([H])([H])c(c([H])2)c([H])c([H])c([H])c([H])2)(N([H])C(=O)C(N(C(=O)C(N(C(C(N([H])[H])(C([H])([H])c(c([H])1)c([H])c([H])c(O[H])c([H])1)[H])=O)[H])([H])[H])[H])([H])[H])[H])(C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])[H])=O","InChI=1S/C28H37N5O7/c1-17(2)12-23(28(39)40)33-27(38)22(14-18-6-4-3-5-7-18)32-25(36)16-30-24(35)15-31-26(37)21(29)13-19-8-10-20(34)11-9-19/h3-11,17,21-23,34H,12-16,29H2,1-2H3,(H,30,35)(H,31,37)(H,32,36)(H,33,38)(H,39,40)","URLZCHNOLZSCCA-UHFFFAOYSA-N"
"C([H])(C([H])([H])[H])(C([H])([H])c(c([H])2)c([H])c([H])c(OC([H])([H])[H])c([H])2)N(C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])OC(=O)c(c([H])1)c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])c([H])1","InChI=1S/C25H35NO5/c1-6-26(19(2)17-20-9-12-22(28-3)13-10-20)15-7-8-16-31-25(27)21-11-14-23(29-4)24(18-21)30-5/h9-14,18-19H,6-8,15-17H2,1-5H3","VYVKHNNGDFVQGA-UHFFFAOYSA-N"
"[H]OC(=O)c(c([H])2)c(c([H])c([H])c([H])2)N([H])c(c([H])1)c(C([H])([H])[H])c(C([H])([H])[H])c([H])c([H])1","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","HYYBABOKPJLUIN-UHFFFAOYSA-N"
"[H]N([H])C(=O)OC([H])([H])C(C([H])([H])[H])(C([H])([H])OC(=O)N([H])[H])C([H])([H])C([H])([H])C([H])([H])[H]","InChI=1S/C9H18N2O4/c1-3-4-9(2,5-14-7(10)12)6-15-8(11)13/h3-6H2,1-2H3,(H2,10,12)(H2,11,13)","NPPQSCRMBWNHMW-UHFFFAOYSA-N"
"[H]C([H])(c(c2[H])c(c(c(c2[H])O[H])[H])[H])C([H])(N([H])[H])C(N(C(C(N(C(C(N(C(C([H])([H])c(c1[H])c(c(c(c1[H])[H])[H])[H])([H])C(N(C([H])(C(=O)O[H])C([H])([H])C(SC([H])([H])[H])([H])[H])[H])=O)[H])=O)([H])[H])[H])=O)([H])[H])[H])=O","InChI=1S/C27H35N5O7S/c1-40-12-11-21(27(38)39)32-26(37)22(14-17-5-3-2-4-6-17)31-24(35)16-29-23(34)15-30-25(36)20(28)13-18-7-9-19(33)10-8-18/h2-10,20-22,33H,11-16,28H2,1H3,(H,29,34)(H,30,36)(H,31,35)(H,32,37)(H,38,39)","YFGBQHOOROIVKG-UHFFFAOYSA-N"
"[H]OC(=O)C([H])([H])C([H])([H])C([H])(C(=O)O[H])N([H])C(=O)c(c([H])3)c([H])c([H])c(c([H])3)N(C([H])([H])[H])C([H])([H])c(c([H])1)nc(c(N([H])[H])2)c(nc(N([H])[H])n2)n1","InChI=1S/C20H22N8O5/c1-28(9-11-8-23-17-15(24-11)16(21)26-20(22)27-17)12-4-2-10(3-5-12)18(31)25-13(19(32)33)6-7-14(29)30/h2-5,8,13H,6-7,9H2,1H3,(H,25,31)(H,29,30)(H,32,33)(H4,21,22,23,26,27)","FBOZXECLQNJBKD-UHFFFAOYSA-N"
"[H]OC([H])([H])C([H])(C([H])([H])C([H])([H])[H])N([H])C(=O)C([H])(C([H])=1)C([H])([H])N(C([H])([H])[H])C([H])(C([H])([H])2)C1c(c([H])4)c(c(c([H])c([H])4)3)c(c([H])n([H])3)2","InChI=1S/C20H25N3O2/c1-3-14(11-24)22-20(25)13-7-16-15-5-4-6-17-19(15)12(9-21-17)8-18(16)23(2)10-13/h4-7,9,13-14,18,21,24H,3,8,10-11H2,1-2H3,(H,22,25)","UNBRKDKAWYKMIV-UHFFFAOYSA-N"
"[H]OC(=O)C([H])(O1)C([H])(O[H])C([H])(O[H])C([H])(O[H])C([H])(Oc(c([H])6)c(O5)c(c(c([H])6)2)C(C([H])([H])3)(C([H])54)C([H])(C([H])=C([H])C([H])(O[H])4)C([H])(N(C([H])([H])[H])C([H])([H])3)C([H])([H])2)1","InChI=1S/C23H27NO9/c1-24-7-6-23-10-3-4-12(25)20(23)32-18-13(5-2-9(14(18)23)8-11(10)24)31-22-17(28)15(26)16(27)19(33-22)21(29)30/h2-5,10-12,15-17,19-20,22,25-28H,6-8H2,1H3,(H,29,30)","WAEXKFONHRHFBZ-UHFFFAOYSA-N"
"[H]Oc(c([H])6)c(O5)c(c(c([H])6)3)C(C([H])([H])1)(C([H])54)C(O[H])(C([H])([H])C([H])([H])C(=O)4)C([H])(C([H])([H])3)N(C([H])([H])C([H])(C([H])([H])2)C([H])([H])2)C([H])([H])1","InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2","DQCKKXVULJGBQN-UHFFFAOYSA-N"
"[H]OC([H])(C([H])([H])4)C(C([H])([H])[H])(C([H])([H])3)C([H])(C([H])([H])4)C([H])(C([H])([H])1)C([H])(C([H])([H])3)C([H])(C([H])([H])2)C(=C([H])C(=O)C([H])([H])2)C([H])([H])1","InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1","NPAGDVCDWIYMMC-IZPLOLCNSA-N"
"CS(=O)(=O)NC1=C(C=C(C=C1)[N+](=O)[O-])OC2=CC=CC=C2","InChI=1S/C13H12N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h2-9,14H,1H3","HYWYRSMBCFDLJT-UHFFFAOYSA-N"
"[H]C([H])([H])N([H])C([H])([H])C([H])(C([H])([H])[H])C(OC(=O)C([H])([H])C([H])([H])[H])(c(c([H])2)c([H])c([H])c([H])c([H])2)C([H])([H])c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C21H27NO2/c1-4-20(23)24-21(17(2)16-22-3,19-13-9-6-10-14-19)15-18-11-7-5-8-12-18/h5-14,17,22H,4,15-16H2,1-3H3","IKACRWYHQXOSGM-UHFFFAOYSA-N"
"[H]C([H])([H])Oc(c([H])5)c(OC([H])([H])[H])c(C(=O)4)c(c([H])5)C([H])(O4)C([H])(N(C([H])([H])[H])1)c(c(OC([H])([H])[H])2)c(c([H])c(O3)c(OC([H])([H])3)2)C([H])([H])C([H])([H])1","InChI=1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3","AKNNEGZIBPJZJG-UHFFFAOYSA-N"
"[H]N([H])c(n2)nc(N([H])[H])c(c([H])2)C([H])([H])c(c([H])1)c(C([H])([H])[H])c([H])c(OC([H])([H])[H])c(OC([H])([H])[H])1","InChI=1S/C14H18N4O2/c1-8-4-11(19-2)12(20-3)6-9(8)5-10-7-17-14(16)18-13(10)15/h4,6-7H,5H2,1-3H3,(H4,15,16,17,18)","KEEYRKYKLYARHO-UHFFFAOYSA-N"
"[H]OC(=O)C([H])([H])C([H])([H])c(n1)oc(c(c([H])3)c([H])c([H])c([H])c([H])3)c1c(c([H])2)c([H])c([H])c([H])c([H])2","InChI=1S/C18H15NO3/c20-16(21)12-11-15-19-17(13-7-3-1-4-8-13)18(22-15)14-9-5-2-6-10-14/h1-10H,11-12H2,(H,20,21)","OFPXSFXSNFPTHF-UHFFFAOYSA-N"
"[H]C([H])([H])C([H])([H])N(C([H])([H])C#CC([H])([H])OC(=O)C(O[H])(c(c([H])2)c([H])c([H])c([H])c([H])2)C([H])(C([H])([H])1)C([H])([H])C([H])([H])C([H])([H])C([H])([H])1)C([H])([H])C([H])([H])[H]","InChI=1S/C22H31NO3/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3","XIQVNETUBQGFHX-UHFFFAOYSA-N"
"[H]C([H])([H])Oc(c([H])5)c(O4)c(c(c([H])5)1)C(C([H])([H])2)(C([H])43)C(O[H])(C([H])([H])C([H])([H])C(=O)3)C([H])(N(C([H])([H])[H])C([H])([H])2)C([H])([H])1","InChI=1S/C18H21NO4/c1-19-8-7-17-14-10-3-4-12(22-2)15(14)23-16(17)11(20)5-6-18(17,21)13(19)9-10/h3-4,13,16,21H,5-9H2,1-2H3","BRUQQQPBMZOVGD-UHFFFAOYSA-N"
"[H]OC(N([H])[H])=C(C(=O)4)C(=O)C(O[H])(C(=O)3)C([H])(C([H])(N(C([H])([H])[H])C([H])([H])[H])4)C([H])(O[H])C([H])(C=13)C(O[H])(C([H])([H])[H])c(c([H])2)c(c(O[H])c([H])c([H])2)C(O[H])1","InChI=1S/C22H24N2O9/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29/h4-6,12-14,17,25-26,28,31-33H,23H2,1-3H3/b20-11-/t12-,13-,14+,17+,21-,22+/m1/s1","FYDOORKXBWEKQM-GUQPPTOYSA-N"
"[H]OC(=O)C([H])(C([H])([H])1)N(C(=O)C([H])(C([H])([H])[H])N([H])C([H])(C(=O)OC([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])(C([H])([H])2)C([H])(C([H])([H])C([H])([H])C([H])([H])2)1","InChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14-,15-,16-/m0/s1","IPVQLZZIHOAWMC-QXKUPLGCSA-N"
"N(c43)(c(c([H])2)c(Sc(c([H])c([H])c([H])c([H])4)3)c([H])c([H])c(C(=O)C([H])([H])[H])2)C([H])([H])C([H])([H])C(N(C1([H])[H])C(C(C(C([H])([H])1)([H])C([H])([H])C([H])([H])O[H])([H])[H])([H])[H])([H])[H]","InChI=1S/C24H30N2O2S/c1-18(28)20-7-8-24-22(17-20)26(21-5-2-3-6-23(21)29-24)13-4-12-25-14-9-19(10-15-25)11-16-27/h2-3,5-8,17,19,27H,4,9-16H2,1H3","BTFMCMVEUCGQDX-UHFFFAOYSA-N"
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"[H]C([H])([H])Oc(c([H])1)c(OC([H])([H])[H])c([H])c(c(N([H])[H])4)c(nc(n4)N(C([H])([H])2)C([H])([H])C([H])([H])N(C(=O)c(o3)c([H])c([H])c([H])3)C([H])([H])2)1","InChI=1S/C19H21N5O4/c1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h3-4,9-11H,5-8H2,1-2H3,(H2,20,21,22)","IENZQIKPVFGBNW-UHFFFAOYSA-N"
"[H]OC([H])([H])C(=O)C(O[H])(C([H])([H])4)C(C([H])([H])[H])(C([H])([H])3)C([H])(C([H])([H])4)C([H])(C([H])([H])1)C([H])(C([H])(O[H])3)C(C([H])=2)(C([H])([H])[H])C(=C([H])C(=O)C([H])2)C([H])([H])1","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3","OIGNJSKKLXVSLS-UHFFFAOYSA-N"
"[H]C([H])(C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])C(OC([H])([H])C(=O)C(O[H])(C4([H])[H])C(C([H])([H])[H])(C3([H])[H])C(C([H])([H])4)([H])C([H])(C([H])(C3([H])O[H])1)C(C(C(=C([H])2)C1(C([H])=C(C2=O)[H])C([H])([H])[H])([H])[H])([H])[H])=O","InChI=1S/C27H38O6/c1-24(2,3)14-22(31)33-15-21(30)27(32)11-9-19-18-7-6-16-12-17(28)8-10-25(16,4)23(18)20(29)13-26(19,27)5/h8,10,12,18-20,23,29,32H,6-7,9,11,13-15H2,1-5H3","HUMXXHTVHHLNRO-UHFFFAOYSA-N"
"[H]OC([H])([H])C(=O)C(O[H])(C([H])([H])4)C(C([H])([H])[H])(C([H])([H])3)C([H])(C([H])([H])4)C([H])(C([H])([H])1)C([H])(C(=O)3)C(C([H])([H])[H])(C([H])=2)C(=C([H])C(=O)C([H])2)C([H])([H])1","InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3","XOFYZVNMUHMLCC-UHFFFAOYSA-N"
"[H]C([H])([H])C([H])([H])C([H])([H])C([H])(C([H])([H])c(c([H])2)c([H])c([H])c([H])c([H])2)N(C([H])([H])1)C([H])([H])C([H])([H])C([H])([H])1","InChI=1S/C15H23N/c1-2-8-15(16-11-6-7-12-16)13-14-9-4-3-5-10-14/h3-5,9-10,15H,2,6-8,11-13H2,1H3","OJCPSBCUMRIPFL-UHFFFAOYSA-N"
"[H]C([H])([H])Oc(c([H])2)c([H])c([H])c(c([H])2)C([H])([H])N(c(n1)c([H])c([H])c([H])c([H])1)C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H]","InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3","YECBIJXISLIIDS-UHFFFAOYSA-N"
"[H]C([H])([H])OC(=O)C([H])([H])C([H])([H])N(C([H])([H])1)C([H])([H])C([H])([H])C(C(=O)OC([H])([H])[H])(N(C(=O)C([H])([H])C([H])([H])[H])c(c([H])2)c([H])c([H])c([H])c([H])2)C([H])([H])1","InChI=1S/C20H28N2O5/c1-4-17(23)22(16-8-6-5-7-9-16)20(19(25)27-3)11-14-21(15-12-20)13-10-18(24)26-2/h5-9H,4,10-15H2,1-3H3","ZTVQQQVZCWLTDF-UHFFFAOYSA-N"
"c(C6([H])[H])(c12)c(C(N(C6([H])[H])5)(C(C([H])(C([H])3C(=O)OC([H])([H])[H])C([H])(C5([H])[H])C(C(OC(=O)c(c4[H])c(c(OC([H])([H])[H])c(c(OC([H])([H])[H])4)OC([H])([H])[H])[H])([H])C3(OC([H])([H])[H])[H])([H])[H])([H])[H])[H])n(c1c([H])c(c(c([H])2)[H])OC([H])([H])[H])[H]","InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3","QEVHRUUCFGRFIF-UHFFFAOYSA-N"
"[H]C([H])(N(C5([H])[H])C(C(C([H])([H])5)([H])[H])([H])[H])N(C(O[H])=C(C(=O)1)C(C(C(=O)4)(C(C(C(C4=3)(C(C([H])([H])[H])(O[H])c(c(C(O[H])3)2)c(c(c(c(O[H])2)[H])[H])[H])[H])([H])[H])(C(N(C([H])([H])[H])C([H])([H])[H])1[H])[H])O[H])=O)[H]","InChI=1S/C27H33N3O8/c1-26(37)13-7-6-8-16(31)17(13)21(32)18-14(26)11-15-20(29(2)3)22(33)19(24(35)27(15,38)23(18)34)25(36)28-12-30-9-4-5-10-30/h6-8,14-15,20,28,31-32,36-38H,4-5,9-12H2,1-3H3/b25-19-/t14?,15?,20-,26+,27-/m0/s1","YHDPWEWZPGTMMU-XZQQPYTISA-N"
"[H]OC([H])([H])c(c(O[H])2)c([H])c(c([H])c([H])2)C([H])(O[H])C([H])([H])N([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])OC([H])([H])C([H])([H])C([H])([H])C([H])([H])c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2","GIIZNNXWQWCKIB-UHFFFAOYSA-N"
"[H]C([H])([H])N([H])C([H])(C([H])(O[H])1)C([H])(O[H])C([H])(O2)C([H])(OC(O[H])(C(=O)3)C([H])(OC([H])(C([H])([H])[H])C([H])([H])3)2)C([H])(N([H])C([H])([H])[H])1","InChI=1S/C14H24N2O7/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14/h5,7-13,15-16,18-20H,4H2,1-3H3","UNFWWIHTNXNPBV-UHFFFAOYSA-N"
"[H]N([H])C(N([H])[H])=NC([H])(C([H])(O[H])1)C([H])(O[H])C([H])(N=C(N([H])[H])N([H])[H])C([H])(OC([H])(O2)C([H])(OC([H])(O3)C([H])(N([H])C([H])([H])[H])C([H])(O[H])C([H])(O[H])C([H])(C([H])([H])O[H])3)C(O[H])(C([H])=O)C([H])(C([H])([H])[H])2)C([H])(O[H])1","InChI=1S/C21H39N7O12/c1-5-21(36,4-30)16(40-17-9(26-2)13(34)10(31)6(3-29)38-17)18(37-5)39-15-8(28-20(24)25)11(32)7(27-19(22)23)12(33)14(15)35/h4-18,26,29,31-36H,3H2,1-2H3,(H4,22,23,27)(H4,24,25,28)/t5-,6-,7+,8-,9-,10-,11+,12-,13-,14+,15+,16-,17-,18-,21+/m0/s1","UCSJYZPVAKXKNQ-HZYVHMACSA-N"
"[H]c(c([H])7)c([H])c(c(c([H])7)1)N(C(=O)5)C([H])(C([H])42)C1(C([H])([H])6)C([H])(N3C([H])([H])6)C([H])([H])C([H])(C(=C([H])C([H])([H])OC([H])(C([H])([H])5)4)C([H])([H])3)2","InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2","QMGVPVSNSZLJIA-UHFFFAOYSA-N"
"C1C[N+]2(CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75)[O-]","InChI=1S/C21H22N2O3/c24-18-10-16-19-13-9-17-21(6-7-23(17,25)11-12(13)5-8-26-16)14-3-1-2-4-15(14)22(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+,23?/m0/s1","ADTDBAKUQAKBGZ-VXJIXCKJSA-N"
"[H]C([H])([H])OC([H])([H])C(N(C(=O)C([H])([H])C([H])([H])[H])c(c([H])3)c([H])c([H])c([H])c([H])3)(C([H])([H])1)C([H])([H])C([H])([H])N(C([H])([H])C([H])([H])c(s2)c([H])c([H])c([H])2)C([H])([H])1","InChI=1S/C22H30N2O2S/c1-3-21(25)24(19-8-5-4-6-9-19)22(18-26-2)12-15-23(16-13-22)14-11-20-10-7-17-27-20/h4-10,17H,3,11-16,18H2,1-2H3","GGCSSNBKKAUURC-UHFFFAOYSA-N"
"[H]C([H])([H])Oc(n2)nc(c([H])c(OC([H])([H])[H])2)N([H])S(=O)(=O)c(c([H])1)c([H])c([H])c(N([H])[H])c([H])1","InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)","ZZORFUFYDOWNEF-UHFFFAOYSA-N"
"[H]OC(=O)c(c(=O)1)c([H])c(=NN([H])c(c([H])3)c([H])c([H])c(c([H])3)S(=O)(=O)N([H])c(n2)c([H])c([H])c([H])c([H])2)c([H])c([H])1","InChI=1S/C18H14N4O5S/c23-16-9-6-13(11-15(16)18(24)25)21-20-12-4-7-14(8-5-12)28(26,27)22-17-3-1-2-10-19-17/h1-11,20H,(H,19,22)(H,24,25)/b21-13+","OQANPHBRHBJGNZ-FYJGNVAPSA-N"
"","InChI=1S/C26H45NO7S/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15?,16?,17-,18?,19?,20?,21-,22+,24?,25?,26?/m1/s1","WBWWGRHZICKQGZ-XWWYUOLUSA-N"
"[H]OC(N([H])c(n3)c([H])c([H])c([H])c([H])3)=C(C(=O)1)N(C([H])([H])[H])S(=O)(=O)c(c([H])2)c(sc([H])2)1","InChI=1S/C13H11N3O4S2/c1-16-10(13(18)15-9-4-2-3-6-14-9)11(17)12-8(5-7-21-12)22(16,19)20/h2-7,18H,1H3,(H,14,15)/b13-10+","WZWYJBNHTWCXIM-JLHYYAGUSA-N"
"[H]Oc(c([H])1)c([H])c(c([H])c(O[H])1)C([H])(O[H])C([H])([H])N([H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H]","InChI=1S/C12H19NO3/c1-12(2,3)13-7-11(16)8-4-9(14)6-10(15)5-8/h4-6,11,13-16H,7H2,1-3H3","XWTYSIMOBUGWOL-UHFFFAOYSA-N"
"[H]C([H])(N(C(C([H])([H])C([H])([H])C([H])(O[H])c(c([H])4)c([H])c([H])c(C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])c4[H])([H])[H])1)C([H])([H])C(C(O[H])(c(c([H])3)c([H])c([H])c([H])c([H])3)c(c([H])2)c([H])c([H])c([H])c([H])2)(C([H])([H])C([H])([H])1)[H]","InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3","GUGOEEXESWIERI-UHFFFAOYSA-N"
"[H]C([H])([H])C([H])([H])C(=O)OC([H])(C([H])([H])4)C(C([H])([H])[H])(C([H])([H])3)C([H])(C([H])([H])4)C([H])(C([H])([H])1)C([H])(C([H])([H])3)C(C([H])([H])[H])(C([H])([H])2)C(=C([H])C(=O)C([H])([H])2)C([H])([H])1","InChI=1S/C22H32O3/c1-4-20(24)25-19-8-7-17-16-6-5-14-13-15(23)9-11-21(14,2)18(16)10-12-22(17,19)3/h13,16-19H,4-12H2,1-3H3/t16?,17?,18?,19-,21-,22-/m0/s1","PDMMFKSKQVNJMI-PPRDLICTSA-N"
"[H]C([H])([H])C([H])([H])C([H])([H])C([H])([H])N([H])c(c([H])1)c([H])c([H])c(C(=O)OC([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])c([H])1","InChI=1S/C15H24N2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3/h6-9,16H,4-5,10-12H2,1-3H3","GKCBAIGFKIBETG-UHFFFAOYSA-N"
"[H]OC(N([H])[H])=C(C(=O)4)C(=O)C(O[H])(C(=O)3)C([H])(C([H])(N(C([H])([H])[H])C([H])([H])[H])4)C([H])([H])C([H])(C=13)C(O[H])(C([H])([H])[H])c(c([H])2)c(c(O[H])c([H])c([H])2)C(O[H])1","InChI=1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,30-32H,7,23H2,1-3H3/b20-14-","JYHCQVWYCGHXGP-ZHZULCJRSA-N"
"[H]c(c([H])3)c([H])c([H])c(c([H])3)C([H])(N=2)C([H])([H])N(C12)C([H])([H])C([H])([H])S1","InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2","HLFSDGLLUJUHTE-UHFFFAOYSA-N"
"[H]C([H])([H])N(C(=O)2)c(n1)c(C(=O)N([H])2)n(C([H])([H])[H])c([H])1","InChI=1S/C7H8N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3H,1-2H3,(H,9,12,13)","YAPQBXQYLJRXSA-UHFFFAOYSA-N"
"[H]C([H])([H])C([H])([H])Sc(c([H])4)c([H])c(c2c([H])4)N(c(c([H])3)c(c([H])c([H])c([H])3)S2)C([H])([H])C([H])([H])C([H])([H])N(C([H])([H])1)C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])1","InChI=1S/C22H29N3S2/c1-3-26-18-9-10-22-20(17-18)25(19-7-4-5-8-21(19)27-22)12-6-11-24-15-13-23(2)14-16-24/h4-5,7-10,17H,3,6,11-16H2,1-2H3","XCTYLCDETUVOIP-UHFFFAOYSA-N"
"[H]C([H])([H])Sc(c([H])4)c([H])c(c2c([H])4)N(c(c([H])3)c(c([H])c([H])c([H])3)S2)C([H])([H])C([H])([H])C([H])(N(C([H])([H])[H])1)C([H])([H])C([H])([H])C([H])([H])C([H])([H])1","InChI=1S/C21H26N2S2/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3","KLBQZWRITKRQQV-UHFFFAOYSA-N"
"[H]c(c([H])4)c([H])c(S1)c(c([H])4)C(=C([H])C([H])([H])C([H])([H])N(C([H])([H])3)C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])3)c(c([H])2)c1c([H])c([H])c2S(=O)(=O)N(C([H])([H])[H])C([H])([H])[H]","InChI=1S/C23H29N3O2S2/c1-24(2)30(27,28)18-10-11-23-21(17-18)19(20-7-4-5-9-22(20)29-23)8-6-12-26-15-13-25(3)14-16-26/h4-5,7-11,17H,6,12-16H2,1-3H3/b19-8-","GFBKORZTTCHDGY-UWVJOHFNSA-N"
"CCCCCCCCCCCCCCCC[N+](C)(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CC=N2","InChI=1S/C32H55N4O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-27-36(2,3)28-26-35(32-33-24-19-25-34-32)29-30-20-22-31(37-4)23-21-30/h19-25H,5-18,26-29H2,1-4H3/q+1","IOYZYMQFUSNATM-UHFFFAOYSA-N"
"[H]c(c([H])2)nc(c([H])c([H])2)N(C([H])([H])C([H])([H])N(C([H])([H])[H])C([H])([H])[H])C([H])([H])c(c([H])1)c([H])c([H])c([H])c([H])1","InChI=1S/C16H21N3/c1-18(2)12-13-19(16-10-6-7-11-17-16)14-15-8-4-3-5-9-15/h3-11H,12-14H2,1-2H3","UFLGIAIHIAPJJC-UHFFFAOYSA-N"
"CC(=O)O[C@H]1C[C@@H]2CC[C@@H]3[C@@H]([C@]2(C[C@@H]1N4CCCCC4)C)CC[C@]5([C@H]3C[C@@H]([C@@H]5OC(=O)C)[N+]6(CCCCC6)C)C","InChI=1S/C34H57N2O4/c1-23(37)39-31-20-25-12-13-26-27(34(25,4)22-29(31)35-16-8-6-9-17-35)14-15-33(3)28(26)21-30(32(33)40-24(2)38)36(5)18-10-7-11-19-36/h25-32H,6-22H2,1-5H3/q+1/t25-,26+,27-,28-,29-,30-,31-,32-,33-,34-/m0/s1","BGSZAXLLHYERSY-XQIGCQGXSA-N"
"","InChI=1S/C54H92O23/c1-23(2)10-9-14-54(8,77-48-44(69)40(65)37(62)29(74-48)22-70-46-42(67)38(63)34(59)26(19-55)71-46)24-11-16-53(7)33(24)25(58)18-31-51(5)15-13-32(50(3,4)30(51)12-17-52(31,53)6)75-49-45(41(66)36(61)28(21-57)73-49)76-47-43(68)39(64)35(60)27(20-56)72-47/h10,24-49,55-69H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46+,47-,48-,49-,51-,52+,53+,54-/m0/s1","GZYPWOGIYAIIPV-JBDTYSNRSA-N"
"C(C8)(C(C(C)3C(C([H])78)(CCC(C74C)([H])C(C)(C)C(OC([H])(C5OC([H])(O6)C(C(C(O)C(CO)6)O)O)OC(C(O)C5O)CO)CC4)C)(C(CC3)([H])C(CCC=C(C)C)(OC(O1)C(C(O)C(C1COC(C(O)2)OC(CO)C2O)O)O)C)[H])O","InChI=1S/C53H90O22/c1-23(2)10-9-14-53(8,75-47-43(67)39(63)37(61)29(72-47)22-68-45-41(65)36(60)28(21-56)69-45)24-11-16-52(7)33(24)25(57)18-31-50(5)15-13-32(49(3,4)30(50)12-17-51(31,52)6)73-48-44(40(64)35(59)27(20-55)71-48)74-46-42(66)38(62)34(58)26(19-54)70-46/h10,24-48,54-67H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28-,29+,30-,31+,32-,33-,34+,35+,36-,37+,38-,39-,40-,41+,42+,43+,44+,45+,46-,47-,48-,50-,51+,52+,53-/m0/s1","JDCPEKQWFDWQLI-LUQKBWBOSA-N"
"C(C1)(O)C(C([H])6C(C)(CCC=C(C)C)OC(C(O)7)OC(CO)C(C(O)7)O)([H])C(C)(CC6)C(C)(C5)C1(C(C2)(C)C(C5)(C(C)(C)C(OC(O3)(C(OC([H])(C(O)4)OC(C(O)C4O)CO)C(O)C(C3CO)O)[H])C2)[H])[H]","InChI=1S/C48H82O18/c1-22(2)10-9-14-48(8,66-42-39(60)36(57)33(54)26(20-50)62-42)23-11-16-47(7)31(23)24(52)18-29-45(5)15-13-30(44(3,4)28(45)12-17-46(29,47)6)64-43-40(37(58)34(55)27(21-51)63-43)65-41-38(59)35(56)32(53)25(19-49)61-41/h10,23-43,49-60H,9,11-21H2,1-8H3/t23-,24+,25+,26+,27+,28-,29+,30-,31-,32+,33+,34+,35-,36-,37-,38+,39+,40+,41-,42-,43-,45-,46+,47+,48-/m0/s1","RLDVZILFNVRJTL-IWFVLDDISA-N"
"C(CC(C(=C14)CCC1(C(C([H])2C(O)C4)(C)CCC(C(C)(C)3)([H])C(CCC3=O)2C)C)C)(C(C(C)(C)O)O)O","InChI=1S/C30H50O5/c1-17(15-21(32)25(34)27(4,5)35)18-9-13-29(7)19(18)16-20(31)24-28(6)12-11-23(33)26(2,3)22(28)10-14-30(24,29)8/h17,20-22,24-25,31-32,34-35H,9-16H2,1-8H3/t17-,20+,21+,22+,24+,25-,28+,29+,30+/m1/s1","HNOSJVWYGXOFRP-UNPOXIGHSA-N"
"CC(C3=4)(CCC4C(C)CC(C([H])(C5(C)C)O5)O)C(C)(C(C(O)C3)([H])1)CCC(C(C)(C)2)([H])C(CCC2=O)1C","InChI=1S/C30H48O4/c1-17(15-21(32)25-27(4,5)34-25)18-9-13-29(7)19(18)16-20(31)24-28(6)12-11-23(33)26(2,3)22(28)10-14-30(24,29)8/h17,20-22,24-25,31-32H,9-16H2,1-8H3/t17-,20+,21+,22+,24+,25-,28+,29+,30+/m1/s1","GBJKHDVRXAVITG-UNPOXIGHSA-N"
"","InChI=1S/C32H50O5/c1-18(16-23(36-19(2)33)27-29(5,6)37-27)20-10-14-31(8)21(20)17-22(34)26-30(7)13-12-25(35)28(3,4)24(30)11-15-32(26,31)9/h18,22-24,26-27,34H,10-17H2,1-9H3/t18-,22+,23+,24+,26+,27-,30+,31+,32+/m1/s1","NLOAQXKIIGTTRE-JSWHPQHOSA-N"
"[H]C(C(C)(C)7)(C(CCC7OC(O8)([H])C(O)C(C(O)C8)O)23)C(CC([H])(C(C)46)C(CCC(C(C(C6)O)([H])C(C5)(C)OC(C(C)(C)O)C5)4C)2C3)OC(C1O)([H])OC(CO)C(C1O)O","InChI=1S/C41H68O14/c1-35(2)24(54-33-29(48)26(45)20(44)17-51-33)9-11-41-18-40(41)13-12-37(5)31(39(7)10-8-25(55-39)36(3,4)50)19(43)15-38(37,6)23(40)14-21(32(35)41)52-34-30(49)28(47)27(46)22(16-42)53-34/h19-34,42-50H,8-18H2,1-7H3/t19-,20+,21-,22+,23-,24-,25-,26-,27+,28-,29+,30+,31-,32-,33-,34+,37+,38-,39+,40-,41+/m0/s1","QMNWISYXSJWHRY-YLNUDOOFSA-N"
"","InChI=1S/C26H36O6/c1-15(27)32-21-13-26(30)20-6-5-17-12-18(28)8-10-24(17,2)19(20)9-11-25(26,3)23(21)16-4-7-22(29)31-14-16/h4,7,14,17-21,23,28,30H,5-6,8-13H2,1-3H3/t17-,18+,19+,20-,21+,23+,24+,25-,26+/m1/s1","VOZHMAYHYHEWBW-NVOOAVKYSA-N"
"O(C1CO)C([H])(OC(C7)C(C(C([H])(C(C)74)CC(O)C([H])(C(C(CCC=C(C)C)(OC(O6)C(O)C(O)C(O)C6CO)C)([H])5)C(CC5)4C)3C)([H])C(C(O)CC3)(C)C)C(OC([H])(O2)C(C(C(O)C2C)O)O)C(O)C1O","InChI=1S/C48H82O18/c1-21(2)11-10-14-48(9,66-42-38(60)35(57)32(54)26(19-49)63-42)23-12-16-46(7)30(23)24(51)17-28-45(6)15-13-29(52)44(4,5)40(45)25(18-47(28,46)8)62-43-39(36(58)33(55)27(20-50)64-43)65-41-37(59)34(56)31(53)22(3)61-41/h11,22-43,49-60H,10,12-20H2,1-9H3/t22-,23-,24+,25-,26+,27+,28+,29-,30-,31-,32+,33+,34+,35-,36-,37+,38+,39+,40-,41-,42-,43+,45+,46+,47+,48-/m0/s1","PWAOOJDMFUQOKB-WCZZMFLVSA-N"
"C(C6)(C32C)([H])C(C(C)(C4(C(O)6)[H])CCC(C(OC(C(O)5)OC(CO)C(C5O)O)(C)CCC=C(C)C)([H])4)(CC(C2(C(C(CC3)O)(C)C)[H])OC([H])(O1)C(C(O)C(O)C(CO)1)O)C","InChI=1S/C42H72O14/c1-20(2)10-9-13-42(8,56-37-34(52)32(50)30(48)25(19-44)55-37)21-11-15-40(6)28(21)22(45)16-26-39(5)14-12-27(46)38(3,4)35(39)23(17-41(26,40)7)53-36-33(51)31(49)29(47)24(18-43)54-36/h10,21-37,43-52H,9,11-19H2,1-8H3/t21-,22+,23-,24+,25+,26+,27-,28-,29+,30+,31-,32-,33+,34+,35-,36+,37-,39+,40+,41+,42-/m0/s1","YURJSTAIMNSZAE-HHNZYBFYSA-N"
"C(C([H])54)(C1)(C)C([H])(CCC4(C(C7)(C(O8)(C(C(C8)6C(O)7)(CC(CC6)(C)C)[H])C=C5)C)C)C(C(OC(O3)([H])C(C(C(C3C)O)OC(C(O)2)(OC(C(C2O)O)CO)[H])O)C1)(C)CO","InChI=1S/C42H68O13/c1-21-28(46)33(55-34-31(49)30(48)29(47)22(18-43)53-34)32(50)35(52-21)54-27-10-11-37(4)23(38(27,5)19-44)8-12-39(6)24(37)9-13-42-25-16-36(2,3)14-15-41(25,20-51-42)26(45)17-40(39,42)7/h9,13,21-35,43-50H,8,10-12,14-20H2,1-7H3/t21-,22-,23-,24-,25-,26+,27+,28+,29-,30+,31-,32-,33+,34+,35+,37+,38+,39-,40+,41-,42+/m1/s1","KYWSCMDFVARMPN-MSSMMRRTSA-N"
"COc(c(O)3)c(O1)c(c(O)c3)C(=O)C=C(c(c2)cccc2)1","InChI=1S/C16H12O5/c1-20-15-12(19)7-10(17)14-11(18)8-13(21-16(14)15)9-5-3-2-4-6-9/h2-8,17,19H,1H3","XLTFNNCXVBYBSX-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(=C2)Oc(c1)c(C(=O)2)c(O)c(O)c(O)1","InChI=1S/C15H10O5/c16-9-6-11(8-4-2-1-3-5-8)20-12-7-10(17)14(18)15(19)13(9)12/h1-7,17-19H","FXNFHKRTJBSTCS-UHFFFAOYSA-N"
"c(O)(c3)c(C(=O)2)c(cc3OC(O4)C(O)C(O)C(O)C(COC(O5)C(O)C(C(C5C)O)O)4)OC(C2)c(c1)ccc(c1O)OC","InChI=1S/C28H34O15/c1-10-21(32)23(34)25(36)27(40-10)39-9-19-22(33)24(35)26(37)28(43-19)41-12-6-14(30)20-15(31)8-17(42-18(20)7-12)11-3-4-16(38-2)13(29)5-11/h3-7,10,17,19,21-30,32-37H,8-9H2,1-2H3/t10-,17+,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1","QUQPHWDTPGMPEX-UTWYECKDSA-N"
"c(c3O)c(cc(O4)c3C(CC(c(c5)ccc(O)c5)4)=O)OC(O2)C(C(C(C2CO)O)O)OC(O1)(C(C(C(C1C)O)O)O)[H]","InChI=1S/C27H32O14/c1-10-20(32)22(34)24(36)26(37-10)41-25-23(35)21(33)18(9-28)40-27(25)38-13-6-14(30)19-15(31)8-16(39-17(19)7-13)11-2-4-12(29)5-3-11/h2-7,10,16,18,20-30,32-36H,8-9H2,1H3/t10-,16-,18+,20-,21+,22+,23-,24+,25+,26-,27+/m0/s1","DFPMSGMNTNDNHN-ZPHOTFPESA-N"
"COc(c(O)3)c(O)c(C(=O)1)c(c3)OC(Oc(c2)ccc(O)c2)=C1","InChI=1S/C16H12O7/c1-21-16-11(19)6-12-14(15(16)20)10(18)7-13(23-12)22-9-4-2-8(17)3-5-9/h2-7,17,19-20H,1H3","NTKNGUAZSFAKEE-UHFFFAOYSA-N"
"","InChI=1S/C34H47NO11/c1-7-35-15-31(16-41-3)20(37)13-21(42-4)33-19-14-32(40)28(45-30(39)18-11-9-8-10-12-18)22(19)34(46-17(2)36,27(38)29(32)44-6)23(26(33)35)24(43-5)25(31)33/h8-12,19-29,37-38,40H,7,13-16H2,1-6H3/t19-,20-,21+,22-,23+,24+,25-,26+,27+,28-,29+,31+,32-,33+,34-/m1/s1","XFSBVAOIAHNAPC-XZHDXZNSSA-N"
"COC(C61[H])C([H])(C75COC)C(C6([H])N(C7)C)(C(OC)CC5O)C(C2)(C([H])(C(OC(c(c4)cccc4)=O)3)C1(O)C(O)C(OC)C23O)[H]","InChI=1S/C31H43NO10/c1-32-13-28(14-38-2)17(33)11-18(39-3)30-16-12-29(36)25(42-27(35)15-9-7-6-8-10-15)19(16)31(37,24(34)26(29)41-5)20(23(30)32)21(40-4)22(28)30/h6-10,16-26,33-34,36-37H,11-14H2,1-5H3/t16-,17-,18+,19-,20+,21+,22-,23+,24+,25-,26+,28+,29-,30+,31-/m1/s1","PULWZCUZNRVAHT-ALJFZQNLSA-N"
"C(O1)Oc(c2)c1cc(C6)c2c(c3)[n+1](C6)cc(c54)c(ccc(OCO5)4)3","InChI=1S/C19H14NO4/c1-2-16-19(24-10-21-16)14-8-20-4-3-12-6-17-18(23-9-22-17)7-13(12)15(20)5-11(1)14/h1-2,5-8H,3-4,9-10H2/q+1","XYHOBCMEDLZUMP-UHFFFAOYSA-N"
"COc(c4)c(OC)cc(c43)C([H])(N(CC3)1)C(C)c(c2)c(c(OC)c(OC)c2)C1","InChI=1S/C22H27NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-11,13,21H,8-9,12H2,1-5H3/t13-,21+/m0/s1","VRSRXLJTYQVOHC-YEJXKQKISA-N"
"COc(c4)c(OC)cc(c34)c([n+1](CC3)2)c(C)c(c1)c(c2)c(OC)c(OC)c1","InChI=1S/C22H24NO4/c1-13-15-6-7-18(24-2)22(27-5)17(15)12-23-9-8-14-10-19(25-3)20(26-4)11-16(14)21(13)23/h6-7,10-12H,8-9H2,1-5H3/q+1","RFKQJTRWODZPHF-UHFFFAOYSA-N"
"CC[C@H]1CN2CCC3=C([C@H]2C[C@@H]1/C(=C\OC)/C(=O)OC)NC4=CC=CC=C34","InChI=1S/C22H28N2O3/c1-4-14-12-24-10-9-16-15-7-5-6-8-19(15)23-21(16)20(24)11-17(14)18(13-26-2)22(25)27-3/h5-8,13-14,17,20,23H,4,9-12H2,1-3H3/b18-13+/t14-,17-,20+/m0/s1","NMLUOJBSAYAYEM-AZQGJTAVSA-N"
"C(C562)([H])(N7C)C(C(C([H])5C(C7)(CCC6OC)COC)OC)(C(C31[H])(OC(C)=O)C(C(OC)C(C(OC(=O)c(c4)cccc4)3)(O)CC12[H])O)[H]","InChI=1S/C33H45NO10/c1-17(35)44-33-21-19(14-31(38,28(42-6)26(33)36)27(21)43-29(37)18-10-8-7-9-11-18)32-20(40-4)12-13-30(16-39-3)15-34(2)25(32)22(33)23(41-5)24(30)32/h7-11,19-28,36,38H,12-16H2,1-6H3/t19-,20+,21-,22+,23+,24-,25+,26+,27-,28+,30+,31-,32+,33-/m1/s1","FIDOCHXHMJHKRW-FRKYWMJVSA-N"
"O(C)C(C26[H])C(C(COC)17)([H])C(C6([H])N(C)C7)(C(C3)([H])C([H])(C4OC(=O)c(c5)cccc5)C2(C(C(C34O)OC)O)OC(C)=O)C(CC(O)1)OC","InChI=1S/C33H45NO11/c1-16(35)45-33-21-18(13-31(39,28(43-6)26(33)37)27(21)44-29(38)17-10-8-7-9-11-17)32-20(41-4)12-19(36)30(15-40-3)14-34(2)25(32)22(33)23(42-5)24(30)32/h7-11,18-28,36-37,39H,12-15H2,1-6H3/t18-,19-,20+,21-,22+,23+,24-,25+,26+,27-,28+,30+,31-,32+,33-/m1/s1","XUHJBXVYNBQQBD-DIMAMZENSA-N"
"O=C(C4)N(C1)C([H])(CC4)C([H])(C3)C([H])(N(=O)2CC3)C([H])(CCC2)1","InChI=1S/C15H24N2O2/c18-14-7-1-6-13-12-5-3-9-17(19)8-2-4-11(15(12)17)10-16(13)14/h11-13,15H,1-10H2/t11-,12+,13+,15-,17+/m0/s1","XVPBINOPNYFXID-JARXUMMXSA-N"
"COC=C(C(=O)OC)C(C(CC)4)CC([H])(N(C4)3)C(CC3)(C(=O)1)c(c2)c(ccc2)N1","InChI=1S/C22H28N2O4/c1-4-14-12-24-10-9-22(17-7-5-6-8-18(17)23-21(22)26)19(24)11-15(14)16(13-27-2)20(25)28-3/h5-8,13-15,19H,4,9-12H2,1-3H3,(H,23,26)/b16-13+/t14-,15-,19-,22+/m0/s1","DAXYUDFNWXHGBE-KAXDATADSA-N"
"COc(c4)c(O)c(c(c4)1)C(C2)(C3)C([H])(C=C(OC)C(=O)3)C(N(C)C2)C1","InChI=1S/C19H23NO4/c1-20-7-6-19-10-14(21)16(24-3)9-12(19)13(20)8-11-4-5-15(23-2)18(22)17(11)19/h4-5,9,12-13,22H,6-8,10H2,1-3H3/t12-,13+,19-/m1/s1","INYYVPJSBIVGPH-QHRIQVFBSA-N"
"CC(C)=CCC(O)c(c1)c(=O)c(c(O)2)c(c(O)cc2)c(=O)1","InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3/t10-/m0/s1","NEZONWMXZKDMKF-JTQLQIEISA-N"
"COC(=O)C(=C2)C([H])(C3)C([H])(C(CO)=C3)C(O2)OC([H])(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C17H24O10/c1-24-15(23)9-6-25-16(11-7(4-18)2-3-8(9)11)27-17-14(22)13(21)12(20)10(5-19)26-17/h2,6,8,10-14,16-22H,3-5H2,1H3/t8-,10-,11-,12-,13+,14-,16+,17+/m1/s1","IBFYXTRXDNAPMM-BVTMAQQCSA-N"
"OCC(C(O)1)OC([H])(OC(O3)C(C=C)C(=C2)C(=C3)C(=O)OC2)C(O)C(O)1","InChI=1S/C16H20O9/c1-2-7-8-3-4-22-14(21)9(8)6-23-15(7)25-16-13(20)12(19)11(18)10(5-17)24-16/h2-3,6-7,10-13,15-20H,1,4-5H2/t7-,10-,11-,12+,13-,15+,16+/m1/s1","DUAGQYUORDTXOR-GPQRQXLASA-N"
"COC(=O)C(=C2)C([H])(C3)C([H])(C(C)C(O)3)C(O2)OC([H])(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C17H26O10/c1-6-9(19)3-7-8(15(23)24-2)5-25-16(11(6)7)27-17-14(22)13(21)12(20)10(4-18)26-17/h5-7,9-14,16-22H,3-4H2,1-2H3/t6-,7+,9-,10+,11+,12+,13-,14+,16-,17-/m0/s1","AMBQHHVBBHTQBF-UOUCRYGSSA-N"
"C=CCc(c2)cc(c(O)c2)c(c1)c(O)ccc(CC=C)1","InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2","VVOAZFWZEDHOOU-UHFFFAOYSA-N"
"C(OC(C5C(C=6)=COC(=O)C6)C(C(C52C)(C(C4)(C(C(C)(C([H])3C4)CCC(C3)O)(CC2)[H])[H])1)O1)(C)=O","InChI=1S/C26H34O6/c1-14(27)31-22-21(15-4-7-20(29)30-13-15)25(3)11-9-18-19(26(25)23(22)32-26)6-5-16-12-17(28)8-10-24(16,18)2/h4,7,13,16-19,21-23,28H,5-6,8-12H2,1-3H3/t16-,17+,18+,19-,21+,22-,23-,24+,25-,26-/m1/s1","SCULJPGYOQQXTK-OLRINKBESA-N"
"C(OC(C5C(C=6)=COC(=O)C6)C(C(C52C)1C(C4)(C(C(C)(C(O)3C4)CCC(C3)O)(CC2)[H])[H])O1)(C)=O","InChI=1S/C26H34O7/c1-14(27)32-21-20(15-4-5-19(29)31-13-15)24(3)10-7-17-18(26(24)22(21)33-26)8-11-25(30)12-16(28)6-9-23(17,25)2/h4-5,13,16-18,20-22,28,30H,6-12H2,1-3H3/t16-,17-,18+,20-,21+,22+,23+,24+,25-,26+/m0/s1","KBKUJJFDSHBPPA-ZNCGZLKOSA-N"
"","InChI=1S/C24H32O4/c1-22-9-7-16(25)11-15(22)4-5-18-17(22)8-10-23(2)19(12-20-24(18,23)28-20)14-3-6-21(26)27-13-14/h3,6,13,15-20,25H,4-5,7-12H2,1-2H3/t15-,16+,17+,18-,19-,20-,22+,23-,24-/m1/s1","ATLJNLYIJOCWJE-CWMZOUAVSA-N"
"","InChI=1S/C42H68O13/c1-21-29(47)34(55-35-32(50)31(49)30(48)24(18-43)53-35)33(51)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21-,24-,25-,26-,27-,28+,29+,30-,31+,32-,33-,34+,35+,36+,38+,39+,40-,41-,42-/m1/s1","WRYJYFCCMSVEPQ-ORAXXRKOSA-N"
"COc(c4)c(OC)c(OC)c(c34)c(c(CC(C)C(C)C3)1)c(OC)c(O2)c(OC2)c1","InChI=1S/C23H28O6/c1-12-7-14-9-16(24-3)20(25-4)22(26-5)18(14)19-15(8-13(12)2)10-17-21(23(19)27-6)29-11-28-17/h9-10,12-13H,7-8,11H2,1-6H3","RTZKSTLPRTWFEV-UHFFFAOYSA-N"
"COc(c3)c(OC)c(OC)c(c13)c(c(OC)2)c(cc(OC)c(OC)2)CC(C)(O)C(C)C1","InChI=1S/C24H32O7/c1-13-9-14-10-16(26-3)20(28-5)22(30-7)18(14)19-15(12-24(13,2)25)11-17(27-4)21(29-6)23(19)31-8/h10-11,13,25H,9,12H2,1-8H3","YEFOAORQXAOVJQ-UHFFFAOYSA-N"
"OCC(C(O)1)OC([H])(OC(O3)C([H])(C(CO)=2)C([H])(C=C3)C(O)C2)C(O)C(O)1","InChI=1S/C15H22O9/c16-4-6-3-8(18)7-1-2-22-14(10(6)7)24-15-13(21)12(20)11(19)9(5-17)23-15/h1-3,7-21H,4-5H2/t7-,8+,9+,10+,11+,12-,13+,14-,15-/m0/s1","RJWJHRPNHPHBRN-FKVJWERZSA-N"
"OCC(C(O)4)OC([H])(C(O)C(O)4)OC(O3)C([H])(C([H])(C=C3)2)C(CO)(O1)C1C(O)2","InChI=1S/C15H22O10/c16-3-6-9(19)10(20)11(21)14(23-6)24-13-7-5(1-2-22-13)8(18)12-15(7,4-17)25-12/h1-2,5-14,16-21H,3-4H2/t5-,6-,7-,8+,9-,10+,11-,12+,13+,14+,15-/m1/s1","LHDWRKICQLTVDL-PZYDOOQISA-N"
"OCC(C(O)1)OC([H])(OC(O2)C([H])(C(CO)=3)C([H])(CC3)C(C(O)=O)=C2)C(O)C(O)1","InChI=1S/C16H22O10/c17-3-6-1-2-7-8(14(22)23)5-24-15(10(6)7)26-16-13(21)12(20)11(19)9(4-18)25-16/h1,5,7,9-13,15-21H,2-4H2,(H,22,23)/t7-,9-,10-,11-,12+,13-,15+,16+/m1/s1","ZJDOESGVOWAULF-OGJQONSISA-N"
"OCC(C(O)1)OC([H])(OC(O3)C(C=C)C(O)(C2)C(=C3)C(=O)OC2)C(O)C(O)1","InChI=1S/C16H22O10/c1-2-7-14(24-6-8-13(21)23-4-3-16(7,8)22)26-15-12(20)11(19)10(18)9(5-17)25-15/h2,6-7,9-12,14-15,17-20,22H,1,3-5H2/t7-,9+,10+,11-,12+,14-,15-,16+/m0/s1","HEYZWPRKKUGDCR-QBXMEVCASA-N"
"OCC(C(O)1)OC([H])(c32)C([H])(OC(=O)c(cc(O)c(OC)c(O)3)2)C(O)1","InChI=1S/C14H16O9/c1-21-11-5(16)2-4-7(9(11)18)12-13(23-14(4)20)10(19)8(17)6(3-15)22-12/h2,6,8,10,12-13,15-19H,3H2,1H3/t6-,8-,10+,12+,13-/m1/s1","YWJXCIXBAKGUKZ-HJJNZUOJSA-N"
"C1=CC(=CC=C1/C=C/C(=O)CC(=O)/C=C/C2=CC=C(C=C2)O)O","InChI=1S/C19H16O4/c20-16-7-1-14(2-8-16)5-11-18(22)13-19(23)12-6-15-3-9-17(21)10-4-15/h1-12,20-21H,13H2/b11-5+,12-6+","PREBVFJICNPEKM-YDWXAUTNSA-N"
"COc(c1)c(O)ccc(C=CC(=O)CC(=O)C=Cc(c2)ccc(O)c2)1","InChI=1S/C20H18O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-12,21,24H,13H2,1H3/b9-4+,10-5+","HJTVQHVGMGKONQ-LUZURFALSA-N"
"C=CCc(c2)cc(c(O)c2)c(c1)cc(CC=C)c(O)c1","InChI=1S/C18H18O2/c1-3-5-13-7-9-18(20)16(11-13)14-8-10-17(19)15(12-14)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2","FVYXIJYOAGAUQK-UHFFFAOYSA-N"
"OCc(c4)cc(c(c(O)4)2)C([H])(c(c3)c(c(O)cc3)C(=O)2)C([H])(O1)C(O)C(O)C(O)C(CO)1","InChI=1S/C21H22O9/c22-6-8-4-10-14(21-20(29)19(28)17(26)13(7-23)30-21)9-2-1-3-11(24)15(9)18(27)16(10)12(25)5-8/h1-5,13-14,17,19-26,28-29H,6-7H2/t13-,14+,17-,19+,20-,21+/m1/s1","AFHJQYHRLPMKHU-OSYMLPPYSA-N"
"COc(c1)c(O)c(OC)c(O2)c(C=CC(=O)2)1","InChI=1S/C11H10O5/c1-14-7-5-6-3-4-8(12)16-10(6)11(15-2)9(7)13/h3-5,13H,1-2H3","HOEVRHHMDJKUMZ-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C)(C)C(C2)Oc(c3)c(cc(C=4)c(OC(=O)C4)3)2","InChI=1S/C20H24O9/c1-20(2,29-19-18(25)17(24)16(23)13(8-21)28-19)14-6-10-5-9-3-4-15(22)27-11(9)7-12(10)26-14/h3-5,7,13-14,16-19,21,23-25H,6,8H2,1-2H3/t13-,14-,16-,17+,18-,19+/m1/s1","HXCGUCZXPFBNRD-DNLMCPORSA-N"
"CC(C)=CCc(c(OC)1)c(O2)c(C=CC(=O)2)cc1","InChI=1S/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H3","MBRLOUHOWLUMFF-UHFFFAOYSA-N"
"OC(=O)c(c8)cc(c(c38)C(c(c(C([H])(C([H])(c67)c(c(C(c(c(cc(c7)C(O)=O)O)6)=O)4)cccc4OC(C(O)5)OC(CO)C(C5O)O)3)2)c(ccc2)OC(C(O)1)OC(CO)C(C1O)O)=O)O","InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58)/t23-,24-,25-,26+,31-,32-,35+,36+,37-,38-,41-,42-/m1/s1","IPQVTOJGNYVQEO-AIFLABODSA-N"
"N#CC(c(c3)cccc3)OC(O1)C(O)C(O)C(O)C(COC(O2)C(O)C(O)C(O)C(CO)2)1","InChI=1S/C20H27NO11/c21-6-10(9-4-2-1-3-5-9)30-20-18(28)16(26)14(24)12(32-20)8-29-19-17(27)15(25)13(23)11(7-22)31-19/h1-5,10-20,22-28H,7-8H2/t10-,11+,12+,13+,14+,15-,16-,17+,18+,19+,20+/m0/s1","XUCIJNAGGSZNQT-JHSLDZJXSA-N"
"Oc(c4)cc(O)c(c4)C(C3)Cc(c2)c(O3)c(C=1)c(c2)OC(C)(C)C1","InChI=1S/C20H20O4/c1-20(2)8-7-16-18(24-20)6-3-12-9-13(11-23-19(12)16)15-5-4-14(21)10-17(15)22/h3-8,10,13,21-22H,9,11H2,1-2H3/t13-/m0/s1","LBQIJVLKGVZRIW-ZDUSSCGKSA-N"
"OC(=O)c(c(=O)1)c(O)c(=C2)c(C(C)C(C)O2)c(C)1","InChI=1S/C13H14O5/c1-5-7(3)18-4-8-9(5)6(2)11(14)10(12(8)15)13(16)17/h4-5,7,15H,1-3H3,(H,16,17)/t5-,7-/m1/s1","CQIUKKVOEOPUDV-IYSWYEEDSA-N"
"OCC=Cc(c1)cc(OC)c(OC(O2)C(O)C(O)C(O)C(CO)2)c(OC)1","InChI=1S/C17H24O9/c1-23-10-6-9(4-3-5-18)7-11(24-2)16(10)26-17-15(22)14(21)13(20)12(8-19)25-17/h3-4,6-7,12-15,17-22H,5,8H2,1-2H3/b4-3+/t12-,13-,14+,15-,17+/m1/s1","QJVXKWHHAMZTBY-GCPOEHJPSA-N"
"","InChI=1S/C48H78O17/c1-22-30(51)32(53)36(57)40(61-22)65-38-24(20-59-39-35(56)33(54)31(52)23(19-49)62-39)63-41(37(58)34(38)55)64-29-11-12-44(6)25(43(29,4)5)9-13-45(7)26(44)10-14-48-27-17-42(2,3)15-16-47(27,21-60-48)28(50)18-46(45,48)8/h10,14,22-41,49-58H,9,11-13,15-21H2,1-8H3/t22-,23+,24+,25-,26+,27+,28-,29-,30-,31+,32+,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45+,46-,47+,48-/m0/s1","VJEMOEYSQDKAQF-JDRYWMLESA-N"
"C(C([H])54)(C1)(C)C([H])(CCC4(C(C7)(C(O8)(C(C(C8)6C(O)7)(CC(CC6)(C)C)[H])C=C5)C)C)C(C(OC(O3)([H])C(C(C(C3C)O)OC(C(O)2)(OC(C(C2O)O)CO)[H])O)C1)(C)CO","InChI=1S/C42H68O13/c1-21-28(46)33(55-34-31(49)30(48)29(47)22(18-43)53-34)32(50)35(52-21)54-27-10-11-37(4)23(38(27,5)19-44)8-12-39(6)24(37)9-13-42-25-16-36(2,3)14-15-41(25,20-51-42)26(45)17-40(39,42)7/h9,13,21-35,43-50H,8,10-12,14-20H2,1-7H3/t21-,22-,23-,24-,25-,26-,27+,28+,29-,30+,31-,32-,33+,34+,35+,37+,38+,39-,40+,41-,42+/m1/s1","KYWSCMDFVARMPN-LCSVLAELSA-N"
"O=C(C=2)c(c(O)1)c(OC2c(c3)cc(c(c54)c(O)cc(O)c4C(=O)C=C(c(c6)ccc(c6)O)O5)c(O)c3)cc(O)c1","InChI=1S/C30H18O10/c31-15-4-1-13(2-5-15)24-12-23(38)29-21(36)10-20(35)27(30(29)40-24)17-7-14(3-6-18(17)33)25-11-22(37)28-19(34)8-16(32)9-26(28)39-25/h1-12,31-36H","YUSWMAULDXZHPY-UHFFFAOYSA-N"
"COc(c3)cc(O1)c(c(OC)3)C(=O)C(O)=C1c(c2)cc(OC)c(OC)c2","InChI=1S/C19H18O7/c1-22-11-8-14(25-4)16-15(9-11)26-19(18(21)17(16)20)10-5-6-12(23-2)13(7-10)24-3/h5-9,21H,1-4H3","AAASNKNLMQBKFV-UHFFFAOYSA-N"
"COc(c1)c(OC)c(OC)c(C(=O)2)c1OC(c(c3)cccc3)=C2","InChI=1S/C18H16O5/c1-20-15-10-14-16(18(22-3)17(15)21-2)12(19)9-13(23-14)11-7-5-4-6-8-11/h4-10H,1-3H3","HJNJAUYFFFOFBW-UHFFFAOYSA-N"
"COc(c(O)3)cc(cc3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C16H12O6/c1-21-14-4-8(2-3-10(14)18)13-7-12(20)16-11(19)5-9(17)6-15(16)22-13/h2-7,17-19H,1H3","SCZVLDHREVKTSH-UHFFFAOYSA-N"
"COc(c1)c(OC)c(O)c(C(=O)3)c1OC(=C3)c(c2)cc(O)c(O)c2","InChI=1S/C17H14O7/c1-22-14-7-13-15(16(21)17(14)23-2)11(20)6-12(24-13)8-3-4-9(18)10(19)5-8/h3-7,18-19,21H,1-2H3","IMEYGBIXGJLUIS-UHFFFAOYSA-N"
"OCC(O1)C(O)C(O)C(O)C(Oc(c4)ccc(c4)C(=C3)Oc(c2)c(C(=O)3)c(O)c(OC)c(OC)2)1","InChI=1S/C23H24O11/c1-30-15-8-14-17(19(27)22(15)31-2)12(25)7-13(33-14)10-3-5-11(6-4-10)32-23-21(29)20(28)18(26)16(9-24)34-23/h3-8,16,18,20-21,23-24,26-29H,9H2,1-2H3/t16-,18-,20+,21-,23-/m1/s1","RETJLKUBHXTIGH-FZFRBNDOSA-N"
"COc(c3)c(O)cc(c3)C(=C1)Oc(c2)c(c(O)cc(O)2)C(=O)1","InChI=1S/C16H12O6/c1-21-13-3-2-8(4-10(13)18)14-7-12(20)16-11(19)5-9(17)6-15(16)22-14/h2-7,17-19H,1H3","MBNGWHIJMBWFHU-UHFFFAOYSA-N"
"c(OC)(c(C(O5)C(C(C(C5CO)O)O)OC([H])(C(O)4)OC(C)C(O)C(O)4)1)cc(O2)c(C(=O)C=C2c(c3)ccc(OC)c3)c(O)1","InChI=1S/C29H34O14/c1-11-21(32)24(35)26(37)29(40-11)43-28-25(36)22(33)18(10-30)42-27(28)20-16(39-3)9-17-19(23(20)34)14(31)8-15(41-17)12-4-6-13(38-2)7-5-12/h4-9,11,18,21-22,24-30,32-37H,10H2,1-3H3/t11-,18+,21-,22+,24+,25-,26+,27-,28+,29-/m0/s1","OXTGLFRGBDFBHI-ZXWKGARDSA-N"
"Oc(c14)c(C(C(O)5)OC(CO)C(O)C5O)c(OC)cc(OC(=CC4=O)c(c2)ccc(OC(O3)C(O)C(O)C(O)C3CO)c2)1","InChI=1S/C28H32O15/c1-39-14-7-15-18(22(34)19(14)27-25(37)23(35)20(32)16(8-29)42-27)12(31)6-13(41-15)10-2-4-11(5-3-10)40-28-26(38)24(36)21(33)17(9-30)43-28/h2-7,16-17,20-21,23-30,32-38H,8-9H2,1H3/t16-,17-,20-,21-,23+,24+,25-,26-,27+,28-/m1/s1","QLOUGKRWTZAXFE-JFECCKQBSA-N"
"","InChI=1S/C30H48O4/c1-25(2)13-15-30(24(33)34)16-14-28(5)19(20(30)17-25)7-8-22-26(3)11-10-23(32)27(4,18-31)21(26)9-12-29(22,28)6/h7,20-23,31-32H,8-18H2,1-6H3,(H,33,34)/t20-,21+,22+,23-,26-,27-,28+,29+,30-/m0/s1","PGOYMURMZNDHNS-MYPRUECHSA-N"
"OCC(O1)C(O)C(O)C(O)C(Oc(c4)ccc(c4)C(C2)Oc(c3)c(ccc(O)3)C(=O)2)1","InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2/t15-,17+,18+,19-,20+,21+/m0/s1","DEMKZLAVQYISIA-ZRWXNEIDSA-N"
"OCC(C(O)4)OC(C(O)C(O)4)c(c(O)3)c(O)c(C(=O)1)c(c3)Oc(c2)c(cc(O)c(O)2)1","InChI=1S/C19H18O11/c20-4-11-15(25)17(27)18(28)19(30-11)12-8(23)3-10-13(16(12)26)14(24)5-1-6(21)7(22)2-9(5)29-10/h1-3,11,15,17-23,25-28H,4H2/t11-,15-,17+,18-,19+/m1/s1","AEDDIBAIWPIIBD-ZJKJAXBQSA-N"
"Oc(c3)cc(O)c(c3)C(O1)=C(O)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C15H10O7/c16-6-1-2-8(9(18)3-6)15-14(21)13(20)12-10(19)4-7(17)5-11(12)22-15/h1-5,16-19,21H","YXOLAZRVSSWPPT-UHFFFAOYSA-N"
"c(O)(c3)c(C(=O)2)c(cc3OC(O4)C(O)C(O)C(O)C(COC(O5)C(O)C(C(C5C)O)O)4)OC(C2)c(c1)ccc(OC)c1","InChI=1S/C28H34O14/c1-11-21(31)23(33)25(35)27(39-11)38-10-19-22(32)24(34)26(36)28(42-19)40-14-7-15(29)20-16(30)9-17(41-18(20)8-14)12-3-5-13(37-2)6-4-12/h3-8,11,17,19,21-29,31-36H,9-10H2,1-2H3/t11-,17-,19+,21-,22+,23+,24-,25+,26+,27+,28+/m0/s1","RMCRQBAILCLJGU-HIBKWJPLSA-N"
"","InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,27-,28+,29+,30-/m0/s1","MIJYXULNPSFWEK-GTOFXWBISA-N"
"c(c3)(c1c(c(c3OC(O4)C(O)C(O)C(O)C(COC(O5)C(O)C(C(C5C)O)O)4)OC)O)OC(c(c2)ccc(OC)c2)=CC1=O","InChI=1S/C29H34O15/c1-11-20(31)23(34)25(36)28(41-11)40-10-18-21(32)24(35)26(37)29(44-18)43-17-9-16-19(22(33)27(17)39-3)14(30)8-15(42-16)12-4-6-13(38-2)7-5-12/h4-9,11,18,20-21,23-26,28-29,31-37H,10H2,1-3H3/t11-,18+,20-,21+,23+,24-,25+,26+,28+,29+/m0/s1","DUXQKCCELUKXOE-CBBZIXHGSA-N"
"Oc(c2)ccc(c2)CCC(=O)c(c(O)1)c(O)cc(O)c1","InChI=1S/C15H14O5/c16-10-4-1-9(2-5-10)3-6-12(18)15-13(19)7-11(17)8-14(15)20/h1-2,4-5,7-8,16-17,19-20H,3,6H2","VGEREEWJJVICBM-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(=C2)Oc(c(OC)1)c(C(=O)2)c(OC)c(OC)c(OC)1","InChI=1S/C20H20O7/c1-22-12-8-6-11(7-9-12)14-10-13(21)15-16(23-2)18(24-3)20(26-5)19(25-4)17(15)27-14/h6-10H,1-5H3","ULSUXBXHSYSGDT-UHFFFAOYSA-N"
"Oc(c4)c(O)cc(c4)C(O1)=C(OC(O3)C(O)C(O)C(O)C3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C20H18O11/c21-8-4-11(24)14-13(5-8)30-18(7-1-2-9(22)10(23)3-7)19(16(14)27)31-20-17(28)15(26)12(25)6-29-20/h1-5,12,15,17,20-26,28H,6H2/t12-,15+,17+,20-/m0/s1","PZZRDJXEMZMZFD-QFZSKUSHSA-N"
"COc(c3)ccc(c3)C(=C2)Oc(c1)c(C(=O)2)c(OC(C)=O)cc(OC(C)=O)1","InChI=1S/C20H16O7/c1-11(21)25-15-8-18(26-12(2)22)20-16(23)10-17(27-19(20)9-15)13-4-6-14(24-3)7-5-13/h4-10H,1-3H3","VYHHSBHXZVSILO-UHFFFAOYSA-N"
"COc(c(OC)5)cc(cc(OC)5)C(c21)C([H])(C(=O)4)C([H])(CO4)Cc(cc(O3)c(OC3)c2)1","InChI=1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3/t13-,19+,20-/m0/s1","ZGLXUQQMLLIKAN-SVIJTADQSA-N"
"COc(c(O)3)c(OC)c(C(=O)2)c(c3)OC(=C2)c(c1)cccc1","InChI=1S/C17H14O5/c1-20-16-12(19)9-14-15(17(16)21-2)11(18)8-13(22-14)10-6-4-3-5-7-10/h3-9,19H,1-2H3","QMQAOYFHVBKQCG-UHFFFAOYSA-N"
"c(O)(c1)cc(O)c(C3=O)c1OC(C3c(c54)c(O)cc(O)c4C(C=C(c(c6)ccc(O)c6O)O5)=O)c(c2)ccc(c2)O","InChI=1S/C30H20O11/c31-14-4-1-12(2-5-14)29-27(28(39)25-18(35)8-15(32)9-23(25)41-29)26-20(37)10-19(36)24-21(38)11-22(40-30(24)26)13-3-6-16(33)17(34)7-13/h1-11,27,29,31-37H/t27-,29+/m1/s1","GFWPWSNIXRDQJC-PXJZQJOASA-N"
"C(C5O)(CO)OC(C5O)OCC(O1)C(C(C(C1Oc(c4)cc(O2)c(c4O)C(C=C2c(c3)cc(O)c(OC)c3)=O)O)O)O","InChI=1S/C27H30O15/c1-37-15-3-2-10(4-12(15)29)16-7-14(31)20-13(30)5-11(6-17(20)40-16)39-27-25(36)23(34)22(33)19(42-27)9-38-26-24(35)21(32)18(8-28)41-26/h2-7,18-19,21-30,32-36H,8-9H2,1H3/t18-,19+,21-,22+,23-,24+,25+,26+,27+/m0/s1","GHYGFLACCCIQKR-FZDLENLWSA-N"
"","InChI=1S/C48H76O19/c1-43(2)14-16-48(42(61)67-40-35(58)31(54)29(52)24(20-50)63-40)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(33(56)32(55)36(65-41)38(59)60)66-39-34(57)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-58H,9-20H2,1-7H3,(H,59,60)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32-,33-,34+,35+,36-,37+,39-,40-,41+,45-,46+,47+,48-/m0/s1","NFZYDZXHKFHPGA-QQHDHSITSA-N"
"","InChI=1S/C47H80O17/c1-22(2)10-9-14-47(8,58)23-11-16-46(7)31(23)24(49)18-29-44(5)15-13-30(43(3,4)28(44)12-17-45(29,46)6)63-42-39(64-41-38(57)35(54)33(52)26(19-48)61-41)36(55)34(53)27(62-42)21-60-40-37(56)32(51)25(50)20-59-40/h10,23-42,48-58H,9,11-21H2,1-8H3/t23-,24+,25+,26+,27+,28-,29+,30-,31-,32-,33+,34+,35-,36-,37+,38+,39+,40-,41-,42-,44-,45+,46+,47-/m0/s1","ZICDJKZDHVLVOD-HUGMCNGHSA-N"
"","InChI=1S/C47H74O18/c1-42(2)14-16-47(41(59)65-39-33(55)30(52)28(50)23(19-48)61-39)17-15-45(6)21(22(47)18-42)8-9-26-44(5)12-11-27(43(3,4)25(44)10-13-46(26,45)7)62-40-34(56)31(53)35(36(64-40)37(57)58)63-38-32(54)29(51)24(20-49)60-38/h8,22-36,38-40,48-56H,9-20H2,1-7H3,(H,57,58)/t22-,23+,24-,25-,26+,27-,28+,29-,30-,31+,32+,33+,34+,35-,36-,38-,39-,40+,44-,45+,46+,47-/m0/s1","KQSFNXMDCOFFGW-GNDIVNLPSA-N"
"OC(=O)c(c8)cc(c(c38)C(c(c(C([H])(C([H])(c67)c(c(C(c(c(cc(c7)C(O)=O)O)6)=O)4)cccc4OC(C(O)5)OC(CO)C(C5O)O)3)2)c(ccc2)OC(C(O)1)OC(CO)C(C1O)O)=O)O","InChI=1S/C42H38O20/c43-11-23-31(47)35(51)37(53)41(61-23)59-21-5-1-3-15-25(17-7-13(39(55)56)9-19(45)27(17)33(49)29(15)21)26-16-4-2-6-22(60-42-38(54)36(52)32(48)24(12-44)62-42)30(16)34(50)28-18(26)8-14(40(57)58)10-20(28)46/h1-10,23-26,31-32,35-38,41-48,51-54H,11-12H2,(H,55,56)(H,57,58)/t23-,24-,25-,26-,31-,32-,35+,36+,37-,38-,41-,42-/m1/s1","IPQVTOJGNYVQEO-KGFNBKMBSA-N"
"C(C721)(CCC(C(C)57)(C(C6)(C4([H])CC(O6)=O)C(CC5=O)([H])C(C)(C)O4)[H])(C(c(c3)coc3)OC(=O)C(O2)1)C","InChI=1S/C26H30O8/c1-22(2)15-9-16(27)24(4)14(25(15)12-31-18(28)10-17(25)33-22)5-7-23(3)19(13-6-8-30-11-13)32-21(29)20-26(23,24)34-20/h6,8,11,14-15,17,19-20H,5,7,9-10,12H2,1-4H3/t14-,15-,17-,19-,20+,23-,24-,25+,26+/m0/s1","KBDSLGBFQAGHBE-MSGMIQHVSA-N"
"Oc(c3)ccc(c3)C(O1)Cc(c2)c(c(O)cc2)C(=O)1","InChI=1S/C15H12O4/c16-11-6-4-9(5-7-11)13-8-10-2-1-3-12(17)14(10)15(18)19-13/h1-7,13,16-17H,8H2/t13-/m1/s1","DGKDFNDHPXVXHW-CYBMUJFWSA-N"
"OCC(O1)C(O)C(O)C(O)C1Oc(c2)c(OC)c(O)c(C(=O)3)c(OC=C(c(c4)cc(OC)c(OC)c(O)4)3)2","InChI=1S/C24H26O13/c1-32-13-5-9(4-11(26)22(13)33-2)10-8-35-12-6-14(23(34-3)19(29)16(12)17(10)27)36-24-21(31)20(30)18(28)15(7-25)37-24/h4-6,8,15,18,20-21,24-26,28-31H,7H2,1-3H3/t15-,18-,20+,21-,24-/m1/s1","LNQCUTNLHUQZLR-OZJWLQQPSA-N"
"COc(c4)c(O)cc(c4)C(=C3)C(=O)c(c(O)1)c(O3)cc(OC(O2)C(O)C(O)C(O)C(CO)2)c(OC)1","InChI=1S/C23H24O12/c1-31-12-4-3-9(5-11(12)25)10-8-33-13-6-14(22(32-2)19(28)16(13)17(10)26)34-23-21(30)20(29)18(27)15(7-24)35-23/h3-6,8,15,18,20-21,23-25,27-30H,7H2,1-2H3/t15-,18-,20+,21-,23-/m1/s1","HFODKTZIQVSGJO-ZTATXHNCSA-N"
"Oc(c4)ccc(c4)C(O1)C(OC([H])(O3)C(O)C(O)C(O)C(C)3)C(=O)c(c(O)2)c(cc(O)c2)1","InChI=1S/C21H22O10/c1-8-15(25)17(27)18(28)21(29-8)31-20-16(26)14-12(24)6-11(23)7-13(14)30-19(20)9-2-4-10(22)5-3-9/h2-8,15,17-25,27-28H,1H3/t8-,15-,17+,18+,19+,20+,21-/m0/s1","VQUPQWGKORWZII-RPJYBVRZSA-N"
"OCC(O1)C(O)C(O)C(O)C1OC(C(=O)3)=C(Oc(c4)c(c(O)cc(O)4)3)c(c2)cc(O)c(O)c2","InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18+,21-/m0/s1","OVSQVDMCBVZWGM-LVWULRLVSA-N"
"OCC(O1)C(O)C(O)C1OC(C(=O)2)=C(c(c4)ccc(O)c4)Oc(c3)c(c(O)cc(O)3)2","InChI=1S/C20H18O10/c21-7-13-15(25)17(27)20(29-13)30-19-16(26)14-11(24)5-10(23)6-12(14)28-18(19)8-1-3-9(22)4-2-8/h1-6,13,15,17,20-25,27H,7H2/t13-,15-,17+,20-/m0/s1","POQICXMTUPVZMX-UXYNSRGZSA-N"
"c(c5)(O)cc(c(c51)C(C(OC(O4)C(C(C(C4CO)O)O)OC(O3)(C(C(C(C3C)O)O)O)[H])=C(c(c2)ccc(O)c2)O1)=O)O","InChI=1S/C27H30O15/c1-9-17(32)20(35)22(37)26(38-9)42-25-21(36)18(33)15(8-28)40-27(25)41-24-19(34)16-13(31)6-12(30)7-14(16)39-23(24)10-2-4-11(29)5-3-10/h2-7,9,15,17-18,20-22,25-33,35-37H,8H2,1H3/t9-,15+,17-,18+,20+,21-,22+,25+,26-,27-/m0/s1","OHOBPOYHROOXEI-JWMUNMLDSA-N"
"CC(=O)Oc(c3)ccc(c3)C(=C2)Oc(c1)c(C(=O)2)c(OC(C)=O)c(OC)c(OC(C)=O)1","InChI=1S/C22H18O9/c1-11(23)28-15-7-5-14(6-8-15)17-9-16(26)20-18(31-17)10-19(29-12(2)24)21(27-4)22(20)30-13(3)25/h5-10H,1-4H3","HIOZFEXHRPPNDN-UHFFFAOYSA-N"
"COc(c3)ccc(c3)C(=C2)Oc(c1)c(C(=O)2)c(O)c(OC)c(OC)1","InChI=1S/C18H16O6/c1-21-11-6-4-10(5-7-11)13-8-12(19)16-14(24-13)9-15(22-2)18(23-3)17(16)20/h4-9,20H,1-3H3","QCDYOIZVELGOLZ-UHFFFAOYSA-N"
"CC(=O)Oc(c3)ccc(c3)C(=C2)Oc(c1)c(C(=O)2)c(OC(C)=O)c(OC(C)=O)c(OC(C)=O)1","InChI=1S/C23H18O10/c1-11(24)29-16-7-5-15(6-8-16)18-9-17(28)21-19(33-18)10-20(30-12(2)25)22(31-13(3)26)23(21)32-14(4)27/h5-10H,1-4H3","SRVJEQWEVJCHCF-UHFFFAOYSA-N"
"C[C@H](CCC[C@H](C)CCCC(C)C)CCC[C@@H](C)CCOC[C@H](COP(=O)(O)OC[C@H](C(=O)O)N)OCC[C@H](C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C","InChI=1S/C46H94NO8P/c1-36(2)17-11-19-38(5)21-13-23-40(7)25-15-27-42(9)29-31-52-33-44(34-54-56(50,51)55-35-45(47)46(48)49)53-32-30-43(10)28-16-26-41(8)24-14-22-39(6)20-12-18-37(3)4/h36-45H,11-35,47H2,1-10H3,(H,48,49)(H,50,51)/t38-,39-,40-,41-,42-,43-,44-,45-/m1/s1","REWAKYJADCBFMU-UFSSTKFDSA-N"
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"OC(=O)[C@H](C3)c(c2)n(C3)c(c2)C(=O)c(c1)cccc1","InChI=1S/C15H13NO3/c17-14(10-4-2-1-3-5-10)13-7-6-12-11(15(18)19)8-9-16(12)13/h1-7,11H,8-9H2,(H,18,19)/t11-/m1/s1","OZWKMVRBQXNZKK-LLVKDONJSA-N"
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"COC1=CC=CC=C1CC(CC2=NC3=CC=CC=C3N2)C4=NC5=CC=CC=C5N4","InChI=1S/C24H22N4O/c1-29-22-13-7-2-8-16(22)14-17(24-27-20-11-5-6-12-21(20)28-24)15-23-25-18-9-3-4-10-19(18)26-23/h2-13,17H,14-15H2,1H3,(H,25,26)(H,27,28)","FQFJIJMMCVBRBL-UHFFFAOYSA-N"
"CC1=CC=C(C=C1)CC(CC2=NC3=CC=CC=C3N2)C4=NC5=CC=CC=C5N4","InChI=1S/C24H22N4/c1-16-10-12-17(13-11-16)14-18(24-27-21-8-4-5-9-22(21)28-24)15-23-25-19-6-2-3-7-20(19)26-23/h2-13,18H,14-15H2,1H3,(H,25,26)(H,27,28)","GAODIMGJPXDDHA-UHFFFAOYSA-N"
"CC(C)(C(COC1=CC=CC2=C1N(C(=O)C=C2OC)C)O)O","InChI=1S/C16H21NO5/c1-16(2,20)13(18)9-22-11-7-5-6-10-12(21-4)8-14(19)17(3)15(10)11/h5-8,13,18,20H,9H2,1-4H3","IUPYLWAXGAJZQC-UHFFFAOYSA-N"
"COC1=C(C2=C(C=C1)C(=C3C=COC3=N2)OC)OC","InChI=1S/C14H13NO4/c1-16-10-5-4-8-11(13(10)18-3)15-14-9(6-7-19-14)12(8)17-2/h4-7H,1-3H3","SLSIBLKBHNKZTB-UHFFFAOYSA-N"
"C/C(=C\COC1=CC(=O)NC2=CC=CC=C21)/CCC(C(C)(C)O)O","InChI=1S/C19H25NO4/c1-13(8-9-17(21)19(2,3)23)10-11-24-16-12-18(22)20-15-7-5-4-6-14(15)16/h4-7,10,12,17,21,23H,8-9,11H2,1-3H3,(H,20,22)/b13-10+","PBWIOAMUZKICDN-JLHYYAGUSA-N"
"CC1(C=CC2=C(O1)C3=C(C=CC(=C3)OC)NC2=O)C","InChI=1S/C15H15NO3/c1-15(2)7-6-10-13(19-15)11-8-9(18-3)4-5-12(11)16-14(10)17/h4-8H,1-3H3,(H,16,17)","IXRKDGGGFFCRIR-UHFFFAOYSA-N"
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"CC1CC2(C3C(C1(COC3C4=CC=CC=C4O2)COC(=O)NC5=CC=CC=C5)C)C","InChI=1S/C25H29NO4/c1-16-13-24(3)21-17(2)25(16,15-29-23(27)26-18-9-5-4-6-10-18)14-28-22(21)19-11-7-8-12-20(19)30-24/h4-12,16-17,21-22H,13-15H2,1-3H3,(H,26,27)","UONFBIWUOHBYQS-UHFFFAOYSA-N"
"C=CC1CN2CCC1CC2C(C3=CC=NC4=CC=CC=C34)O","InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2","KMPWYEUPVWOPIM-UHFFFAOYSA-N"
"CCC12CCCN3C1C4(CC3)C(CC2)N(C5=C4C=CC(=C5O)OC)C(=O)C","InChI=1S/C22H30N2O3/c1-4-21-9-5-12-23-13-11-22(20(21)23)15-6-7-16(27-3)19(26)18(15)24(14(2)25)17(22)8-10-21/h6-7,17,20,26H,4-5,8-13H2,1-3H3","CITPXCNSMZMNIW-UHFFFAOYSA-N"
"CN[C@H]1[C@H]2CN3[C@@H]1C(O2)CC3","InChI=1S/C8H14N2O/c1-9-7-6-4-10-3-2-5(11-6)8(7)10/h5-9H,2-4H2,1H3/t5?,6-,7+,8-/m1/s1","OPMNROCQHKJDAQ-KTUCCBJNSA-N"
"C1CCN2CC3CC(C2C1)CN4C3CCCC4","InChI=1S/C15H26N2/c1-3-7-16-11-13-9-12(14(16)5-1)10-17-8-4-2-6-15(13)17/h12-15H,1-11H2","SLRCCWJSBJZJBV-UHFFFAOYSA-N"
"C1[C@@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=CC=C3","InChI=1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2/t13-/m1/s1","URFCJEUYXNAHFI-CYBMUJFWSA-N"
"CC(=O)OC1=C(C=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)OC(=O)C)OC(=O)C)OC(=O)C","InChI=1S/C23H18O10/c1-11(24)29-16-8-21(32-14(4)27)23-17(28)10-19(33-22(23)9-16)15-5-6-18(30-12(2)25)20(7-15)31-13(3)26/h5-10H,1-4H3","MABQMQKDSPCURQ-UHFFFAOYSA-N"
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"CC(=CCC1=C(C=C(C2=C1OC(CC2=O)C3=CC=CC=C3)O)O)C","InChI=1S/C20H20O4/c1-12(2)8-9-14-15(21)10-16(22)19-17(23)11-18(24-20(14)19)13-6-4-3-5-7-13/h3-8,10,18,21-22H,9,11H2,1-2H3","DAWSYIQAGQMLFS-UHFFFAOYSA-N"
"CN1C=CC(=C(C1=O)C#N)OC","InChI=1S/C8H8N2O2/c1-10-4-3-7(12-2)6(5-9)8(10)11/h3-4H,1-2H3","PETSAYFQSGAEQY-UHFFFAOYSA-N"
"COC1=C(C(=C2C(=C1)C=CC(=O)O2)O)O","InChI=1S/C10H8O5/c1-14-6-4-5-2-3-7(11)15-10(5)9(13)8(6)12/h2-4,12-13H,1H3","HAVWRBANWNTOJX-UHFFFAOYSA-N"
"COC1=C(C=C2C(=C1)C=C(C(=O)O2)OC3=CC4=C(C=C3)C=CC(=O)O4)O","InChI=1S/C19H12O7/c1-23-16-6-11-7-17(19(22)26-15(11)9-13(16)20)24-12-4-2-10-3-5-18(21)25-14(10)8-12/h2-9,20H,1H3","JRHMMVBOTXEHGJ-UHFFFAOYSA-N"
"COC1C(CC2CN3CCC4=C(C3CC2C1C(=O)OC)NC5=C4C=CC(=C5)OC)OC(=O)C6=CC(=C(C(=C6)OC)OC)OC","InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3","QEVHRUUCFGRFIF-UHFFFAOYSA-N"
"CC(=CCOC1=C(C=C2C=CC(=O)OC2=C1O)OC)C","InChI=1S/C15H16O5/c1-9(2)6-7-19-15-11(18-3)8-10-4-5-12(16)20-14(10)13(15)17/h4-6,8,17H,7H2,1-3H3","QJZRVRVZRIXGMR-UHFFFAOYSA-N"
"COC1=C(C=C2C(=C1)[C@H]3[C@@H](CO2)OC4=C(C3=O)C=CC5=C4C[C@@H](O5)C(=C)CO)OC","InChI=1S/C23H22O7/c1-11(9-24)16-7-14-15(29-16)5-4-12-22(25)21-13-6-18(26-2)19(27-3)8-17(13)28-10-20(21)30-23(12)14/h4-6,8,16,20-21,24H,1,7,9-10H2,2-3H3/t16-,20-,21+/m1/s1","ZJMLELXRQUXRIU-HBGVWJBISA-N"
"CC(=O)OC1=C(C=CC(=C1)C2=C(C(=O)C3=C(C(=C(C=C3O2)OC)OC(=O)C)OC)OC)OC","InChI=1S/C23H22O10/c1-11(24)31-15-9-13(7-8-14(15)27-3)20-23(30-6)19(26)18-16(33-20)10-17(28-4)21(22(18)29-5)32-12(2)25/h7-10H,1-6H3","FWZKNPRCZCUJMQ-UHFFFAOYSA-N"
"COC1=C(C=C2C(=C1)C3=C(CO2)OC4=C(C3=O)C=CC5=C4CC(O5)C(=C)CO)OC","InChI=1S/C23H20O7/c1-11(9-24)16-7-14-15(29-16)5-4-12-22(25)21-13-6-18(26-2)19(27-3)8-17(13)28-10-20(21)30-23(12)14/h4-6,8,16,24H,1,7,9-10H2,2-3H3","ZHDJHNSKUYZDCF-UHFFFAOYSA-N"
"CC(=O)OCC1C(C(C(C(O1)OC2=C(C3=C(C=C2)OC=C(C3=O)C4=CC=C(C=C4)OC)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C","InChI=1S/C32H32O15/c1-15(33)40-14-25-29(43-17(3)35)30(44-18(4)36)31(45-19(5)37)32(47-25)46-24-12-11-23-26(28(24)42-16(2)34)27(38)22(13-41-23)20-7-9-21(39-6)10-8-20/h7-13,25,29-32H,14H2,1-6H3","RFTHIXXAUSTEOS-UHFFFAOYSA-N"
"C1=CC(=CC(=C1)O)C2=CC(=O)C3=C(O2)C=C(C=C3)O","InChI=1S/C15H10O4/c16-10-3-1-2-9(6-10)14-8-13(18)12-5-4-11(17)7-15(12)19-14/h1-8,16-17H","DYARIVMCYYQNNQ-UHFFFAOYSA-N"
"CC1=C(C(=C(C2=C1COC2=O)O)CC=C(C)CCC(=O)O)OC","InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)","HPNSFSBZBAHARI-UHFFFAOYSA-N"
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"CC1=C(C(=C2C(=C1O)C3(C(=CC(=O)C(C3=O)C(=O)C)O2)C)C(=O)C)O","InChI=1S/C18H16O7/c1-6-14(22)12(8(3)20)16-13(15(6)23)18(4)10(25-16)5-9(21)11(7(2)19)17(18)24/h5,11,22-23H,1-4H3","CUCUKLJLRRAKFN-UHFFFAOYSA-N"
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"CC1=CC2=C(C=C1)OC(=C(C2=O)O)C3=CC=CC=C3","InChI=1S/C16H12O3/c1-10-7-8-13-12(9-10)14(17)15(18)16(19-13)11-5-3-2-4-6-11/h2-9,18H,1H3","KLGALCMPMFKGDQ-UHFFFAOYSA-N"
"COC1=C(OC2=C(C1=O)C=CC3=C2C=CO3)C4=CC=CC=C4","InChI=1S/C18H12O4/c1-20-18-15(19)13-7-8-14-12(9-10-21-14)17(13)22-16(18)11-5-3-2-4-6-11/h2-10H,1H3","LKPQNZRGGNOPPU-UHFFFAOYSA-N"
"C1=CC(=CC=C1C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O)O","InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)15-14(19)13(18)11-6-5-10(17)7-12(11)20-15/h1-7,16-17,19H","OBWHQJYOOCRPST-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(=O)C(=C(O2)C3=CC(=CC=C3)O)O","InChI=1S/C15H10O4/c16-10-5-3-4-9(8-10)15-14(18)13(17)11-6-1-2-7-12(11)19-15/h1-8,16,18H","QZESEGHSLFKZIV-UHFFFAOYSA-N"
"COC1=CC=CC(=C1)C2=C(C(=O)C3=CC=CC=C3O2)O","InChI=1S/C16H12O4/c1-19-11-6-4-5-10(9-11)16-15(18)14(17)12-7-2-3-8-13(12)20-16/h2-9,18H,1H3","GYLGASXCHFNKHD-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C=CC3=C2OC(=CC3=O)C4=CC=CC=C4O","InChI=1S/C19H12O3/c20-16-8-4-3-7-14(16)18-11-17(21)15-10-9-12-5-1-2-6-13(12)19(15)22-18/h1-11,20H","ZKMLQDNHMSFULN-UHFFFAOYSA-N"
"CC1=C(OC2=C(C1=O)C=CC(=C2)O)C3=CC=CC=C3","InChI=1S/C16H12O3/c1-10-15(18)13-8-7-12(17)9-14(13)19-16(10)11-5-3-2-4-6-11/h2-9,17H,1H3","SUNCCQBNDWHMPR-UHFFFAOYSA-N"
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"CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O","InChI=1S/C20H16N2O4/c1-2-20(25)14-8-16-17-12(7-11-5-3-4-6-15(11)21-17)9-22(16)18(23)13(14)10-26-19(20)24/h3-8,25H,2,9-10H2,1H3","VSJKWCGYPAHWDS-UHFFFAOYSA-N"
"CC1CC(=O)C=C(C12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)OC","InChI=1S/C17H17ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h6-8H,5H2,1-4H3","DDUHZTYCFQRHIY-UHFFFAOYSA-N"
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"CCC1C2CC3C4C5(CC(C2C5O)N3C1O)C6=CC=CC=C6N4C","InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3","CJDRUOGAGYHKKD-UHFFFAOYSA-N"
"C1=COC(=C1)CNC2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O","InChI=1S/C15H17N5O5/c21-5-9-11(22)12(23)15(25-9)20-7-19-10-13(17-6-18-14(10)20)16-4-8-2-1-3-24-8/h1-3,6-7,9,11-12,15,21-23H,4-5H2,(H,16,17,18)/t9-,11-,12-,15-/m1/s1","CAGLGYNQQSIUGX-SDBHATRESA-N"
"CC1C2C(CC(=C3C(C2OC1=O)C(=CC3=O)C)C)O","InChI=1S/C15H18O4/c1-6-4-10(17)13-8(3)15(18)19-14(13)12-7(2)5-9(16)11(6)12/h5,8,10,12-14,17H,4H2,1-3H3","YMUOZXZDDBRJEP-UHFFFAOYSA-N"
"C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2C[C@H]([C@]4([C@@]3(CC[C@@H]4C5=CC(=O)OC5)O)C)O)O","InChI=1S/C23H34O5/c1-21-7-5-15(24)10-14(21)3-4-17-18(21)11-19(25)22(2)16(6-8-23(17,22)27)13-9-20(26)28-12-13/h9,14-19,24-25,27H,3-8,10-12H2,1-2H3/t14-,15+,16-,17-,18+,19-,21+,22+,23+/m1/s1","SHIBSTMRCDJXLN-KCZCNTNESA-N"
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"CC1C(=O)OC2C1(C34C(=O)OC5C3(C2O)C6(C(C5)C(C)(C)C)C(C(=O)OC6O4)O)O","InChI=1S/C20H24O10/c1-6-12(23)28-11-9(21)18-8-5-7(16(2,3)4)17(18)10(22)13(24)29-15(17)30-20(18,14(25)27-8)19(6,11)26/h6-11,15,21-22,26H,5H2,1-4H3","SQOJOAFXDQDRGF-UHFFFAOYSA-N"
"CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1)C)C(=O)O)C","InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)","MIJYXULNPSFWEK-UHFFFAOYSA-N"
"CN1C2CCC1CC(C2)OC(=O)C(CO)C3=CC=CC=C3","InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3","RKUNBYITZUJHSG-UHFFFAOYSA-N"
"CN1CCC2=CC3=C(C=C2C1C4C5=C(C(=C(C=C5)OC)OC)C(=O)O4)OCO3","InChI=1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3","JZUTXVTYJDCMDU-UHFFFAOYSA-N"
"CC1C(=O)OC2C1(C34C(=O)OC5C3(C2)C6(C(C5)C(C)(C)C)C(C(=O)OC6O4)O)O","InChI=1S/C20H24O9/c1-7-12(22)26-10-6-17-9-5-8(16(2,3)4)18(17)11(21)13(23)28-15(18)29-20(17,14(24)27-9)19(7,10)25/h7-11,15,21,25H,5-6H2,1-4H3","FPUXKXIZEIDQKW-UHFFFAOYSA-N"
"C1CN2CC3=CCOC4CC(=O)N5C6C4C3CC2C61C7=CC=CC=C75","InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2","QMGVPVSNSZLJIA-UHFFFAOYSA-N"
"CC(=C)C1C2C3C4(C(C1C(=O)O2)(CC5C4(O5)C(=O)O3)O)C","InChI=1S/C15H16O6/c1-5(2)7-8-11(16)19-9(7)10-13(3)14(8,18)4-6-15(13,21-6)12(17)20-10/h6-10,18H,1,4H2,2-3H3","PIMZUZSSNYHVCU-UHFFFAOYSA-N"
"C1=CC(=O)OC2=CC3=C(C=CO3)C=C21","InChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6H","ZCCUUQDIBDJBTK-UHFFFAOYSA-N"
"CC(=CCC1=C(C=C2C(=C1O)C(=O)C3=C(C(=C(C=C3O2)O)OC)CC=C(C)C)O)C","InChI=1S/C24H26O6/c1-12(2)6-8-14-16(25)10-19-21(22(14)27)23(28)20-15(9-7-13(3)4)24(29-5)17(26)11-18(20)30-19/h6-7,10-11,25-27H,8-9H2,1-5H3","GNRIZKKCNOBBMO-UHFFFAOYSA-N"
"CC(=CCCC(=CCOC1=C2C=CC(=O)OC2=CC3=C1C=CO3)C)C","InChI=1S/C21H22O4/c1-14(2)5-4-6-15(3)9-11-24-21-16-7-8-20(22)25-19(16)13-18-17(21)10-12-23-18/h5,7-10,12-13H,4,6,11H2,1-3H3","DBMJZOMNXBSRED-UHFFFAOYSA-N"
"CC12C3C4C(C(C1(CC5C2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O","InChI=1S/C15H18O7/c1-12(2,18)6-7-10(16)20-8(6)9-13(3)14(7,19)4-5-15(13,22-5)11(17)21-9/h5-9,18-19H,4H2,1-3H3","RYEFFICCPKWYML-UHFFFAOYSA-N"
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"CCCN1C[C@@H](C[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CSC","InChI=1S/C19H26N2S/c1-3-7-21-11-13(12-22-2)8-16-15-5-4-6-17-19(15)14(10-20-17)9-18(16)21/h4-6,10,13,16,18,20H,3,7-9,11-12H2,1-2H3/t13-,16-,18-/m1/s1","YEHCICAEULNIGD-MZMPZRCHSA-N"
"CC1=CC(=CC(=C1C2=C(C3=C(C=C2N)OC4=CC(=O)C=C(C4=N3)C)C)O)O","InChI=1S/C21H18N2O4/c1-9-4-12(24)6-15(26)18(9)19-11(3)21-17(8-14(19)22)27-16-7-13(25)5-10(2)20(16)23-21/h4-8,24,26H,22H2,1-3H3","NNZHGEUZKBYASA-UHFFFAOYSA-N"
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"C1=CC=C(C(=C1)CO)OC2C(C(C(C(O2)CO)O)O)O","InChI=1S/C13H18O7/c14-5-7-3-1-2-4-8(7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2","NGFMICBWJRZIBI-UHFFFAOYSA-N"
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"CC1=CC(=O)OC2=CC(=CC(=C12)OC)OC","InChI=1S/C12H12O4/c1-7-4-11(13)16-10-6-8(14-2)5-9(15-3)12(7)10/h4-6H,1-3H3","WFSKVHPOKPQJSU-UHFFFAOYSA-N"
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"COC1=CC(=C2C(=O)CC(OC2=C1)C3=CC=CC=C3)OC","InChI=1S/C17H16O4/c1-19-12-8-15(20-2)17-13(18)10-14(21-16(17)9-12)11-6-4-3-5-7-11/h3-9,14H,10H2,1-2H3","IAFBOKYTDSDNHV-UHFFFAOYSA-N"
"CC1=CC2=C(C=C1)OC(=CC2=O)C3=CC(=CC=C3)C","InChI=1S/C17H14O2/c1-11-4-3-5-13(8-11)17-10-15(18)14-9-12(2)6-7-16(14)19-17/h3-10H,1-2H3","JAFAHOKDGKCLNO-UHFFFAOYSA-N"
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"C1=CC2=C(C=C1F)NC=C2CC(C(=O)O)N","InChI=1S/C11H11FN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)","YMEXGEAJNZRQEH-UHFFFAOYSA-N"
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"CN(CCC#N)CC1=CC(=O)OC2=C1C=CC(=C2)OC","InChI=1S/C15H16N2O3/c1-17(7-3-6-16)10-11-8-15(18)20-14-9-12(19-2)4-5-13(11)14/h4-5,8-9H,3,7,10H2,1-2H3","FMDMLXZPCLVWSQ-UHFFFAOYSA-N"
"CCOC1=CC2=C(C=C1)C=C(C(=O)O2)C3=CC=CC=C3Cl","InChI=1S/C17H13ClO3/c1-2-20-12-8-7-11-9-14(17(19)21-16(11)10-12)13-5-3-4-6-15(13)18/h3-10H,2H2,1H3","GIFPGRLKDGPYAR-UHFFFAOYSA-N"
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"CC1=CC2=C(C=C1)OC(=O)C(=C2C)C3=CC=C(C=C3)Cl","InChI=1S/C17H13ClO2/c1-10-3-8-15-14(9-10)11(2)16(17(19)20-15)12-4-6-13(18)7-5-12/h3-9H,1-2H3","RGNMXSPMIDBLKW-UHFFFAOYSA-N"
"CC1=CC=CC(=C1)C2=CC(=O)C3=C(O2)C=CC(=C3)Br","InChI=1S/C16H11BrO2/c1-10-3-2-4-11(7-10)16-9-14(18)13-8-12(17)5-6-15(13)19-16/h2-9H,1H3","VNLPVWHRKKWDQB-UHFFFAOYSA-N"
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"CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(C(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)OC)O)OC)O)O)O)O)O)O","InChI=1S/C29H34O15/c1-11-20(31)23(34)25(36)28(41-11)40-10-18-21(32)24(35)26(37)29(44-18)43-17-9-16-19(22(33)27(17)39-3)14(30)8-15(42-16)12-4-6-13(38-2)7-5-12/h4-9,11,18,20-21,23-26,28-29,31-37H,10H2,1-3H3","DUXQKCCELUKXOE-UHFFFAOYSA-N"
"COC1=C(C=CC(=C1)C2=C(C(=O)C3=C(O2)C(=C(C=C3O)O)OC)O)O","InChI=1S/C17H14O8/c1-23-11-5-7(3-4-8(11)18)15-14(22)13(21)12-9(19)6-10(20)16(24-2)17(12)25-15/h3-6,18-20,22H,1-2H3","IBXCKSUZOFKGSB-UHFFFAOYSA-N"
"COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O)O","InChI=1S/C16H12O6/c1-21-14-4-8(2-3-10(14)18)13-7-12(20)16-11(19)5-9(17)6-15(16)22-13/h2-7,17-19H,1H3","SCZVLDHREVKTSH-UHFFFAOYSA-N"
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"COC1=CC2=CC3=C(C(=C2C=C1OC)C4=CC5=C(C=C4)OCO5)C(=O)OC3","InChI=1S/C21H16O6/c1-23-16-7-12-5-13-9-25-21(22)20(13)19(14(12)8-17(16)24-2)11-3-4-15-18(6-11)27-10-26-15/h3-8H,9-10H2,1-2H3","RTDRYYULUYRTAN-UHFFFAOYSA-N"
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"CC(=O)OC1COC(C(C1OC(=O)C)OC(=O)C)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC=C(C4=O)C5=CC=C(C=C5)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C","InChI=1S/C42H44O22/c1-18(43)55-27-11-9-26(10-12-27)29-15-52-30-13-28(14-31(56-19(2)44)34(30)35(29)51)63-42-40(62-25(8)50)38(60-23(6)48)36(58-21(4)46)33(64-42)17-54-41-39(61-24(7)49)37(59-22(5)47)32(16-53-41)57-20(3)45/h9-15,32-33,36-42H,16-17H2,1-8H3","PWNURKDPPRSGQU-UHFFFAOYSA-N"
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"C1C(OC2=C(C1=O)C=CC(=C2)O)C3=CC=C(C=C3)OC4C(C(C(C(O4)CO)O)O)O","InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2","DEMKZLAVQYISIA-UHFFFAOYSA-N"
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"C1CCN(CC1)C(=O)C=CC=CC2=CC3=C(C=C2)OCO3","InChI=1S/C17H19NO3/c19-17(18-10-4-1-5-11-18)7-3-2-6-14-8-9-15-16(12-14)21-13-20-15/h2-3,6-9,12H,1,4-5,10-11,13H2","MXXWOMGUGJBKIW-UHFFFAOYSA-N"
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"COC1=CC(=C(C(=C1)OC)C(=O)/C=C/C2=CC(=C(C=C2)O)OC)OC","InChI=1S/C19H20O6/c1-22-13-10-17(24-3)19(18(11-13)25-4)15(21)8-6-12-5-7-14(20)16(9-12)23-2/h5-11,20H,1-4H3/b8-6+","BAHHZVVNFAOLAZ-SOFGYWHQSA-N"
"COC1=C(C=C(C=C1)/C=C/C(=O)C2=C(C=C(C=C2OC)OC)OC)OC","InChI=1S/C20H22O6/c1-22-14-11-18(25-4)20(19(12-14)26-5)15(21)8-6-13-7-9-16(23-2)17(10-13)24-3/h6-12H,1-5H3/b8-6+","TVKGYMYAOVADOP-SOFGYWHQSA-N"
"COC1=CC=CC=C1C2=CC(=O)C3=C(O2)C=CC=C3OC","InChI=1S/C17H14O4/c1-19-13-7-4-3-6-11(13)16-10-12(18)17-14(20-2)8-5-9-15(17)21-16/h3-10H,1-2H3","QNKIRTADURZGPG-UHFFFAOYSA-N"
"COC1=CC=CC(=C1)C2=CC(=O)C3=C(O2)C=CC=C3O","InChI=1S/C16H12O4/c1-19-11-5-2-4-10(8-11)15-9-13(18)16-12(17)6-3-7-14(16)20-15/h2-9,17H,1H3","IPQOBEBHJDIMQR-UHFFFAOYSA-N"
"CC(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3","InChI=1S/C18H16O3/c1-12(2)21-14-8-9-15-17(10-14)20-11-16(18(15)19)13-6-4-3-5-7-13/h3-12H,1-2H3","SFBODOKJTYAUCM-UHFFFAOYSA-N"
"CC(C)C(=O)NC1=NC2=C(C(=O)N1)N=CN2[C@H]3C[C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O","InChI=1S/C35H37N5O7/c1-21(2)32(42)38-34-37-31-30(33(43)39-34)36-20-40(31)29-18-27(41)28(47-29)19-46-35(22-8-6-5-7-9-22,23-10-14-25(44-3)15-11-23)24-12-16-26(45-4)17-13-24/h5-17,20-21,27-29,41H,18-19H2,1-4H3,(H2,37,38,39,42,43)/t27-,28+,29+/m0/s1","RMQXDNUKLIDXOS-ZGIBFIJWSA-N"
"C1CC2=C(C1)C(=O)OC3=C4CCCN5C4=C(CCC5)C=C23","InChI=1S/C18H19NO2/c20-18-13-6-1-5-12(13)15-10-11-4-2-8-19-9-3-7-14(16(11)19)17(15)21-18/h10H,1-9H2","LLSRPENMALNOFW-UHFFFAOYSA-N"
"C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@H]([C@@]3([C@@H]4[C@@H](CC[C@@]3(C2)O)[C@]5(CC[C@@H]([C@]5(C[C@H]4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O","InChI=1S/C29H44O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3/t13-,15-,16+,17+,18+,19+,21+,22-,23+,24+,25-,26+,27-,28+,29-/m0/s1","LPMXVESGRSUGHW-HBYQJFLCSA-N"
"C1CNC(=O)C2=C1C3=C(N2)C(=CC=C3)Cl","InChI=1S/C11H9ClN2O/c12-8-3-1-2-6-7-4-5-13-11(15)10(7)14-9(6)8/h1-3,14H,4-5H2,(H,13,15)","ILCLBYYAGZLAGC-UHFFFAOYSA-N"
"COC1=CC(=C2C(=O)CC(OC2=C1)C3=CC=C(C=C3)O)OC","InChI=1S/C17H16O5/c1-20-12-7-15(21-2)17-13(19)9-14(22-16(17)8-12)10-3-5-11(18)6-4-10/h3-8,14,18H,9H2,1-2H3","REBBZOCNEVVAPX-UHFFFAOYSA-N"
"COC1=CC(=CC(=C1OC)OC)C2=C(C(=O)C3=C(O2)C=C(C=C3)O)O","InChI=1S/C18H16O7/c1-22-13-6-9(7-14(23-2)18(13)24-3)17-16(21)15(20)11-5-4-10(19)8-12(11)25-17/h4-8,19,21H,1-3H3","NJNGYVOYOVPWBB-UHFFFAOYSA-N"
"COC1=CC(=CC(=C1OC)OC)C2=C(C(=O)C3=CC=CC=C3O2)O","InChI=1S/C18H16O6/c1-21-13-8-10(9-14(22-2)18(13)23-3)17-16(20)15(19)11-6-4-5-7-12(11)24-17/h4-9,20H,1-3H3","MWFLTXAQDCOKEK-UHFFFAOYSA-N"
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"C1[C@H]2CN(C[C@@H]1C3=CC=CC(=O)N3C2)C=O","InChI=1S/C12H14N2O2/c15-8-13-5-9-4-10(7-13)11-2-1-3-12(16)14(11)6-9/h1-3,8-10H,4-7H2/t9-,10+/m0/s1","PCYQRXYBKKZUSR-VHSXEESVSA-N"
"C[C@@]12CCN([C@@H]1N(C3=C2C=C(C=C3)O)C)C","InChI=1S/C13H18N2O/c1-13-6-7-14(2)12(13)15(3)11-5-4-9(16)8-10(11)13/h4-5,8,12,16H,6-7H2,1-3H3/t12-,13+/m1/s1","HKGWQUVGHPDEBZ-OLZOCXBDSA-N"
"CN1CC[C@@]23C=C[C@@H](C[C@@H]2OC4=C(C=CC(=C34)C1)OC)O","InChI=1S/C17H21NO3/c1-18-8-7-17-6-5-12(19)9-14(17)21-16-13(20-2)4-3-11(10-18)15(16)17/h3-6,12,14,19H,7-10H2,1-2H3/t12-,14-,17-/m0/s1","ASUTZQLVASHGKV-JDFRZJQESA-N"
"C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)C(C)O)C(C)C","InChI=1S/C13H24O3/c1-8(2)11-6-5-9(3)7-12(11)16-13(15)10(4)14/h8-12,14H,5-7H2,1-4H3/t9-,10?,11+,12-/m1/s1","UJNOLBSYLSYIBM-SGUBAKSOSA-N"
"COC1C(C(C2C(O1)COC(O2)C3=CC=CC=C3)O)O","InChI=1S/C14H18O6/c1-17-14-11(16)10(15)12-9(19-14)7-18-13(20-12)8-5-3-2-4-6-8/h2-6,9-16H,7H2,1H3","VVSWDMJYIDBTMV-UHFFFAOYSA-N"
"CC1=C(C(=C2C(=C1O)C3(C(=CC(=C(C3=O)C(=O)C)O)O2)C)C(=O)C)O","InChI=1S/C18H16O7/c1-6-14(22)12(8(3)20)16-13(15(6)23)18(4)10(25-16)5-9(21)11(7(2)19)17(18)24/h5,21-23H,1-4H3","WEYVVCKOOFYHRW-UHFFFAOYSA-N"
"C=CCCN1C[C@@H]2CC(C1)C3=CC=CC(=O)N3C2","InChI=1S/C15H20N2O/c1-2-3-7-16-9-12-8-13(11-16)14-5-4-6-15(18)17(14)10-12/h2,4-6,12-13H,1,3,7-11H2/t12-,13?/m0/s1","ZVTFRRVBMAUIQW-UEWDXFNNSA-N"
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"CC1CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)O","InChI=1S/C10H16N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h5-8,13-14H,2-4H2,1H3,(H,11,15,16)/t5?,6-,7+,8+/m0/s1","FEYHMSUYKIMUAL-UNYLCCJPSA-N"
"C[C@@H]1[C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)C)O","InChI=1S/C10H14N2O4/c1-5-4-12(10(15)11-9(5)14)8-3-7(13)6(2)16-8/h4,6-8,13H,3H2,1-2H3,(H,11,14,15)/t6-,7+,8-/m1/s1","UGUILUGCFSCUKR-GJMOJQLCSA-N"
"COC1=CN(C(=O)NC1=O)C2[C@@H]([C@@H]([C@H](O2)CO)O)O","InChI=1S/C10H14N2O7/c1-18-4-2-12(10(17)11-8(4)16)9-7(15)6(14)5(3-13)19-9/h2,5-7,9,13-15H,3H2,1H3,(H,11,16,17)/t5-,6-,7-,9?/m1/s1","ZXIATBNUWJBBGT-PILSHRGASA-N"
"CC1=CN(C(=S)NC1=O)C2C(C(C(O2)CO)O)O","InChI=1S/C10H14N2O5S/c1-4-2-12(10(18)11-8(4)16)9-7(15)6(14)5(3-13)17-9/h2,5-7,9,13-15H,3H2,1H3,(H,11,16,18)","SNNBPMAXGYBMHM-UHFFFAOYSA-N"
"C1=NN(C(=O)NC1=O)C2C(C(C(O2)CO)O)O","InChI=1S/C8H11N3O6/c12-2-3-5(14)6(15)7(17-3)11-8(16)10-4(13)1-9-11/h1,3,5-7,12,14-15H,2H2,(H,10,13,16)","WYXSYVWAUAUWLD-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)Cl)N=CN2C3C(C(C(O3)CO)O)O","InChI=1S/C10H11ClN4O4/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(18)6(17)4(1-16)19-10/h2-4,6-7,10,16-18H,1H2","XHRJGHCQQPETRH-UHFFFAOYSA-N"
"CN(C)CC1=CNC2=C1C=CC=C2OCC3=CC=CC=C3","InChI=1S/C18H20N2O/c1-20(2)12-15-11-19-18-16(15)9-6-10-17(18)21-13-14-7-4-3-5-8-14/h3-11,19H,12-13H2,1-2H3","SUZMCIRGERDWMV-UHFFFAOYSA-N"
"CC1C2CCC(=C3C(C2OC1=O)C(=CC3=O)C)C","InChI=1S/C15H18O3/c1-7-4-5-10-9(3)15(17)18-14(10)13-8(2)6-11(16)12(7)13/h6,9-10,13-14H,4-5H2,1-3H3","BJPSSVHNEGMBDQ-UHFFFAOYSA-N"
"C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COC(=O)CCC(=O)O)O)O","InChI=1S/C14H17N5O7/c15-12-9-13(17-4-16-12)19(5-18-9)14-11(24)10(23)6(26-14)3-25-8(22)2-1-7(20)21/h4-6,10-11,14,23-24H,1-3H2,(H,20,21)(H2,15,16,17)","SOVSEJILHKLDOS-UHFFFAOYSA-N"
"C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C=C(C=C4C2=O)CO)O","InChI=1S/C21H20O10/c22-6-8-4-10-14(11(24)5-8)18(27)15-9(16(10)25)2-1-3-12(15)30-21-20(29)19(28)17(26)13(7-23)31-21/h1-5,13,17,19-24,26,28-29H,6-7H2","KIZBWUUJNJEYCM-UHFFFAOYSA-N"
"CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O","InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)","YDOTUXAWKBPQJW-UHFFFAOYSA-N"
"CC(=O)N1CCCC(=C1)C2CCCCN2","InChI=1S/C12H20N2O/c1-10(15)14-8-4-5-11(9-14)12-6-2-3-7-13-12/h9,12-13H,2-8H2,1H3","APKLQIQRPUDADG-UHFFFAOYSA-N"
"C1CCNC(C1)C2=CN=CC=C2","InChI=1S/C10H14N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h3-4,6,8,10,12H,1-2,5,7H2","MTXSIJUGVMTTMU-UHFFFAOYSA-N"
"CC12CCC(C(C1CCC(=C)C2CC=C3C(COC3=O)O)(C)CO)O","InChI=1S/C20H30O5/c1-12-4-7-16-19(2,9-8-17(23)20(16,3)11-21)14(12)6-5-13-15(22)10-25-18(13)24/h5,14-17,21-23H,1,4,6-11H2,2-3H3","BOJKULTULYSRAS-UHFFFAOYSA-N"
"CC1CCC2C(C(=O)OC3C24C1CCC(O3)(OO4)C)C","InChI=1S/C15H22O5/c1-8-4-5-11-9(2)12(16)17-13-15(11)10(8)6-7-14(3,18-13)19-20-15/h8-11,13H,4-7H2,1-3H3","BLUAFEHZUWYNDE-UHFFFAOYSA-N"
"C1C2C(COC2C3=CC4=C(C=C3)OCO4)C(O1)C5=CC6=C(C=C5)OCO6","InChI=1S/C20H18O6/c1-3-15-17(25-9-23-15)5-11(1)19-13-7-22-20(14(13)8-21-19)12-2-4-16-18(6-12)26-10-24-16/h1-6,13-14,19-20H,7-10H2","PEYUIKBAABKQKQ-UHFFFAOYSA-N"
"CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC(=C(C=C43)OC)O)OC)O","InChI=1S/C19H21NO4/c1-20-5-4-10-7-15(22)19(24-3)18-12-9-16(23-2)14(21)8-11(12)6-13(20)17(10)18/h7-9,13,21-22H,4-6H2,1-3H3/t13-/m0/s1","LZJRNLRASBVRRX-ZDUSSCGKSA-N"
"CC1CCCC=CC2CC(CC2C(C=CC(=O)O1)O)O","InChI=1S/C16H24O4/c1-11-5-3-2-4-6-12-9-13(17)10-14(12)15(18)7-8-16(19)20-11/h4,6-8,11-15,17-18H,2-3,5,9-10H2,1H3","KQNZDYYTLMIZCT-UHFFFAOYSA-N"
"C1C(C(OC1N2C=C(C(=O)NC2=O)C=CBr)CO)O","InChI=1S/C11H13BrN2O5/c12-2-1-6-4-14(11(18)13-10(6)17)9-3-7(16)8(5-15)19-9/h1-2,4,7-9,15-16H,3,5H2,(H,13,17,18)","ODZBBRURCPAEIQ-UHFFFAOYSA-N"
"CC1(C2CCC1(C(=O)C2)C)C","InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3","DSSYKIVIOFKYAU-UHFFFAOYSA-N"
"CC12C3CCC(C1(C(=O)OC2=O)C)O3","InChI=1S/C10H12O4/c1-9-5-3-4-6(13-5)10(9,2)8(12)14-7(9)11/h5-6H,3-4H2,1-2H3","DHZBEENLJMYSHQ-UHFFFAOYSA-N"
"C=CC1CN2CCC1CC2C3=C(C4=CC=CC=C4N3)CCO","InChI=1S/C19H24N2O/c1-2-13-12-21-9-7-14(13)11-18(21)19-16(8-10-22)15-5-3-4-6-17(15)20-19/h2-6,13-14,18,20,22H,1,7-12H2","YAUKSCGKZYUZRH-UHFFFAOYSA-N"
"CCN1C2=CC3=C(C=C2C(=O)C(=N1)C(=O)O)OCO3","InChI=1S/C12H10N2O5/c1-2-14-7-4-9-8(18-5-19-9)3-6(7)11(15)10(13-14)12(16)17/h3-4H,2,5H2,1H3,(H,16,17)","VDUWPHTZYNWKRN-UHFFFAOYSA-N"
"C[C@H]1[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)N(C)C)C)CN1C","InChI=1S/C24H40N2/c1-16-20-8-9-22-19-7-6-17-14-18(25(3)4)10-12-23(17,2)21(19)11-13-24(20,22)15-26(16)5/h6,16,18-22H,7-15H2,1-5H3/t16-,18-,19+,20+,21-,22-,23-,24-/m0/s1","GPLGAQQQNWMVMM-MYAJQUOBSA-N"
"CC(C)(C)OC(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3","InChI=1S/C20H23NO4/c1-20(2,3)25-19(23)15-11-13-10-12-6-4-8-21-9-5-7-14(16(12)21)17(13)24-18(15)22/h10-11H,4-9H2,1-3H3","XSHJSSYQUYNTBG-UHFFFAOYSA-N"
"C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)OP(=O)(O)O)O","InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-6(14)7(4(3-13)19-8)20-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1","UOOOPKANIPLQPU-XVFCMESISA-N"
"CC12CCC3C(C1CCC2=O)CC=C4C3(CCC(C4)O)C","InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h3,13-16,20H,4-11H2,1-2H3","FMGSKLZLMKYGDP-UHFFFAOYSA-N"
"CN1CCC2=CC(=C(C3=C4C=C(C(=CC4=CC1=C23)OC)OC)OC)OC","InChI=1S/C21H23NO4/c1-22-7-6-12-9-18(25-4)21(26-5)20-14-11-17(24-3)16(23-2)10-13(14)8-15(22)19(12)20/h8-11H,6-7H2,1-5H3","RZUHGAKUNBFQJS-UHFFFAOYSA-N"
"CC1C(C(CC(O1)OC2C(OC(CC2O)OC3C(OC(CC3O)OC4CCC5(C(C4)CCC6C5CC(C7(C6(CCC7C8=CC(=O)OC8)O)C)O)C)C)C)O)O","InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3","LTMHDMANZUZIPE-UHFFFAOYSA-N"
"CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC7=CNC8=CC=CC6=C78)N(C5)C","InChI=1S/C33H37N5O5/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39)","LUZRJRNZXALNLM-UHFFFAOYSA-N"
"CS(=O)CCC(C(=O)O)N","InChI=1S/C5H11NO3S/c1-10(9)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)","QEFRNWWLZKMPFJ-UHFFFAOYSA-N"
"C1=CC(=CC(=C1)O)C(CN)O","InChI=1S/C8H11NO2/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4,8,10-11H,5,9H2","LRCXRAABFLIVAI-UHFFFAOYSA-N"
"COC1C(C(C(C(C1O)O)O)O)O","InChI=1S/C7H14O6/c1-13-7-5(11)3(9)2(8)4(10)6(7)12/h2-12H,1H3","DSCFFEYYQKSRSV-UHFFFAOYSA-N"
"CCC12CCCN3C1C4=C(CC3)C5=CC=CC=C5N4C(=O)C2","InChI=1S/C19H22N2O/c1-2-19-9-5-10-20-11-8-14-13-6-3-4-7-15(13)21(16(22)12-19)17(14)18(19)20/h3-4,6-7,18H,2,5,8-12H2,1H3","WYJAPUKIYAZSEM-UHFFFAOYSA-N"
"CC(C(C1=CC=CC=C1)O)NC","InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3","KWGRBVOPPLSCSI-UHFFFAOYSA-N"
"CC12CCC(CC1CCC3C2CCC4(C3CCC4=O)C)O","InChI=1S/C19H30O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h12-16,20H,3-11H2,1-2H3","QGXBDMJGAMFCBF-UHFFFAOYSA-N"
"CCC1C(C(C(C(=O)C(CC(C(C(C(C(C(=O)O1)C)OC2CC(C(C(O2)C)O)(C)OC)C)OC3C(C(CC(O3)C)N(C)C)O)(C)O)C)C)O)(C)O","InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3","ULGZDMOVFRHVEP-UHFFFAOYSA-N"
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"C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)NC(=NC2=O)N","InChI=1S/C10H14N5O8P/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(23-9)1-22-24(19,20)21/h2-3,5-6,9,16-17H,1H2,(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1","RQFCJASXJCIDSX-UUOKFMHZSA-N"
"CC1=C2C(=C3C=CC(=O)C=C3N2)CCN1","InChI=1S/C12H12N2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12/h2-3,6,13-14H,4-5H2,1H3","CRQDWQWZCNKKAC-UHFFFAOYSA-N"
"CC1=C2C(=C3C=CC(=O)C=C3N2)C=CN1","InChI=1S/C12H10N2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12/h2-6,13-14H,1H3","LBBJNGFCXDOYMQ-UHFFFAOYSA-N"
"C1=NC(=O)C2=C(N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O","InChI=1S/C10H12N4O5/c15-1-4-6(16)7(17)10(19-4)14-3-13-5-8(14)11-2-12-9(5)18/h2-4,6-7,10,15-17H,1H2,(H,11,12,18)/t4-,6-,7-,10-/m1/s1","UGQMRVRMYYASKQ-KQYNXXCUSA-N"
"C[C@]12CCCC(=C)[C@@H]1C[C@H]3[C@@H](C2)OC(=O)C3=C","InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h11-13H,1-2,4-8H2,3H3/t11-,12+,13-,15-/m1/s1","CVUANYCQTOGILD-QVHKTLOISA-N"
"CC=CC1=CC2=C(C=C1)OCO2","InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2-6H,7H2,1H3","VHVOLFRBFDOUSH-UHFFFAOYSA-N"
"CC1CC=CC=CC(C(CC(C(C(C(CC(=O)O1)OC(=O)C)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)OC(=O)CC(C)C)(C)O)N(C)C)O)CC=O)C)O","InChI=1S/C42H69NO15/c1-23(2)19-32(47)56-40-27(6)53-34(22-42(40,8)50)57-37-26(5)54-41(36(49)35(37)43(9)10)58-38-29(17-18-44)20-24(3)30(46)16-14-12-13-15-25(4)52-33(48)21-31(39(38)51-11)55-28(7)45/h12-14,16,18,23-27,29-31,34-41,46,49-50H,15,17,19-22H2,1-11H3","XJSFLOJWULLJQS-UHFFFAOYSA-N"
"CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]2C[C@@H](C31)[C@]5(C[C@@H]([C@H]6C[C@@H]4[C@@H]5[C@H]6O)OC)O)O)C","InChI=1S/C22H35NO4/c1-4-23-10-20(2)6-5-16(24)22-12-7-11-14(27-3)9-21(26,17(12)18(11)25)13(19(22)23)8-15(20)22/h11-19,24-26H,4-10H2,1-3H3/t11-,12-,13+,14+,15-,16+,17-,18+,19?,20+,21+,22-/m1/s1","HKQZUYOVMYOFIT-VHNBHZRZSA-N"
"CC1=CC(=O)[C@H]2C[C@@H]1C2(C)C","InChI=1S/C10H14O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-8H,5H2,1-3H3/t7-,8+/m0/s1","DCSCXTJOXBUFGB-JGVFFNPUSA-N"
"CC1C(C(CC(O1)OC2CCC3(C(C2)CCC4C3CC(C5(C4(CCC5C6=CC(=O)OC6)O)C)O)C)O)OC7CC(C(C(O7)C)OC8CC(C(C(O8)C)OC9C(C(C(C(O9)CO)O)O)O)OC(=O)C)O","InChI=1S/C49H76O20/c1-21-43(67-38-17-32(53)44(22(2)62-38)68-39-18-33(64-24(4)51)45(23(3)63-39)69-46-42(58)41(57)40(56)34(19-50)66-46)31(52)16-37(61-21)65-27-9-11-47(5)26(14-27)7-8-29-30(47)15-35(54)48(6)28(10-12-49(29,48)59)25-13-36(55)60-20-25/h13,21-23,26-35,37-46,50,52-54,56-59H,7-12,14-20H2,1-6H3","JAYAGJDXJIDEKI-UHFFFAOYSA-N"
"C1CCN2C[C@@H](CC[C@@H]2C1)[C@H]3CCCCN3C=O","InChI=1S/C15H26N2O/c18-12-17-10-4-2-6-15(17)13-7-8-14-5-1-3-9-16(14)11-13/h12-15H,1-11H2/t13-,14+,15-/m1/s1","LUGPGVVCVOWJLT-QLFBSQMISA-N"
"C1=CC=C2C=C(C=CC2=C1)NC(=O)C(CC3=CN=CN3)N","InChI=1S/C16H16N4O/c17-15(8-14-9-18-10-19-14)16(21)20-13-6-5-11-3-1-2-4-12(11)7-13/h1-7,9-10,15H,8,17H2,(H,18,19)(H,20,21)","DKDILZBBFKZMRO-UHFFFAOYSA-N"
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"CCC(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O)C","InChI=1S/C24H36O5/c1-5-15(3)24(27)29-21-11-14(2)10-17-7-6-16(4)20(23(17)21)9-8-19-12-18(25)13-22(26)28-19/h6-7,10,14-16,18-21,23,25H,5,8-9,11-13H2,1-4H3","PCZOHLXUXFIOCF-UHFFFAOYSA-N"
"C(CC(C(=O)O)N)CNC(=S)N","InChI=1S/C6H13N3O2S/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12)","BKGWACHYAMTLAF-UHFFFAOYSA-N"
"C1CCN2CCC[C@H]([C@H]2C1)CO","InChI=1S/C10H19NO/c12-8-9-4-3-7-11-6-2-1-5-10(9)11/h9-10,12H,1-8H2/t9-,10+/m0/s1","HDVAWXXJVMJBAR-VHSXEESVSA-N"
"C1CC2C3CCCN4C3C(CCC4)CN2C(=O)C1","InChI=1S/C15H24N2O/c18-14-7-1-6-13-12-5-3-9-16-8-2-4-11(15(12)16)10-17(13)14/h11-13,15H,1-10H2","ZSBXGIUJOOQZMP-UHFFFAOYSA-N"
"CN1CC(CC2C1CC3=CN(C4=CC=CC2=C34)C)CNC(=O)OCC5=CC=CC=C5","InChI=1S/C25H29N3O2/c1-27-14-18(13-26-25(29)30-16-17-7-4-3-5-8-17)11-21-20-9-6-10-22-24(20)19(12-23(21)27)15-28(22)2/h3-10,15,18,21,23H,11-14,16H2,1-2H3,(H,26,29)","WZHJKEUHNJHDLS-UHFFFAOYSA-N"
"C1=CN(C=C(C1=O)O)CC(C(=O)O)N","InChI=1S/C8H10N2O4/c9-5(8(13)14)3-10-2-1-6(11)7(12)4-10/h1-2,4-5,12H,3,9H2,(H,13,14)","WZNJWVWKTVETCG-UHFFFAOYSA-N"
"COC1=CC=CC(=C1)C(=O)NNC2C(C(C(O2)CO)O)O","InChI=1S/C13H18N2O6/c1-20-8-4-2-3-7(5-8)12(19)14-15-13-11(18)10(17)9(6-16)21-13/h2-5,9-11,13,15-18H,6H2,1H3,(H,14,19)","IICZVACQCLOELP-UHFFFAOYSA-N"
"CC(=O)NC1=NC(=O)C2=C(N1)N=CN2","InChI=1S/C7H7N5O2/c1-3(13)10-7-11-5-4(6(14)12-7)8-2-9-5/h2H,1H3,(H3,8,9,10,11,12,13,14)","MXSMRDDXWJSGMC-UHFFFAOYSA-N"
"CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)OC)O)O","InChI=1S/C12H21NO9/c1-5(15)13-8-6(16)3-12(20,11(19)21-2)22-10(8)9(18)7(17)4-14/h6-10,14,16-18,20H,3-4H2,1-2H3,(H,13,15)","BKZQMWNJESHHSA-UHFFFAOYSA-N"
"C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CNC5=CC=CC=C54)C(=O)O","InChI=1S/C26H22N2O4/c29-25(30)24(13-16-14-27-23-12-6-5-7-17(16)23)28-26(31)32-15-22-20-10-3-1-8-18(20)19-9-2-4-11-21(19)22/h1-12,14,22,24,27H,13,15H2,(H,28,31)(H,29,30)","MGHMWKZOLAAOTD-UHFFFAOYSA-N"
"CN1CCC[C@H]1C2=CN=CC=C2","InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1","SNICXCGAKADSCV-JTQLQIEISA-N"
"CNCCC1=CNC2=C1C=C(C=C2)O","InChI=1S/C11H14N2O/c1-12-5-4-8-7-13-11-3-2-9(14)6-10(8)11/h2-3,6-7,12-14H,4-5H2,1H3","ASUSBMNYRHGZIG-UHFFFAOYSA-N"
"C1CC2C3C(C1O2)C(=O)OC3=O","InChI=1S/C8H8O4/c9-7-5-3-1-2-4(11-3)6(5)8(10)12-7/h3-6H,1-2H2","JAABVEXCGCXWRR-UHFFFAOYSA-N"
"C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)O","InChI=1S/C13H18N4O3/c14-13(15)16-8-4-7-10(12(19)20)17-11(18)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2,(H,17,18)(H,19,20)(H4,14,15,16)","RSYYQCDERUOEFI-UHFFFAOYSA-N"
"C1=CN2C3C(C(C(O3)CO)O)OC2=NC1=O","InChI=1S/C9H10N2O5/c12-3-4-6(14)7-8(15-4)11-2-1-5(13)10-9(11)16-7/h1-2,4,6-8,12,14H,3H2","UUGITDASWNOAGG-UHFFFAOYSA-N"
"C[C@@H]1C[C@]2([C@@H](O2)C)C(=O)O[C@@H]3CCN(C/C=C(\C3=O)/COC(=O)[C@]1(C)O)C","InChI=1S/C19H27NO7/c1-11-9-19(12(2)27-19)17(23)26-14-6-8-20(4)7-5-13(15(14)21)10-25-16(22)18(11,3)24/h5,11-12,14,24H,6-10H2,1-4H3/b13-5-/t11-,12+,14-,18-,19+/m1/s1","CZQLULNMKQAIQL-GZSSMBGUSA-N"
"CC1(C2C(C3C(C(=O)C(=C(N)O)C(=O)C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)N(C)C)O)O","InChI=1S/C22H24N2O9/c1-21(32)7-5-4-6-8(25)9(7)15(26)10-12(21)17(28)13-14(24(2)3)16(27)11(20(23)31)19(30)22(13,33)18(10)29/h4-6,12-14,17,25-26,28,31-33H,23H2,1-3H3","FYDOORKXBWEKQM-UHFFFAOYSA-N"
"C/C/1=C\CC[C@@]2([C@@H](O2)[C@@H]3[C@@H](CC1)C(=C)C(=O)O3)C","InChI=1S/C15H20O3/c1-9-5-4-8-15(3)13(18-15)12-11(7-6-9)10(2)14(16)17-12/h5,11-13H,2,4,6-8H2,1,3H3/b9-5+/t11-,12-,13-,15+/m0/s1","KTEXNACQROZXEV-SLXBATTESA-N"
"C1CN2CC3=CC=CC=C3N=C2C1O","InChI=1S/C11H12N2O/c14-10-5-6-13-7-8-3-1-2-4-9(8)12-11(10)13/h1-4,10,14H,5-7H2","YIICVSCAKJMMDJ-UHFFFAOYSA-N"
"CC1=C(C(=O)C2=CC=CC=C2C1=O)C/C=C(\C)/CCCC(C)CCCC(C)CCCC(C)C","InChI=1S/C31H46O2/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-17-25(5)20-21-27-26(6)30(32)28-18-7-8-19-29(28)31(27)33/h7-8,18-20,22-24H,9-17,21H2,1-6H3/b25-20+","MBWXNTAXLNYFJB-LKUDQCMESA-N"
"CC[C@H]1[C@H](COC1=O)CC2=CN=CN2C","InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8-,10-/m0/s1","QCHFTSOMWOSFHM-WPRPVWTQSA-N"
"CC1=CC(=O)C2=C(C1=O)C=CC=C2O","InChI=1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3","VCMMXZQDRFWYSE-UHFFFAOYSA-N"
"CC12CCCC(C1CCC3=C2C=C(C=C3)O)(C)C(=O)O","InChI=1S/C17H22O3/c1-16-8-3-9-17(2,15(19)20)14(16)7-5-11-4-6-12(18)10-13(11)16/h4,6,10,14,18H,3,5,7-9H2,1-2H3,(H,19,20)","VJILEYKNALCDDV-UHFFFAOYSA-N"
"CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C","InChI=1S/C21H30O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h12,16-19H,4-11H2,1-3H3","RJKFOVLPORLFTN-UHFFFAOYSA-N"
"C[C@@H]([C@@H]([C@H](C1=CN=C2C(=N1)C(=O)N=C(N2)N)O)O)O","InChI=1S/C10H13N5O4/c1-3(16)6(17)7(18)4-2-12-8-5(13-4)9(19)15-10(11)14-8/h2-3,6-7,16-18H,1H3,(H3,11,12,14,15,19)/t3-,6-,7-/m0/s1","QSVZLFABRHDXRR-ZIMNBKJVSA-N"
"CC1=C(C(=C(C(=C1O)C(=O)C)O)CC2=C(C3=C(C(=C2O)C(=O)/C=C/C4=CC=CC=C4)OC(C=C3)(C)C)O)O","InChI=1S/C30H28O8/c1-15-24(33)19(27(36)22(16(2)31)25(15)34)14-20-26(35)18-12-13-30(3,4)38-29(18)23(28(20)37)21(32)11-10-17-8-6-5-7-9-17/h5-13,33-37H,14H2,1-4H3/b11-10+","DEZFNHCVIZBHBI-ZHACJKMWSA-N"
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"CC1C2=CC(=C(C=C2CCN1)OC)OC","InChI=1S/C12H17NO2/c1-8-10-7-12(15-3)11(14-2)6-9(10)4-5-13-8/h6-8,13H,4-5H2,1-3H3","HMYJLVDKPJHJCF-UHFFFAOYSA-N"
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"C1CCN2[C@H](C1)[C@]34C[C@H]2C=CC3=CC(=O)O4","InChI=1S/C13H15NO2/c15-12-7-9-4-5-10-8-13(9,16-12)11-3-1-2-6-14(10)11/h4-5,7,10-11H,1-3,6,8H2/t10-,11-,13+/m1/s1","SWZMSZQQJRKFBP-WZRBSPASSA-N"
"CC1CC(=O)C2(C(O1)OC3C(C(C(C(C3O2)NC)O)NC)O)O","InChI=1S/C14H24N2O7/c1-5-4-6(17)14(20)13(21-5)22-12-10(19)7(15-2)9(18)8(16-3)11(12)23-14/h5,7-13,15-16,18-20H,4H2,1-3H3","UNFWWIHTNXNPBV-UHFFFAOYSA-N"
"C[C@@H]1C/C=C/C=C/[C@@H]([C@@H](C[C@@H]([C@@H]([C@H]([C@@H](CC(=O)O1)O)OC)OC2C(C(C(C(O2)C)OC3CC(C(C(O3)C)O)(C)O)N(C)C)O)CC=O)C)OC4CCC(C(O4)C)N(C)C","InChI=1S/C43H74N2O14/c1-24-21-29(19-20-46)39(59-42-37(49)36(45(9)10)38(27(4)56-42)58-35-23-43(6,51)41(50)28(5)55-35)40(52-11)31(47)22-33(48)53-25(2)15-13-12-14-16-32(24)57-34-18-17-30(44(7)8)26(3)54-34/h12-14,16,20,24-32,34-42,47,49-51H,15,17-19,21-23H2,1-11H3/b13-12+,16-14+/t24-,25-,26?,27?,28?,29+,30?,31-,32+,34?,35?,36?,37?,38?,39+,40+,41?,42?,43?/m1/s1","ACTOXUHEUCPTEW-JMRHEKERSA-N"
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"C1CCN2C[C@H]3C[C@@H]([C@@H]2C1)CN4C3=CC=CC4=O","InChI=1S/C15H20N2O/c18-15-6-3-5-14-11-8-12(10-17(14)15)13-4-1-2-7-16(13)9-11/h3,5-6,11-13H,1-2,4,7-10H2/t11-,12-,13+/m1/s1","FQEQMASDZFXSJI-UPJWGTAASA-N"
"CC1=C2C(=C(C(=C1C)OC(=O)CCC(=O)O)C)CCC(O2)(C)CCCC(C)CCCC(C)CCCC(C)C","InChI=1S/C33H54O5/c1-22(2)12-9-13-23(3)14-10-15-24(4)16-11-20-33(8)21-19-28-27(7)31(25(5)26(6)32(28)38-33)37-30(36)18-17-29(34)35/h22-24H,9-21H2,1-8H3,(H,34,35)","IELOKBJPULMYRW-UHFFFAOYSA-N"
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"C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O","InChI=1S/C9H12N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h1-2,4,6-8,12,14-15H,3H2,(H,10,13,16)/t4-,6-,7-,8-/m1/s1","DRTQHJPVMGBUCF-XVFCMESISA-N"
"C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O","InChI=1S/C9H13N2O9P/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1","DJJCXFVJDGTHFX-XVFCMESISA-N"
"CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)C(=O)O","InChI=1S/C30H48O3/c1-18-10-15-30(25(32)33)17-16-28(6)20(24(30)19(18)2)8-9-22-27(5)13-12-23(31)26(3,4)21(27)11-14-29(22,28)7/h8,18-19,21-24,31H,9-17H2,1-7H3,(H,32,33)","WCGUUGGRBIKTOS-UHFFFAOYSA-N"
"C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NC(=O)NC2=O","InChI=1S/C10H12N4O6/c15-1-3-5(16)6(17)9(20-3)14-2-11-4-7(14)12-10(19)13-8(4)18/h2-3,5-6,9,15-17H,1H2,(H2,12,13,18,19)/t3-,5-,6-,9-/m1/s1","UBORTCNDUKBEOP-UUOKFMHZSA-N"
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"COC1=C(C=CC(=C1)C[C@@H](CO)[C@@H](CC2=CC(=C(C=C2)O)OC)CO)O","InChI=1S/C20H26O6/c1-25-19-9-13(3-5-17(19)23)7-15(11-21)16(12-22)8-14-4-6-18(24)20(10-14)26-2/h3-6,9-10,15-16,21-24H,7-8,11-12H2,1-2H3/t15-,16-/m0/s1","PUETUDUXMCLALY-HOTGVXAUSA-N"
"COC1=C(C=CC(=C1)[C@@H]2[C@H]3CO[C@@H]([C@H]3CO2)C4=CC(=C(C=C4)O)OC)O","InChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3/t13-,14-,19+,20+/m0/s1","HGXBRUKMWQGOIE-AFHBHXEDSA-N"
"CC(C)(CC[C@](CC(=O)OC)(C(=O)O[C@H]1[C@H]2C3=CC4=C(C=C3CCN5[C@@]2(CCC5)C=C1OC)OCO4)O)O","InChI=1S/C28H37NO9/c1-26(2,32)8-9-28(33,15-22(30)35-4)25(31)38-24-21(34-3)14-27-7-5-10-29(27)11-6-17-12-19-20(37-16-36-19)13-18(17)23(24)27/h12-14,23-24,32-33H,5-11,15-16H2,1-4H3/t23-,24-,27+,28+/m1/s1","HAVJATCHLFRDHY-ZBVBGGFBSA-N"
"CC(=O)O[C@H]1[C@H]([C@@H]2[C@]([C@H](CCC2(C)C)O)([C@@]3([C@@]1(O[C@@](CC3=O)(C)C=C)C)O)C)O","InChI=1S/C22H34O7/c1-8-19(5)11-14(25)22(27)20(6)13(24)9-10-18(3,4)16(20)15(26)17(28-12(2)23)21(22,7)29-19/h8,13,15-17,24,26-27H,1,9-11H2,2-7H3/t13-,15-,16-,17-,19-,20-,21+,22-/m0/s1","OHCQJHSOBUTRHG-KGGHGJDLSA-N"
"CC1=C2C(C(=O)C3(C(CC4C(C3C(C(C2(C)C)(CC1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)O","InChI=1S/C29H36O10/c1-14-17(31)12-29(36)24(38-25(35)16-9-7-6-8-10-16)22-27(5,23(34)21(33)20(14)26(29,3)4)18(32)11-19-28(22,13-37-19)39-15(2)30/h6-10,17-19,21-22,24,31-33,36H,11-13H2,1-5H3","YWLXLRUDGLRYDR-UHFFFAOYSA-N"
"CC1=C2[C@H](C(=O)[C@@]3([C@H](C[C@@H]4[C@]([C@H]3[C@@H]([C@@](C2(C)C)(C[C@@H]1O)O)OC(=O)C5=CC=CC=C5)(CO4)OC(=O)C)O)C)OC(=O)C","InChI=1S/C31H38O11/c1-15-19(34)13-31(38)26(41-27(37)18-10-8-7-9-11-18)24-29(6,20(35)12-21-30(24,14-39-21)42-17(3)33)25(36)23(40-16(2)32)22(15)28(31,4)5/h7-11,19-21,23-24,26,34-35,38H,12-14H2,1-6H3/t19-,20-,21+,23+,24-,26-,29+,30-,31+/m0/s1","OVMSOCFBDVBLFW-VHLOTGQHSA-N"
"C/C=C(\C)/C(=O)N[C@@H](C1=CC=CC=C1)[C@H](C(=O)O[C@H]2C[C@]3([C@H](C4[C@@]([C@H](C[C@@H]5[C@]4(CO5)OC(=O)C)O)(C(=O)[C@@H](C(=C2C)C3(C)C)OC(=O)C)C)OC(=O)C6=CC=CC=C6)O)O","InChI=1S/C45H53NO14/c1-9-23(2)39(52)46-33(27-16-12-10-13-17-27)34(50)41(54)58-29-21-45(55)38(59-40(53)28-18-14-11-15-19-28)36-43(8,30(49)20-31-44(36,22-56-31)60-26(5)48)37(51)35(57-25(4)47)32(24(29)3)42(45,6)7/h9-19,29-31,33-36,38,49-50,55H,20-22H2,1-8H3,(H,46,52)/b23-9+/t29-,30-,31+,33-,34+,35+,36?,38-,43+,44-,45+/m0/s1","DBXFAPJCZABTDR-UJLUYDJNSA-N"
"COC1=C(C=CC(=C1)[C@H]2[C@H]3CO[C@@H]([C@H]3CO2)C4=CC(=C(C=C4)O)OC)O","InChI=1S/C20H22O6/c1-23-17-7-11(3-5-15(17)21)19-13-9-26-20(14(13)10-25-19)12-4-6-16(22)18(8-12)24-2/h3-8,13-14,19-22H,9-10H2,1-2H3/t13-,14-,19-,20+/m0/s1","HGXBRUKMWQGOIE-WZBLMQSHSA-N"
"COC1=C(C=CC(=C1)C[C@H]2CO[C@@H]([C@H]2CO)C3=CC(=C(C=C3)O)OC)O","InChI=1S/C20H24O6/c1-24-18-8-12(3-5-16(18)22)7-14-11-26-20(15(14)10-21)13-4-6-17(23)19(9-13)25-2/h3-6,8-9,14-15,20-23H,7,10-11H2,1-2H3/t14-,15-,20+/m0/s1","MHXCIKYXNYCMHY-AUSJPIAWSA-N"
"COC1=CC(=CC(=C1O)OC)[C@H]2[C@@H]3[C@@H](CC4=C(C5=C(C=C24)OCO5)O)COC3=O","InChI=1S/C21H20O8/c1-25-13-4-9(5-14(26-2)19(13)23)16-11-6-15-20(29-8-28-15)18(22)12(11)3-10-7-27-21(24)17(10)16/h4-6,10,16-17,22-23H,3,7-8H2,1-2H3/t10-,16+,17-/m0/s1","JGGWNGRBXJWAOC-HKJPBSJPSA-N"
"COC1=C(C=CC(=C1)C[C@H]2COC(=O)[C@@H]2CC3=CC(=C(C=C3)O)OC)O","InChI=1S/C20H22O6/c1-24-18-9-12(3-5-16(18)21)7-14-11-26-20(23)15(14)8-13-4-6-17(22)19(10-13)25-2/h3-6,9-10,14-15,21-22H,7-8,11H2,1-2H3/t14-,15+/m0/s1","MATGKVZWFZHCLI-LSDHHAIUSA-N"
"COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@@H](CC4=C(C5=C(C=C24)OCO5)O)COC3=O","InChI=1S/C22H22O8/c1-25-14-5-10(6-15(26-2)20(14)27-3)17-12-7-16-21(30-9-29-16)19(23)13(12)4-11-8-28-22(24)18(11)17/h5-7,11,17-18,23H,4,8-9H2,1-3H3/t11-,17+,18-/m0/s1","HLBPOYVRLSXWJJ-PDSMFRHLSA-N"
"COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=C(C5=C(C=C24)OCO5)OC)O","InChI=1S/C23H24O9/c1-26-13-5-10(6-14(27-2)20(13)28-3)16-11-7-15-21(32-9-31-15)22(29-4)18(11)19(24)12-8-30-23(25)17(12)16/h5-7,12,16-17,19,24H,8-9H2,1-4H3/t12-,16+,17-,19+/m0/s1","PDQAOYGENRRPQO-UXDKQJBESA-N"
"CC[C@@]1(C2=C(COC1=O)C(=O)N3CC4=C(C3=C2)N=C5C=CC(=CC5=C4)O)O","InChI=1S/C20H16N2O5/c1-2-20(26)14-7-16-17-11(5-10-6-12(23)3-4-15(10)21-17)8-22(16)18(24)13(14)9-27-19(20)25/h3-7,23,26H,2,8-9H2,1H3/t20-/m0/s1","HAWSQZCWOQZXHI-FQEVSTJZSA-N"
"CN1CC[C@]23[C@@H]4C(=CC=C2[C@H]1CC5=C3C(=C(C=C5)OC)O4)OC","InChI=1S/C19H21NO3/c1-20-9-8-19-12-5-7-15(22-3)18(19)23-17-14(21-2)6-4-11(16(17)19)10-13(12)20/h4-7,13,18H,8-10H2,1-3H3/t13-,18+,19+/m1/s1","FQXXSQDCDRQNQE-VMDGZTHMSA-N"
"CN1[C@@H]2CC(C[C@H]1[C@H]3[C@@H]2O3)OC(=O)[C@H](CO)C4=CC=CC=C4","InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11?,12-,13-,14+,15-,16+/m1/s1","STECJAGHUSJQJN-USLFZFAMSA-N"
"COC(=O)C1=CO[C@H]([C@@H]([C@@H]1C[C@H]2C3=C(CCN2)C4=CC=CC=C4N3)C=C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O","InChI=1S/C27H34N2O9/c1-3-13-16(10-19-21-15(8-9-28-19)14-6-4-5-7-18(14)29-21)17(25(34)35-2)12-36-26(13)38-27-24(33)23(32)22(31)20(11-30)37-27/h3-7,12-13,16,19-20,22-24,26-33H,1,8-11H2,2H3/t13-,16+,19+,20-,22-,23+,24-,26+,27+/m1/s1","XBAMJZTXGWPTRM-NTXHKPOFSA-N"
"CC(C)[C@@]12[C@@H](O1)[C@H]3[C@@]4(O3)[C@]5(CCC6=C([C@@H]5C[C@H]7[C@]4([C@@H]2O)O7)COC6=O)C","InChI=1S/C20H24O6/c1-8(2)18-13(25-18)14-20(26-14)17(3)5-4-9-10(7-23-15(9)21)11(17)6-12-19(20,24-12)16(18)22/h8,11-14,16,22H,4-7H2,1-3H3/t11-,12-,13-,14-,16+,17-,18-,19+,20+/m0/s1","DFBIRQPKNDILPW-CIVMWXNOSA-N"
"C/C=C/1\C2CC3=C(C1(CC(=C2)C)N)C=CC(=O)N3","InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+","ZRJBHWIHUMBLCN-QDEBKDIKSA-N"
"COP(=O)(OC)SCN(C(=O)1)c(n2)c(cc(Cl)c2)O1","InChI=1S/C9H10ClN2O5PS/c1-15-18(14,16-2)19-5-12-8-7(17-9(12)13)3-6(10)4-11-8/h3-4H,5H2,1-2H3","VNKBTWQZTQIWDV-UHFFFAOYSA-N"
"COP(=S)(OC)SCN(N=1)C(=O)c(c2)c(ccc2)N1","InChI=1S/C10H12N3O3PS2/c1-15-17(18,16-2)19-7-13-10(14)8-5-3-4-6-9(8)11-12-13/h3-6H,7H2,1-2H3","CJJOSEISRRTUQB-UHFFFAOYSA-N"
"[H]C(C(O)7)(O6)C(O)(C3(C=C7C)[H])C(C6)=CC=CC(C(OC(C4)OC(C(OC(O5)CC(C(O)C(C)5)OC)C4OC)C)C(=CCC(C2)OC(CC2OC3=O)(C=1)OC([H])(C(C1)C)C(C)CC)C)C","InChI=1S/C48H72O14/c1-11-25(2)43-28(5)17-18-47(62-43)23-34-20-33(61-47)16-15-27(4)42(26(3)13-12-14-32-24-55-45-40(49)29(6)19-35(46(51)58-34)48(32,45)52)59-39-22-37(54-10)44(31(8)57-39)60-38-21-36(53-9)41(50)30(7)56-38/h12-15,17-19,25-26,28,30-31,33-45,49-50,52H,11,16,20-24H2,1-10H3/b13-12+,27-15+,32-14+/t25-,26-,28-,30-,31-,33+,34-,35-,36-,37-,38-,39-,40+,41-,42-,43+,44-,45+,47+,48+/m0/s1","RRZXIRBKKLTSOM-XPNPUAGNSA-N"
"CC(C)OC(=O)NC(C(C)C)C(=O)NC(C)c(c1)ccc(C)c1","InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14-,16+/m1/s1","NWUWYYSKZYIQAE-ZBFHGGJFSA-N"
"O=N(=O)N=C(N2)N(CC2)Cc(c1)cnc(Cl)c1","InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)","YWTYJOPNNQFBPC-UHFFFAOYSA-N"
"COC(=O)N(c(c4)ccc(OC(F)(F)F)c4)C(=O)N(C3)N=C(c21)C(O3)(C(=O)OC)Cc(cc(Cl)cc2)1","InChI=1S/C22H17ClF3N3O7/c1-33-18(30)21-10-12-9-13(23)3-8-16(12)17(21)27-28(11-35-21)19(31)29(20(32)34-2)14-4-6-15(7-5-14)36-22(24,25)26/h3-9H,10-11H2,1-2H3/t21-/m0/s1","VBCVPMMZEGZULK-NRFANRHFSA-N"
"c(c2)ccc(c2)NC(=O)C(=C(C)1)S(=O)(=O)CCO1","InChI=1S/C12H13NO4S/c1-9-11(18(15,16)8-7-17-9)12(14)13-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3,(H,13,14)","AMEKQAFGQBKLKX-UHFFFAOYSA-N"
"CCCN(CCC)c(c(N(=O)=O)1)c(N(=O)=O)cc(c1)S(N)(=O)=O","InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22)","UNAHYJYOSSSJHH-UHFFFAOYSA-N"
"O=C(OCC(C4)OCC4)C(C)Oc(c3)ccc(c3)Oc(c1)nc(c2)c(cc(Cl)c2)n1","InChI=1S/C22H21ClN2O5/c1-14(22(26)28-13-18-3-2-10-27-18)29-16-5-7-17(8-6-16)30-21-12-24-20-11-15(23)4-9-19(20)25-21/h4-9,11-12,14,18H,2-3,10,13H2,1H3","BBKDWPHJZANJGB-UHFFFAOYSA-N"
"CCCCCC(C)OC(=O)COc(c1)c(n2)c(ccc2)c(Cl)c1","InChI=1S/C18H22ClNO3/c1-3-4-5-7-13(2)23-17(21)12-22-16-10-9-15(19)14-8-6-11-20-18(14)16/h6,8-11,13H,3-5,7,12H2,1-2H3","COYBRKAVBMYYSF-UHFFFAOYSA-N"
"CNC(NCc(c1)sc(Cl)n1)=N[N+1]([O-1])=O","InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)","PGOOBECODWQEAB-UHFFFAOYSA-N"
"Cc(c3)cc(cc(C)3)C(=O)N(NC(=O)c(c1)c(C)c(C2)c(OCC2)c1)C(C)(C)C","InChI=1S/C24H30N2O3/c1-15-12-16(2)14-18(13-15)23(28)26(24(4,5)6)25-22(27)20-9-10-21-19(17(20)3)8-7-11-29-21/h9-10,12-14H,7-8,11H2,1-6H3,(H,25,27)","HPNSNYBUADCFDR-UHFFFAOYSA-N"
"O=C(Nc(c2)cccc2)C(C)Oc(c1)c(Cl)c(C)c(Cl)c1","InChI=1S/C16H15Cl2NO2/c1-10-13(17)8-9-14(15(10)18)21-11(2)16(20)19-12-6-4-3-5-7-12/h3-9,11H,1-2H3,(H,19,20)","BDQWWOHKFDSADC-UHFFFAOYSA-N"
"NC(C=2)=C(Cl)C(=O)N(N2)c(c1)cccc1","InChI=1S/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2","WYKYKTKDBLFHCY-UHFFFAOYSA-N"
"Cc(c2)ccc(c2)c(c(Cl)1)n(c(C#N)n1)S(=O)(=O)N(C)C","InChI=1S/C13H13ClN4O2S/c1-9-4-6-10(7-5-9)12-13(14)16-11(8-15)18(12)21(19,20)17(2)3/h4-7H,1-3H3","YXKMMRDKEKCERS-UHFFFAOYSA-N"
"c(c3)ccc(c3)CC(=O)NC(=NOCC(C2)C2)c(c(F)1)c(ccc(F)1)C(F)(F)F","InChI=1S/C20H17F5N2O2/c21-15-9-8-14(20(23,24)25)17(18(15)22)19(27-29-11-13-6-7-13)26-16(28)10-12-4-2-1-3-5-12/h1-5,8-9,13H,6-7,10-11H2,(H,26,27,28)","ACMXQHFNODYQAT-UHFFFAOYSA-N"
"Fc(c2)ccc(c2)C(O)(Cn(c1)ncn1)C[Si](C)(C)C","InChI=1S/C14H20FN3OSi/c1-20(2,3)9-14(19,8-18-11-16-10-17-18)12-4-6-13(15)7-5-12/h4-7,10-11,19H,8-9H2,1-3H3","YABFPHSQTSFWQB-UHFFFAOYSA-N"
"CCCCc(c(C)1)c(O)nc(N(C)C)n1","InChI=1S/C11H19N3O/c1-5-6-7-9-8(2)12-11(14(3)4)13-10(9)15/h5-7H2,1-4H3,(H,12,13,15)","CJHXCRMKMMBYJQ-UHFFFAOYSA-N"
"N#CN=C(S2)N(CC2)Cc(c1)cnc(Cl)c1","InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2/b14-10-","HOKKPVIRMVDYPB-UVTDQMKNSA-N"
"O=N(=O)N=C(N(C)2)N(COC2)Cc(c1)sc(Cl)n1","InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3/b11-8-","NWWZPOKUUAIXIW-FLIBITNWSA-N"
"CCON=C(CC)C(=C(O)2)C(=O)CC(C2)c(c(C)1)c(C)cc(C)c1","InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,22H,6-7,10-11H2,1-5H3/b21-16+","DQFPEYARZIQXRM-LTGZKZEYSA-N"
"CCONC(CC)=C(C(=O)2)C(=O)CC(C2)c(c(C)1)c(C)cc(C)c1","InChI=1S/C20H27NO3/c1-6-16(21-24-7-2)20-17(22)10-15(11-18(20)23)19-13(4)8-12(3)9-14(19)5/h8-9,15,21H,6-7,10-11H2,1-5H3/b20-16-","SOTLWPHEAQOHHC-SILNSSARSA-N"
"Clc(c3)ccc(c3)C=C(C1)C(O)(Cn(c2)ncn2)C(C)(C)C1","InChI=1S/C17H20ClN3O/c1-16(2)8-7-14(9-13-3-5-15(18)6-4-13)17(16,22)10-21-12-19-11-20-21/h3-6,9,11-12,22H,7-8,10H2,1-2H3/b14-9+","PPDBOQMNKNNODG-NTEUORMPSA-N"
"CCCCCCCCCCCCCN(C1)CC(C)OC(C)1","InChI=1S/C19H39NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-20-16-18(2)21-19(3)17-20/h18-19H,4-17H2,1-3H3","YTOPFCCWCSOHFV-UHFFFAOYSA-N"
"O=C(Nc(c3)cccc3)C(C)Oc(c1)cc(c2)c(ccc2)c1","InChI=1S/C19H17NO2/c1-14(19(21)20-17-9-3-2-4-10-17)22-18-12-11-15-7-5-6-8-16(15)13-18/h2-14H,1H3,(H,20,21)","LVKTWOXHRYGDMM-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)S(=O)(=O)Oc(n(C)2)c(c(C)n2)C(=O)c(c1)c(Cl)cc(Cl)c1","InChI=1S/C19H16Cl2N2O4S/c1-11-4-7-14(8-5-11)28(25,26)27-19-17(12(2)22-23(19)3)18(24)15-9-6-13(20)10-16(15)21/h4-10H,1-3H3","ASRAWSBMDXVNLX-UHFFFAOYSA-N"
"COc(c3)nc(nc(OC)3)Sc(c2)c(C(=O)1)c(cc2)C(C)O1","InChI=1S/C15H14N2O4S/c1-8-9-5-4-6-10(13(9)14(18)21-8)22-15-16-11(19-2)7-12(17-15)20-3/h4-8H,1-3H3","RRKHIAYNPVQKEF-UHFFFAOYSA-N"
"CCOC(=O)NCCOc(c2)ccc(c2)Oc(c1)cccc1","InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)","HJUFTIJOISQSKQ-UHFFFAOYSA-N"
"CC(=C1)NC(=NN=C(C)c(c2)c(C)ccc2)N=C(C)1","InChI=1S/C15H18N4/c1-10-7-5-6-8-14(10)13(4)18-19-15-16-11(2)9-12(3)17-15/h5-9H,1-4H3,(H,16,17,19)/b18-13+","GOWLARCWZRESHU-QGOAFFKASA-N"
"CC(=C1)NC(=NN=C(C)c(c2)c(C)ccc2)N=C(C)1","InChI=1S/C15H18N4/c1-10-7-5-6-8-14(10)13(4)18-19-15-16-11(2)9-12(3)17-15/h5-9H,1-4H3,(H,16,17,19)/b18-13-","GOWLARCWZRESHU-AQTBWJFISA-N"
"COC(=O)Nc(c2)cc(cc2)OC(=O)Nc(c1)cc(C)cc1","InChI=1S/C16H16N2O4/c1-11-5-3-6-12(9-11)18-16(20)22-14-8-4-7-13(10-14)17-15(19)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)","IDOWTHOLJBTAFI-UHFFFAOYSA-N"
"C=CCOC(=O)C(C)(C)OC(=O)c(c(Cl)2)cc(cc2)N(C(=O)1)C(=O)N(C)C(=C1)C(F)(F)F","InChI=1S/C20H18ClF3N2O6/c1-5-8-31-17(29)19(2,3)32-16(28)12-9-11(6-7-13(12)21)26-15(27)10-14(20(22,23)24)25(4)18(26)30/h5-7,9-10H,1,8H2,2-4H3","JEDYYFXHPAIBGR-UHFFFAOYSA-N"
"CCCCOC(=O)N(C)SN(C)C(=O)Oc(c2)c(O1)c(cc2)CC(C)(C)1","InChI=1S/C18H26N2O5S/c1-6-7-11-23-16(21)19(4)26-20(5)17(22)24-14-10-8-9-13-12-18(2,3)25-15(13)14/h8-10H,6-7,11-12H2,1-5H3","HAWJXYBZNNRMNO-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)C(=O)COc(n(C)2)c(c(C)n2)C(=O)c(c1)c(Cl)c(C)c(Cl)c1","InChI=1S/C22H20Cl2N2O3/c1-12-5-7-15(8-6-12)18(27)11-29-22-19(14(3)25-26(22)4)21(28)16-9-10-17(23)13(2)20(16)24/h5-10H,11H2,1-4H3","JDWQITFHZOBBFE-UHFFFAOYSA-N"
"C(C(O)43)(C5)=CC=CC(C)CC(=CCC(C2)(OC(C1)(CC2(OC(=O)C(C=C(C(O)C4(O5)[H])C)3[H])[H])OC(C)C(C1)C)[H])C","InChI=1S/C31H44O7/c1-18-7-6-8-23-17-35-28-27(32)21(4)14-26(31(23,28)34)29(33)36-25-15-24(10-9-19(2)13-18)38-30(16-25)12-11-20(3)22(5)37-30/h6-9,14,18,20,22,24-28,32,34H,10-13,15-17H2,1-5H3/b7-6+,19-9+,23-8+/t18-,20-,22+,24+,25-,26-,27+,28+,30-,31+/m0/s1","ZLBGSRMUSVULIE-GSMJGMFJSA-N"
"C(C14O)([H])(O5)C(O)C(=CC1(C(OC(C2)([H])CC(CC=C(C)CC(C)C=CC=C4C5)(OC(O3)2CCC(C)C3CC)[H])=O)[H])C","InChI=1S/C32H46O7/c1-6-27-21(4)12-13-31(39-27)17-25-16-24(38-31)11-10-20(3)14-19(2)8-7-9-23-18-36-29-28(33)22(5)15-26(30(34)37-25)32(23,29)35/h7-10,15,19,21,24-29,33,35H,6,11-14,16-18H2,1-5H3/b8-7+,20-10+,23-9+/t19-,21-,24+,25-,26-,27+,28+,29+,31+,32+/m0/s1","VOZIAWLUULBIPN-LRBNAKOISA-N"
"CCOC(=O)C(C)OC(=O)c(c1)c(N(=O)=O)ccc(Oc(c2)c(Cl)cc(c2)C(F)(F)F)1","InChI=1S/C19H15ClF3NO7/c1-3-29-17(25)10(2)30-18(26)13-9-12(5-6-15(13)24(27)28)31-16-7-4-11(8-14(16)20)19(21,22)23/h4-10H,3H2,1-2H3","CONWAEURSVPLRM-UHFFFAOYSA-N"
"COc(c2)c(C)c(cc2)C(=O)NN(C(C)(C)C)C(=O)c(c1)cc(C)cc(C)1","InChI=1S/C22H28N2O3/c1-14-11-15(2)13-17(12-14)21(26)24(22(4,5)6)23-20(25)18-9-8-10-19(27-7)16(18)3/h8-13H,1-7H3,(H,23,25)","QCAWEPFNJXQPAN-UHFFFAOYSA-N"
"OC(=O)CCCOc(c1)c(C)cc(Cl)c1","InChI=1S/C11H13ClO3/c1-8-7-9(12)4-5-10(8)15-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14)","LLWADFLAOKUBDR-UHFFFAOYSA-N"
"N#Cc(c1)cc(I)c(O)c(I)1","InChI=1S/C7H3I2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","NRXQIUSYPAHGNM-UHFFFAOYSA-N"
"O=N(=O)c(c2)c(C(O)=O)cc(c2)Oc(c1)c(Cl)cc(c1)C(F)(F)F","InChI=1S/C14H7ClF3NO5/c15-10-5-7(14(16,17)18)1-4-12(10)24-8-2-3-11(19(22)23)9(6-8)13(20)21/h1-6H,(H,20,21)","NUFNQYOELLVIPL-UHFFFAOYSA-N"
"OC(=O)c(c2)c(nc(c3)c(ccc3)2)C(N1)=NC(C)(C(C)C)C(=O)1","InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)","CABMTIJINOIHOD-UHFFFAOYSA-N"
"OC(=O)C(C)Oc(c1)cc(Cl)cc1","InChI=1S/C9H9ClO3/c1-6(9(11)12)13-8-4-2-3-7(10)5-8/h2-6H,1H3,(H,11,12)","YNTJKQDWYXUTLZ-UHFFFAOYSA-N"
"CCOC(=N3)n(n1)c(C=C(F)3)nc1S(=O)(=O)Nc(c(Cl)2)c(ccc2)C(=O)OC","InChI=1S/C15H13ClFN5O5S/c1-3-27-15-18-10(17)7-11-19-14(20-22(11)15)28(24,25)21-12-8(13(23)26-2)5-4-6-9(12)16/h4-7,21H,3H2,1-2H3","BIKACRYIQSLICJ-UHFFFAOYSA-N"
"OC(=O)C(C2)(C2)C(=O)Nc(c(Cl)1)c(Cl)ccc1","InChI=1S/C11H9Cl2NO3/c12-6-2-1-3-7(13)8(6)14-9(15)11(4-5-11)10(16)17/h1-3H,4-5H2,(H,14,15)(H,16,17)","ZDPIRDKFNASDAO-UHFFFAOYSA-N"
"OC(=O)C(C2)(C2)C(=O)Nc(c1)c(Cl)cc(Cl)c1","InChI=1S/C11H9Cl2NO3/c12-6-1-2-8(7(13)5-6)14-9(15)11(3-4-11)10(16)17/h1-2,5H,3-4H2,(H,14,15)(H,16,17)","GLWWLNJJJCTFMZ-UHFFFAOYSA-N"
"CCOC(=N3)n(n1)c(C=C(F)3)nc1S(=O)(=O)Nc(c(Cl)2)c(Cl)ccc2","InChI=1S/C13H10Cl2FN5O3S/c1-2-24-13-17-9(16)6-10-18-12(19-21(10)13)25(22,23)20-11-7(14)4-3-5-8(11)15/h3-6,20H,2H2,1H3","QNXAVFXEJCPCJO-UHFFFAOYSA-N"
"OC(=O)C(C)Oc(c1)c(Cl)cc(Cl)c1","InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)","MZHCENGPTKEIGP-UHFFFAOYSA-N"
"O=C(Nc(c2)cccc2)Nc(c1)snn1","InChI=1S/C9H8N4OS/c14-9(12-8-6-10-13-15-8)11-7-4-2-1-3-5-7/h1-6H,(H2,11,12,14)","HFCYZXMHUIHAQI-UHFFFAOYSA-N"
"COc(n2)nc(nc(C)2)NC(=O)NS(=O)(=O)c(c1)c(sc1)C(=O)OC","InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)","AHTPATJNIAFOLR-UHFFFAOYSA-N"
"OC(=O)COc(n1)c(Cl)cc(Cl)c(Cl)1","InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)","REEQLXCGVXDJSQ-UHFFFAOYSA-N"
"COC(=O)c(c2)c(c(C)cc2)S(=O)(=O)NC(=O)Nc(n1)nc(OCC(F)(F)F)nc(N(C)C)1","InChI=1S/C17H19F3N6O6S/c1-9-6-5-7-10(12(27)31-4)11(9)33(29,30)25-15(28)22-13-21-14(26(2)3)24-16(23-13)32-8-17(18,19)20/h5-7H,8H2,1-4H3,(H2,21,22,23,24,25,28)","IMEVJVISCHQJRM-UHFFFAOYSA-N"
"OC(=O)C(C)Oc(c2)ccc(c2)Oc(n1)c(Cl)cc(c1)C(F)(F)F","InChI=1S/C15H11ClF3NO4/c1-8(14(21)22)23-10-2-4-11(5-3-10)24-13-12(16)6-9(7-20-13)15(17,18)19/h2-8H,1H3,(H,21,22)","GOCUAJYOYBLQRH-UHFFFAOYSA-N"
"CC(C=3)=Nc(n1)n(C3)nc1S(=O)(=O)Nc(c(F)2)c(F)ccc2","InChI=1S/C12H9F2N5O2S/c1-7-5-6-19-11(15-7)16-12(17-19)22(20,21)18-10-8(13)3-2-4-9(10)14/h2-6,18H,1H3","RXCPQSJAVKGONC-UHFFFAOYSA-N"
"OC(=O)COc(n1)c(Cl)c(N)c(Cl)c(F)1","InChI=1S/C7H5Cl2FN2O3/c8-3-5(11)4(9)7(12-6(3)10)15-1-2(13)14/h1H2,(H2,11,12)(H,13,14)","MEFQWPUMEMWTJP-UHFFFAOYSA-N"
"N#Cc(c1)cc(Br)c(O)c(Br)1","InChI=1S/C7H3Br2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","UPMXNNIRAGDFEH-UHFFFAOYSA-N"
"COC(=N3)n(n1)c(C(F)=C3)nc1S(=O)(=O)Nc(c(F)2)c(F)ccc2","InChI=1S/C12H8F3N5O3S/c1-23-12-16-5-8(15)10-17-11(18-20(10)12)24(21,22)19-9-6(13)3-2-4-7(9)14/h2-5,19H,1H3","QZXATCCPQKOEIH-UHFFFAOYSA-N"
"O=N(=O)c(c2)c(cc(c2)Oc(c1)c(Cl)cc(c1)C(F)(F)F)C(=O)NS(C)(=O)=O","InChI=1S/C15H10ClF3N2O6S/c1-28(25,26)20-14(22)10-7-9(3-4-12(10)21(23)24)27-13-5-2-8(6-11(13)16)15(17,18)19/h2-7H,1H3,(H,20,22)","BGZZWXTVIYUUEY-UHFFFAOYSA-N"
"O=C(Nc(c2)cccc2)Nc(c1)cc(Cl)nc1","InChI=1S/C12H10ClN3O/c13-11-8-10(6-7-14-11)16-12(17)15-9-4-2-1-3-5-9/h1-8H,(H2,14,15,16,17)","GPXLRLUVLMHHIK-UHFFFAOYSA-N"
"OC(=O)C(C)Oc(c1)c(C)cc(Cl)c1","InChI=1S/C10H11ClO3/c1-6-5-8(11)3-4-9(6)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13)","WNTGYJSOUMFZEP-UHFFFAOYSA-N"
"CNCCCC(c21)c(c3)c(ccc3)C=Cc(cccc2)1","InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3","BWPIARFWQZKAIA-UHFFFAOYSA-N"
"COc(c4)cc(c3c4)c(ccn3)C(O)C([H])(C1)N(C2)CC(C=C)C(C2)1","InChI=1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19+,20-/m0/s1","LOUPRKONTZGTKE-LHHVKLHASA-N"
"CNC(C2)c(c3)c(ccc3)C(C2)c(c1)cc(Cl)c(Cl)c1","InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17-/m0/s1","VGKDLMBJGBXTGI-SJCJKPOMSA-N"
"Clc(c2)cc(C=1C(C3)=CCCC3)c(c2)N(C)C(=O)CN1","InChI=1S/C16H17ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h5,7-9H,2-4,6,10H2,1H3","IQWYAQCHYZHJOS-UHFFFAOYSA-N"
"OC(=O)CCCCCCNC(c21)c(c3)c(cc(Cl)c3)S(=O)(=O)N(C)c(cccc2)1","InChI=1S/C21H25ClN2O4S/c1-24-18-9-6-5-8-16(18)21(23-13-7-3-2-4-10-20(25)26)17-12-11-15(22)14-19(17)29(24,27)28/h5-6,8-9,11-12,14,21,23H,2-4,7,10,13H2,1H3,(H,25,26)","JICJBGPOMZQUBB-UHFFFAOYSA-N"
"COc(c2)ccc(c2)C(CN(C)C)C(O)(C1)CCCC1","InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3","PNVNVHUZROJLTJ-UHFFFAOYSA-N"
"CN(C)C(=O)Cc(n32)c(nc(C=CC(C)=C3)2)c(c1)ccc(C)c1","InChI=1S/C19H21N3O/c1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19/h5-10,12H,11H2,1-4H3","ZAFYATHCZYHLPB-UHFFFAOYSA-N"
"CN(C4)CCN(C4)C(=O)OC(c21)N(c(c3)ncc(Cl)c3)C(=O)c(nccn2)1","InChI=1S/C17H17ClN6O3/c1-22-6-8-23(9-7-22)17(26)27-16-14-13(19-4-5-20-14)15(25)24(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3","GBBSUAFBMRNDJC-UHFFFAOYSA-N"
"Clc(c2)c(cc(c12)S(=O)(=O)NCN1)S(N)(=O)=O","InChI=1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)","JZUFKLXOESDKRF-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C(=O)1)C(=O)c(c2)c(ccc2)1","InChI=1S/C15H10O2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9,13H","NFBAXHOPROOJAW-UHFFFAOYSA-N"
"C(C23[H])(SC(C)=O)CC(C(C2([H])CCC(C(C5)(OC(=O)C5)4)(C3([H])CC4)C)(C)1)=CC(=O)CC1","InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1","LXMSZDCAJNLERA-ZHYRCANASA-N"
"Clc(c3)cc(C=1c(c4)c(Cl)ccc4)c(c3)n(c(C)2)c(nn2)CN1","InChI=1S/C17H12Cl2N4/c1-10-21-22-16-9-20-17(12-4-2-3-5-14(12)19)13-8-11(18)6-7-15(13)23(10)16/h2-8H,9H2,1H3","JOFWLTCLBGQGBO-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)1)C(C#CC(C2)C2)(OC(=O)N1)C(F)(F)F","InChI=1S/C14H9ClF3NO2/c15-9-3-4-11-10(7-9)13(14(16,17)18,21-12(20)19-11)6-5-8-1-2-8/h3-4,7-8H,1-2H2,(H,19,20)/t13-/m0/s1","XPOQHMRABVBWPR-ZDUSSCGKSA-N"
"OCC(=O)C(O)(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(=O)3)C(C)(C2)C(=CC(=O)C2)C1","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h9,14-15,18,22,26H,3-8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1","MFYSYFVPBJMHGN-ZPOLXVRWSA-N"
"CC(N)Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C10H13NO2/c1-7(11)4-8-2-3-9-10(5-8)13-6-12-9/h2-3,5,7H,4,6,11H2,1H3","NGBBVGZWCFBOGO-UHFFFAOYSA-N"
"CC(N)Cc(c1)cccc1","InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3","KWTSXDURSIMDCE-UHFFFAOYSA-N"
"Fc(c4)ccc(c4)C(=O)CCCN(C3)CC=C(C3)N(C(=O)1)c(c2)c(ccc2)N1","InChI=1S/C22H22FN3O2/c23-17-9-7-16(8-10-17)21(27)6-3-13-25-14-11-18(12-15-25)26-20-5-2-1-4-19(20)24-22(26)28/h1-2,4-5,7-11H,3,6,12-15H2,(H,24,28)","RMEDXOLNCUSCGS-UHFFFAOYSA-N"
"OCC(C3)OC(C3)n(c2)c(n1)c(n2)c(O)nc1","InChI=1S/C10H12N4O3/c15-3-6-1-2-7(17-6)14-5-13-8-9(14)11-4-12-10(8)16/h4-7,15H,1-3H2,(H,11,12,16)/t6-,7+/m0/s1","BXZVVICBKDXVGW-NKWVEPMBSA-N"
"ClCCc(s1)c(C)nc1","InChI=1S/C6H8ClNS/c1-5-6(2-3-7)9-4-8-5/h4H,2-3H2,1H3","PCLITLDOTJTVDJ-UHFFFAOYSA-N"
"C=CC(N)CCC(O)=O","InChI=1S/C6H11NO2/c1-2-5(7)3-4-6(8)9/h2,5H,1,3-4,7H2,(H,8,9)","PJDFLNIOAUIZSL-UHFFFAOYSA-N"
"CCCC(CCC)C(N)=O","InChI=1S/C8H17NO/c1-3-5-7(6-4-2)8(9)10/h7H,3-6H2,1-2H3,(H2,9,10)","OMOMUFTZPTXCHP-UHFFFAOYSA-N"
"O(c(c1OCC)c(c(C2C(N3C)Cc(c5OC)c(cc(c45)OCO4)C3)c(C(O2)=O)c1N)OCC)CC","InChI=1S/C26H32N2O8/c1-6-31-23-18-17(19(27)24(32-7-2)25(23)33-8-3)26(29)36-21(18)15-10-14-13(11-28(15)4)9-16-22(20(14)30-5)35-12-34-16/h9,15,21H,6-8,10-12,27H2,1-5H3","HPZAECZDDHOSOA-UHFFFAOYSA-N"
"C(C(c54)OC(=O)c4c(c(c(OCC)c(OCC)5)OCC)N)(N3C)c(c(CC3)1)c(OC)c(O2)c(OC2)c1","InChI=1S/C26H32N2O8/c1-6-31-23-17-16(18(27)24(32-7-2)25(23)33-8-3)26(29)36-21(17)19-15-13(9-10-28(19)4)11-14-20(22(15)30-5)35-12-34-14/h11,19,21H,6-10,12,27H2,1-5H3","IRGJVQIJENCTQF-UHFFFAOYSA-N"
"OCC(O2)CN(C(=O)2)c(c1)cc(C)cc1","InChI=1S/C11H13NO3/c1-8-3-2-4-9(5-8)12-6-10(7-13)15-11(12)14/h2-5,10,13H,6-7H2,1H3","MXUNKHLAEDCYJL-UHFFFAOYSA-N"
"C(c(c4)cccc4)(c(c3)cccc3)(C(C2)CCN(C2)CCCC(O)c(c1)ccc(C(C)(C)C)c1)O","InChI=1S/C32H41NO2/c1-31(2,3)26-18-16-25(17-19-26)30(34)15-10-22-33-23-20-29(21-24-33)32(35,27-11-6-4-7-12-27)28-13-8-5-9-14-28/h4-9,11-14,16-19,29-30,34-35H,10,15,20-24H2,1-3H3","GUGOEEXESWIERI-UHFFFAOYSA-N"
"CN(C4)CCC(C4)=C(c21)c(c3)c(sc3)CCc(cccc2)1","InChI=1S/C19H21NS/c1-20-11-8-15(9-12-20)19-16-5-3-2-4-14(16)6-7-18-17(19)10-13-21-18/h2-5,10,13H,6-9,11-12H2,1H3","FIADGNVRKBPQEU-UHFFFAOYSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc3)S(=O)(=O)c(cccc2)1","InChI=1S/C18H22N2O2S/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)23(21,22)18-11-7-5-9-16(18)20/h4-11,14H,12-13H2,1-3H3","QTQPVLDZQVPLGV-UHFFFAOYSA-N"
"CN(C)CC(Oc(c2)cccc2)Oc(c1)cccc1","InChI=1S/C16H19NO2/c1-17(2)13-16(18-14-9-5-3-6-10-14)19-15-11-7-4-8-12-15/h3-12,16H,13H2,1-2H3","QNMGHBMGNRQPNL-UHFFFAOYSA-N"
"O=C(N3)OC(C3)(C1)CCN(CCc(c2)cccc2)C1","InChI=1S/C15H20N2O2/c18-14-16-12-15(19-14)7-10-17(11-8-15)9-6-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,16,18)","FVNFBBAOMBJTST-UHFFFAOYSA-N"
"COC(=O)C(C(O)1)C(C2)N(C)C(C2)C1","InChI=1S/C10H17NO3/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2/h6-9,12H,3-5H2,1-2H3/t6-,7+,8-,9+/m0/s1","QIQNNBXHAYSQRY-UYXSQOIJSA-N"
"CN(C)C(C)CN(c21)c(c3)c(ccc3S(=O)(=O)N(C)C)Sc(cccc2)1","InChI=1S/C19H25N3O2S2/c1-14(20(2)3)13-22-16-8-6-7-9-18(16)25-19-11-10-15(12-17(19)22)26(23,24)21(4)5/h6-12,14H,13H2,1-5H3","VWNWVCJGUMZDIU-UHFFFAOYSA-N"
"CN(C)CCC(c(c2)nccc2)c(c1)ccc(Br)c1","InChI=1S/C16H19BrN2/c1-19(2)12-10-15(16-5-3-4-11-18-16)13-6-8-14(17)9-7-13/h3-9,11,15H,10,12H2,1-2H3","ZDIGNSYAACHWNL-UHFFFAOYSA-N"
"C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(CC5=C(C4)NN=C5)C","InChI=1S/C21H32N2O/c1-19-11-13-12-22-23-18(13)10-14(19)4-5-15-16(19)6-8-20(2)17(15)7-9-21(20,3)24/h12,14-17,24H,4-11H2,1-3H3,(H,22,23)/t14-,15+,16-,17-,19-,20-,21-/m0/s1","LKAJKIOFIWVMDJ-IYRCEVNGSA-N"
"Fc(c5)cc(o4)c(c5)c(n4)C(C3)CCN(C3)CCC(=C(C)1)C(=O)N(C2)C(CCC2)=N1","InChI=1S/C23H27FN4O2/c1-15-18(23(29)28-10-3-2-4-21(28)25-15)9-13-27-11-7-16(8-12-27)22-19-6-5-17(24)14-20(19)30-26-22/h5-6,14,16H,2-4,7-13H2,1H3","RAPZEAPATHNIPO-UHFFFAOYSA-N"
"CCCC(C)C(CC)(C(=O)1)C(=O)N=C(O)N1","InChI=1S/C11H18N2O3/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)","WEXRUCMBJFQVBZ-UHFFFAOYSA-N"
"CCOC(=O)c(n3)c(C1)n(c3)c(c2)c(cc(F)c2)C(=O)N(C)1","InChI=1S/C15H14FN3O3/c1-3-22-15(21)13-12-7-18(2)14(20)10-6-9(16)4-5-11(10)19(12)8-17-13/h4-6,8H,3,7H2,1-2H3","OFBIFZUFASYYRE-UHFFFAOYSA-N"
"CCCCOCC(OC(N)=O)CN(C(=O)1)C(=O)C(CC)(c(c2)cccc2)C(=O)N1","InChI=1S/C20H27N3O6/c1-3-5-11-28-13-15(29-18(21)26)12-23-17(25)20(4-2,16(24)22-19(23)27)14-9-7-6-8-10-14/h6-10,15H,3-5,11-13H2,1-2H3,(H2,21,26)(H,22,24,27)","QHZQILHUJDRDAI-UHFFFAOYSA-N"
"CN(C)CCOC(C)(c(c2)cccc2)c(c1)nccc1","InChI=1S/C17H22N2O/c1-17(20-14-13-19(2)3,15-9-5-4-6-10-15)16-11-7-8-12-18-16/h4-12H,13-14H2,1-3H3","HCFDWZZGGLSKEP-UHFFFAOYSA-N"
"","InChI=1S/C41H64O14/c1-19-36(47)28(42)15-34(50-19)54-38-21(3)52-35(17-30(38)44)55-37-20(2)51-33(16-29(37)43)53-24-8-10-39(4)23(13-24)6-7-26-27(39)14-31(45)40(5)25(9-11-41(26,40)48)22-12-32(46)49-18-22/h12,19-21,23-31,33-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23-,24+,25-,26-,27+,28+,29+,30+,31-,33+,34+,35+,36-,37-,38-,39+,40+,41+/m1/s1","LTMHDMANZUZIPE-PUGKRICDSA-N"
"","InChI=1S/C41H64O13/c1-20-36(46)29(42)16-34(49-20)53-38-22(3)51-35(18-31(38)44)54-37-21(2)50-33(17-30(37)43)52-25-8-11-39(4)24(15-25)6-7-28-27(39)9-12-40(5)26(10-13-41(28,40)47)23-14-32(45)48-19-23/h14,20-22,24-31,33-38,42-44,46-47H,6-13,15-19H2,1-5H3/t20-,21-,22-,24-,25+,26-,27+,28-,29+,30+,31+,33+,34+,35+,36-,37-,38-,39+,40-,41+/m1/s1","WDJUZGPOPHTGOT-XUDUSOBPSA-N"
"O(CC(OC(N)=O)CN(C(=O)1)C(N(C(=O)C1(CC)c(c2)cccc2)CC(COCCCC)OC(N)=O)=O)CCCC","InChI=1S/C28H42N4O9/c1-4-7-14-38-18-21(40-25(29)35)16-31-23(33)28(6-3,20-12-10-9-11-13-20)24(34)32(27(31)37)17-22(41-26(30)36)19-39-15-8-5-2/h9-13,21-22H,4-8,14-19H2,1-3H3,(H2,29,35)(H2,30,36)","GJJRIOLBUILIGK-UHFFFAOYSA-N"
"CCCC(C)C(CC)(C(=O)1)C(=O)NC(=S)N1","InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)","IUJDSEJGGMCXSG-UHFFFAOYSA-N"
"[N-1]=[N+1]=NC(C1)C(CO)OC1N(C=2)C(=O)NC(=O)C(C)2","InChI=1S/C10H13N5O4/c1-5-3-15(10(18)12-9(5)17)8-2-6(13-14-11)7(4-16)19-8/h3,6-8,16H,2,4H2,1H3,(H,12,17,18)/t6-,7-,8-/m1/s1","HBOMLICNUCNMMY-BWZBUEFSSA-N"
"CCOc(c2)c(ccc2)OCC(C1)OCCN1","InChI=1S/C13H19NO3/c1-2-15-12-5-3-4-6-13(12)17-10-11-9-14-7-8-16-11/h3-6,11,14H,2,7-10H2,1H3","YWPHCCPCQOJSGZ-UHFFFAOYSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc3)CCc(cccc2)1","InChI=1S/C20H26N2/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22/h4-11,16H,12-15H2,1-3H3","ZSCDBOWYZJWBIY-UHFFFAOYSA-N"
"COc(c3)c(OC)cc(c3)C(=N1)c(c2)c(cc(OC)c(OC)2)C(CC)C(C)=N1","InChI=1S/C22H26N2O4/c1-7-15-13(2)23-24-22(14-8-9-18(25-3)19(10-14)26-4)17-12-21(28-6)20(27-5)11-16(15)17/h8-12,15H,7H2,1-6H3","RUJBDQSFYCKFAA-UHFFFAOYSA-N"
"Clc(c3)c(ccc3)CN(C1)Cc(c2)c(sc2)C1","InChI=1S/C14H14ClNS/c15-13-4-2-1-3-11(13)9-16-7-5-14-12(10-16)6-8-17-14/h1-4,6,8H,5,7,9-10H2","PHWBOXQYWZNQIN-UHFFFAOYSA-N"
"COCC(C2)(CCN(CCc(c3)scc3)C2)N(C(=O)CC)c(c1)cccc1","InChI=1S/C22H30N2O2S/c1-3-21(25)24(19-8-5-4-6-9-19)22(18-26-2)12-15-23(16-13-22)14-11-20-10-7-17-27-20/h4-10,17H,3,11-16,18H2,1-2H3","GGCSSNBKKAUURC-UHFFFAOYSA-N"
"c(c7)cc(c(c7)1)N(C(=O)6)C([H])(C([H])45)C(C2)1C(C3)N(CC(=CCOC([H])(C6)5)C34)C2","InChI=1S/C21H22N2O2/c24-18-10-16-19-13-9-17-21(6-7-22(17)11-12(13)5-8-25-16)14-3-1-2-4-15(14)23(18)20(19)21/h1-5,13,16-17,19-20H,6-11H2/t13-,16-,17-,19-,20-,21+/m0/s1","QMGVPVSNSZLJIA-FVWCLLPLSA-N"
"CC(C)NCC(O)c(c1)ccc(c1)NS(C)(=O)=O","InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3","ZBMZVLHSJCTVON-UHFFFAOYSA-N"
"CCN(CC)C(=O)[C@H]1CN[C@@H]2CC3=CNC4=CC=CC(=C34)C2=C1","InChI=1S/C19H23N3O/c1-3-22(4-2)19(23)13-8-15-14-6-5-7-16-18(14)12(10-20-16)9-17(15)21-11-13/h5-8,10,13,17,20-21H,3-4,9,11H2,1-2H3/t13-,17-/m1/s1","SUXLVXOMPKZBOV-CXAGYDPISA-N"
"CCOC(=O)C(C(OC(=O)c(c3)cccc3)1)C(C2)N(C)C(C2)C1","InChI=1S/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3/t13-,14+,15-,16+/m0/s1","NMPOSNRHZIWLLL-XUWVNRHRSA-N"
"COC(=O)C(C(OC(=O)c(c3)cccc3)1)C(C2)N(C)C(C2)C1","InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14-,15+/m0/s1","ZPUCINDJVBIVPJ-LJISPDSOSA-N"
"OC(=O)C(C(OC(=O)c(c3)cccc3)1)C(C2)N(C)C(C2)C1","InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11-,12+,13-,14+/m0/s1","GVGYEFKIHJTNQZ-RFQIPJPRSA-N"
"OCc(c1)c(O)ccc1C(O)CNC(C)(C)C","InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3","NDAUXUAQIAJITI-UHFFFAOYSA-N"
"CCCNCC(O)COc(c2)c(ccc2)C(=O)CCc(c1)cccc1","InChI=1S/C21H27NO3/c1-2-14-22-15-18(23)16-25-21-11-7-6-10-19(21)20(24)13-12-17-8-4-3-5-9-17/h3-11,18,22-23H,2,12-16H2,1H3","JWHAUXFOSRPERK-UHFFFAOYSA-N"
"NC(=O)CCCN=C(c(c2)ccc(Cl)c2)c(c1)c(O)ccc(F)1","InChI=1S/C17H16ClFN2O2/c18-12-5-3-11(4-6-12)17(21-9-1-2-16(20)23)14-10-13(19)7-8-15(14)22/h3-8,10,22H,1-2,9H2,(H2,20,23)/b21-17+","IBALRBWGSVJPAP-HEHNFIMWSA-N"
"Clc(c3)cc(C=1c(c4)cccc4)c(c3)N(CC(C2)C2)C(=O)CN1","InChI=1S/C19H17ClN2O/c20-15-8-9-17-16(10-15)19(14-4-2-1-3-5-14)21-11-18(23)22(17)12-13-6-7-13/h1-5,8-10,13H,6-7,11-12H2","MWQCHHACWWAQLJ-UHFFFAOYSA-N"
"OC(=O)c(c1)cc(S(N)(=O)=O)c(Oc(c3)cccc3)c1N(C2)CCC2","InChI=1S/C17H18N2O5S/c18-25(22,23)15-11-12(17(20)21)10-14(19-8-4-5-9-19)16(15)24-13-6-2-1-3-7-13/h1-3,6-7,10-11H,4-5,8-9H2,(H,20,21)(H2,18,22,23)","UJEWTUDSLQGTOA-UHFFFAOYSA-N"
"CC(C)=CCN(C3)C([H])(C1)C([H])(C)C(C)(C3)c(c2)c(ccc(O)2)1","InChI=1S/C19H27NO/c1-13(2)7-9-20-10-8-19(4)14(3)18(20)11-15-5-6-16(21)12-17(15)19/h5-7,12,14,18,21H,8-11H2,1-4H3/t14-,18+,19+/m0/s1","VOKSWYLNZZRQPF-GDIGMMSISA-N"
"NC(=O)N(c21)c(c3)c(ccc3)C(O)=Cc(cccc2)1","InChI=1S/C15H12N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-9,18H,(H2,16,19)","WRIZWKOAYKZGHB-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)2)C(=NC(O)C(=O)N2)c(c1)cccc1","InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)/t15-/m0/s1","ADIMAYPTOBDMTL-HNNXBMFYSA-N"
"OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc3)C=Cc(cccc2)1","InChI=1S/C23H29N3O/c27-19-18-25-16-14-24(15-17-25)12-5-13-26-22-8-3-1-6-20(22)10-11-21-7-2-4-9-23(21)26/h1-4,6-11,27H,5,12-19H2","YNZFUWZUGRBMHL-UHFFFAOYSA-N"
"O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)cccc1","InChI=1S/C15H11ClN2O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9H2,(H,18,19)","AKPLHCDWDRPJGD-UHFFFAOYSA-N"
"Clc(c3)cc(c(c3)2)C(=NCCN(C)2)c(c1)cccc1","InChI=1S/C16H15ClN2/c1-19-10-9-18-16(12-5-3-2-4-6-12)14-11-13(17)7-8-15(14)19/h2-8,11H,9-10H2,1H3","YLCXGBZIZBEVPZ-UHFFFAOYSA-N"
"O=N(=O)c(c3)cc(c2c3)C(=NCC(=O)N2)c(c1)cccc1","InChI=1S/C15H11N3O3/c19-14-9-16-15(10-4-2-1-3-5-10)12-8-11(18(20)21)6-7-13(12)17-14/h1-8H,9H2,(H,17,19)","KJONHKAYOJNZEC-UHFFFAOYSA-N"
"c(c(O)1)(c(C(=O)NC(C(O)CN(C(C(NC(C)(C)C)=O)4)CC(C(C4)3[H])(CCCC3)[H])CSc(c2)cccc2)ccc1)C","InChI=1S/C32H45N3O4S/c1-21-25(15-10-16-28(21)36)30(38)33-26(20-40-24-13-6-5-7-14-24)29(37)19-35-18-23-12-9-8-11-22(23)17-27(35)31(39)34-32(2,3)4/h5-7,10,13-16,22-23,26-27,29,36-37H,8-9,11-12,17-20H2,1-4H3,(H,33,38)(H,34,39)/t22-,23+,26-,27-,29+/m0/s1","QAGYKUNXZHXKMR-HKWSIXNMSA-N"
"Oc(c6)c(O5)c(c(c6)3)C(C1)(C45)C(O)(CCC(=O)4)C(C3)N(CC(C2)C2)C1","InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1","DQCKKXVULJGBQN-XFWGSAIBSA-N"
"NC(=O)OCC(c21)C(OC)(C43)N(CC(N4)3)c(c(=O)c(C)c(N)c(=O)2)1","InChI=1S/C15H18N4O5/c1-5-9(16)12(21)8-6(4-24-14(17)22)15(23-2)13-7(18-13)3-19(15)10(8)11(5)20/h6-7,13,18H,3-4,16H2,1-2H3,(H2,17,22)/t6-,7+,13+,15-/m1/s1","NWIBSHFKIJFRCO-WUDYKRTCSA-N"
"CCOC(=O)C(C(=O)1)N=C(c(c3)c(F)ccc3)c(c2)c(ccc(Cl)2)N1","InChI=1S/C18H14ClFN2O3/c1-2-25-18(24)16-17(23)21-14-8-7-10(19)9-12(14)15(22-16)11-5-3-4-6-13(11)20/h3-9,16H,2H2,1H3,(H,21,23)","CUCHJCMWNFEYOM-UHFFFAOYSA-N"
"C(C(NC(=O)C(CC(CN(C4)C(C(=O)NC(C)(C)C)CN(Cc(c5)cncc5)C4)O)Cc(c3)cccc3)1)(Cc(c2)c1ccc2)O","InChI=1S/C36H47N5O4/c1-36(2,3)39-35(45)31-24-40(22-26-12-9-15-37-21-26)16-17-41(31)23-29(42)19-28(18-25-10-5-4-6-11-25)34(44)38-33-30-14-8-7-13-27(30)20-32(33)43/h4-15,21,28-29,31-33,42-43H,16-20,22-24H2,1-3H3,(H,38,44)(H,39,45)/t28-,29+,31+,32-,33+/m1/s1","CBVCZFGXHXORBI-PXQQMZJSSA-N"
"O=C(NN(C(C)2)c(c3)c(ccc3)C2)c(c1)cc(c(Cl)c1)S(N)(=O)=O","InChI=1S/C16H16ClN3O3S/c1-10-8-11-4-2-3-5-14(11)20(10)19-16(21)12-6-7-13(17)15(9-12)24(18,22)23/h2-7,9-10H,8H2,1H3,(H,19,21)(H2,18,22,23)","NDDAHWYSQHTHNT-UHFFFAOYSA-N"
"CC(C3)CCC(C3)NC(=O)NS(=O)(=O)c(c1)ccc(CCNC(=O)N(C2)C(=O)C(CC)=C(C)2)c1","InChI=1S/C24H34N4O5S/c1-4-21-17(3)15-28(22(21)29)24(31)25-14-13-18-7-11-20(12-8-18)34(32,33)27-23(30)26-19-9-5-16(2)6-10-19/h7-8,11-12,16,19H,4-6,9-10,13-15H2,1-3H3,(H,25,31)(H2,26,27,30)/t16-,19-","WIGIZIANZCJQQY-RUCARUNLSA-N"
"COCCCCC(=NOCCN)c(c1)ccc(c1)C(F)(F)F","InChI=1S/C15H21F3N2O2/c1-21-10-3-2-4-14(20-22-11-9-19)12-5-7-13(8-6-12)15(16,17)18/h5-8H,2-4,9-11,19H2,1H3/b20-14-","CJOFXWAVKWHTFT-ZHZULCJRSA-N"
"CCN(CC)CCN(C(=O)2)c(c3)c(cc(Cl)c3)C(=NC2)c(c1)c(F)ccc1","InChI=1S/C21H23ClFN3O/c1-3-25(4-2)11-12-26-19-10-9-15(22)13-17(19)21(24-14-20(26)27)16-7-5-6-8-18(16)23/h5-10,13H,3-4,11-12,14H2,1-2H3","SAADBVWGJQAEFS-UHFFFAOYSA-N"
"C(C2)CNC(C2)CNC(=O)c(c1)c(OCC(F)(F)F)ccc(OCC(F)(F)F)1","InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)","DJBNUMBKLMJRSA-UHFFFAOYSA-N"
"Clc(c3)cc(C=1c(c4)cccc4)c(c3)n(c2)c(nn2)CN1","InChI=1S/C16H11ClN4/c17-12-6-7-14-13(8-12)16(11-4-2-1-3-5-11)18-9-15-20-19-10-21(14)15/h1-8,10H,9H2","CDCHDCWJMGXXRH-UHFFFAOYSA-N"
"C(c(c4)cccc4)(c(c3)cccc3)(C(=O)1)C(CCN(C2)CCOC2)CN(CC)1","InChI=1S/C24H30N2O2/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21/h3-12,22H,2,13-19H2,1H3","XFDJYSQDBULQSI-UHFFFAOYSA-N"
"Clc(c5)cc(N1)c(c5)N(C(C2)CCN(CCCN(C(=O)3)c(c4)c(ccc4)N3)C2)C(=O)1","InChI=1S/C22H24ClN5O2/c23-15-6-7-20-18(14-15)25-22(30)28(20)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)","FGXWKSZFVQUSTL-UHFFFAOYSA-N"
"CC(C)N(C(C)C)CCC(C(N)=O)(c(c2)cccc2)c(c1)nccc1","InChI=1S/C21H29N3O/c1-16(2)24(17(3)4)15-13-21(20(22)25,18-10-6-5-7-11-18)19-12-8-9-14-23-19/h5-12,14,16-17H,13,15H2,1-4H3,(H2,22,25)","UVTNFZQICZKOEM-UHFFFAOYSA-N"
"Clc(c4)c(cc(c43)S(=O)(=O)NC(N3)C(C1)C(C=2)CC(C2)1)S(N)(=O)=O","InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20)","BOCUKUHCLICSIY-UHFFFAOYSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc(C#N)3)Sc(cccc2)1","InChI=1S/C19H21N3S/c1-14(12-21(2)3)13-22-16-6-4-5-7-18(16)23-19-9-8-15(11-20)10-17(19)22/h4-10,14H,12-13H2,1-3H3","SLFGIOIONGJGRT-UHFFFAOYSA-N"
"CN(C)CCN(C(=O)1)c(c3)c(ccc3)SC(c(c2)ccc(OC)c2)C(OC(C)=O)1","InChI=1S/C22H26N2O4S/c1-15(25)28-20-21(16-9-11-17(27-4)12-10-16)29-19-8-6-5-7-18(19)24(22(20)26)14-13-23(2)3/h5-12,20-21H,13-14H2,1-4H3/t20-,21+/m1/s1","HSUGRBWQSSZJOP-RTWAWAEBSA-N"
"CNC(C)Cc(c1)cccc1","InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3","MYWUZJCMWCOHBA-UHFFFAOYSA-N"
"CCCCCc(c3)cc(O1)c(c(O)3)C([H])(C=2)C([H])(CCC(C(O)=O)2)C(C)(C)1","InChI=1S/C21H28O4/c1-4-5-6-7-13-10-17(22)19-15-12-14(20(23)24)8-9-16(15)21(2,3)25-18(19)11-13/h10-12,15-16,22H,4-9H2,1-3H3,(H,23,24)/t15-,16-/m1/s1","YOVRGSHRZRJTLZ-HZPDHXFCSA-N"
"CCCCCc(c3)cc(O1)c(c(O)3)C([H])(C=2)C([H])(CCC(CO)2)C(C)(C)1","InChI=1S/C21H30O3/c1-4-5-6-7-14-11-18(23)20-16-10-15(13-22)8-9-17(16)21(2,3)24-19(20)12-14/h10-12,16-17,22-23H,4-9,13H2,1-3H3/t16-,17-/m1/s1","YCBKSSAWEUDACY-IAGOWNOFSA-N"
"CCCCCc(c3)cc(O1)c(c(O)3)C([H])(C=2)C([H])(CCC(C)2)C(C)(C)1","InChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1","CYQFCXCEBYINGO-IAGOWNOFSA-N"
"NCC(O)COc(c2)c(ccc2)C(=O)CCc(c1)cccc1","InChI=1S/C18H21NO3/c19-12-15(20)13-22-18-9-5-4-8-16(18)17(21)11-10-14-6-2-1-3-7-14/h1-9,15,20H,10-13,19H2","HIGKMVIPYOFHBP-UHFFFAOYSA-N"
"O=C(C2)Nc(c3)c(cc(Cl)c3)N(C(=O)2)c(c1)cccc1","InChI=1S/C15H11ClN2O2/c16-10-6-7-12-13(8-10)18(11-4-2-1-3-5-11)15(20)9-14(19)17-12/h1-8H,9H2,(H,17,19)","RRTVVRIFVKKTJK-UHFFFAOYSA-N"
"NCCCC(O1)(c(c3)ccc(F)c3)c(c2)c(cc(C#N)c2)C1","InChI=1S/C18H17FN2O/c19-16-5-3-15(4-6-16)18(8-1-9-20)17-7-2-13(11-21)10-14(17)12-22-18/h2-7,10H,1,8-9,12,20H2/t18-/m0/s1","RKUKMUWCRLRPEJ-SFHVURJKSA-N"
"CCCC(=O)Nc(c1)cc(C(C)=O)c(OCC(O)CNC(C)C)c1","InChI=1S/C18H28N2O4/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23)","GOEMGAFJFRBGGG-UHFFFAOYSA-N"
"Clc(c3)cc(C=1c(c4)cccc4)c(c3)n(c(C)2)c(nn2)CN1","InChI=1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3","VREFGVBLTWBCJP-UHFFFAOYSA-N"
"OCc(n4)n(c(n4)2)c(c3)c(cc(Cl)c3)C(=NC2)c(c1)c(Cl)ccc1","InChI=1S/C17H12Cl2N4O/c18-10-5-6-14-12(7-10)17(11-3-1-2-4-13(11)19)20-8-15-21-22-16(9-24)23(14)15/h1-7,24H,8-9H2","BHUYWUDMVCLHND-UHFFFAOYSA-N"
"Clc(c4)cc(N=1)c(c4)Nc(c3)c(ccc3)C1N(C2)CCNC2","InChI=1S/C17H17ClN4/c18-12-5-6-15-16(11-12)21-17(22-9-7-19-8-10-22)13-3-1-2-4-14(13)20-15/h1-6,11,19-20H,7-10H2","JNNOSTQEZICQQP-UHFFFAOYSA-N"
"CC(C)OCCOCc(c1)ccc(OCC(O)CNC(C)C)c1","InChI=1S/C18H31NO4/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h5-8,14-15,17,19-20H,9-13H2,1-4H3","VHYCDWMUTMEGQY-UHFFFAOYSA-N"
"COc(c1)cc(OC)c(C(=O)CCCN(C2)CCC2)c(OC)1","InChI=1S/C17H25NO4/c1-20-13-11-15(21-2)17(16(12-13)22-3)14(19)7-6-10-18-8-4-5-9-18/h11-12H,4-10H2,1-3H3","OWYLAEYXIQKAOL-UHFFFAOYSA-N"
"CCCCN(C2)C(CCC2)C(=O)Nc(c(C)1)c(C)ccc1","InChI=1S/C18H28N2O/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21)","LEBVLXFERQHONN-UHFFFAOYSA-N"
"C(C(C)(C)C)(C)(O)C(C(OC)16)CC(C473)(C(Cc(c5)c4c(OC67)c(O)c5)N(CC3)CC(C2)C2)CC1","InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1","RMRJXGBAOAMLHD-IHFGGWKQSA-N"
"NC(=O)N(c21)c(c3)c(ccc3)C(O)Cc(cccc2)1","InChI=1S/C15H14N2O2/c16-15(19)17-12-7-3-1-5-10(12)9-14(18)11-6-2-4-8-13(11)17/h1-8,14,18H,9H2,(H2,16,19)","BMPDWHIDQYTSHX-UHFFFAOYSA-N"
"OC(=O)COCCN(C3)CCN(C3)C(c(c2)cccc2)c(c1)ccc(Cl)c1","InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)","ZKLPARSLTMPFCP-UHFFFAOYSA-N"
"CN(C)CCCC(O1)(c(c3)ccc(F)c3)c(c2)c(cc(C#N)c2)C1","InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3/t20-/m0/s1","WSEQXVZVJXJVFP-FQEVSTJZSA-N"
"CNCCCC(O1)(c(c3)ccc(F)c3)c(c2)c(cc(C#N)c2)C1","InChI=1S/C19H19FN2O/c1-22-10-2-9-19(16-4-6-17(20)7-5-16)18-8-3-14(12-21)11-15(18)13-23-19/h3-8,11,22H,2,9-10,13H2,1H3/t19-/m0/s1","PTJADDMMFYXMMG-IBGZPJMESA-N"
"CN(C)CCCN(c21)c(c3)c(ccc(Cl)3)CCc(cccc2)1","InChI=1S/C19H23ClN2/c1-21(2)12-5-13-22-18-7-4-3-6-15(18)8-9-16-10-11-17(20)14-19(16)22/h3-4,6-7,10-11,14H,5,8-9,12-13H2,1-2H3","GDLIGKIOYRNHDA-UHFFFAOYSA-N"
"CNCCCN(c21)c(c3)c(ccc(Cl)3)CCc(cccc2)1","InChI=1S/C18H21ClN2/c1-20-11-4-12-21-17-6-3-2-5-14(17)7-8-15-9-10-16(19)13-18(15)21/h2-3,5-6,9-10,13,20H,4,7-8,11-12H2,1H3","VPIXQGUBUKFLRF-UHFFFAOYSA-N"
"COc(c5)c(O4)c(c(c5)1)C(C2)(C34)C([H])(C=CC(O)3)C(N(C)C2)C1","InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11-,12+,13-,17-,18-/m0/s1","OROGSEYTTFOCAN-DNJOTXNNSA-N"
"O=C(C1)N=C(c(c3)cccc3)c(c2)c(ccc(Cl)2)N(C)1","InChI=1S/C16H13ClN2O/c1-19-10-15(20)18-16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19/h2-9H,10H2,1H3","JFFQHFQOJYMFOE-UHFFFAOYSA-N"
"CNC(C)C(O)c(c1)cccc1","InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10-/m0/s1","KWGRBVOPPLSCSI-WPRPVWTQSA-N"
"CCC(=O)N(c(c3)cccc3)C(C1)CCN(CCc(c2)cccc2)C1","InChI=1S/C22H28N2O/c1-2-22(25)24(20-11-7-4-8-12-20)21-14-17-23(18-15-21)16-13-19-9-5-3-6-10-19/h3-12,21H,2,13-18H2,1H3","PJMPHNIQZUBGLI-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)S(=O)(=O)NC(=O)NN(C1)CC(C2)C(CC2)1","InChI=1S/C15H21N3O3S/c1-11-5-7-14(8-6-11)22(20,21)17-15(19)16-18-9-12-3-2-4-13(12)10-18/h5-8,12-13H,2-4,9-10H2,1H3,(H2,16,17,19)","BOVGTQGAOIONJV-UHFFFAOYSA-N"
"CC(=O)Oc(c5)c(O4)c(c(c5)1)C(C2)(C34)C([H])(C=CC(OC(C)=O)3)C(N(C)C2)C1","InChI=1S/C21H23NO5/c1-11(23)25-16-6-4-13-10-15-14-5-7-17(26-12(2)24)20-21(14,8-9-22(15)3)18(13)19(16)27-20/h4-7,14-15,17,20H,8-10H2,1-3H3/t14-,15+,17-,20-,21-/m0/s1","GVGLGOZIDCSQPN-PVHGPHFFSA-N"
"OC(C5)CN(C(C5)=1)C(=O)C(CCN(C4)CCC(C4)c(n2)c(c3)c(cc(F)c3)o2)=C(C)N1","InChI=1S/C23H27FN4O3/c1-14-18(23(30)28-13-17(29)3-5-21(28)25-14)8-11-27-9-6-15(7-10-27)22-19-4-2-16(24)12-20(19)31-26-22/h2,4,12,15,17,29H,3,5-11,13H2,1H3","ABWPQNZPAOAQSG-UHFFFAOYSA-N"
"CCCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5","InChI=1S/C25H28N6O/c1-2-3-10-22-26-25(15-6-7-16-25)24(32)31(22)17-18-11-13-19(14-12-18)20-8-4-5-9-21(20)23-27-29-30-28-23/h4-5,8-9,11-14H,2-3,6-7,10,15-17H2,1H3,(H,27,28,29,30)","YOSHYTLCDANDAN-UHFFFAOYSA-N"
"CNC(C)Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C11H15NO2/c1-8(12-2)5-9-3-4-10-11(6-9)14-7-13-10/h3-4,6,8,12H,5,7H2,1-2H3","SHXWCVYOXRDMCX-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c1)c(OC)cc(N)c(Cl)1","InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)","TTWJBBZEZQICBI-UHFFFAOYSA-N"
"CN(C4)CC(c21)N(C4)c(c3)c(ccc3)Cc(cccc2)1","InChI=1S/C18H20N2/c1-19-10-11-20-17-9-5-3-7-15(17)12-14-6-2-4-8-16(14)18(20)13-19/h2-9,18H,10-13H2,1H3","UEQUQVLFIPOEMF-UHFFFAOYSA-N"
"Clc(c3)cc(C=1c(c4)c(F)ccc4)c(c3)n(c(C)2)c(cn2)CN1","InChI=1S/C18H13ClFN3/c1-11-21-9-13-10-22-18(14-4-2-3-5-16(14)20)15-8-12(19)6-7-17(15)23(11)13/h2-9H,10H2,1H3","DDLIGBOFAVUZHB-UHFFFAOYSA-N"
"CCN(CC)C(=O)C(c(c2)cccc2)(C1)C(CN)1","InChI=1S/C15H22N2O/c1-3-17(4-2)14(18)15(10-13(15)11-16)12-8-6-5-7-9-12/h5-9,13H,3-4,10-11,16H2,1-2H3/t13-,15+/m0/s1","GJJFMKBJSRMPLA-DZGCQCFKSA-N"
"CN(C4)CC(c21)N(C4)c(n3)c(ccc3)Cc(cccc2)1","InChI=1S/C17H19N3/c1-19-9-10-20-16(12-19)15-7-3-2-5-13(15)11-14-6-4-8-18-17(14)20/h2-8,16H,9-12H2,1H3","RONZAEMNMFQXRA-UHFFFAOYSA-N"
"C(C526)CNC(C436)([H])Cc(c15)ccc(c(OC(C(CC4)(C(C(C)(O)C(C)(C)C)(C3)[H])OC)2[H])1)O","InChI=1S/C25H35NO4/c1-21(2,3)22(4,28)16-13-23-8-9-25(16,29-5)20-24(23)10-11-26-17(23)12-14-6-7-15(27)19(30-20)18(14)24/h6-7,16-17,20,26-28H,8-13H2,1-5H3/t16-,17-,20-,22+,23-,24+,25-/m1/s1","YOYLLRBMGQRFTN-IOMBULRVSA-N"
"Fc(c4)ccc(c4)C(C3)C(CNC3)COc(c1)cc(O2)c(OC2)c1","InChI=1S/C19H20FNO3/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18/h1-6,9,14,17,21H,7-8,10-12H2/t14-,17-/m0/s1","AHOUBRCZNHFOSL-YOEHRIQHSA-N"
"OC(=O)CCC(O)(C4)C(C)(C3)C([H])(C4)C([H])(C=1)C([H])(C3)C(C)(C2)C(=CC(=O)C2)C1","InChI=1S/C22H30O4/c1-20-9-5-15(23)13-14(20)3-4-16-17(20)6-10-21(2)18(16)7-11-22(21,26)12-8-19(24)25/h3-4,13,16-18,26H,5-12H2,1-2H3,(H,24,25)/t16-,17+,18+,20+,21+,22-/m1/s1","PBKZPPIHUVSDNM-WNHSNXHDSA-N"
"O(C6)CCN(C6)CCOc(c5)c(O4)c(c(c5)1)C(C2)(C34)C([H])(C=CC(O)3)C(N(C)C2)C1","InChI=1S/C23H30N2O4/c1-24-7-6-23-16-3-4-18(26)22(23)29-21-19(5-2-15(20(21)23)14-17(16)24)28-13-10-25-8-11-27-12-9-25/h2-5,16-18,22,26H,6-14H2,1H3/t16-,17+,18-,22-,23-/m0/s1","GPFAJKDEDBRFOS-FKQDBXSBSA-N"
"OCC(=O)C(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(O)3)C(C)(C2)C(=CC(=O)C2)C1","InChI=1S/C21H30O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h9,14-17,19,22,24H,3-8,10-11H2,1-2H3/t14-,15-,16+,17-,19+,20-,21-/m0/s1","OMFXVFTZEKFJBZ-HJTSIMOOSA-N"
"Clc(c4)cc(N=1)c(c4)Nc(c3)c(ccc3)C1N(C2)CC[N+1](C)([O-1])C2","InChI=1S/C18H19ClN4O/c1-23(24)10-8-22(9-11-23)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3","OGUCZBIQSYYWEF-UHFFFAOYSA-N"
"CN(C4)CCN(C4)C(=N1)c(c3)c(ccc3)Nc(c2)c(cc(Cl)c2)1","InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3","QZUDBNBUXVUHMW-UHFFFAOYSA-N"
"O=C(N1)c(c3)c(ccc3)C(O)1c(c2)cc(c(Cl)c2)S(N)(=O)=O","InChI=1S/C14H11ClN2O4S/c15-11-6-5-8(7-12(11)22(16,20)21)14(19)10-4-2-1-3-9(10)13(18)17-14/h1-7,19H,(H,17,18)(H2,16,20,21)","JIVPVXMEBJLZRO-UHFFFAOYSA-N"
"NC(=O)N(c21)c(c3)c(ccc3)C=Cc(cccc2)1","InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)","FFGPTBGBLSHEPO-UHFFFAOYSA-N"
"","InChI=1S/C25H34O6/c1-4-5-21-30-20-11-17-16-7-6-14-10-15(27)8-9-23(14,2)22(16)18(28)12-24(17,3)25(20,31-21)19(29)13-26/h8-10,16-18,20-22,26,28H,4-7,11-13H2,1-3H3/t16-,17-,18-,20+,21?,22+,23-,24-,25+/m0/s1","VOVIALXJUBGFJZ-KWVAZRHASA-N"
"O=C(C2)Nc(c3)c(cc(Br)c3)C(=N2)c(c1)nccc1","InChI=1S/C14H10BrN3O/c15-9-4-5-11-10(7-9)14(17-8-13(19)18-11)12-3-1-2-6-16-12/h1-7H,8H2,(H,18,19)","VMIYHDSEFNYJSL-UHFFFAOYSA-N"
"OCC(=O)C(O)(C(C)4)C(C)(C3)C([H])(C4)C([H])(C1)C(F)(C(O)3)C(C)(C=2)C(=CC(=O)C2)C1","InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,17-,19-,20-,21-,22-/m0/s1","UREBDLICKHMUKA-DVTGEIKXSA-N"
"CC(C)CN(CC(O)C(NC(=O)OC(C3)COC3)Cc(c2)cccc2)S(=O)(=O)c(c1)ccc(N)c1","InChI=1S/C25H35N3O6S/c1-18(2)15-28(35(31,32)22-10-8-20(26)9-11-22)16-24(29)23(14-19-6-4-3-5-7-19)27-25(30)34-21-12-13-33-17-21/h3-11,18,21,23-24,29H,12-17,26H2,1-2H3,(H,27,30)/t21-,23-,24+/m0/s1","YMARZQAQMVYCKC-OEMFJLHTSA-N"
"CCN(C2)C(CC2)CNC(=O)c(c(OC)1)cc(c(N)c1)S(=O)(=O)CC","InChI=1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)","NTJOBXMMWNYJFB-UHFFFAOYSA-N"
"CCCCc(o2)c(c(c3)c(ccc3)2)C(=O)c(c1)cc(I)c(OCCN(CC)CC)c(I)1","InChI=1S/C25H29I2NO3/c1-4-7-11-22-23(18-10-8-9-12-21(18)31-22)24(29)17-15-19(26)25(20(27)16-17)30-14-13-28(5-2)6-3/h8-10,12,15-16H,4-7,11,13-14H2,1-3H3","IYIKLHRQXLHMJQ-UHFFFAOYSA-N"
"CN(C)C(C)CN(c21)c(c3)c(ccc(C(C)=O)3)Sc(cccc2)1","InChI=1S/C19H22N2OS/c1-13(20(3)4)12-21-16-7-5-6-8-18(16)23-19-10-9-15(14(2)22)11-17(19)21/h5-11,13H,12H2,1-4H3","XLOQNFNTQIRSOX-UHFFFAOYSA-N"
"CC(=O)CC(c(c3)ccc(N(=O)=O)c3)C(C(=O)1)=C(O)c(c2)c(ccc2)O1","InChI=1S/C19H15NO6/c1-11(21)10-15(12-6-8-13(9-7-12)20(24)25)17-18(22)14-4-2-3-5-16(14)26-19(17)23/h2-9,15,22H,10H2,1H3/t15-/m0/s1","VABCILAOYCMVPS-HNNXBMFYSA-N"
"CC(C)NCC(COC1=CC=CC2=C1C=CN2)O","InChI=1S/C14H20N2O2/c1-10(2)16-8-11(17)9-18-14-5-3-4-13-12(14)6-7-15-13/h3-7,10-11,15-17H,8-9H2,1-2H3","JZQKKSLKJUAGIC-UHFFFAOYSA-N"
"C=CCOc(c1)c(ccc1)OCC(O)CNC(C)C","InChI=1S/C15H23NO3/c1-4-9-18-14-7-5-6-8-15(14)19-11-13(17)10-16-12(2)3/h4-8,12-13,16-17H,1,9-11H2,2-3H3","CEMAWMOMDPGJMB-UHFFFAOYSA-N"
"NCCC(Oc(c2)ccc(c2)C(F)(F)F)c(c1)cccc1","InChI=1S/C16H16F3NO/c17-16(18,19)13-6-8-14(9-7-13)21-15(10-11-20)12-4-2-1-3-5-12/h1-9,15H,10-11,20H2","WIQRCHMSJFFONW-UHFFFAOYSA-N"
"O=C(C4)C=C(C3)C([H])(C4)C([H])(C2)C([H])(C3)C([H])(C1)C(C)(C2)C(O)C1","InChI=1S/C18H26O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h10,13-17,20H,2-9H2,1H3/t13-,14+,15+,16-,17-,18-/m0/s1","NPAGDVCDWIYMMC-IZPLOLCNSA-N"
"COCCc(c1)ccc(OCC(O)CNC(C)C)c1","InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3","IUBSYMUCCVWXPE-UHFFFAOYSA-N"
"CN(C5)CCN(C5)C=c(n4)c(=O)n(c24)c(c3)c(cc(N(=O)=O)c3)C(=NC2)c(c1)c(Cl)ccc1","InChI=1S/C23H21ClN6O3/c1-27-8-10-28(11-9-27)14-19-23(31)29-20-7-6-15(30(32)33)12-17(20)22(25-13-21(29)26-19)16-4-2-3-5-18(16)24/h2-7,12,14H,8-11,13H2,1H3/b19-14+","UTEFBSAVJNEPTR-XMHGGMMESA-N"
"Nc(n2)nc(N)c(n2)c(c1)c(Cl)c(Cl)cc1","InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)","PYZRQGJRPPTADH-UHFFFAOYSA-N"
"CC(CCc(c2)cccc2)NCC(O)c(c1)cc(C(N)=O)c(O)c1","InChI=1S/C19H24N2O3/c1-13(7-8-14-5-3-2-4-6-14)21-12-18(23)15-9-10-17(22)16(11-15)19(20)24/h2-6,9-11,13,18,21-23H,7-8,12H2,1H3,(H2,20,24)","SGUAFYQXFOLMHL-UHFFFAOYSA-N"
"CNCCC(Oc(c2)ccc(c2)C(F)(F)F)c(c1)cccc1","InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3","RTHCYVBBDHJXIQ-UHFFFAOYSA-N"
"O=N(=O)c(c3)cc(c(c3)2)C(=NCC(=O)N(C)2)c(c1)c(F)ccc1","InChI=1S/C16H12FN3O3/c1-19-14-7-6-10(20(22)23)8-12(14)16(18-9-15(19)21)11-4-2-3-5-13(11)17/h2-8H,9H2,1H3","PPTYJKAXVCCBDU-UHFFFAOYSA-N"
"CN(C)CCC=C(c21)c(c3)c(ccc3)SCc(cccc2)1","InChI=1S/C19H21NS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11-","PHTUQLWOUWZIMZ-BOPFTXTBSA-N"
"Clc(c3)cc(c(c3)2)N(C(=O)CC(=O)N(C)2)c(c1)cccc1","InChI=1S/C16H13ClN2O2/c1-18-13-8-7-11(17)9-14(13)19(16(21)10-15(18)20)12-5-3-2-4-6-12/h2-9H,10H2,1H3","CXOXHMZGEKVPMT-UHFFFAOYSA-N"
"CC(C)(C)NCC(O)c(c1)cc(Cl)c(N)c(Cl)1","InChI=1S/C12H18Cl2N2O/c1-12(2,3)16-6-10(17)7-4-8(13)11(15)9(14)5-7/h4-5,10,16-17H,6,15H2,1-3H3","STJMRWALKKWQGH-UHFFFAOYSA-N"
"CC(C)NCC(O)COc(c1)ccc(CC(N)=O)c1","InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)","METKIMKYRPQLGS-UHFFFAOYSA-N"
"CCNC(=O)C([H])(C)OC(=O)Nc(c1)cccc1","InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)/t9-/m1/s1","AMRQXHFXNZFDCH-SECBINFHSA-N"
"C(C=1C(c(c5)cccc5)CC(O)c(c4)ccc(c4)c(c3)ccc(Br)c3)(=O)Oc(c2)c(ccc2)C1O","InChI=1S/C30H23BrO4/c31-23-16-14-20(15-17-23)19-10-12-22(13-11-19)26(32)18-25(21-6-2-1-3-7-21)28-29(33)24-8-4-5-9-27(24)35-30(28)34/h1-17,25-26,32-33H,18H2","OWNRRUFOJXFKCU-UHFFFAOYSA-N"
"OCCN(CC)CCn(c(Cc(c3)cccc3)2)c(C(=O)1)c(n2)N(C)C(=O)N(C)1","InChI=1S/C20H27N5O3/c1-4-24(12-13-26)10-11-25-16(14-15-8-6-5-7-9-15)21-18-17(25)19(27)23(3)20(28)22(18)2/h5-9,26H,4,10-14H2,1-3H3","VVUYEFBRTFASAH-UHFFFAOYSA-N"
"C1=C2C(=NC=NC2=O)NN1","InChI=1S/C5H4N4O/c10-5-3-1-8-9-4(3)6-2-7-5/h1-2H,(H2,6,7,8,9,10)","OFCNXPDARWKPPY-UHFFFAOYSA-N"
"OC(=O)Cn(c2)c(C(=O)1)c(n2)N(C)C(=O)N(C)1","InChI=1S/C9H10N4O4/c1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h4H,3H2,1-2H3,(H,14,15)","HCYFGRCYSCXKNQ-UHFFFAOYSA-N"
"CC(=O)NCCCS(O)(=O)=O","InChI=1S/C5H11NO4S/c1-5(7)6-3-2-4-11(8,9)10/h2-4H2,1H3,(H,6,7)(H,8,9,10)","AFCGFAGUEYAMAO-UHFFFAOYSA-N"
"OCC(=C1)C(O)C(O)C(O)C1NC(C(C)4)C(O)C(O)C(O4)OC(C(CO)3)C(O)C(O)C(O3)OC(C(CO)2)C(O)C(O)C(O)O2","InChI=1S/C25H43NO18/c1-6-11(26-8-2-7(3-27)12(30)15(33)13(8)31)14(32)19(37)24(40-6)43-22-10(5-29)42-25(20(38)17(22)35)44-21-9(4-28)41-23(39)18(36)16(21)34/h2,6,8-39H,3-5H2,1H3/t6-,8+,9-,10-,11-,12-,13+,14+,15+,16-,17-,18-,19-,20-,21-,22-,23?,24-,25-/m1/s1","XUFXOAAUWZOOIT-UGEKTDRHSA-N"
"COc(c3)cc(n(CC(O)=O)1)c(c3)c(C(=O)c(c2)ccc(F)c2)c(C)1","InChI=1S/C19H16FNO4/c1-11-18(19(24)12-3-5-13(20)6-4-12)15-8-7-14(25-2)9-16(15)21(11)10-17(22)23/h3-9H,10H2,1-2H3,(H,22,23)","NSNZBVZOKLXXFU-UHFFFAOYSA-N"
"CC(C)N(C(C)C)CCC(C(N)=O)(c(c2)nccc2)c(c1)ccc(Cl)c1","InChI=1S/C21H28ClN3O/c1-15(2)25(16(3)4)14-12-21(20(23)26,19-7-5-6-13-24-19)17-8-10-18(22)11-9-17/h5-11,13,15-16H,12,14H2,1-4H3,(H2,23,26)","JFFGSFYJCBZOQH-UHFFFAOYSA-N"
"NC(=O)C(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(S(C)(=O)=O)3)Sc(cccc2)1","InChI=1S/C22H27N3O3S2/c1-30(27,28)17-7-8-21-19(15-17)25(18-5-2-3-6-20(18)29-21)12-4-11-24-13-9-16(10-14-24)22(23)26/h2-3,5-8,15-16H,4,9-14H2,1H3,(H2,23,26)","BQDBKDMTIJBJLA-UHFFFAOYSA-N"
"CCC(CO)NC(=O)C(C4)C=C(c31)C([H])(N(C)4)Cc(c2)c(c(ccc3)n(C)2)1","InChI=1S/C21H27N3O2/c1-4-15(12-25)22-21(26)14-8-17-16-6-5-7-18-20(16)13(10-23(18)2)9-19(17)24(3)11-14/h5-8,10,14-15,19,25H,4,9,11-12H2,1-3H3,(H,22,26)/t14-,15-,19+/m0/s1","KPJZHOPZRAFDTN-YZVOILCLSA-N"
"COc(c1)c(ccc1)OCC(O)COC(N)=O","InChI=1S/C11H15NO5/c1-15-9-4-2-3-5-10(9)16-6-8(13)7-17-11(12)14/h2-5,8,13H,6-7H2,1H3,(H2,12,14)","GNXFOGHNGIVQEH-UHFFFAOYSA-N"
"CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)CO)Cl","InChI=1S/C22H23ClN6O/c1-2-3-8-20-24-21(23)19(14-30)29(20)13-15-9-11-16(12-10-15)17-6-4-5-7-18(17)22-25-27-28-26-22/h4-7,9-12,30H,2-3,8,13-14H2,1H3,(H,25,26,27,28)","PSIFNNKUMBGKDQ-UHFFFAOYSA-N"
"NCCCCC(NC(C(O)=O)CCc(c2)cccc2)C(=O)N(C1)C(CC1)C(O)=O","InChI=1S/C21H31N3O5/c22-13-5-4-9-16(19(25)24-14-6-10-18(24)21(28)29)23-17(20(26)27)12-11-15-7-2-1-3-8-15/h1-3,7-8,16-18,23H,4-6,9-14,22H2,(H,26,27)(H,28,29)/t16-,17-,18-/m0/s1","RLAWWYSOJDYHDC-BZSNNMDCSA-N"
"CNC(C2)(C(=O)CCC2)c(c1)c(Cl)ccc1","InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3/t13-/m1/s1","YQEZLKZALYSWHR-CYBMUJFWSA-N"
"CCN(CC)CCN(C(=N)2)C(=NO2)c(c1)cccc1","InChI=1S/C14H20N4O/c1-3-17(4-2)10-11-18-13(16-19-14(18)15)12-8-6-5-7-9-12/h5-9,15H,3-4,10-11H2,1-2H3","MGSPDRWOUCPKNZ-UHFFFAOYSA-N"
"CCOC(=O)C(CCc(c2)cccc2)NC(C)C(=O)N(C(=O)1)C(C(O)=O)CN(C)1","InChI=1S/C20H27N3O6/c1-4-29-19(27)15(11-10-14-8-6-5-7-9-14)21-13(2)17(24)23-16(18(25)26)12-22(3)20(23)28/h5-9,13,15-16,21H,4,10-12H2,1-3H3,(H,25,26)/t13-,15-,16-/m0/s1","KLZWOWYOHUKJIG-BPUTZDHNSA-N"
"CC(N)CCCC(C)(C)O","InChI=1S/C8H19NO/c1-7(9)5-4-6-8(2,3)10/h7,10H,4-6,9H2,1-3H3","LREQLEBVOXIEOM-UHFFFAOYSA-N"
"OCC(O)COc(c1)c(OC)ccc1","InChI=1S/C10H14O4/c1-13-9-4-2-3-5-10(9)14-7-8(12)6-11/h2-5,8,11-12H,6-7H2,1H3","HSRJKNPTNIJEKV-UHFFFAOYSA-N"
"OC(=O)C(C)c(c2)cc(F)c(c2)c(c1)cccc1","InChI=1S/C15H13FO2/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18)","SYTBZMRGLBWNTM-UHFFFAOYSA-N"
"OCC(O)COC(=O)c(c3)c(ccc3)Nc(c2)c(c1)c(nc2)c(cc1)C(F)(F)F","InChI=1S/C20H17F3N2O4/c21-20(22,23)15-6-3-5-13-17(8-9-24-18(13)15)25-16-7-2-1-4-14(16)19(28)29-11-12(27)10-26/h1-9,12,26-27H,10-11H2,(H,24,25)","APQPGQGAWABJLN-UHFFFAOYSA-N"
"CCN(CC)C(=S)SSC(=S)N(CC)CC","InChI=1S/C10H20N2S4/c1-5-11(6-2)9(13)15-16-10(14)12(7-3)8-4/h5-8H2,1-4H3","AUZONCFQVSMFAP-UHFFFAOYSA-N"
"ClCCC(=O)NCc(c1)cccc1","InChI=1S/C10H12ClNO/c11-7-6-10(13)12-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13)","JPYQFYIEOUVJDU-UHFFFAOYSA-N"
"OC(=O)c(c3)c(ccc3)Nc(c2)c(c1)c(nc2)c(cc1)C(F)(F)F","InChI=1S/C17H11F3N2O2/c18-17(19,20)12-6-3-5-10-14(8-9-21-15(10)12)22-13-7-2-1-4-11(13)16(23)24/h1-9H,(H,21,22)(H,23,24)","RGUIKQRAZCQMBM-UHFFFAOYSA-N"
"C(c(n5)ccc(c54)cccc4)(NC(CC(N)=O)C(=O)NC(C(CN(C3)C(CC(C32[H])(CCCC2)[H])C(NC(C)(C)C)=O)O)Cc(c1)cccc1)=O","InChI=1S/C38H50N6O5/c1-38(2,3)43-37(49)32-20-26-14-7-8-15-27(26)22-44(32)23-33(45)30(19-24-11-5-4-6-12-24)41-36(48)31(21-34(39)46)42-35(47)29-18-17-25-13-9-10-16-28(25)40-29/h4-6,9-13,16-18,26-27,30-33,45H,7-8,14-15,19-23H2,1-3H3,(H2,39,46)(H,41,48)(H,42,47)(H,43,49)/t26-,27+,30-,31-,32-,33+/m0/s1","QWAXKHKRTORLEM-UGJKXSETSA-N"
"c(c1)cc(CC(NC(=O)C(C(C)C)NC(=O)N(Cc(n4)csc4C(C)C)C)CC(C(NC(=O)OCc(c3)scn3)Cc(c2)cccc2)O)cc1","InChI=1S/C37H48N6O5S2/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)/t28-,31-,32-,33-/m0/s1","NCDNCNXCDXHOMX-XGKFQTDJSA-N"
"C=CCN(C5)C(C3)C([H])(C=4)C(C5)(C(C(O)C4)1)c(c23)c(c(O)cc2)O1","InChI=1S/C19H21NO3/c1-2-8-20-9-7-19-12-4-6-15(22)18(19)23-17-14(21)5-3-11(16(17)19)10-13(12)20/h2-6,12-13,15,18,21-22H,1,7-10H2/t12-,13+,15-,18-,19-/m0/s1","UIQMVEYFGZJHCZ-SSTWWWIQSA-N"
"C(C1)CC1CN(C6)C(C4)C(O)(C5)C(C6)(C(C(O)C5)2)c(c34)c(c(O)cc3)O2","InChI=1S/C21H27NO4/c23-14-5-4-13-10-16-21(25)7-6-15(24)19-20(21,17(13)18(14)26-19)8-9-22(16)11-12-2-1-3-12/h4-5,12,15-16,19,23-25H,1-3,6-11H2/t15-,16+,19-,20-,21+/m0/s1","NETZHAKZCGBWSS-CEDHKZHLSA-N"
"OC(=O)COc(c2)c(Cl)c(Cl)c(c2)C(=O)c(c1)csc1","InChI=1S/C13H8Cl2O4S/c14-11-8(13(18)7-3-4-20-6-7)1-2-9(12(11)15)19-5-10(16)17/h1-4,6H,5H2,(H,16,17)","FCWMZGOTKKOFPK-UHFFFAOYSA-N"
"OC(=O)COc(c2)c(Cl)c(Cl)c(c2)C(=O)c(c1)scc1","InChI=1S/C13H8Cl2O4S/c14-11-7(13(18)9-2-1-5-20-9)3-4-8(12(11)15)19-6-10(16)17/h1-5H,6H2,(H,16,17)","AGHANLSBXUWXTB-UHFFFAOYSA-N"
"OC(=O)C(C)c(c2)sc(c2)C(=O)c(c1)cccc1","InChI=1S/C14H12O3S/c1-9(14(16)17)11-7-8-12(18-11)13(15)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)","GUHPRPJDBZHYCJ-UHFFFAOYSA-N"
"Cc(c3)ncc(n3)C(=O)NCCc(c2)ccc(c2)S(=O)(=O)NC(=O)NC(C1)CCCC1","InChI=1S/C21H27N5O4S/c1-15-13-24-19(14-23-15)20(27)22-12-11-16-7-9-18(10-8-16)31(29,30)26-21(28)25-17-5-3-2-4-6-17/h7-10,13-14,17H,2-6,11-12H2,1H3,(H,22,27)(H2,25,26,28)","ZJJXGWJIGJFDTL-UHFFFAOYSA-N"
"Cc(c3)ccc(c3)S(=O)(=O)NC(=O)NC(C(O)1)C(C2)C(C)(C)C(C)(C2)1","InChI=1S/C18H26N2O4S/c1-11-5-7-12(8-6-11)25(23,24)20-16(22)19-14-13-9-10-18(4,15(14)21)17(13,2)3/h5-8,13-15,21H,9-10H2,1-4H3,(H2,19,20,22)","RMTYNAPTNBJHQI-UHFFFAOYSA-N"
"COc(c3)c(cc(Cl)c3)C(=O)NCCc(c2)ccc(c2)S(=O)(=O)NC(=O)NC(C1)CCCC1","InChI=1S/C23H28ClN3O5S/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29)","ZNNLBTZKUZBEKO-UHFFFAOYSA-N"
"OCC(O)COC(=O)c(c3)c(ccc3)Nc(c2)c(c1)c(nc2)cc(Cl)c1","InChI=1S/C19H17ClN2O4/c20-12-5-6-14-17(7-8-21-18(14)9-12)22-16-4-2-1-3-15(16)19(25)26-11-13(24)10-23/h1-9,13,23-24H,10-11H2,(H,21,22)","GWOFUCIGLDBNKM-UHFFFAOYSA-N"
"CC(C)OC(=O)C(C)(C)Oc(c2)ccc(c2)C(=O)c(c1)ccc(Cl)c1","InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3","YMTINGFKWWXKFG-UHFFFAOYSA-N"
"CCNC(C21)C(c(c3)cccc3)C(CC2)C1","InChI=1S/C15H21N/c1-2-16-15-13-9-8-12(10-13)14(15)11-6-4-3-5-7-11/h3-7,12-16H,2,8-10H2,1H3","IKFBPFGUINLYQI-UHFFFAOYSA-N"
"CN(C)CCC=C(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C18H18ClNS/c1-20(2)11-5-7-14-15-6-3-4-8-17(15)21-18-10-9-13(19)12-16(14)18/h3-4,6-10,12H,5,11H2,1-2H3/b14-7-","WSPOMRSOLSGNFJ-AUWJEWJLSA-N"
"CCCNC(=O)NS(=O)(=O)c(c1)ccc(Cl)c1","InChI=1S/C10H13ClN2O3S/c1-2-7-12-10(14)13-17(15,16)9-5-3-8(11)4-6-9/h3-6H,2,7H2,1H3,(H2,12,13,14)","RKWGIWYCVPQPMF-UHFFFAOYSA-N"
"CCCCNC(=O)NS(=O)(=O)c(c1)ccc(N)c1","InChI=1S/C11H17N3O3S/c1-2-3-8-13-11(15)14-18(16,17)10-6-4-9(12)5-7-10/h4-7H,2-3,8,12H2,1H3,(H2,13,14,15)","VDTNNGKXZGSZIP-UHFFFAOYSA-N"
"CCOC(=O)N(C=1)C(=S)N(C)C1","InChI=1S/C7H10N2O2S/c1-3-11-7(10)9-5-4-8(2)6(9)12/h4-5H,3H2,1-2H3","CFOYWRHIYXMDOT-UHFFFAOYSA-N"
"CCCCN(CCCC)CCNc(o2)nc(n2)c(c1)cccc1","InChI=1S/C18H28N4O/c1-3-5-13-22(14-6-4-2)15-12-19-18-20-17(21-23-18)16-10-8-7-9-11-16/h7-11H,3-6,12-15H2,1-2H3,(H,19,20,21)","VYWQZAARVNRSTR-UHFFFAOYSA-N"
"CC(C)(C)NC(C)C(=O)c(c1)cc(Cl)cc1","InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3","SNPPWIUOZRMYNY-UHFFFAOYSA-N"
"CC(NCCOC(=O)c(c2)cccc2)Cc(c1)cc(cc1)C(F)(F)F","InChI=1S/C19H20F3NO2/c1-14(12-15-6-5-9-17(13-15)19(20,21)22)23-10-11-25-18(24)16-7-3-2-4-8-16/h2-9,13-14,23H,10-12H2,1H3","CJAVTWRYCDNHSM-UHFFFAOYSA-N"
"OC(=O)C(C)c(c2)cc(cc2)Oc(c1)cccc1","InChI=1S/C15H14O3/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13/h2-11H,1H3,(H,16,17)","RDJGLLICXDHJDY-UHFFFAOYSA-N"
"CCNCC(O)c(c1)cc(O)cc1","InChI=1S/C10H15NO2/c1-2-11-7-10(13)8-4-3-5-9(12)6-8/h3-6,10-13H,2,7H2,1H3","SQVIAVUSQAWMKL-UHFFFAOYSA-N"
"CCCN(CC)C(CC)C(=O)Nc(c(C)1)c(C)ccc1","InChI=1S/C17H28N2O/c1-6-12-19(8-3)15(7-2)17(20)18-16-13(4)10-9-11-14(16)5/h9-11,15H,6-8,12H2,1-5H3,(H,18,20)","VTUSIVBDOCDNHS-UHFFFAOYSA-N"
"O=C(O5)C=C(C5)C(C4)C(C)(C(O)3)C(O)(C4)C([H])(C1)C([H])(C3)C(C)(C2)C([H])(CC(O)C2)C1","InChI=1S/C23H34O5/c1-21-7-5-15(24)10-14(21)3-4-17-18(21)11-19(25)22(2)16(6-8-23(17,22)27)13-9-20(26)28-12-13/h9,14-19,24-25,27H,3-8,10-12H2,1-2H3/t14-,15+,16-,17-,18+,19-,21+,22+,23+/m1/s1","SHIBSTMRCDJXLN-KCZCNTNESA-N"
"CC(C)NCC(O)COc(c1)c(C(C)=O)cc(NC(C)=O)c1","InChI=1S/C16H24N2O4/c1-10(2)17-8-14(21)9-22-16-6-5-13(18-12(4)20)7-15(16)11(3)19/h5-7,10,14,17,21H,8-9H2,1-4H3,(H,18,20)","AWOGXJOBNAWQSF-UHFFFAOYSA-N"
"C(c(c4)cccc4)(c(c3)cccc3)(C(=O)N(C2)CCC2)C([H])(C)CN(C1)CCOC1","InChI=1S/C25H32N2O2/c1-21(20-26-16-18-29-19-17-26)25(22-10-4-2-5-11-22,23-12-6-3-7-13-23)24(28)27-14-8-9-15-27/h2-7,10-13,21H,8-9,14-20H2,1H3/t21-/m1/s1","INUNXTSAACVKJS-OAQYLSRUSA-N"
"COc(c4)cc(c(c4)1)C(C3)(C2)C([H])(CCC3)C(N(C)C2)C1","InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15-,17+,18+/m1/s1","MKXZASYAUGDDCJ-NJAFHUGGSA-N"
"C(=O)(C=1)OCC1C(C(C)62)CCC(O)2C(C5)([H])C(CC6)([H])C(C3)(C(O)(C5)CC(OC(C(O)4)(OC(C)C(O)C4O)[H])C3)C=O","InChI=1S/C29H42O10/c1-15-22(32)23(33)24(34)25(38-15)39-17-3-8-27(14-30)19-4-7-26(2)18(16-11-21(31)37-13-16)6-10-29(26,36)20(19)5-9-28(27,35)12-17/h11,14-15,17-20,22-25,32-36H,3-10,12-13H2,1-2H3/t15-,17-,18+,19-,20+,22-,23+,24+,25-,26+,27-,28-,29-/m0/s1","HULMNSIAKWANQO-JQKSAQOKSA-N"
"C=CC(C3)C(C4)CC([H])(N(C4)3)C(O)c(c1)c(c2)c(ccc2)nc1","InChI=1S/C19H22N2O/c1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17/h2-7,9,13-14,18-19,22H,1,8,10-12H2/t13-,14-,18+,19-/m0/s1","KMPWYEUPVWOPIM-QAMTZSDWSA-N"
"CCN(CC)CCCN(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C19H23ClN2S/c1-3-21(4-2)12-7-13-22-16-8-5-6-9-18(16)23-19-11-10-15(20)14-17(19)22/h5-6,8-11,14H,3-4,7,12-13H2,1-2H3","DBOUGBAQLIXZLV-UHFFFAOYSA-N"
"CN(C)CCC(O)(c(c2)cccc2)c(c1)c(Cl)ccc1","InChI=1S/C17H20ClNO/c1-19(2)13-12-17(20,14-8-4-3-5-9-14)15-10-6-7-11-16(15)18/h3-11,20H,12-13H2,1-2H3","WRCHFMBCVFFYEQ-UHFFFAOYSA-N"
"CON=C(C(=O)NC(C(=O)2)C([H])(S3)N(C(C(O)=O)=C(CSC(=N4)N(C)N=C(O)C(=O)4)C3)2)c(c1)nc(N)s1","InChI=1S/C18H18N8O7S3/c1-25-18(22-12(28)13(29)23-25)36-4-6-3-34-15-9(14(30)26(15)10(6)16(31)32)21-11(27)8(24-33-2)7-5-35-17(19)20-7/h5,9,15H,3-4H2,1-2H3,(H2,19,20)(H,21,27)(H,23,29)(H,31,32)/b24-8-/t9-,15-/m1/s1","VAAUVRVFOQPIGI-SPQHTLEESA-N"
"CON=C(c(c3)nc(N)s3)C(=O)NC([H])(C(=O)1)C([H])(S2)N(C(C(O)=O)=C(COC(C)=O)C2)1","InChI=1S/C16H17N5O7S2/c1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8/h5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,23)(H,25,26)/b20-9+/t10-,14-/m1/s1","GPRBEKHLDVQUJE-VINNURBNSA-N"
"COC(=C1)c(c3)c(ccc3)N(C(N)=O)c(c2)c(ccc2)1","InChI=1S/C16H14N2O2/c1-20-15-10-11-6-2-4-8-13(11)18(16(17)19)14-9-5-3-7-12(14)15/h2-10H,1H3,(H2,17,19)","PIZOFBKQWNPKDK-UHFFFAOYSA-N"
"Oc(c3)ccc(c3)C(N)C(=O)NC(C(=O)1)C(S2)N1C(C(O)=O)C(C)(C)2","InChI=1S/C16H19N3O5S/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24)","LSQZJLSUYDQPKJ-UHFFFAOYSA-N"
"Oc(c3)ccc(c3)C(N)C(=O)NC(C(=O)1)C(S2)N1C(C(O)=O)C(C)(C)2","InChI=1S/C16H19N3O5S/c1-16(2)11(15(23)24)19-13(22)10(14(19)25-16)18-12(21)9(17)7-3-5-8(20)6-4-7/h3-6,9-11,14,20H,17H2,1-2H3,(H,18,21)(H,23,24)/t9-,10-,11+,14-/m1/s1","LSQZJLSUYDQPKJ-NJBDSQKTSA-N"
"C=CCSCC(N1)NS(=O)(=O)c(c2)c1cc(Cl)c2S(N)(=O)=O","InChI=1S/C11H14ClN3O4S3/c1-2-3-20-6-11-14-8-4-7(12)9(21(13,16)17)5-10(8)22(18,19)15-11/h2,4-5,11,14-15H,1,3,6H2,(H2,13,16,17)","VGLGVJVUHYTIIU-UHFFFAOYSA-N"
"C([N+1]1(C(C2)C(C(C3)(C)C([H])2C(C6)([H])C(C(C4(C6)[H])(CC(N(C5)CCCC5)C(C4)OC(C)=O)C)([H])C3)OC(C)=O)C)CCCC1","InChI=1S/C34H57N2O4/c1-23(37)39-31-20-25-12-13-26-27(34(25,4)22-29(31)35-16-8-6-9-17-35)14-15-33(3)28(26)21-30(32(33)40-24(2)38)36(5)18-10-7-11-19-36/h25-32H,6-22H2,1-5H3/q+1/t25-,26+,27-,28-,29-,30-,31-,32-,33-,34-/m0/s1","BGSZAXLLHYERSY-XQIGCQGXSA-N"
"OC(=O)c(c2)c(ccc2)Nc(c(Cl)1)c(Cl)c(C)cc1","InChI=1S/C14H11Cl2NO2/c1-8-6-7-10(15)13(12(8)16)17-11-5-3-2-4-9(11)14(18)19/h2-7,17H,1H3,(H,18,19)","SBDNJUWAMKYJOX-UHFFFAOYSA-N"
"CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O","InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23-,24+,25+,31-,32+/m1/s1","OZVBMTJYIDMWIL-AYFBDAFISA-N"
"CC[N+1](C)(C)Cc(c1)c(Br)ccc1","InChI=1S/C11H17BrN/c1-4-13(2,3)9-10-7-5-6-8-11(10)12/h5-8H,4,9H2,1-3H3/q+1","AAQOQKQBGPPFNS-UHFFFAOYSA-N"
"CC(C)COCC(CN(Cc(c3)cccc3)c(c2)cccc2)N(C1)CCC1","InChI=1S/C24H34N2O/c1-21(2)19-27-20-24(25-15-9-10-16-25)18-26(23-13-7-4-8-14-23)17-22-11-5-3-6-12-22/h3-8,11-14,21,24H,9-10,15-20H2,1-2H3","UIEATEWHFDRYRU-UHFFFAOYSA-N"
"OCC(N)C(=O)NNCc(c1)c(O)c(O)c(O)c1","InChI=1S/C10H15N3O5/c11-6(4-14)10(18)13-12-3-5-1-2-7(15)9(17)8(5)16/h1-2,6,12,14-17H,3-4,11H2,(H,13,18)","BNQDCRGUHNALGH-UHFFFAOYSA-N"
"CC(=O)Nc(c2)ccc(c2)OC(=O)c(c1)c(ccc1)OC(C)=O","InChI=1S/C17H15NO5/c1-11(19)18-13-7-9-14(10-8-13)23-17(21)15-5-3-4-6-16(15)22-12(2)20/h3-10H,1-2H3,(H,18,19)","FEJKLNWAOXSSNR-UHFFFAOYSA-N"
"c(c3)ccc(c3)CC(N1)NS(=O)(=O)c(c2)c1cc(C(F)(F)F)c2S(N)(=O)=O","InChI=1S/C15H14F3N3O4S2/c16-15(17,18)10-7-11-13(8-12(10)26(19,22)23)27(24,25)21-14(20-11)6-9-4-2-1-3-5-9/h1-5,7-8,14,20-21H,6H2,(H2,19,22,23)","HDWIHXWEUNVBIY-UHFFFAOYSA-N"
"c(c3)ccc(c3)C(C)C(N1)NS(=O)(=O)c(c2)c(cc(Cl)c2S(N)(=O)=O)1","InChI=1S/C15H16ClN3O4S2/c1-9(10-5-3-2-4-6-10)15-18-12-7-11(16)13(24(17,20)21)8-14(12)25(22,23)19-15/h2-9,15,18-19H,1H3,(H2,17,20,21)","PYVUMAGVCSQCBD-UHFFFAOYSA-N"
"NC(=O)C(=C(O)4)C(=O)C(O)(C(O)=1)C([H])(C(N(C)C)4)CC([H])(C(C)(O)2)C(C(=O)c(c(O)3)c(c(Cl)cc3)2)1","InChI=1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31)/t7-,8-,15-,21-,22-/m0/s1","CYDMQBQPVICBEU-XRNKAMNCSA-N"
"CCN(CC)CCCN(c(c3)cccc3)C(C1)Cc(c2)c(ccc2)1","InChI=1S/C22H30N2/c1-3-23(4-2)15-10-16-24(21-13-6-5-7-14-21)22-17-19-11-8-9-12-20(19)18-22/h5-9,11-14,22H,3-4,10,15-18H2,1-2H3","NZLBHDRPUJLHCE-UHFFFAOYSA-N"
"n(c12)ccc(Nc(c3C(=O)OCCN(C4)CCN(c(c5)cccc5C(F)(F)F)C4)cccc3)c1ccc(C(F)(F)F)c2","InChI=1S/C30H26F6N4O2/c31-29(32,33)20-4-3-5-22(18-20)40-14-12-39(13-15-40)16-17-42-28(41)24-6-1-2-7-25(24)38-26-10-11-37-27-19-21(30(34,35)36)8-9-23(26)27/h1-11,18-19H,12-17H2,(H,37,38)","NWGGKKGAFZIVBJ-UHFFFAOYSA-N"
"CCN(CC)Cc(c(O)3)cc(cc3)Nc(c2)c(c1)c(nc2)cc(Cl)c1","InChI=1S/C20H22ClN3O/c1-3-24(4-2)13-14-11-16(6-8-20(14)25)23-18-9-10-22-19-12-15(21)5-7-17(18)19/h5-12,25H,3-4,13H2,1-2H3,(H,22,23)","OVCDSSHSILBFBN-UHFFFAOYSA-N"
"NCCOCC(N1)=C(C(=O)OCC)C(c(c2)c(Cl)ccc2)C(C(=O)OC)=C(C)1","InChI=1S/C20H25ClN2O5/c1-4-28-20(25)18-15(11-27-10-9-22)23-12(2)16(19(24)26-3)17(18)13-7-5-6-8-14(13)21/h5-8,17,23H,4,9-11,22H2,1-3H3/t17-/m0/s1","HTIQEAQVCYTUBX-KRWDZBQOSA-N"
"OC(C2)CCC(C2)NCc(c1)c(N)c(Br)cc(Br)1","InChI=1S/C13H18Br2N2O/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10/h5-6,10-11,17-18H,1-4,7,16H2/t10-,11-","JBDGDEWWOUBZPM-XYPYZODXSA-N"
"CNCC(=O)c(c1)cc(O)c(O)c1","InChI=1S/C9H11NO3/c1-10-5-9(13)6-2-3-7(11)8(12)4-6/h2-4,10-12H,5H2,1H3","PZMVOUYYNKPMSI-UHFFFAOYSA-N"
"C(N1CCCN(c45)c(c(CCc4cccc5)3)cccc3)CC(N(C2)CCCC2)(CC1)C(N)=O","InChI=1S/C28H38N4O/c29-27(33)28(31-18-6-1-7-19-31)15-21-30(22-16-28)17-8-20-32-25-11-4-2-9-23(25)13-14-24-10-3-5-12-26(24)32/h2-5,9-12H,1,6-8,13-22H2,(H2,29,33)","NWPJLRSCSQHPJV-UHFFFAOYSA-N"
"OCCN(C4)CCN(C4)CCC=C(c21)c(c3)c(ccc(Cl)3)Sc(cccc2)1","InChI=1S/C22H25ClN2OS/c23-17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)27-22)5-3-9-24-10-12-25(13-11-24)14-15-26/h1-2,4-8,16,26H,3,9-15H2/b18-5-","WFPIAZLQTJBIFN-DVZOWYKESA-N"
"NS(=O)(=O)OCC(O2)(O3)C([H])(OC(C)(C)3)C([H])(O1)C([H])(C2)OC(C)(C)1","InChI=1S/C12H21NO8S/c1-10(2)18-7-5-16-12(6-17-22(13,14)15)9(8(7)19-10)20-11(3,4)21-12/h7-9H,5-6H2,1-4H3,(H2,13,14,15)/t7-,8-,9+,12+/m1/s1","KJADKKWYZYXHBB-XBWDGYHZSA-N"
"CCOC(=O)C(CCc(c3)cccc3)NC(C)C(=O)N(C(C(O)=O)1)C([H])(C2)C([H])(CC2)C1","InChI=1S/C23H32N2O5/c1-3-30-23(29)18(13-12-16-8-5-4-6-9-16)24-15(2)21(26)25-19-11-7-10-17(19)14-20(25)22(27)28/h4-6,8-9,15,17-20,24H,3,7,10-14H2,1-2H3,(H,27,28)/t15-,17-,18-,19-,20-/m0/s1","HDACQVRGBOVJII-JBDAPHQKSA-N"
"CN(C)CCC(c(c2)cccc2)c(c1)nccc1","InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3","IJHNSHDBIRRJRN-UHFFFAOYSA-N"
"ON=C(N)CC(O)COc(c1)c(c2)c(ccc2)cc1","InChI=1S/C14H16N2O3/c15-14(16-18)8-11(17)9-19-13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11,17-18H,8-9H2,(H2,15,16)","UPZVYDSBLFNMLK-UHFFFAOYSA-N"
"OC(CNC(C)(C)C)COc(c2)c(C1)c(cc2)CC(O)C(O)1","InChI=1S/C17H27NO4/c1-17(2,3)18-9-12(19)10-22-16-6-4-5-11-7-14(20)15(21)8-13(11)16/h4-6,12,14-15,18-21H,7-10H2,1-3H3/t12?,14-,15+/m1/s1","VWPOSFSPZNDTMJ-UCWKZMIHSA-N"
"Fc(c3)ccc(c3)N(C1)CCN(CCC(C)NC(=O)c(c2)cncc2)C1","InChI=1S/C20H25FN4O/c1-16(23-20(26)17-3-2-9-22-15-17)8-10-24-11-13-25(14-12-24)19-6-4-18(21)5-7-19/h2-7,9,15-16H,8,10-14H2,1H3,(H,23,26)","RSKQGBFMNPDPLR-UHFFFAOYSA-N"
"NCC(C1)(CCCC1)CC(O)=O","InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)","UGJMXCAKCUNAIE-UHFFFAOYSA-N"
"CN(C)CCOC(=O)COc(c1)ccc(Cl)c1","InChI=1S/C12H16ClNO3/c1-14(2)7-8-16-12(15)9-17-11-5-3-10(13)4-6-11/h3-6H,7-9H2,1-2H3","XZTYGFHCIAKPGJ-UHFFFAOYSA-N"
"CCNC(=N2)OC(C(=O)2)c(c1)cccc1","InChI=1S/C11H12N2O2/c1-2-12-11-13-10(14)9(15-11)8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H,12,13,14)","RXOIEVSUURELPG-UHFFFAOYSA-N"
"COC(=O)CCc(c1)ccc(OCC(O)CNC(C)C)c1","InChI=1S/C16H25NO4/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3","AQNDDEOPVVGCPG-UHFFFAOYSA-N"
"CCOC(=O)C(CCc(c2)cccc2)NC(C)C(=O)N(C1)C(CC1)C(O)=O","InChI=1S/C20H28N2O5/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25)/t14-,16-,17-/m0/s1","GBXSMTUPTTWBMN-XIRDDKMYSA-N"
"CCN(CC)C(=O)Nc(c1)cc(C(C)=O)c(OCC(O)CNC(C)(C)C)c1","InChI=1S/C20H33N3O4/c1-7-23(8-2)19(26)22-15-9-10-18(17(11-15)14(3)24)27-13-16(25)12-21-20(4,5)6/h9-11,16,21,25H,7-8,12-13H2,1-6H3,(H,22,26)","JOATXPAWOHTVSZ-UHFFFAOYSA-N"
"OC(CNC(C)(C)C)COc(c2)c(C1)c(cc2)NC(=O)C1","InChI=1S/C16H24N2O3/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20)","LWAFSWPYPHEXKX-UHFFFAOYSA-N"
"SCC(C)C(=O)N(C1)C(CC1)C(O)=O","InChI=1S/C9H15NO3S/c1-6(5-14)8(11)10-4-2-3-7(10)9(12)13/h6-7,14H,2-5H2,1H3,(H,12,13)/t6-,7+/m1/s1","FAKRSMQSSFJEIM-RQJHMYQMSA-N"
"C(C4)CCN(C4)CCC(O)(c(c3)cccc3)C(C1)C(C=2)CC(C2)1","InChI=1S/C21H29NO/c23-21(19-7-3-1-4-8-19,11-14-22-12-5-2-6-13-22)20-16-17-9-10-18(20)15-17/h1,3-4,7-10,17-18,20,23H,2,5-6,11-16H2","YSXKPIUOCJLQIE-UHFFFAOYSA-N"
"CC(C)NCC(O)COc(c1)ccc(CCOCC(C2)C2)c1","InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3","NWIUTZDMDHAVTP-UHFFFAOYSA-N"
"Oc(c4)c(O)c(c(c4)1)c(c3)c(c(cc3)2)C([H])(N(C)CC2)C1","InChI=1S/C17H17NO2/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12/h2-6,13,19-20H,7-9H2,1H3/t13-/m1/s1","VMWNQDUVQKEIOC-CYBMUJFWSA-N"
"C=CCc(c1)c(ccc1)OCC(O)CNC(C)C","InChI=1S/C15H23NO2/c1-4-7-13-8-5-6-9-15(13)18-11-14(17)10-16-12(2)3/h4-6,8-9,12,14,16-17H,1,7,10-11H2,2-3H3","PAZJSJFMUHDSTF-UHFFFAOYSA-N"
"ONC(=O)CS(=O)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H15NO3S/c17-14(16-18)11-20(19)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15,18H,11H2,(H,16,17)","CGNMLOKEMNBUAI-UHFFFAOYSA-N"
"O=C(CNc(n3)c(C)cc(n3)c(c2)cccc2)N(C1)CCOC1","InChI=1S/C17H20N4O2/c1-13-11-15(14-5-3-2-4-6-14)19-20-17(13)18-12-16(22)21-7-9-23-10-8-21/h2-6,11H,7-10,12H2,1H3,(H,18,20)","SGOJRGZBIVIGIS-UHFFFAOYSA-N"
"Oc(c3)ccc(c3)c(n1)cc(C)c(NCCN(C2)CCOC2)n1","InChI=1S/C17H22N4O2/c1-13-12-16(14-2-4-15(22)5-3-14)19-20-17(13)18-6-7-21-8-10-23-11-9-21/h2-5,12,22H,6-11H2,1H3,(H,18,20)","ADRHYFBXMFKHDO-UHFFFAOYSA-N"
"CCN(CC)C(=O)C(c(c2)ccc(C)c2)(C1)C(CN)1","InChI=1S/C16H24N2O/c1-4-18(5-2)15(19)16(10-14(16)11-17)13-8-6-12(3)7-9-13/h6-9,14H,4-5,10-11,17H2,1-3H3/t14-,16+/m0/s1","FWSXXKQITHMJAY-GOEBONIOSA-N"
"CN(C4)CCN(C4)CCCN(c21)c(c3)c(ccc(C(F)(F)F)3)S(=O)c(cccc2)1","InChI=1S/C21H24F3N3OS/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)29(28)20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3","UCTLPXYMIYHZST-UHFFFAOYSA-N"
"CCN(C2)C(CC2)CNC(=O)c(c(OC)1)cc(cc1)S(N)(=O)=O","InChI=1S/C15H23N3O4S/c1-3-18-8-4-5-11(18)10-17-15(19)13-9-12(23(16,20)21)6-7-14(13)22-2/h6-7,9,11H,3-5,8,10H2,1-2H3,(H,17,19)(H2,16,20,21)","BGRJTUBHPOOWDU-UHFFFAOYSA-N"
"Oc(c21)c(C=NN(C5)CCN(C)C5)c(N4)c(O)c1c(O)c(C)c(O3)c2C(=O)C(C)3OC=CC(C(C(C(C)C(C(C(O)C(C=CC=C(C)C4=O)C)C)O)OC(C)=O)C)OC","InChI=1S/C43H58N4O12/c1-21-12-11-13-22(2)42(55)45-33-28(20-44-47-17-15-46(9)16-18-47)37(52)30-31(38(33)53)36(51)26(6)40-32(30)41(54)43(8,59-40)57-19-14-29(56-10)23(3)39(58-27(7)48)25(5)35(50)24(4)34(21)49/h11-14,19-21,23-25,29,34-35,39,49-53H,15-18H2,1-10H3,(H,45,55)/b12-11+,19-14+,22-13-,44-20+/t21-,23+,24+,25+,29-,34-,35+,39+,43-/m0/s1","JQXXHWHPUNPDRT-WLSIYKJHSA-N"
"c(c5)cc(C3)c(c5)N(c(c4)c(ccc4)C3)C(C1)C(C2)CCN(C2)1","InChI=1S/C21H24N2/c1-3-7-19-16(5-1)9-10-17-6-2-4-8-20(17)23(19)21-15-22-13-11-18(21)12-14-22/h1-8,18,21H,9-15H2","JCBQCKFFSPGEDY-UHFFFAOYSA-N"
"CCCC(Cc(c2)cccc2)N(C1)CCC1","InChI=1S/C15H23N/c1-2-8-15(16-11-6-7-12-16)13-14-9-4-3-5-10-14/h3-5,9-10,15H,2,6-8,11-13H2,1H3","OJCPSBCUMRIPFL-UHFFFAOYSA-N"
"OCCC(C4)CCN(C4)CCCN(c21)c(c3)c(ccc3S(=O)(=O)N(C)C)Sc(cccc2)1","InChI=1S/C24H33N3O3S2/c1-25(2)32(29,30)20-8-9-24-22(18-20)27(21-6-3-4-7-23(21)31-24)14-5-13-26-15-10-19(11-16-26)12-17-28/h3-4,6-9,18-19,28H,5,10-17H2,1-2H3","JOMHSQGEWSNUKU-UHFFFAOYSA-N"
"Clc(c2)ccc(c2)C(=O)NCCN(C1)CCOC1","InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)","YHXISWVBGDMDLQ-UHFFFAOYSA-N"
"O(C3)CCN(C3)CCNc(n2)c(C)cc(n2)c(c1)cccc1","InChI=1S/C17H22N4O/c1-14-13-16(15-5-3-2-4-6-15)19-20-17(14)18-7-8-21-9-11-22-12-10-21/h2-6,13H,7-12H2,1H3,(H,18,20)","LDMWSLGGVTVJPG-UHFFFAOYSA-N"
"CNC(C1)c(c3)c(ccc3)N(C)c(c2)c(ccc2)1","InChI=1S/C16H18N2/c1-17-14-11-12-7-3-5-9-15(12)18(2)16-10-6-4-8-13(14)16/h3-10,14,17H,11H2,1-2H3","YXVZOBVWVRFPTE-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)COc(c1)ccc(OC)c1","InChI=1S/C15H24N2O3/c1-4-17(5-2)11-10-16-15(18)12-20-14-8-6-13(19-3)7-9-14/h6-9H,4-5,10-12H2,1-3H3,(H,16,18)","HUNIPYLVUPMFCZ-UHFFFAOYSA-N"
"NCCCC(C3)(c21)c(c4)c(ccc4)C(C3)c(cccc2)1","InChI=1S/C19H21N/c20-13-5-11-19-12-10-14(15-6-1-3-8-17(15)19)16-7-2-4-9-18(16)19/h1-4,6-9,14H,5,10-13,20H2","IFHUOEQJTQWFGJ-UHFFFAOYSA-N"
"CNCCCC(C3)(c21)c(c4)c(ccc4)C(C3)c(cccc2)1","InChI=1S/C20H23N/c1-21-14-6-12-20-13-11-15(16-7-2-4-9-18(16)20)17-8-3-5-10-19(17)20/h2-5,7-10,15,21H,6,11-14H2,1H3","QSLMDECMDJKHMQ-UHFFFAOYSA-N"
"COc(c4)cc(O1)c(c4)N=C(N(C3)CCN(C)C3)c(c2)c(ccc(Cl)2)1","InChI=1S/C19H20ClN3O2/c1-22-7-9-23(10-8-22)19-15-11-13(20)3-6-17(15)25-18-12-14(24-2)4-5-16(18)21-19/h3-6,11-12H,7-10H2,1-2H3","RQVJIDOFDAAWDW-UHFFFAOYSA-N"
"CN(C4)CCN(C4)C(=N1)c(c3)c(ccc(Cl)3)Oc(c2)c(ccc2)1","InChI=1S/C18H18ClN3O/c1-21-8-10-22(11-9-21)18-14-12-13(19)6-7-16(14)23-17-5-3-2-4-15(17)20-18/h2-7,12H,8-11H2,1H3","XJGVXQDUIWGIRW-UHFFFAOYSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc(OC)3)S(=O)c(cccc2)1","InChI=1S/C19H24N2O2S/c1-14(12-20(2)3)13-21-16-7-5-6-8-18(16)24(22)19-10-9-15(23-4)11-17(19)21/h5-11,14H,12-13H2,1-4H3/t14-,24?/m0/s1","CUJAZGOWDHBZEI-LNYMIDHXSA-N"
"C1CNCCC1CCC2=CNC3=CC=CC=C32","InChI=1S/C15H20N2/c1-2-4-15-14(3-1)13(11-17-15)6-5-12-7-9-16-10-8-12/h1-4,11-12,16-17H,5-10H2","SADQVAVFGNTEOD-UHFFFAOYSA-N"
"OCCN(C4)CCN(C4)CCC=C(c21)c(c3)c(ccc(C(F)(F)F)3)Sc(cccc2)1","InChI=1S/C23H25F3N2OS/c24-23(25,26)17-7-8-22-20(16-17)18(19-4-1-2-6-21(19)30-22)5-3-9-27-10-12-28(13-11-27)14-15-29/h1-2,4-8,16,29H,3,9-15H2/b18-5-","NJMYODHXAKYRHW-DVZOWYKESA-N"
"CNCCON=C(c21)c(c3)c(ccc3)C=Cc(cccc2)1","InChI=1S/C18H18N2O/c1-19-12-13-21-20-18-16-8-4-2-6-14(16)10-11-15-7-3-5-9-17(15)18/h2-11,19H,12-13H2,1H3","SEDQWOMFMIJKCU-UHFFFAOYSA-N"
"Oc(c4)cc(N=1)c(c4)Oc(c3)c(cc(Cl)c3)C1N(C2)CCNC2","InChI=1S/C17H16ClN3O2/c18-11-1-3-15-13(9-11)17(21-7-5-19-6-8-21)20-14-10-12(22)2-4-16(14)23-15/h1-4,9-10,19,22H,5-8H2","QDWNOKXUZTYVGO-UHFFFAOYSA-N"
"Clc(c4)cc(c(c4)2)C(=Nc(c3)c(ccc3)O2)N(C1)CCNC1","InChI=1S/C17H16ClN3O/c18-12-5-6-15-13(11-12)17(21-9-7-19-8-10-21)20-14-3-1-2-4-16(14)22-15/h1-6,11,19H,7-10H2","QWGDMFLQWFTERH-UHFFFAOYSA-N"
"CN(C4)CCN(C4)C(=N1)c(c3)c(ccc(Cl)3)Oc(c2)c(cc(O)c2)1","InChI=1S/C18H18ClN3O2/c1-21-6-8-22(9-7-21)18-14-10-12(19)2-4-16(14)24-17-5-3-13(23)11-15(17)20-18/h2-5,10-11,23H,6-9H2,1H3","VNJRIWXLPIYFGI-UHFFFAOYSA-N"
"COc(c2)c(OC)c(OC)c(c2)CN(C1)CCNC1","InChI=1S/C14H22N2O3/c1-17-12-5-4-11(13(18-2)14(12)19-3)10-16-8-6-15-7-9-16/h4-5,15H,6-10H2,1-3H3","UHWVSEOVJBQKBE-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c(O)1)cc(cc1)S(C)(=O)=O","InChI=1S/C14H22N2O4S/c1-4-16(5-2)9-8-15-14(18)12-10-11(21(3,19)20)6-7-13(12)17/h6-7,10,17H,4-5,8-9H2,1-3H3,(H,15,18)","SMMXTJMPESFCOQ-UHFFFAOYSA-N"
"CCN(CC)CCNC(=O)c(c(OC)1)cc(cc1)S(C)(=O)=O","InChI=1S/C15H24N2O4S/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18)","JTVPZMFULRWINT-UHFFFAOYSA-N"
"CCN(C2)C(CC2)CNC(=O)c(c(OC)1)cc(cc1)S(=O)(=O)CC","InChI=1S/C17H26N2O4S/c1-4-19-10-6-7-13(19)12-18-17(20)15-11-14(24(21,22)5-2)8-9-16(15)23-3/h8-9,11,13H,4-7,10,12H2,1-3H3,(H,18,20)","UNRHXEPDKXPRTM-UHFFFAOYSA-N"
"OCC(C=2)OC(C2)N(C=1)C(=O)NC(=O)C(C)1","InChI=1S/C10H12N2O4/c1-6-4-12(10(15)11-9(6)14)8-3-2-7(5-13)16-8/h2-4,7-8,13H,5H2,1H3,(H,11,14,15)/t7-,8+/m0/s1","XNKLLVCARDGLGL-JGVFFNPUSA-N"
"C(C1N(C(=O)5)c(c4)c(N5)ccc4)CN(CCCC(c(c3)ccc(c3)F)c(c2)ccc(c2)F)CC1","InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34)","YVUQSNJEYSNKRX-UHFFFAOYSA-N"
"OCCN(C4)CCN(C4)CCCN(c21)c(c3)c(cc(Cl)c3)Sc(cccc2)1","InChI=1S/C21H26ClN3OS/c22-17-6-7-19-21(16-17)27-20-5-2-1-4-18(20)25(19)9-3-8-23-10-12-24(13-11-23)14-15-26/h1-2,4-7,16,26H,3,8-15H2","QKCRCAHAOIHDMI-UHFFFAOYSA-N"
"COc(c4)cc(c(c4)1)N(CC(C)CN(C3)CCC(O)C3)c(c2)c(ccc2)S1","InChI=1S/C22H28N2O2S/c1-16(14-23-11-9-17(25)10-12-23)15-24-19-5-3-4-6-21(19)27-22-8-7-18(26-2)13-20(22)24/h3-8,13,16-17,25H,9-12,14-15H2,1-2H3","WYRWAVVTDKZRIJ-UHFFFAOYSA-N"
"N(CCCC(c(c4)ccc(c4)F)c(c3)ccc(c3)F)(C2)CCC(C2)(c(c1)cc(c(c1)Cl)C(F)(F)F)O","InChI=1S/C28H27ClF5NO/c29-26-12-7-21(18-25(26)28(32,33)34)27(36)13-16-35(17-14-27)15-1-2-24(19-3-8-22(30)9-4-19)20-5-10-23(31)11-6-20/h3-12,18,24,36H,1-2,13-17H2","MDLAAYDRRZXJIF-UHFFFAOYSA-N"
"CN(C4)CCN(C4)C(=N1)c(c3)c(sc(C)3)Nc(c2)c(ccc2)1","InChI=1S/C17H20N4S/c1-12-11-13-16(21-9-7-20(2)8-10-21)18-14-5-3-4-6-15(14)19-17(13)22-12/h3-6,11,19H,7-10H2,1-2H3","KVWDHTXUZHCGIO-UHFFFAOYSA-N"
"CN(C)CCN(Cc(c2)ccc(OC)c2)c(c1)nccc1","InChI=1S/C17H23N3O/c1-19(2)12-13-20(17-6-4-5-11-18-17)14-15-7-9-16(21-3)10-8-15/h4-11H,12-14H2,1-3H3","YECBIJXISLIIDS-UHFFFAOYSA-N"
"CC(C)NNC(=O)c(c1)ccnc1","InChI=1S/C9H13N3O/c1-7(2)11-12-9(13)8-3-5-10-6-4-8/h3-7,11H,1-2H3,(H,12,13)","NYMGNSNKLVNMIA-UHFFFAOYSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc(CC)3)Sc(cccc2)1","InChI=1S/C20H26N2S/c1-5-16-10-11-20-18(12-16)22(14-15(2)13-21(3)4)17-8-6-7-9-19(17)23-20/h6-12,15H,5,13-14H2,1-4H3","USKHCLAXJXCWMO-UHFFFAOYSA-N"
"Fc(c3)ccc(c3)C(=O)CCCN(C2)CCC(O)(C2)c(c1)ccc(Cl)c1","InChI=1S/C21H23ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,26H,1-2,11-15H2","LNEPOXFFQSENCJ-UHFFFAOYSA-N"
"Fc(c3)ccc(c3)C(O)CCCN(C2)CCC(O)(C2)c(c1)ccc(Cl)c1","InChI=1S/C21H25ClFNO2/c22-18-7-5-17(6-8-18)21(26)11-14-24(15-12-21)13-1-2-20(25)16-3-9-19(23)10-4-16/h3-10,20,25-26H,1-2,11-15H2","WNZBBTJFOIOEMP-UHFFFAOYSA-N"
"CC=C(N(C)3)C(CC(C)3)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C20H23N/c1-4-19-20(15-16(2)21(19)3,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h4-14,16H,15H2,1-3H3/b19-4-","AJRJPORIQGYFMT-PVOVUMCXSA-N"
"CN(C)CC(C)CN(c21)c(c3)c(ccc3)S(=O)c(cccc2)1","InChI=1S/C18H22N2OS/c1-14(12-19(2)3)13-20-15-8-4-6-10-17(15)22(21)18-11-7-5-9-16(18)20/h4-11,14H,12-13H2,1-3H3","XZLXDYORQZVLKR-UHFFFAOYSA-N"
"CC(C1)OC(OC(C2C)C(C)(O)CC(C(=O)C(C(C(C(CC)OC(=O)C(C2OC(C3)OC(C)C(O)C3(C)OC)C)(C)O)O)C)C)C(O)C(N(C)C)1","InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31+,32-,34+,35-,36-,37-/m1/s1","ULGZDMOVFRHVEP-RWJQBGPGSA-N"
"CCC(NC)Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C12H17NO2/c1-3-10(13-2)6-9-4-5-11-12(7-9)15-8-14-11/h4-5,7,10,13H,3,6,8H2,1-2H3","USWVWJSAJAEEHQ-UHFFFAOYSA-N"
"CCNC(C)Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C12H17NO2/c1-3-13-9(2)6-10-4-5-11-12(7-10)15-8-14-11/h4-5,7,9,13H,3,6,8H2,1-2H3","PVXVWWANJIWJOO-UHFFFAOYSA-N"
"NC(=N)N(C1)Cc(c2)c(ccc2)C1","InChI=1S/C10H13N3/c11-10(12)13-6-5-8-3-1-2-4-9(8)7-13/h1-4H,5-7H2,(H3,11,12)","JWPGJSVJDAJRLW-UHFFFAOYSA-N"
"NNC(C)(C(O)=O)Cc(c1)cc(O)c(O)c1","InChI=1S/C10H14N2O4/c1-10(12-11,9(15)16)5-6-2-3-7(13)8(14)4-6/h2-4,12-14H,5,11H2,1H3,(H,15,16)/t10-/m0/s1","TZFNLOMSOLWIDK-JTQLQIEISA-N"
"CC(O1)C(OC(C8)OC(C)C(C(O)8)O)C(O)CC(OC(C7O)C(OC(C7)OC(C2)CCC(C([H])36)(C(CCC3(C(O)(C4(C)CC6)CC(C4C(=C5)COC5=O)O)[H])([H])2)C)C)1","InChI=1S/C41H64O14/c1-19-36(47)27(42)14-33(50-19)54-38-21(3)52-34(16-29(38)44)55-37-20(2)51-32(15-28(37)43)53-24-8-10-39(4)23(13-24)6-7-26-25(39)9-11-40(5)35(22-12-31(46)49-18-22)30(45)17-41(26,40)48/h12,19-21,23-30,32-38,42-45,47-48H,6-11,13-18H2,1-5H3/t19-,20-,21-,23-,24+,25+,26-,27+,28+,29+,30+,32+,33+,34+,35+,36-,37-,38-,39+,40-,41+/m1/s1","LKRDZKPBAOKJBT-CNPIRKNPSA-N"
"NC(=O)CN(C1)C(=O)CC1","InChI=1S/C6H10N2O2/c7-5(9)4-8-3-1-2-6(8)10/h1-4H2,(H2,7,9)","GMZVRMREEHBGGF-UHFFFAOYSA-N"
"OCC(=O)C(O)(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(O)3)C(C)(C=2)C(=CC(=O)C2)C1","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,16-,18+,19-,20-,21-/m0/s1","OIGNJSKKLXVSLS-VWUMJDOOSA-N"
"","InChI=1S/C24H31FO6/c1-20(2)30-19-10-16-15-6-5-13-9-14(27)7-8-21(13,3)23(15,25)17(28)11-22(16,4)24(19,31-20)18(29)12-26/h7-9,15-17,19,26,28H,5-6,10-12H2,1-4H3/t15-,16-,17-,19+,21-,22-,23-,24+/m0/s1","YNDXUCZADRHECN-JNQJZLCISA-N"
"Clc(c2)ccc(c2)NC(=O)Nc(c1)cc(Cl)c(Cl)c1","InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)","ICUTUKXCWQYESQ-UHFFFAOYSA-N"
"NC(=O)OCCCc(c1)cccc1","InChI=1S/C10H13NO2/c11-10(12)13-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H2,11,12)","CAMYKONBWHRPDD-UHFFFAOYSA-N"
"[K]OC(=O)C(C(C)(C)3)N(C(=O)1)C([H])(S3)C(NC(=O)Cc(c2)cccc2)1","InChI=1S/C16H18N2O4S.K/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9;/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22);/q;+1/p-1/t11-,12+,14-;/m1./s1","IYNDLOXRXUOGIU-LQDWTQKMSA-M"
"c(c3)ccc(c3)CC(=O)NC(C(=O)1)C([H])(S2)N1C(C(O)=O)C(C)(C)2","InChI=1S/C16H18N2O4S/c1-16(2)12(15(21)22)18-13(20)11(14(18)23-16)17-10(19)8-9-6-4-3-5-7-9/h3-7,11-12,14H,8H2,1-2H3,(H,17,19)(H,21,22)/t11-,12+,14-/m1/s1","JGSARLDLIJGVTE-MBNYWOFBSA-N"
"CCOC(=O)C(CCC)NC(C)C(=O)N(C(C(O)=O)1)C([H])(C2)C([H])(CCC2)C1","InChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14-,15-,16-/m0/s1","IPVQLZZIHOAWMC-QXKUPLGCSA-N"
"CCCC(C(O)=O)NC(C)C(=O)N(C(C(O)=O)1)C([H])(C2)C([H])(CCC2)C1","InChI=1S/C17H28N2O5/c1-3-6-12(16(21)22)18-10(2)15(20)19-13-8-5-4-7-11(13)9-14(19)17(23)24/h10-14,18H,3-9H2,1-2H3,(H,21,22)(H,23,24)/t10-,11-,12-,13-,14-/m0/s1","ODAIHABQVKJNIY-PEDHHIEDSA-N"
"C(C(OC(=O)CC)4C(=O)COC(=O)CC)(C3([H])CC(C)4)(CC(O)C(C23[H])(C(C=1CC2)(C=CC(=O)C1)C)Cl)C","InChI=1S/C28H37ClO7/c1-6-23(33)35-15-22(32)28(36-24(34)7-2)16(3)12-20-19-9-8-17-13-18(30)10-11-25(17,4)27(19,29)21(31)14-26(20,28)5/h10-11,13,16,19-21,31H,6-9,12,14-15H2,1-5H3/t16-,19-,20-,21-,25-,26-,27-,28-/m0/s1","KUVIULQEHSCUHY-XYWKZLDCSA-N"
"OCCN(CCO)c(n1)nc(c(N(C4)CCCC4)3)c(nc(N(CCO)CCO)n3)c(N(C2)CCCC2)1","InChI=1S/C24H40N8O4/c33-15-11-31(12-16-34)23-26-20-19(21(27-23)29-7-3-1-4-8-29)25-24(32(13-17-35)14-18-36)28-22(20)30-9-5-2-6-10-30/h33-36H,1-18H2","IZEKFCXSFNUWAM-UHFFFAOYSA-N"
"C(C3)CNC(C3)C(O)c(c2)c(c1)c(nc(C(F)(F)F)2)c(cc1)C(F)(F)F","InChI=1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2","XEEQGYMUWCZPDN-UHFFFAOYSA-N"
"CN(C)CCC1=CNC2=C1C=C(C=C2)C[C@H]3COC(=O)N3","InChI=1S/C16H21N3O2/c1-19(2)6-5-12-9-17-15-4-3-11(8-14(12)15)7-13-10-21-16(20)18-13/h3-4,8-9,13,17H,5-7,10H2,1-2H3,(H,18,20)/t13-/m0/s1","ULSDMUVEXKOYBU-ZDUSSCGKSA-N"
"COC(CN(C3)CCN(C3)CC(O)C(OC)c(c2)cccc2)c(c1)cccc1","InChI=1S/C23H32N2O3/c1-27-22(19-9-5-3-6-10-19)18-25-15-13-24(14-16-25)17-21(26)23(28-2)20-11-7-4-8-12-20/h3-12,21-23,26H,13-18H2,1-2H3","VSTNNAYSCJQCQI-UHFFFAOYSA-N"
"COC(=O)C(O)(C1)n(c54)c(c3c(cccc5)4)C([H])(N2CC3)C(CC)(CCC2)1","InChI=1S/C21H26N2O3/c1-3-20-10-6-11-22-12-9-15-14-7-4-5-8-16(14)23(17(15)18(20)22)21(25,13-20)19(24)26-2/h4-5,7-8,18,25H,3,6,9-13H2,1-2H3/t18-,20+,21+/m1/s1","RXPRRQLKFXBCSJ-GIVPXCGWSA-N"
"CCC(C5)(C3)C([H])(N(CC5)4)c(c(CC4)1)n(C(=O)3)c(c2)c(ccc2)1","InChI=1S/C19H22N2O/c1-2-19-9-5-10-20-11-8-14-13-6-3-4-7-15(13)21(16(22)12-19)17(14)18(19)20/h3-4,6-7,18H,2,5,8-12H2,1H3/t18-,19+/m1/s1","WYJAPUKIYAZSEM-MOPGFXCFSA-N"
"C=CCN(C2)C(CC2)CNC(=O)c(c1)c(OC)c(OC)cc1S(N)(=O)=O","InChI=1S/C17H25N3O5S/c1-4-7-20-8-5-6-12(20)11-19-17(21)14-9-13(26(18,22)23)10-15(24-2)16(14)25-3/h4,9-10,12H,1,5-8,11H2,2-3H3,(H,19,21)(H2,18,22,23)","RYJXBGGBZJGVQF-UHFFFAOYSA-N"
"OCC(=O)C(O)(C4)C(C)(C3)C([H])(C4)C([H])(C1)C([H])(C(=O)3)C(C)(C=2)C(=CC(=O)C2)C1","InChI=1S/C21H26O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-15,18,22,26H,3-4,6,8,10-11H2,1-2H3/t14-,15-,18+,19-,20-,21-/m0/s1","XOFYZVNMUHMLCC-ZPOLXVRWSA-N"
"C(OC(O3)CC(OC)(C(O)C(C)3)C)(C1C)C(C(OC(CC)C(C(C(C(C(C)CC(C1OC(C2O)OC(C)CC2N(C)C)(C)O)=NOCOCCOC)C)O)(C)O)=O)C","InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/b42-31-/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1","RXZBMPWDPOLZGW-HEWSMUCTSA-N"
"C(CCCCNCC(O)c(c2)cc(CO)c(O)c2)COCCCCc(c1)cccc1","InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2","GIIZNNXWQWCKIB-UHFFFAOYSA-N"
"CCOc(c4)c(cc(c4)S(=O)(=O)N(C3)CCN(C)C3)C(N1)=Nc(c(CCC)2)c(n(C)n2)C(=O)1","InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)","BNRNXUUZRGQAQC-UHFFFAOYSA-N"
"CCCCNc(c1)ccc(c1)C(=O)OCCN(C)C","InChI=1S/C15H24N2O2/c1-4-5-10-16-14-8-6-13(7-9-14)15(18)19-12-11-17(2)3/h6-9,16H,4-5,10-12H2,1-3H3","GKCBAIGFKIBETG-UHFFFAOYSA-N"
"CCCCNC(=O)NS(=O)(=O)c(c1)ccc(C)c1","InChI=1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15)","JLRGJRBPOGGCBT-UHFFFAOYSA-N"
"COc(c2)cc(cc2)C(O)(C1)C(CN(C)C)CCC1","InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/t14-,16+/m1/s1","TVYLLZQTGLZFBW-ZBFHGGJFSA-N"
"O=C(O5)C=C(C5)C(C4)C(C)(C3)C(O)(C4)C([H])(C1)C([H])(C3)C(C)(C2)C([H])(CC(O)C2)C1","InChI=1S/C23H34O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15-,16+,17-,18+,19-,21+,22-,23+/m1/s1","XZTUSOXSLKTKJQ-CESUGQOBSA-N"
"CCCCC(C(=O)1)C(=O)N(c(c3)cccc3)N(c(c2)cccc2)1","InChI=1S/C19H20N2O2/c1-2-3-14-17-18(22)20(15-10-6-4-7-11-15)21(19(17)23)16-12-8-5-9-13-16/h4-13,17H,2-3,14H2,1H3","VYMDGNCVAMGZFE-UHFFFAOYSA-N"
"OC(C(O)1)C(OC(OC(C6)C=C(C5)C(C)(C6)C(C4)([H])C([H])(C5)C(C(C)(C4)2)(CCC2C(C=3)=COC(C3)=O)O)C1O)C","InChI=1S/C30H42O8/c1-16-24(32)25(33)26(34)27(37-16)38-19-8-11-28(2)18(14-19)5-6-22-21(28)9-12-29(3)20(10-13-30(22,29)35)17-4-7-23(31)36-15-17/h4,7,14-16,19-22,24-27,32-35H,5-6,8-13H2,1-3H3/t16-,19-,20+,21-,22+,24-,25+,26+,27-,28-,29+,30-/m0/s1","MYEJFUXQJGHEQK-ALRJYLEOSA-N"
"CCCNC(C)C(=O)Nc(c1)c(C)ccc1","InChI=1S/C13H20N2O/c1-4-9-14-11(3)13(16)15-12-8-6-5-7-10(12)2/h5-8,11,14H,4,9H2,1-3H3,(H,15,16)","MVFGUOIZUNYYSO-UHFFFAOYSA-N"
"CC(NCCC(c(c3)cccc3)c(c2)cccc2)Cc(c1)cccc1","InChI=1S/C24H27N/c1-20(19-21-11-5-2-6-12-21)25-18-17-24(22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-16,20,24-25H,17-19H2,1H3","IFFPICMESYHZPQ-UHFFFAOYSA-N"
"CCC(C(=O)2)C(CO2)Cc(c1)n(C)cn1","InChI=1S/C11H16N2O2/c1-3-10-8(6-15-11(10)14)4-9-5-12-7-13(9)2/h5,7-8,10H,3-4,6H2,1-2H3/t8-,10-/m0/s1","QCHFTSOMWOSFHM-WPRPVWTQSA-N"
"CCOC(=O)C(=C(C)1)C(c(c2)cc(N(=O)=O)cc2)C(C(=O)OC)=C(C)N1","InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3","PVHUJELLJLJGLN-UHFFFAOYSA-N"
"c(c1)(N(=O)=O)cccc1C(C(C(=O)OC)=2)C(C(=O)OCCN(C)Cc(c3)cccc3)=C(NC2C)C","InChI=1S/C26H29N3O6/c1-17-22(25(30)34-4)24(20-11-8-12-21(15-20)29(32)33)23(18(2)27-17)26(31)35-14-13-28(3)16-19-9-6-5-7-10-19/h5-12,15,24,27H,13-14,16H2,1-4H3","ZBBHBTPTTSWHBA-UHFFFAOYSA-N"
"OC(=O)c(c1)c(NCc(c2)occ2)cc(Cl)c1S(N)(=O)=O","InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)","ZZUFCTLCJUWOSV-UHFFFAOYSA-N"
"Cc(c3)sc(n3)NC(=O)C(=C(O)1)N(C)S(=O)(=O)c(c2)c(ccc2)1","InChI=1S/C14H13N3O4S2/c1-8-7-15-14(22-8)16-13(19)11-12(18)9-5-3-4-6-10(9)23(20,21)17(11)2/h3-7,18H,1-2H3,(H,15,16,19)","ZRVUJXDFFKFLMG-UHFFFAOYSA-N"
"CC(C)(C)NCC([H])(O)COc(c2)c(ccc2)C(C1)CCC1","InChI=1S/C18H29NO2/c1-18(2,3)19-12-15(20)13-21-17-11-7-6-10-16(17)14-8-4-5-9-14/h6-7,10-11,14-15,19-20H,4-5,8-9,12-13H2,1-3H3/t15-/m0/s1","KQXKVJAGOJTNJS-HNNXBMFYSA-N"
"Clc(c4)ccc(c4)C(O)CC(c(c3)sc(Cl)c3)C(C(=O)1)=C(O)c(c2)c(ccc2)O1","InChI=1S/C22H16Cl2O4S/c23-13-7-5-12(6-8-13)16(25)11-15(18-9-10-19(24)29-18)20-21(26)14-3-1-2-4-17(14)28-22(20)27/h1-10,15-16,25-26H,11H2","WRGOVNKNTPWHLZ-UHFFFAOYSA-N"
"CCC(C)N(C(=O)1)C(=O)C(Br)=C(C)N1","InChI=1S/C9H13BrN2O2/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14/h5H,4H2,1-3H3,(H,11,14)","CTSLUCNDVMMDHG-UHFFFAOYSA-N"
"Fc(c3)ccc(c3)C(C(=O)1)C(=O)c(c2)c(ccc2)1","InChI=1S/C15H9FO2/c16-10-7-5-9(6-8-10)13-14(17)11-3-1-2-4-12(11)15(13)18/h1-8,13H","NASXCEITKQITLD-UHFFFAOYSA-N"
"COC(=O)c(c(C)1)c(c(c2)c(ccc2)[N+1]([O-1])=O)c(C(=O)OC)c(C)n1","InChI=1S/C17H16N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8H,1-4H3","UMQHJQGNGLQJPF-UHFFFAOYSA-N"
"NNc(n1)c(c2)c(ccc2)c(NN)n1","InChI=1S/C8H10N6/c9-11-7-5-3-1-2-4-6(5)8(12-10)14-13-7/h1-4H,9-10H2,(H,11,13)(H,12,14)","VQKLRVZQQYVIJW-UHFFFAOYSA-N"
"","InChI=1S/C29H44O12/c1-13-22(34)23(35)24(36)25(40-13)41-15-8-19(32)28(12-30)21-17(3-5-27(28,37)9-15)29(38)6-4-16(14-7-20(33)39-11-14)26(29,2)10-18(21)31/h7,13,15-19,21-25,30-32,34-38H,3-6,8-12H2,1-2H3/t13-,15-,16+,17+,18+,19+,21+,22+,23+,24+,25-,26+,27-,28+,29-/m0/s1","LPMXVESGRSUGHW-PUBTVXBGSA-N"
"CCN(CC)CC#CCOC(=O)C(O)(C(C2)CCCC2)c(c1)cccc1","InChI=1S/C22H31NO3/c1-3-23(4-2)17-11-12-18-26-21(24)22(25,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5,7-8,13-14,20,25H,3-4,6,9-10,15-18H2,1-2H3","XIQVNETUBQGFHX-UHFFFAOYSA-N"
"C(C([H])54)(c(c(C(OC(C8O)(OC([H])(C7([H])C(O)8)COC(O7)c(c6)scc6)[H])C4(COC5=O)[H])3)cc(c2c3)OCO2)c(c1)cc(OC)c(c1OC)O","InChI=1S/C32H32O13S/c1-37-19-6-13(7-20(38-2)25(19)33)23-14-8-17-18(42-12-41-17)9-15(14)28(16-10-39-30(36)24(16)23)44-32-27(35)26(34)29-21(43-32)11-40-31(45-29)22-4-3-5-46-22/h3-9,16,21,23-24,26-29,31-35H,10-12H2,1-2H3/t16-,21+,23+,24-,26+,27+,28+,29+,31+,32-/m0/s1","NRUKOCRGYNPUPR-QBPJDGROSA-N"
"Oc(c2)ccc(c2)C(=O)NN=Cc(c1)oc(N(=O)=O)c1","InChI=1S/C12H9N3O5/c16-9-3-1-8(2-4-9)12(17)14-13-7-10-5-6-11(20-10)15(18)19/h1-7,16H,(H,14,17)/b13-7+","YCWSUKQGVSGXJO-NTUHNPAUSA-N"
"C(C3)CCC(C3)N(C(=O)1)C(=O)C(C2)=C(CC2)N1","InChI=1S/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)","ZTMKADLOSYKWCA-UHFFFAOYSA-N"
"CSC(=N1)N(N)C(=O)C(=N1)C(C)(C)C","InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3","FOXFZRUHNHCZPX-UHFFFAOYSA-N"
"CCN(CC)CCOC(=O)C(CC(C3)OCC3)Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C24H33NO3/c1-3-25(4-2)14-16-28-24(26)21(18-22-12-8-15-27-22)17-20-11-7-10-19-9-5-6-13-23(19)20/h5-7,9-11,13,21-22H,3-4,8,12,14-18H2,1-2H3","KBAFPSLPKGSANY-UHFFFAOYSA-N"
"CC1=CN=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC","InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)","SUBDBMMJDZJVOS-UHFFFAOYSA-N"
"[H]C(C36[H])(C(C5)(O)C(CC6)(C)C(C5OC(C)=O)C(C4)=CC(O4)=O)CCC(C31C)([H])CC(OC(C2)OC(C(O)C(OC)2)C)CC1","InChI=1S/C32H48O9/c1-17-29(35)24(37-5)14-27(39-17)41-21-8-10-30(3)20(13-21)6-7-23-22(30)9-11-31(4)28(19-12-26(34)38-16-19)25(40-18(2)33)15-32(23,31)36/h12,17,20-25,27-29,35-36H,6-11,13-16H2,1-5H3/t17-,20+,21-,22-,23+,24-,25-,27-,28-,29-,30-,31+,32-/m0/s1","JLPDBLFIVFSOCC-XYXFTTADSA-N"
"C(C(OC)41)([H])(N(C)CC(COC(=O)c(c5)cc(Br)cn5)C4)Cc(c3)c(c2n(C)3)c1ccc2","InChI=1S/C24H26BrN3O3/c1-27-13-17-8-21-24(30-3,19-5-4-6-20(27)22(17)19)9-15(12-28(21)2)14-31-23(29)16-7-18(25)11-26-10-16/h4-7,10-11,13,15,21H,8-9,12,14H2,1-3H3/t15-,21-,24+/m1/s1","YSEXMKHXIOCEJA-FVFQAYNVSA-N"
"C(C3)NC(=N3)Cc(c1)c(c2)c(ccc2)cc1","InChI=1S/C14H14N2/c1-2-7-13-11(4-1)5-3-6-12(13)10-14-15-8-9-16-14/h1-7H,8-10H2,(H,15,16)","CNIIGCLFLJGOGP-UHFFFAOYSA-N"
"CCC(C(O)1)C([H])(C2)C([H])(C(O)4)C([H])(C3)N1C([H])2C([H])(N(C)5)C(c(c6)c(ccc6)5)34","InChI=1S/C20H26N2O2/c1-3-10-11-8-14-17-20(12-6-4-5-7-13(12)21(17)2)9-15(16(11)18(20)23)22(14)19(10)24/h4-7,10-11,14-19,23-24H,3,8-9H2,1-2H3/t10-,11-,14-,15-,16+,17-,18+,19+,20+/m0/s1","CJDRUOGAGYHKKD-OVXZWHIBSA-N"
"Oc(c3)ccc(c3)C(O)C(C)N(C2)CCC(C2)Cc(c1)cccc1","InChI=1S/C21H27NO2/c1-16(21(24)19-7-9-20(23)10-8-19)22-13-11-18(12-14-22)15-17-5-3-2-4-6-17/h2-10,16,18,21,23-24H,11-15H2,1H3","UYNVMODNBIQBMV-UHFFFAOYSA-N"
"OCC(O)COC(=O)c(c3)c(ccc(O)3)Nc(c2)c(c1)c(nc2)c(cc1)C(F)(F)F","InChI=1S/C20H17F3N2O5/c21-20(22,23)15-3-1-2-13-17(6-7-24-18(13)15)25-16-5-4-11(27)8-14(16)19(29)30-10-12(28)9-26/h1-8,12,26-28H,9-10H2,(H,24,25)","RBFYACKGKXTHMK-UHFFFAOYSA-N"
"CN(C)CCc(c1)ccc(O)c1","InChI=1S/C10H15NO/c1-11(2)8-7-9-3-5-10(12)6-4-9/h3-6,12H,7-8H2,1-2H3","KUBCEEMXQZUPDQ-UHFFFAOYSA-N"
"NC(CCP(C)(O)=O)C(O)=O","InChI=1S/C5H12NO4P/c1-11(9,10)3-2-4(6)5(7)8/h4H,2-3,6H2,1H3,(H,7,8)(H,9,10)","IAJOBQBIJHVGMQ-UHFFFAOYSA-N"
"CC(C)NCC(O)c(c1)cc(O)c(O)c1","InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3","JWZZKOKVBUJMES-UHFFFAOYSA-N"
"Clc(c4)ccc(c4)OCC(=O)N(C3)CCN(C3)Cc(c1)cc(O2)c(OC2)c1","InChI=1S/C20H21ClN2O4/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18/h1-6,11H,7-10,12-14H2","BFUJHVVEMMWLHC-UHFFFAOYSA-N"
"C(C3)CC[N+1](C)(C3)CCC(C(N)=O)(c(c2)cccc2)c(c1)cccc1","InChI=1S/C22H28N2O/c1-24(16-9-4-10-17-24)18-15-22(21(23)25,19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-3,5-8,11-14H,4,9-10,15-18H2,1H3,(H-,23,25)/p+1","QDIYJDPBMZUZEH-UHFFFAOYSA-O"
"Oc(c2)c(O)c(O)c(c2)C(=O)c(c1)cc(O)c(O)c(O)1","InChI=1S/C13H10O7/c14-7-2-1-6(11(18)13(7)20)10(17)5-3-8(15)12(19)9(16)4-5/h1-4,14-16,18-20H","XEDWWPGWIXPVRQ-UHFFFAOYSA-N"
"CN(C)C(=O)Nc(c1)cc(Cl)c(Cl)c1","InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","XMTQQYYKAHVGBJ-UHFFFAOYSA-N"
"S=C(N1)NC(=N2)C(N=C2)=C1","InChI=1S/C5H4N4S/c10-5-6-1-3-4(9-5)8-2-7-3/h1-2H,(H2,6,7,8,9,10)","HDBQZGJWHMCXIL-UHFFFAOYSA-N"
"C1=NC2=C(N1)C(=S)N=C(N2)N","InChI=1S/C5H5N5S/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)","WYWHKKSPHMUBEB-UHFFFAOYSA-N"
"c(c4)cc(C3)c(c4)C(CC3)C(C(=O)1)=C(O)c(c2)c(ccc2)O1","InChI=1S/C19H16O3/c20-18-15-9-3-4-11-16(15)22-19(21)17(18)14-10-5-7-12-6-1-2-8-13(12)14/h1-4,6,8-9,11,14,20H,5,7,10H2","ULSLJYXHZDTLQK-UHFFFAOYSA-N"
"Clc(c4)ccc(c4)C(c(c3)cccc3)C(=O)C(C(=O)1)C(=O)c(c2)c(ccc2)1","InChI=1S/C23H15ClO3/c24-16-12-10-15(11-13-16)19(14-6-2-1-3-7-14)23(27)20-21(25)17-8-4-5-9-18(17)22(20)26/h1-13,19-20H","UDHXJZHVNHGCEC-UHFFFAOYSA-N"
"CNC(=O)Oc(c2)c(O1)c(cc2)CC(C)(C)1","InChI=1S/C12H15NO3/c1-12(2)7-8-5-4-6-9(10(8)16-12)15-11(14)13-3/h4-6H,7H2,1-3H3,(H,13,14)","DUEPRVBVGDRKAG-UHFFFAOYSA-N"
"CN(C)c(c1)nc(Cl)nc(C)1","InChI=1S/C7H10ClN3/c1-5-4-6(11(2)3)10-7(8)9-5/h4H,1-3H3","HJIUPFPIEBPYIE-UHFFFAOYSA-N"
"CCNCCOc(c(I)3)c(I)cc(c3)C(=O)c(c(CCCC)1)c(c2)c(ccc2)o1","InChI=1S/C23H25I2NO3/c1-3-5-9-20-21(16-8-6-7-10-19(16)29-20)22(27)15-13-17(24)23(18(25)14-15)28-12-11-26-4-2/h6-8,10,13-14,26H,3-5,9,11-12H2,1-2H3","VXOKDLACQICQFA-UHFFFAOYSA-N"
"O=C(C2)Nc(c3)c(cc(Cl)c3)C(=N2)c(c1)c(F)ccc1","InChI=1S/C15H10ClFN2O/c16-9-5-6-13-11(7-9)15(18-8-14(20)19-13)10-3-1-2-4-12(10)17/h1-7H,8H2,(H,19,20)","UVCOILFBWYKHHB-UHFFFAOYSA-N"
"CN(C)CC(c(c2)ccc(O)c2)C(O)(C1)CCCC1","InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3","KYYIDSXMWOZKMP-UHFFFAOYSA-N"
"CC(C)NCCC(C(N)=O)(c(c2)cccc2)c(c1)nccc1","InChI=1S/C18H23N3O/c1-14(2)20-13-11-18(17(19)22,15-8-4-3-5-9-15)16-10-6-7-12-21-16/h3-10,12,14,20H,11,13H2,1-2H3,(H2,19,22)","UWNSWIXIVDMCHZ-UHFFFAOYSA-N"
"Clc(c4)cnc(c4)N(C(=O)1)C(OC(=O)N(C3)CC[N+1](C)([O-1])C3)c(n2)c(ncc2)1","InChI=1S/C17H17ClN6O4/c1-24(27)8-6-22(7-9-24)17(26)28-16-14-13(19-4-5-20-14)15(25)23(16)12-3-2-11(18)10-21-12/h2-5,10,16H,6-9H2,1H3","IPTIKKTXLHVRKN-UHFFFAOYSA-N"
"CC(=O)OC(C=5)C(O2)C(C4)(c13)C([H])(C5)C(N(C)C4)Cc(ccc(O)c23)1","InChI=1S/C19H21NO4/c1-10(21)23-15-6-4-12-13-9-11-3-5-14(22)17-16(11)19(12,18(15)24-17)7-8-20(13)2/h3-6,12-13,15,18,22H,7-9H2,1-2H3/t12-,13+,15-,18-,19-/m0/s1","JJGYGPZNTOPXGV-SSTWWWIQSA-N"
"O=C(C2)Nc(c3)c(cc(N)c3)C(=N2)c(c1)cccc1","InChI=1S/C15H13N3O/c16-11-6-7-13-12(8-11)15(17-9-14(19)18-13)10-4-2-1-3-5-10/h1-8H,9,16H2,(H,18,19)","OYOUQHVDCKOOAL-UHFFFAOYSA-N"
"Nc(c3)cc(c(c3)2)C(=NCC(=O)N(C)2)c(c1)c(F)ccc1","InChI=1S/C16H14FN3O/c1-20-14-7-6-10(18)8-12(14)16(19-9-15(20)21)11-4-2-3-5-13(11)17/h2-8H,9,18H2,1H3","LTCDLGUFORGHGY-UHFFFAOYSA-N"
"O=C(C2)Nc(c3)c(cc(N)c3)C(=N2)c(c1)c(Cl)ccc1","InChI=1S/C15H12ClN3O/c16-12-4-2-1-3-10(12)15-11-7-9(17)5-6-13(11)19-14(20)8-18-15/h1-7H,8,17H2,(H,19,20)","HEFRPWRJTGLSSV-UHFFFAOYSA-N"
"CCCNCC(O)COc(c2)c(cc(O)c2)C(=O)CCc(c1)cccc1","InChI=1S/C21H27NO4/c1-2-12-22-14-18(24)15-26-21-11-9-17(23)13-19(21)20(25)10-8-16-6-4-3-5-7-16/h3-7,9,11,13,18,22-24H,2,8,10,12,14-15H2,1H3","LUTWDNUXHDYZRA-UHFFFAOYSA-N"
"CC(N)Cc(c1)ccc(SC)c1","InChI=1S/C10H15NS/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3","OLEWMKVPSUCNLG-UHFFFAOYSA-N"
"COc(c1)ccc(CC(C)N)c1","InChI=1S/C10H15NO/c1-8(11)7-9-3-5-10(12-2)6-4-9/h3-6,8H,7,11H2,1-2H3","NEGYEDYHPHMHGK-UHFFFAOYSA-N"
"CC(N)Cc(c1)c(OC)cc(Br)c(OC)1","InChI=1S/C11H16BrNO2/c1-7(13)4-8-5-11(15-3)9(12)6-10(8)14-2/h5-7H,4,13H2,1-3H3","FXMWUTGUCAKGQL-UHFFFAOYSA-N"
"CC(N)Cc(c1)cc(OC)c(OC)c(OC)1","InChI=1S/C12H19NO3/c1-8(13)5-9-6-10(14-2)12(16-4)11(7-9)15-3/h6-8H,5,13H2,1-4H3","WGTASENVNYJZBK-UHFFFAOYSA-N"
"COc(c1)cc(CC([H])(C)N)c(OC)c1","InChI=1S/C11H17NO2/c1-8(12)6-9-7-10(13-2)4-5-11(9)14-3/h4-5,7-8H,6,12H2,1-3H3/t8-/m0/s1","LATVFYDIBMDBSY-QMMMGPOBSA-N"
"OCCN(C(=O)2)c(c3)c(cc(Cl)c3)C(=NC2)c(c1)c(F)ccc1","InChI=1S/C17H14ClFN2O2/c18-11-5-6-15-13(9-11)17(12-3-1-2-4-14(12)19)20-10-16(23)21(15)7-8-22/h1-6,9,22H,7-8,10H2","FOCBRQQHNOKOJQ-UHFFFAOYSA-N"
"NC(=N)N(C1)Cc(c2)c(ccc2)C(O)1","InChI=1S/C10H13N3O/c11-10(12)13-5-7-3-1-2-4-8(7)9(14)6-13/h1-4,9,14H,5-6H2,(H3,11,12)","AKFURXZANOMQBD-UHFFFAOYSA-N"
"O=C(N1)C(O)N=C(c(c3)nccc3)c(c2)c(ccc(Br)2)1","InChI=1S/C14H10BrN3O2/c15-8-4-5-10-9(7-8)12(11-3-1-2-6-16-11)18-14(20)13(19)17-10/h1-7,14,20H,(H,17,19)","URRUSNGCYBXNLO-UHFFFAOYSA-N"
"NC(=O)N(c32)c(c4)c(ccc4)C(O1)C1c(cccc3)2","InChI=1S/C15H12N2O2/c16-15(18)17-11-7-3-1-5-9(11)13-14(19-13)10-6-2-4-8-12(10)17/h1-8,13-14H,(H2,16,18)","ZRWWEEVEIOGMMT-UHFFFAOYSA-N"
"c(c4)cc(C1)c(n4)N(C3)C([H])(CNC3)c(c2)c(ccc2)1","InChI=1S/C16H17N3/c1-2-6-14-12(4-1)10-13-5-3-7-18-16(13)19-9-8-17-11-15(14)19/h1-7,15,17H,8-11H2/t15-/m1/s1","FGLAMNFOHWVQOH-OAHLLOKOSA-N"
"C(C(C(C)C)(c(c2)cc(c(OC)c2)OC)C#N)CCNCCc(c1)cc(OC)c(OC)c1","InChI=1S/C26H36N2O4/c1-19(2)26(18-27,21-9-11-23(30-4)25(17-21)32-6)13-7-14-28-15-12-20-8-10-22(29-3)24(16-20)31-5/h8-11,16-17,19,28H,7,12-15H2,1-6H3","UPKQNCPKPOLASS-UHFFFAOYSA-N"
"C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C)O)CC[C@@H]4[C@@]3(CC5=C(C4)NNC5=O)C","InChI=1S/C21H32N2O2/c1-19-11-14-17(22-23-18(14)24)10-12(19)4-5-13-15(19)6-8-20(2)16(13)7-9-21(20,3)25/h12-13,15-16,25H,4-11H2,1-3H3,(H2,22,23,24)/t12-,13+,15-,16-,19-,20-,21-/m0/s1","SWPAIUOYLTYQKK-YEZTZDHTSA-N"
"CC(C)NCC(O)COc(c1)c(c2)c(ccc2)c(O)c1","InChI=1S/C16H21NO3/c1-11(2)17-9-12(18)10-20-16-8-7-15(19)13-5-3-4-6-14(13)16/h3-8,11-12,17-19H,9-10H2,1-2H3","CWEPACWBWIOYID-UHFFFAOYSA-N"
"CCOc(c5)c(O4)c(c(c5)1)C(C2)(C34)C([H])(C=CC(O)3)C(N(C)C2)C1","InChI=1S/C19H23NO3/c1-3-22-15-7-4-11-10-13-12-5-6-14(21)18-19(12,8-9-20(13)2)16(11)17(15)23-18/h4-7,12-14,18,21H,3,8-10H2,1-2H3/t12-,13+,14-,18-,19-/m0/s1","OGDVEMNWJVYAJL-LEPYJNQMSA-N"
"[O-1][N+1](=O)c(c3)cc(c(c3)2)C(=NCC(=O)N2)c(c1)c(Cl)ccc1","InChI=1S/C15H10ClN3O3/c16-12-4-2-1-3-10(12)15-11-7-9(19(21)22)5-6-13(11)18-14(20)8-17-15/h1-7H,8H2,(H,18,20)","DGBIGWXXNGSACT-UHFFFAOYSA-N"
"OC(=O)CS(=O)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H14O3S/c16-14(17)11-19(18)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H,16,17)","QARQPIWTMBRJFX-UHFFFAOYSA-N"
"NC(=O)CS(=O)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H15NO2S/c16-14(17)11-19(18)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17)","YFGHCGITMMYXAQ-UHFFFAOYSA-N"
"NC(=O)CS(=O)(=O)C(c(c2)cccc2)c(c1)cccc1","InChI=1S/C15H15NO3S/c16-14(17)11-20(18,19)15(12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,15H,11H2,(H2,16,17)","ZESNOWZYHYRSRY-UHFFFAOYSA-N"
"CCOC([O-1])=Nc(o2)c[n+1](n2)N(C1)CCOC1","InChI=1S/C9H14N4O4/c1-2-16-9(14)10-8-7-13(11-17-8)12-3-5-15-6-4-12/h7H,2-6H2,1H3","XLFWDASMENKTKL-UHFFFAOYSA-N"
"c(c4)cnc(n4)N(C1)CCN(CCCCN(C(=O)2)C(=O)CC(C3)(CCC3)C2)C1","InChI=1S/C21H31N5O2/c27-18-16-21(6-1-2-7-21)17-19(28)26(18)11-4-3-10-24-12-14-25(15-13-24)20-22-8-5-9-23-20/h5,8-9H,1-4,6-7,10-17H2","QWCRAEMEVRGPNT-UHFFFAOYSA-N"
"CO/N=C(/C1=CC=CO1)\C(=O)N[C@H]2[C@@H]3N(C2=O)C(=C(CS3)COC(=O)N)C(=O)O","InChI=1S/C16H16N4O8S/c1-26-19-9(8-3-2-4-27-8)12(21)18-10-13(22)20-11(15(23)24)7(5-28-16(17)25)6-29-14(10)20/h2-4,10,14H,5-6H2,1H3,(H2,17,25)(H,18,21)(H,23,24)/b19-9-/t10-,14-/m1/s1","JFPVXVDWJQMJEE-IZRZKJBUSA-N"