Identifier,CompoundName,Synonyms,Compound_Class,Alternative_class_names,MolecularFormula,MonoisotopicMass,SMILES,InChI,InChlKey,PubChemCID,NMR_used,Genus,Species,Strain
CyanoMetDB_0002,Anhydrohapaloxindole B,,other linear non-peptide,,C21H21ClN2OS,384.1063122,O=C1NC2=CC=CC3=C2C1=C4[C@H]([C@@](C=C)([C@@H](C[C@@]4(C3(C)C)[H])Cl)C)N=C=S,"InChI=1S/C21H21ClN2OS/c1-5-21(4)14(22)9-12-16(18(21)23-10-26)17-15-11(20(12,2)3)7-6-8-13(15)24-19(17)25/h5-8,12,14,18H,1,9H2,2-4H3,(H,24,25)/t12-,14+,18+,21-/m0/s1",POWOOZMDXKYYOK-FWKFCYAVSA-N,,yes,Hapalosiphon,fontinalis ,V-3-1  
CyanoMetDB_0003,Columbamide B,,other linear non-peptide,Columbamide,C23H40Cl3NO4,499.2022919,ClC(Cl)CCCCCC(Cl)CCCC/C=C/CCC(N(C)[C@@H](COC)COC(C)=O)=O,"InChI=1S/C23H40Cl3NO4/c1-19(28)31-18-21(17-30-3)27(2)23(29)16-12-7-5-4-6-9-13-20(24)14-10-8-11-15-22(25)26/h5,7,20-22H,4,6,8-18H2,1-3H3/b7-5+/t20?,21-/m0/s1",JBEYLLUXESVNSE-QOZDHKFNSA-N,122183470,yes,Lyngbya/Moorea,bouillonii   ,PNG
CyanoMetDB_0004,Columbamide C,,other linear non-peptide,Columbamide,C21H39Cl2NO3,423.2306995,ClCCCCCCC(Cl)CCCC/C=C/CCC(N(C)[C@@H](COC)CO)=O,"InChI=1S/C21H39Cl2NO3/c1-24(20(17-25)18-27-2)21(26)15-11-6-4-3-5-9-13-19(23)14-10-7-8-12-16-22/h4,6,19-20,25H,3,5,7-18H2,1-2H3/b6-4+/t19?,20-/m1/s1",HFTYBOHUADLAJY-KRTLOWCSSA-N,145740399,yes,Lyngbya/Moorea,bouillonii   ,PNG
CyanoMetDB_0005,Columbamide D,,other linear non-peptide,,C23H43Cl2NO3,451.2619996,CN([C@H](CO)COC)C(=O)CCC=CCCCC[C@@H](CCCCCCCCCl)Cl,"InChI=1S/C23H43Cl2NO3/c1-26(22(19-27)20-29-2)23(28)17-13-9-4-3-7-11-15-21(25)16-12-8-5-6-10-14-18-24/h4,9,21-22,27H,3,5-8,10-20H2,1-2H3/t21-,22+/m0/s1",IVCAHXJIJIGCFU-QJCDSOFHSA-N,,yes,Moorea,bouillonii   ,n.a.
CyanoMetDB_0006,Columbamide E,,other linear non-peptide,,C23H42Cl3NO3,485.2230273,CN([C@H](CO)COC)C(=O)CCC=CCCCC[C@@H](CCCCCCCC(Cl)Cl)Cl,"InChI=1S/C23H42Cl3NO3/c1-27(21(18-28)19-30-2)23(29)17-13-9-4-3-6-10-14-20(24)15-11-7-5-8-12-16-22(25)26/h4,9,20-22,28H,3,5-8,10-19H2,1-2H3/t20-,21+/m0/s1",VKISHKUYLSSBSY-BFOOFZPUSA-N,,yes,Moorea,bouillonii   ,n.a.
CyanoMetDB_0007,Companeramide A,,other cyclic peptide,other cyclic depsipeptide,C57H97N9O11,1083.730755,CC(C)C[C@H](N(C)C([C@H]1N(C([C@H]([C@@H](CC)C)NC([C@@H](N(C)C([C@@H](NC([C@H](N(C([C@@H](OC([C@H]([C@H](N2)CCCC#C)C)=O)C(C)C)=O)C)C)=O)[C@@H](CC)C)=O)C(C)C)=O)=O)CCC1)=O)C(N[C@H](C(N(C)[C@@H](C(C)C)C2=O)=O)C)=O,"InChI=1S/C57H97N9O11/c1-21-24-25-27-40-37(14)57(76)77-47(34(10)11)56(75)62(17)39(16)48(67)60-43(35(12)22-2)54(73)65(20)46(33(8)9)51(70)61-44(36(13)23-3)55(74)66-29-26-28-41(66)53(72)63(18)42(30-31(4)5)49(68)58-38(15)52(71)64(19)45(32(6)7)50(69)59-40/h1,31-47H,22-30H2,2-20H3,(H,58,68)(H,59,69)(H,60,67)(H,61,70)/t35-,36-,37+,38+,39-,40-,41+,42+,43+,44+,45+,46+,47+/m1/s1",HAFPBIZSTAZDFL-RTUBNDGLSA-N,122177432,yes,Leptolyngbya,n.a.,n.a.
CyanoMetDB_0008,Companeramide B,,other cyclic peptide,other cyclic depsipeptide,C55H93N9O11,1055.699455,C[C@@H](N(C)C([C@H]1N(C([C@H]([C@@H](CC)C)NC([C@@H](N(C)C([C@@H](NC([C@@H](N(C([C@@H](OC([C@H]([C@H](N2)CCCC#C)C)=O)C(C)C)=O)C)C)=O)C(C)C)=O)C(C)C)=O)=O)CCC1)=O)C(N[C@H](C(N(C)[C@@H](C(C)C)C2=O)=O)C(C)C)=O,"InChI=1S/C55H93N9O11/c1-21-23-24-26-38-35(14)55(74)75-45(33(11)12)54(73)61(18)37(16)47(66)58-41(30(5)6)52(71)63(20)44(32(9)10)49(68)59-42(34(13)22-2)53(72)64-28-25-27-39(64)50(69)60(17)36(15)46(65)57-40(29(3)4)51(70)62(19)43(31(7)8)48(67)56-38/h1,29-45H,22-28H2,2-20H3,(H,56,67)(H,57,65)(H,58,66)(H,59,68)/t34-,35+,36-,37+,38-,39+,40+,41+,42+,43+,44+,45+/m1/s1",OTDHIQCIDLYTQU-XWDKVCLESA-N,122177433,yes,Leptolyngbya,n.a.,n.a.
CyanoMetDB_0009,Floridamide,(+)-floridamide,other cyclic peptide,other cyclic depsipeptide,C33H50N4O6,598.3730353,CN(C(C1N2CCC1)=O)C(C(NC(C(NC(C(C)C)C(OC(C(C)(C)C2=O)CCCCC)=O)=O)C)=O)CC3=CC=CC=C3,"InChI=1S/C33H50N4O6/c1-8-9-11-18-26-33(5,6)32(42)37-19-14-17-24(37)30(40)36(7)25(20-23-15-12-10-13-16-23)29(39)34-22(4)28(38)35-27(21(2)3)31(41)43-26/h10,12-13,15-16,21-22,24-27H,8-9,11,14,17-20H2,1-7H3,(H,34,39)(H,35,38)",KDCDMMXOSHLPFR-UHFFFAOYSA-N,139591603,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0010,Malyngamide Y,(+)Malyngamide Y,other linear non-peptide,,C23H36ClNO3,409.2383717,CCCCCC(OC)C/C=C/CCC(NC/C(C1=CCCC(C)C1=O)=C/Cl)=O,"InChI=1S/C23H36ClNO3/c1-4-5-7-12-20(28-3)13-8-6-9-15-22(26)25-17-19(16-24)21-14-10-11-18(2)23(21)27/h6,8,14,16,18,20H,4-5,7,9-13,15,17H2,1-3H3,(H,25,26)/b8-6+,19-16-",WWQDIDINXDFXLA-XZQNXHFTSA-N,139591602,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0011,Laucysteinamide A,,other linear non-peptide,,C23H38N2OS,390.270485,CC1=N[C@@H](CS1)/C=C/CCCCCCCCCCC(N(C)/C=C/CC=C)=O,"InChI=1S/C23H38N2OS/c1-4-5-16-19-25(3)23(26)18-15-13-11-9-7-6-8-10-12-14-17-22-20-27-21(2)24-22/h4,14,16-17,19,22H,1,5-13,15,18,20H2,2-3H3/b17-14+,19-16+/t22-/m1/s1",AYRWEQNQZDTIDT-GIWCFZTQSA-N,146683783,yes,Caldora,penicillata,n.a.
CyanoMetDB_0012,Medusamide A,,other cyclic peptide,,C44H79N5O9,821.5877791,CCC[C@H]([C@@H](C)C(N[C@H](CCC)[C@@H](C)C(N[C@@H]1C(C)C)=O)=O)NC([C@H](C)[C@H](NC([C@@H]([C@H](NC([C@@H](CC(C)C)OC([C@@H](OC1=O)C(C)C)=O)=O)CCC)C)=O)CCC)=O,"InChI=1S/C44H79N5O9/c1-15-19-31-28(12)39(51)47-33(21-17-3)30(14)41(53)49-36(25(7)8)43(55)58-37(26(9)10)44(56)57-35(23-24(5)6)42(54)48-34(22-18-4)29(13)40(52)46-32(20-16-2)27(11)38(50)45-31/h24-37H,15-23H2,1-14H3,(H,45,50)(H,46,52)(H,47,51)(H,48,54)(H,49,53)/t27-,28-,29-,30-,31-,32-,33-,34-,35-,36-,37+/m1/s1",ZGUPGLAEKHCUSL-WLHCDTGTSA-N,132559088,yes,n.a.,n.a.,n.a.
CyanoMetDB_0013,Anhydrohapaloxindole M,,other linear non-peptide,,C21H22N2OS,350.1452845,O=C1NC2=CC=CC3=C2C1=C4[C@H]([C@@](C=C)(CC[C@@]4(C3(C)C)[H])C)N=C=S,"InChI=1S/C21H22N2OS/c1-5-21(4)10-9-13-16(18(21)22-11-25)17-15-12(20(13,2)3)7-6-8-14(15)23-19(17)24/h5-8,13,18H,1,9-10H2,2-4H3,(H,23,24)/t13-,18+,21-/m0/s1",NQEQFUOQGBHGNH-NVMYHKGLSA-N,,yes,Hapalosiphon,fontinalis ,V-3-1  
CyanoMetDB_0014,Microseiramide,,other cyclic peptide,,C37H56N8O9,756.4170254,O=C([C@H](CC1=CC=CC=C1)NC([C@@H]2CCCN2C([C@H](C(C)C)NC3=O)=O)=O)N[C@H](C(N[C@H](C(N[C@@H]([C@H](CC)C)C(N[C@H]3CO)=O)=O)CC(N)=O)=O)C(C)C,"InChI=1S/C37H56N8O9/c1-7-21(6)30-36(53)41-25(18-46)33(50)43-29(20(4)5)37(54)45-15-11-14-26(45)34(51)39-23(16-22-12-9-8-10-13-22)31(48)42-28(19(2)3)35(52)40-24(17-27(38)47)32(49)44-30/h8-10,12-13,19-21,23-26,28-30,46H,7,11,14-18H2,1-6H3,(H2,38,47)(H,39,51)(H,40,52)(H,41,53)(H,42,48)(H,43,50)(H,44,49)/t21-,23-,24-,25-,26-,28-,29-,30-/m0/s1",FXQYYQRZKVKMDS-RITHUONJSA-N,122368192,yes,Microseira,n.a.,UIC 10445
CyanoMetDB_0015,Nocuolin A,"NoA, NocA",other linear non-peptide,,C16H30N2O3,298.2256428,CCCCCC1CC(CCCCC)=NN(C(CCO)=O)O1,"InChI=1S/C16H30N2O3/c1-3-5-7-9-14-13-15(10-8-6-4-2)21-18(17-14)16(20)11-12-19/h15,19H,3-13H2,1-2H3",MPGIDXBHXRMMSY-UHFFFAOYSA-N,129017397,yes,Nostoc; Anabaena; Nodularia ,n.a.,"CCAP 1453/38, PCC7108, HBU26"
CyanoMetDB_0016,Nuiapolide,,other cyclic non-peptide,,C44H84O11,788.6013635,OC(CCCC(O)CC(O)CCC/C(C)=C/1)CCCC(O)CCCC(O)CCCC(O)CCCC(O)CCCC(O)CCCC(O)CC(C(C)(C)C)OC1=O,"InChI=1S/C44H84O11/c1-32-13-5-26-39(51)30-40(52)27-11-24-37(49)22-9-20-35(47)18-7-16-33(45)14-6-15-34(46)17-8-19-36(48)21-10-23-38(50)25-12-28-41(53)31-42(44(2,3)4)55-43(54)29-32/h29,33-42,45-53H,5-28,30-31H2,1-4H3/b32-29+",KOLKKRHAEDKYEF-UUDCSCGESA-N,,yes,Okeania,hirsuta,n.a.
CyanoMetDB_0017,Pitiamide A,,other linear non-peptide,,C22H36ClNO2,381.2434571,Cl/C=C/C=C/CC[C@H](C(C[C@@H](CCNC(CC/C=C/CCC)=O)C)=O)C,"InChI=1S/C22H36ClNO2/c1-4-5-6-7-11-14-22(26)24-17-15-19(2)18-21(25)20(3)13-10-8-9-12-16-23/h6-9,12,16,19-20H,4-5,10-11,13-15,17-18H2,1-3H3,(H,24,26)/b7-6+,9-8+,16-12+/t19-,20-/m1/s1",TUUKQSSERLFGKD-RWFPHQFUSA-N,11463182,yes,Hydrocoleum,majus   ,n.a.
CyanoMetDB_0018,1E-pitiamide B,,other linear non-peptide,,C23H38ClNO2,395.2591072,O=C(C[C@H](C)CCNC(CC/C=C/CCC)=O)CCCCC/C=C/C=C/Cl,"InChI=1S/C23H38ClNO2/c1-3-4-5-9-13-16-23(27)25-19-17-21(2)20-22(26)15-12-10-7-6-8-11-14-18-24/h5,8-9,11,14,18,21H,3-4,6-7,10,12-13,15-17,19-20H2,1-2H3,(H,25,27)/b9-5+,11-8+,18-14+/t21-/m1/s1",FPMHRIHOVKXRKQ-MFJSBWDESA-N,146683711,yes,Hydrocoleum,majus   ,VPG 14–38
CyanoMetDB_0019,1Z-pitiamide B,,other linear non-peptide,,C23H38ClNO2,395.2591072,O=C(C[C@H](C)CCNC(CC/C=C/CCC)=O)CCCCC/C=C/C=C\Cl,"InChI=1S/C23H38ClNO2/c1-3-4-5-9-13-16-23(27)25-19-17-21(2)20-22(26)15-12-10-7-6-8-11-14-18-24/h5,8-9,11,14,18,21H,3-4,6-7,10,12-13,15-17,19-20H2,1-2H3,(H,25,27)/b9-5+,11-8+,18-14-/t21-/m1/s1",FPMHRIHOVKXRKQ-GLUIZYGOSA-N,146683712,yes,Hydrocoleum,majus   ,VPG 14–38
CyanoMetDB_0020,Scytodecamide,,other linear peptide,,C47H85N11O12,995.6379172,CC[C@H]([C@H](NC)C(N[C@H](C(N1CCC[C@H]1C(N[C@@H](C)C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](C)C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N)=O)C(C)C)=O)=O)CO)=O)=O)=O)=O)=O)=O)CO)=O)C,"InChI=1S/C47H85N11O12/c1-14-27(10)37(49-13)46(69)56-34(22-60)47(70)58-17-15-16-35(58)45(68)51-29(12)39(62)52-31(19-24(4)5)42(65)53-30(18-23(2)3)41(64)50-28(11)40(63)55-33(21-59)44(67)54-32(20-25(6)7)43(66)57-36(26(8)9)38(48)61/h23-37,49,59-60H,14-22H2,1-13H3,(H2,48,61)(H,50,64)(H,51,68)(H,52,62)(H,53,65)(H,54,67)(H,55,63)(H,56,69)(H,57,66)/t27-,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+/m1/s1",MWUJXBWFBABTFB-RERDJVLRSA-N,,yes,Scytonema,n.a.,UIC 10036
CyanoMetDB_0021,Tutuilamide A,,other cyclic peptide,other cyclic depsipeptide,C51H69ClN8O12,1020.472347,O=C(N(C)[C@@H](CC1=CC=C(O)C=C1)C(N[C@@H](C(C)C)C2=O)=O)[C@H](CC3=CC=CC=C3)N([C@@H](CC4)O)C([C@H]4NC(/C(NC([C@@H](NC([C@H]([C@H](CC)C)NC([C@H](C)NC(C/C(C)=C/Cl)=O)=O)=O)[C@@H](C)O2)=O)=C/C)=O)=O,"InChI=1S/C51H69ClN8O12/c1-10-29(6)42(57-44(64)30(7)53-39(62)23-28(5)26-52)47(67)58-43-31(8)72-51(71)41(27(3)4)56-46(66)37(24-33-17-19-34(61)20-18-33)59(9)50(70)38(25-32-15-13-12-14-16-32)60-40(63)22-21-36(49(60)69)55-45(65)35(11-2)54-48(43)68/h11-20,26-27,29-31,36-38,40-43,61,63H,10,21-25H2,1-9H3,(H,53,62)(H,54,68)(H,55,65)(H,56,66)(H,57,64)(H,58,67)/b28-26+,35-11-/t29-,30-,31+,36-,37-,38-,40+,41-,42-,43-/m0/s1",CWLDDHHTMAJFMM-LKVOOIPRSA-N,146683664,yes,Schizothrix,n.a.,n.a.
CyanoMetDB_0022,Tutuilamide B,,other cyclic peptide,other cyclic depsipeptide,C50H67ClN8O12,1006.456697,O=C(N(C)[C@@H](CC1=CC=C(O)C=C1)C(N[C@@H](C(C)C)C2=O)=O)[C@H](CC3=CC=CC=C3)N([C@@H](CC4)O)C([C@H]4NC(/C(NC([C@@H](NC([C@H](C(C)C)NC([C@H](C)NC(C/C(C)=C/Cl)=O)=O)=O)[C@@H](C)O2)=O)=C/C)=O)=O,"InChI=1S/C50H67ClN8O12/c1-10-34-44(64)54-35-20-21-39(62)59(48(35)68)37(24-31-14-12-11-13-15-31)49(69)58(9)36(23-32-16-18-33(60)19-17-32)45(65)56-41(27(4)5)50(70)71-30(8)42(47(67)53-34)57-46(66)40(26(2)3)55-43(63)29(7)52-38(61)22-28(6)25-51/h10-19,25-27,29-30,35-37,39-42,60,62H,20-24H2,1-9H3,(H,52,61)(H,53,67)(H,54,64)(H,55,63)(H,56,65)(H,57,66)/b28-25+,34-10-/t29-,30+,35-,36-,37-,39+,40-,41-,42-/m0/s1",PYLRNHULHGBIRT-AQSLWEGCSA-N,146683665,yes,Schizothrix,n.a.,n.a.
CyanoMetDB_0023,Tutuilamide C,,other cyclic peptide,other cyclic depsipeptide,C48H64ClN7O11,949.4352336,C/C=C(NC1=O)/C(N[C@@H]2C(N([C@@H](CC3=CC=CC=C3)C(N(C)[C@H](C(N[C@@H](C(C)C)C(O[C@H](C)[C@@H]1NC([C@H](C(C)C)NC(C/C(CC)=C/Cl)=O)=O)=O)=O)CC4=CC=C(O)C=C4)=O)[C@H](O)CC2)=O)=O,"InChI=1S/C48H64ClN7O11/c1-9-29(25-49)24-37(58)52-39(26(3)4)44(62)54-41-28(7)67-48(66)40(27(5)6)53-43(61)35(22-31-16-18-32(57)19-17-31)55(8)47(65)36(23-30-14-12-11-13-15-30)56-38(59)21-20-34(46(56)64)51-42(60)33(10-2)50-45(41)63/h10-19,25-28,34-36,38-41,57,59H,9,20-24H2,1-8H3,(H,50,63)(H,51,60)(H,52,58)(H,53,61)(H,54,62)/b29-25+,33-10-/t28-,34+,35+,36+,38-,39+,40+,41+/m1/s1",ACRBPKVYYHBULA-XUHCOFKKSA-N,146683666,yes,Coleofasciculus,n.a.,n.a.
CyanoMetDB_0024,Ankaraholide A,,other cyclic non-peptide,,C90H152O28,1681.047014,CC(/C=C/C(O[C@H]([C@H]([C@@H](O)[C@H](CC[C@H]1C[C@H](OC)C[C@@H](O1)C)C)C)[C@H]([C@H](O)C[C@H](O)C[C@@H](OC)C[C@@H]2CC=C[C@H](O2)C[C@@H](O[C@@H]3[C@H](OC)[C@H](OC)[C@@H](O)CO3)C/C=C(/C=C\C(O4)=O)C)C)=O)=C/C[C@H](O[C@@H]5[C@H](OC)[C@H](OC)[C@@H](O)CO5)C[C@@H](O6)C=CC[C@H]6C[C@H](OC)C[C@@H](O)C[C@@H](O)[C@@H]([C@H]4[C@H]([C@@H](O)[C@H](CC[C@H]7C[C@H](OC)C[C@@H](O7)C)C)C)C,"InChI=1S/C90H152O28/c1-51-25-31-69(115-89-87(107-17)85(105-15)77(95)49-109-89)43-63-21-19-23-65(113-63)45-73(103-13)40-62(92)42-76(94)58(8)84(60(10)82(100)54(4)30-34-68-48-72(102-12)38-56(6)112-68)118-80(98)36-28-52(2)26-32-70(116-90-88(108-18)86(106-16)78(96)50-110-90)44-64-22-20-24-66(114-64)46-74(104-14)39-61(91)41-75(93)57(7)83(117-79(97)35-27-51)59(9)81(99)53(3)29-33-67-47-71(101-11)37-55(5)111-67/h19-22,25-28,35-36,53-78,81-96,99-100H,23-24,29-34,37-50H2,1-18H3/b35-27-,36-28+,51-25+,52-26-/t53-,54-,55-,56-,57-,58-,59-,60-,61+,62+,63-,64-,65-,66-,67-,68-,69-,70-,71+,72+,73+,74+,75+,76+,77-,78-,81-,82-,83-,84-,85+,86+,87+,88+,89+,90+/m0/s1",PMOHGLKKBUNONX-PTYDLKIRSA-N,146683702,yes,Symploca;Geitlerinema,n.a.,n.a.
CyanoMetDB_0025,1-ethenoxy-2-methylbenzene,,other linear non-peptide,,C9H10O,134.0731649,CC1=C(OC=C)C=CC=C1,"InChI=1S/C9H10O/c1-3-10-9-7-5-4-6-8(9)2/h3-7H,1H2,2H3",TWWWGBSUPNNTMJ-UHFFFAOYSA-N,10749231,yes,Microcoleus,chthonoplastes   ,n.a.
CyanoMetDB_0026,Cryptomaldamide,,other linear peptide,,C18H33N5O5,399.2481692,NC(N[C@@H](CO)C(N[C@@H](C(C)C)C(N(C)[C@@H](C(C)C)/C([H])=C(C)/C(O)=O)=O)=O)=N,"InChI=1S/C18H33N5O5/c1-9(2)13(7-11(5)17(27)28)23(6)16(26)14(10(3)4)22-15(25)12(8-24)21-18(19)20/h7,9-10,12-14,24H,8H2,1-6H3,(H,22,25)(H,27,28)(H4,19,20,21)/b11-7+/t12-,13+,14-/m0/s1",FUCBQNSQRCPSGC-BOUYHWOHSA-N,132489951,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0027,Mooreaside A,,other linear non-peptide,,C48H93NO8,811.690119,O[C@H](C/C=C/CCCCCCCCCCC)[C@@H](NC(CCCCCCCCCCCCCCCCCCCCCCCC)=O)CO[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1,"InChI=1S/C48H93NO8/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-44(52)49-41(40-56-48-47(55)46(54)45(53)43(39-50)57-48)42(51)37-35-33-31-29-27-16-14-12-10-8-6-4-2/h33,35,41-43,45-48,50-51,53-55H,3-32,34,36-40H2,1-2H3,(H,49,52)/b35-33+/t41-,42+,43+,45+,46-,47+,48+/m0/s1",DJXVTSAPDGAYAX-JPUVSGHGSA-N,132580956,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0028,3-acetyl-2?-deoxyuridine,,other linear non-peptide,,C11H14N2O6,270.0851862,O=C(C=CN1[C@H]2C[C@H](O)[C@@H](CO)O2)N(C(C)=O)C1=O,"InChI=1S/C11H14N2O6/c1-6(15)13-9(17)2-3-12(11(13)18)10-4-7(16)8(5-14)19-10/h2-3,7-8,10,14,16H,4-5H2,1H3/t7-,8+,10+/m0/s1",VDXVWUDUXDCDAI-QXFUBDJGSA-N,132580955,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0029,3-phenylethyl-2?-deoxyuridine,,other linear non-peptide,,C17H20N2O5,332.1372218,O=C(C=CN1[C@H]2C[C@H](O)[C@@H](CO)O2)N(CCC3=CC=CC=C3)C1=O,"InChI=1S/C17H20N2O5/c20-11-14-13(21)10-16(24-14)19-9-7-15(22)18(17(19)23)8-6-12-4-2-1-3-5-12/h1-5,7,9,13-14,16,20-21H,6,8,10-11H2/t13-,14+,16+/m0/s1",LYLFFZWTYHJLCZ-SQWLQELKSA-N,132580954,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0030,Caracolamide A,,other linear non-peptide,,C16H21Cl2NO,313.1000197,Cl/C(Cl)=C/CCCCCC(NCCC1=CC=CC=C1)=O,"InChI=1S/C16H21Cl2NO/c17-15(18)10-6-1-2-7-11-16(20)19-13-12-14-8-4-3-5-9-14/h3-5,8-10H,1-2,6-7,11-13H2,(H,19,20)",TXMOJAGAWQKUHG-UHFFFAOYSA-N,139589768,yes,Symploca,n.a.,n.a.
CyanoMetDB_0031,"6,8-di-O-acetylmalyngamide 2",,other linear non-peptide,,C29H46ClNO8,571.29119,CCCCCCC[C@H](OC)C/C=C/CCC(NC/C([C@@]([C@@](O)(C)[C@@H](OC(C)=O)C[C@@H]1OC(C)=O)([H])C1=O)=C/Cl)=O,"InChI=1S/C29H46ClNO8/c1-6-7-8-9-11-14-23(37-5)15-12-10-13-16-26(34)31-19-22(18-30)27-28(35)24(38-20(2)32)17-25(29(27,4)36)39-21(3)33/h10,12,18,23-25,27,36H,6-9,11,13-17,19H2,1-5H3,(H,31,34)/b12-10+,22-18-/t23-,24-,25-,27-,29+/m0/s1",VCYLDGFZBOWHOI-XZALHDRTSA-N,139590546,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0032,6-O-acetylmalyngamide 2,,other linear non-peptide,,C27H44ClNO7,529.2806305,CCCCCCC[C@H](OC)C/C=C/CCC(NC/C([C@@]([C@@](O)(C)[C@@H](O)C[C@@H]1OC(C)=O)([H])C1=O)=C/Cl)=O,"InChI=1S/C27H44ClNO7/c1-5-6-7-8-10-13-21(35-4)14-11-9-12-15-24(32)29-18-20(17-28)25-26(33)22(36-19(2)30)16-23(31)27(25,3)34/h9,11,17,21-23,25,31,34H,5-8,10,12-16,18H2,1-4H3,(H,29,32)/b11-9+,20-17-/t21-,22-,23-,25-,27+/m0/s1",YOGYBVYVKDQUPM-SPVVEVPUSA-N,139590547,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0033,N-demethyl-Isomalyngamide I,,other linear non-peptide,,C25H40ClNO5,469.2595,CCCCCCC[C@H](OC)C/C=C/CCC(NC/C([C@@]12C([C@H](C)[C@H](O)C[C@@H]1O2)=O)=C\Cl)=O,"InChI=1S/C25H40ClNO5/c1-4-5-6-7-9-12-20(31-3)13-10-8-11-14-23(29)27-17-19(16-26)25-22(32-25)15-21(28)18(2)24(25)30/h8,10,16,18,20-22,28H,4-7,9,11-15,17H2,1-3H3,(H,27,29)/b10-8+,19-16+/t18-,20+,21-,22+,25+/m1/s1",YWLFVPLREWALDU-YTCQMKKZSA-N,139590548,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0034,Trichophycin B,,other linear non-peptide,,C24H33ClO4,420.2067372,Cl/C=C(CC1=CC=CC=C1)/C[C@@H](CC[C@H](C[C@H]([C@@H](O2)CC(OC)=CC2=O)C)C)O,"InChI=1S/C24H33ClO4/c1-17(11-18(2)23-14-22(28-3)15-24(27)29-23)9-10-21(26)13-20(16-25)12-19-7-5-4-6-8-19/h4-8,15-18,21,23,26H,9-14H2,1-3H3/b20-16+/t17-,18-,21-,23+/m1/s1",BANUALHDPUSWKA-QXPVXGLLSA-N,146683649,yes,n.a.,n.a.,n.a.
CyanoMetDB_0035,Ankaraholide B,,other linear non-peptide,,C91H154O28,1695.062664,CO[C@H]([C@@H](C)[C@@H](O)C[C@@H](O)[C@H](C)[C@@H]([C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]1C[C@H](OC)C[C@H](C)O1)OC(/C=C/C(C)=C/C[C@H](O[C@H]2OC[C@H](O)[C@@H](OC)[C@H]2OC)C[C@H]3O[C@H](C[C@H](OC)C([H])[C@@H](O)C[C@@H](O)[C@H](C)[C@@H]([C@H]([C@@H](O)[C@@H](C)CC[C@H]4C[C@H](OC)C[C@H](C)O4)C)O5)CC=C3)=O)C[C@H]6O[C@H](C[C@@H](O[C@H]7[C@@H](OC)[C@@H](OC)[C@H](O)CO7)C/C=C(C)/C=C/C5=O)C=CC6,"InChI=1S/C91H154O28/c1-51-26-32-69(116-90-88(108-18)86(106-16)77(96)49-110-90)42-63-22-20-24-65(114-63)44-73(104-14)40-62(92)41-74(93)58(8)84(60(10)82(100)53(3)30-34-67-45-71(102-12)38-55(5)112-67)118-80(98)36-28-52(2)27-33-70(117-91-89(109-19)87(107-17)78(97)50-111-91)43-64-23-21-25-66(115-64)47-79(105-15)57(7)75(94)48-76(95)59(9)85(119-81(99)37-29-51)61(11)83(101)54(4)31-35-68-46-72(103-13)39-56(6)113-68/h20-23,26-29,36-37,53-79,82-97,100-101H,24-25,30-35,38-50H2,1-19H3/b36-28+,37-29+,51-26+,52-27+/t53-,54-,55-,56-,57-,58-,59-,60-,61-,62+,63-,64-,65-,66-,67-,68-,69-,70-,71+,72+,73+,74+,75-,76+,77-,78+,79-,82-,83-,84-,85-,86+,87-,88+,89-,90+,91-/m0/s1",KMBIYPMGRFQUNL-IDCZCWIGSA-N,,yes,Symploca; Geitlerinema,n.a.,n.a.
CyanoMetDB_0036,Trichophycin C,,other linear non-peptide,,C22H32Cl2O2,398.1779357,Cl/C=C(C[C@H](O)CC[C@@H](C)C[C@@H](C)[C@H](C/C=C/Cl)O)\CC1=CC=CC=C1,"InChI=1S/C22H32Cl2O2/c1-17(13-18(2)22(26)9-6-12-23)10-11-21(25)15-20(16-24)14-19-7-4-3-5-8-19/h3-8,12,16-18,21-22,25-26H,9-11,13-15H2,1-2H3/b12-6+,20-16+/t17-,18-,21-,22+/m1/s1",SJNVRGHRZJFALE-COCHCKKMSA-N,146683650,yes,n.a.,n.a.,n.a.
CyanoMetDB_0037,Trichophycin D,,other linear non-peptide,,C20H32Cl2O2,374.1779357,Cl/C=C(C[C@H](O)CC[C@@H](C)C[C@@H](C)[C@H](C/C=C/Cl)O)\CCCC#C,"InChI=1S/C20H32Cl2O2/c1-4-5-6-8-18(15-22)14-19(23)11-10-16(2)13-17(3)20(24)9-7-12-21/h1,7,12,15-17,19-20,23-24H,5-6,8-11,13-14H2,2-3H3/b12-7+,18-15+/t16-,17-,19-,20+/m1/s1",FHIUEIGHOUMYJW-AUHSEPBUSA-N,146683651,yes,n.a.,n.a.,n.a.
CyanoMetDB_0038,Trichophycin E,,other linear non-peptide,,C20H31BrCl2O2,452.0884486,Cl/C=C(C[C@H](O)CC[C@@H](C)C[C@@H](C)[C@H](C/C=C/Cl)O)\CCCC#CBr,"InChI=1S/C20H31BrCl2O2/c1-16(13-17(2)20(25)8-6-12-22)9-10-19(24)14-18(15-23)7-4-3-5-11-21/h6,12,15-17,19-20,24-25H,3-4,7-10,13-14H2,1-2H3/b12-6+,18-15+/t16-,17-,19-,20+/m1/s1",ZCYDJOFQQAFCJI-NZIPSRDRSA-N,146683652,yes,n.a.,n.a.,n.a.
CyanoMetDB_0039,Trichophycin F,,other linear non-peptide,,C25H40ClNO4,453.2645865,Cl/C=C(C/C=C(C)/C[C@@H](C)C[C@@H](C)[C@@]1([H])CC(OC)=CC(O1)=O)\CCCN(C)C(CC)=O,"InChI=1S/C25H40ClNO4/c1-7-24(28)27(5)12-8-9-21(17-26)11-10-18(2)13-19(3)14-20(4)23-15-22(30-6)16-25(29)31-23/h10,16-17,19-20,23H,7-9,11-15H2,1-6H3/b18-10+,21-17+/t19-,20-,23-/m1/s1",WOUKSKQTNWKNDH-BAAHFYCFSA-N,146683653,yes,n.a.,n.a.,n.a.
CyanoMetDB_0040,Tricholactone,,other cyclic peptide,other cyclic depsipeptide,C14H22O4,254.1518092,C[C@@H](C[C@@H](C)[C@@]1([H])CC(OC)=CC(O1)=O)CC(C)=O,"InChI=1S/C14H22O4/c1-9(6-11(3)15)5-10(2)13-7-12(17-4)8-14(16)18-13/h8-10,13H,5-7H2,1-4H3/t9-,10+,13+/m0/s1",QUILGFVARLSNLK-OPQQBVKSSA-N,146683654,yes,n.a.,n.a.,n.a.
CyanoMetDB_0041,Portoamide A,,other cyclic peptide,other cyclic depsipeptide,C74H109N13O22,1531.781012,O=C(NCC(N1[C@H](C(N2[C@H](C(N[C@@H](C(N[C@H](C(N/C(C(N[C@H](C(N[C@@H](C(N3[C@H](C(NC(C4O)CC(CC(C(CC(C)C)O)O)OC([C@@H](N(C(C)=O)C)CC5=CC=C(C=C5)O)=O)=O)CCC3)=O)CCC6=CC=C(OC)C=C6)=O)[C@H](O)C)=O)=C/C)=O)CO)=O)[C@H](CC)C)=O)CCC2)=O)CCC1)=O)[C@H](NC4=O)CCC(N)=O,"InChI=1S/C74H109N13O22/c1-10-40(5)61-69(102)81-52(38-88)66(99)77-48(11-2)65(98)83-62(41(6)89)70(103)79-50(27-22-43-20-25-46(108-9)26-21-43)72(105)86-31-12-15-53(86)67(100)80-51(35-47(36-58(93)57(92)33-39(3)4)109-74(107)56(84(8)42(7)90)34-44-18-23-45(91)24-19-44)63(96)71(104)78-49(28-29-59(75)94)64(97)76-37-60(95)85-30-14-17-55(85)73(106)87-32-13-16-54(87)68(101)82-61/h11,18-21,23-26,39-41,47,49-58,61-63,88-89,91-93,96H,10,12-17,22,27-38H2,1-9H3,(H2,75,94)(H,76,97)(H,77,99)(H,78,104)(H,79,103)(H,80,100)(H,81,102)(H,82,101)(H,83,98)/b48-11+/t40-,41+,47?,49+,50+,51?,52-,53-,54-,55-,56-,57?,58?,61+,62-,63?/m0/s1",IURIYLBJXOYFRR-CFLUNQOMSA-N,146683713,yes,Oscillatoria/Planktothrix,,LEGE 5292 
CyanoMetDB_0042,Portoamide B,,other cyclic peptide,,C73H107N13O21,1501.770448,O=C(NCC(N1[C@H](C(N2[C@H](C(N[C@@H](C(N[C@H](C(N/C(C(N[C@H](C(N[C@@H](C(N3[C@H](C(NC(C4O)CC(CC(C(CC(C)C)O)O)OC([C@@H](N(C(C)=O)C)CC5=CC=C(C=C5)O)=O)=O)CCC3)=O)CCC6=CC=CC=C6)=O)[C@H](O)C)=O)=C/C)=O)CO)=O)[C@H](CC)C)=O)CCC2)=O)CCC1)=O)[C@H](NC4=O)CCC(N)=O,"InChI=1S/C73H107N13O21/c1-9-40(5)60-68(101)80-51(38-87)65(98)76-47(10-2)64(97)82-61(41(6)88)69(102)78-49(27-24-43-17-12-11-13-18-43)71(104)85-31-14-19-52(85)66(99)79-50(35-46(36-57(92)56(91)33-39(3)4)107-73(106)55(83(8)42(7)89)34-44-22-25-45(90)26-23-44)62(95)70(103)77-48(28-29-58(74)93)63(96)75-37-59(94)84-30-16-21-54(84)72(105)86-32-15-20-53(86)67(100)81-60/h10-13,17-18,22-23,25-26,39-41,46,48-57,60-62,87-88,90-92,95H,9,14-16,19-21,24,27-38H2,1-8H3,(H2,74,93)(H,75,96)(H,76,98)(H,77,103)(H,78,102)(H,79,99)(H,80,101)(H,81,100)(H,82,97)/b47-10+/t40-,41+,46?,48+,49+,50?,51-,52-,53-,54-,55-,56?,57?,60+,61-,62?/m0/s1",XCGGFKXEWPNQFS-ABXPXLQLSA-N,146683714,yes,Oscillatoria/Planktothrix,,LEGE 5292 
CyanoMetDB_0043,Somocystinamide A,,other linear non-peptide,,C42H70N4O4S2,758.4838482,C=CC/C=C/N(C)C(CCCCCCCC/C=C/C(NC(C)=O)CSSC[C@H](NC(C)=O)/C=C/CCCCCCCCC(N(C)/C=C/CC=C)=O)=O,"InChI=1S/C42H70N4O4S2/c1-7-9-27-33-45(5)41(49)31-25-21-17-13-11-15-19-23-29-39(43-37(3)47)35-51-52-36-40(44-38(4)48)30-24-20-16-12-14-18-22-26-32-42(50)46(6)34-28-10-8-2/h7-8,23-24,27-30,33-34,39-40H,1-2,9-22,25-26,31-32,35-36H2,3-6H3,(H,43,47)(H,44,48)/b29-23+,30-24+,33-27+,34-28+/t39-,40?/m1/s1",UJORQZOJHPJQER-GYHVPXIPSA-N,21776326,yes,Lyngbya/Moorea; Schizothrix,[Lyngbya/Moorea]majuscula/producens,n.a.
CyanoMetDB_0044,Tolytoxin,,other cyclic peptide,,C46H75NO13,849.52384,CC(/C=C/C(O[C@@]([H])([C@H]([C@@H](C[C@@H]([C@]1([C@H](C[C@@]([H])(O2)CC=C[C@@]2([H])C[C@H]3OC)OC)OC1)OC)OC)C)[C@H]([C@H]([C@H](CCC([C@@H]([C@@H]([C@@H](/C=C/N(C=O)C)C)OC)C)=O)C)O)C)=O)=C\[C@@H]3O,"InChI=1S/C46H75NO13/c1-28-16-19-42(51)60-45(33(6)43(52)29(2)17-18-36(49)31(4)44(57-12)30(3)20-21-47(7)27-48)32(5)38(53-8)25-41(56-11)46(26-58-46)40(55-10)24-35-15-13-14-34(59-35)23-39(54-9)37(50)22-28/h13-14,16,19-22,27,29-35,37-41,43-45,50,52H,15,17-18,23-26H2,1-12H3/b19-16+,21-20+,28-22+/t29-,30+,31-,32-,33-,34-,35-,37-,38+,39+,40-,41-,43-,44+,45-,46-/m0/s1",FTGOWEQDZZMPNJ-GUMZKTDUSA-N,6440827,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_0045,Spumigin I,,other linear peptide,,C26H42N6O6,534.3165831,OC1=CC=C(CC(C(NC(C(N2C(C(NC(CO)CCCNC(N)=N)=O)CCC2)=O)CC(C)C)=O)O)C=C1,"InChI=1S/C26H42N6O6/c1-16(2)13-20(31-24(37)22(35)14-17-7-9-19(34)10-8-17)25(38)32-12-4-6-21(32)23(36)30-18(15-33)5-3-11-29-26(27)28/h7-10,16,18,20-22,33-35H,3-6,11-15H2,1-2H3,(H,30,36)(H,31,37)(H4,27,28,29)",KCGHIZDUEPNSKV-UHFFFAOYSA-N,,no,Nodularia,harveyana ,Hübel 1983/300
CyanoMetDB_0046,Autumnalamide,,other cyclic peptide,,C46H64N10O9,900.4857737,OC(C[C@@H](C(N[C@H]1CC2=CC=CC=C2)=O)NC([C@H](CC(C)C)NC(CNC([C@H]3CCCN3C([C@H](CC4=CC=CC=C4)NC([C@H](NC1=O)CCCNC(NC/C=C(C)/C)=N)=O)=O)=O)=O)=O)=O,"InChI=1S/C46H64N10O9/c1-28(2)19-21-49-46(47)48-20-11-17-32-40(60)55-36(25-31-15-9-6-10-16-31)45(65)56-22-12-18-37(56)44(64)50-27-38(57)51-33(23-29(3)4)41(61)54-35(26-39(58)59)43(63)53-34(42(62)52-32)24-30-13-7-5-8-14-30/h5-10,13-16,19,29,32-37H,11-12,17-18,20-27H2,1-4H3,(H,50,64)(H,51,57)(H,52,62)(H,53,63)(H,54,61)(H,55,60)(H,58,59)(H3,47,48,49)/t32-,33+,34+,35+,36+,37-/m1/s1",GSQBGCSYZANQGB-OBWIRWOGSA-N,101888555,yes,Phormidium,autumnale ,CCAP 1446/10  
CyanoMetDB_0047,Anacyclamide A7,,other cyclic peptide,,C45H65N13O10,947.4977353,NC(NCCC[C@@H](C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](C(C)C)C(N[C@@H](CC2=CC=C(O)C=C2)C(N3[C@@H](CCC3)C4=O)=O)=O)=O)=O)=O)=O)N4[H])=N,"InChI=1S/C45H65N13O10/c1-25(2)36-42(67)56-33(24-27-14-16-28(59)17-15-27)43(68)58-22-8-13-34(58)41(66)54-30(12-7-21-51-45(48)49)37(62)53-31(18-19-35(60)61)39(64)52-29(11-6-20-50-44(46)47)38(63)55-32(40(65)57-36)23-26-9-4-3-5-10-26/h3-5,9-10,14-17,25,29-34,36,59H,6-8,11-13,18-24H2,1-2H3,(H,52,64)(H,53,62)(H,54,66)(H,55,63)(H,56,67)(H,57,65)(H,60,61)(H4,46,47,50)(H4,48,49,51)/t29-,30-,31-,32-,33-,34-,36-/m0/s1",FOHPTXTVCQDQBY-FKNKHIKMSA-N,146684862,no,Anabaena,n.a.,1TU39S8
CyanoMetDB_0048,Anacyclamide A8P,,other cyclic peptide,,C49H64N14O9,992.4980697,O=C([C@H](CC1=CN=CN1)N2[H])N[C@@H](CCC(N)=O)C(N3[C@@H](CCC3)C(N[C@@H](CC4=CN(C/C=C(C)/C)C5=C4C=CC=C5)C(N[C@@H](CC6=CN=CN6)C(N[C@@H](C)C(N[C@@H](C)C(N7[C@@H](CCC7)C2=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C49H64N14O9/c1-27(2)15-18-61-24-30(33-9-5-6-10-38(33)61)19-35-44(67)58-36(20-31-22-51-25-53-31)43(66)55-28(3)42(65)56-29(4)48(71)62-16-7-11-39(62)46(69)60-37(21-32-23-52-26-54-32)45(68)57-34(13-14-41(50)64)49(72)63-17-8-12-40(63)47(70)59-35/h5-6,9-10,15,22-26,28-29,34-37,39-40H,7-8,11-14,16-21H2,1-4H3,(H2,50,64)(H,51,53)(H,52,54)(H,55,66)(H,56,65)(H,57,68)(H,58,67)(H,59,70)(H,60,69)/t28-,29-,34-,35-,36-,37-,39-,40-/m0/s1",OJHRPVYUQLSYHW-OQIFCOLESA-N,146684863,yes,Anabaena,n.a.,UHCC-0232 (formerly TR232)
CyanoMetDB_0049,Anacyclamide A9P,,other cyclic peptide,,C52H79N11O16,1113.570626,O=C([C@H](CC1=CC=C(OC/C=C(C)/C)C=C1)N2[H])N[C@@H](CC(O)=O)C(N[C@@H](CC(O)=O)C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(N[C@@H](CC(N)=O)C(N[C@@H](CC(C)C)C(N[C@@H](CO)C(N3[C@@H](CCC3)C2=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C52H79N11O16/c1-27(2)16-19-79-31-14-12-30(13-15-31)22-35-47(73)59-38(25-43(68)69)50(76)60-37(24-42(66)67)49(75)55-32(10-7-8-17-53)44(70)56-33(20-28(3)4)45(71)58-36(23-41(54)65)48(74)57-34(21-29(5)6)46(72)62-39(26-64)52(78)63-18-9-11-40(63)51(77)61-35/h12-16,28-29,32-40,64H,7-11,17-26,53H2,1-6H3,(H2,54,65)(H,55,75)(H,56,70)(H,57,74)(H,58,71)(H,59,73)(H,60,76)(H,61,77)(H,62,72)(H,66,67)(H,68,69)/t32-,33-,34-,35-,36-,37-,38-,39-,40-/m0/s1",AJQSPEKZRLZWLQ-LCQMPJFHSA-N,146684864,no,Anabaena,n.a.,1TU33S10
CyanoMetDB_0050,Anacyclamide A10,,other cyclic peptide,,C49H72N12O14,1052.529095,O=C([C@H]([C@@H](C)O)N1[H])N[C@@H](CO)C(N[C@@H](CCC(N)=O)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](CC2=CNC3=C2C=CC=C3)C(NCC(N[C@@H](CO)C(N4[C@@H](CCC4)C(N[C@@H](C(C)C)C(N5[C@@H](CCC5)C1=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C49H72N12O14/c1-6-25(4)39-46(72)55-31(19-27-20-51-29-12-8-7-11-28(27)29)41(67)52-21-37(66)53-33(23-63)48(74)60-17-9-13-34(60)44(70)57-38(24(2)3)49(75)61-18-10-14-35(61)45(71)59-40(26(5)64)47(73)56-32(22-62)43(69)54-30(42(68)58-39)15-16-36(50)65/h7-8,11-12,20,24-26,30-35,38-40,51,62-64H,6,9-10,13-19,21-23H2,1-5H3,(H2,50,65)(H,52,67)(H,53,66)(H,54,69)(H,55,72)(H,56,73)(H,57,70)(H,58,68)(H,59,71)/t25-,26+,30-,31-,32-,33-,34-,35-,38-,39-,40-/m0/s1",TWBVBKLXMJGRPJ-WTPCWRIRSA-N,102170967,no,Anabaena,n.a.,90
CyanoMetDB_0051,Anacyclamide A11,,other cyclic peptide,,C62H84N14O16,1280.618973,O=C([C@@H](CC(O)=O)N1[H])N[C@@H](CC(N)=O)C(N[C@@H](CC2=CNC3=C2C=CC=C3)C(N[C@@H](CC(C)C)C(NCC(N[C@@H](CCC(O)=O)C(N[C@@H](CC4=CNC5=C4C=CC=C5)C(N[C@@H]([C@@H](C)CC)C(NCC(N[C@@H]([C@@H](C)CC)C(N6[C@@H](CCC6)C1=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C62H84N14O16/c1-7-32(5)52-61(91)67-30-49(79)74-53(33(6)8-2)62(92)76-21-13-18-46(76)60(90)73-45(26-51(82)83)58(88)72-44(25-47(63)77)57(87)71-42(23-34-27-64-38-16-11-9-14-36(34)38)56(86)69-41(22-31(3)4)54(84)66-29-48(78)68-40(19-20-50(80)81)55(85)70-43(59(89)75-52)24-35-28-65-39-17-12-10-15-37(35)39/h9-12,14-17,27-28,31-33,40-46,52-53,64-65H,7-8,13,18-26,29-30H2,1-6H3,(H2,63,77)(H,66,84)(H,67,91)(H,68,78)(H,69,86)(H,70,85)(H,71,87)(H,72,88)(H,73,90)(H,74,79)(H,75,89)(H,80,81)(H,82,83)/t32-,33-,40-,41-,42-,43-,44-,45+,46-,52-,53-/m0/s1",WOTYFQQVCLMODP-QJHFTDIGSA-N,146684858,no,Anabaena,n.a.,BIR260
CyanoMetDB_0052,Anacyclamide A15,,other cyclic peptide,,C79H107N19O23,1689.778721,O=C([C@@H](CC1=CN=CN1)N2[H])N[C@@H](C)C(N[C@@H](CC3=CC=CC=C3)C(N[C@@H]([C@@H](C)CC)C(NCC(N[C@@H](CC4=CC=C(O)C=C4)C(N[C@@H](CC(O)=O)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC(O)=O)C(N5[C@@H](CCC5)C(N[C@@H]([C@H](O)C)C(NCC(N[C@@H](CCCCN)C(N[C@@H](CC6=CC=C(C=C6)O)C(N7[C@@H](CCC7)C2=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C79H107N19O23/c1-5-41(2)65-76(118)83-39-62(104)88-52(32-45-18-22-48(100)23-19-45)71(113)91-55(35-63(105)106)72(114)89-51(26-27-60(81)102)69(111)94-57(36-64(107)108)79(121)98-30-12-17-59(98)75(117)96-66(43(4)99)77(119)84-38-61(103)87-50(15-9-10-28-80)68(110)93-56(33-46-20-24-49(101)25-21-46)78(120)97-29-11-16-58(97)74(116)92-54(34-47-37-82-40-85-47)70(112)86-42(3)67(109)90-53(73(115)95-65)31-44-13-7-6-8-14-44/h6-8,13-14,18-25,37,40-43,50-59,65-66,99-101H,5,9-12,15-17,26-36,38-39,80H2,1-4H3,(H2,81,102)(H,82,85)(H,83,118)(H,84,119)(H,86,112)(H,87,103)(H,88,104)(H,89,114)(H,90,109)(H,91,113)(H,92,116)(H,93,110)(H,94,111)(H,95,115)(H,96,117)(H,105,106)(H,107,108)/t41-,42-,43+,50-,51-,52-,53-,54+,55-,56-,57-,58-,59-,65-,66-/m0/s1",UEQHWHLUDMRVAA-OOJKBKLASA-N,146684859,no,Anabaena,n.a.,37
CyanoMetDB_0053,Anacyclamide A15G,,other cyclic peptide,,C89H123N19O23,1825.903921,O=C([C@H](CC1=CN=CN1)NC2=O)N[C@@H](C)C(N[C@@H](CC3=CC=CC=C3)C(N[C@@H]([C@@H](C)CC)C(NCC(N[C@@H](CC4=CC=C(O)C=C4)C(N[C@@H](CC(O)=O)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC(O)=O)C(N5[C@@H](CCC5)C(N[C@@H]([C@H](O)C)C(NCC(N[C@@H](CCCCN)C(N[C@@H](CC6=CC=C(O)C=C6)C(N7[C@H]2CCC7)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O.C/C=C(C)/CC/C=C(C)/C,"InChI=1S/C79H107N19O23.C10H18/c1-5-41(2)65-76(118)83-39-62(104)88-52(32-45-18-22-48(100)23-19-45)71(113)91-55(35-63(105)106)72(114)89-51(26-27-60(81)102)69(111)94-57(36-64(107)108)79(121)98-30-12-17-59(98)75(117)96-66(43(4)99)77(119)84-38-61(103)87-50(15-9-10-28-80)68(110)93-56(33-46-20-24-49(101)25-21-46)78(120)97-29-11-16-58(97)74(116)92-54(34-47-37-82-40-85-47)70(112)86-42(3)67(109)90-53(73(115)95-65)31-44-13-7-6-8-14-44;1-5-10(4)8-6-7-9(2)3/h6-8,13-14,18-25,37,40-43,50-59,65-66,99-101H,5,9-12,15-17,26-36,38-39,80H2,1-4H3,(H2,81,102)(H,82,85)(H,83,118)(H,84,119)(H,86,112)(H,87,103)(H,88,104)(H,89,114)(H,90,109)(H,91,113)(H,92,116)(H,93,110)(H,94,111)(H,95,115)(H,96,117)(H,105,106)(H,107,108);5,7H,6,8H2,1-4H3/b;10-5+/t41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,65-,66-;/m0./s1",JIPSYXBOWBNSQY-WUMWWSRESA-N,,no,Anabaena,n.a.,37
CyanoMetDB_0054,Anacyclamide A20P,,other cyclic peptide,,C97H146N24O27,2079.078926,OC(C[C@@H](C(N[C@H](C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@]([C@H](O)C)(C(NCC(NCC(N[C@@]([H])([C@@H](C)CC)C(N[C@H](C(N[C@@H](C)C(N[C@H](C(N1CCC[C@H]1C2=O)=O)CO)=O)=O)CO)=O)=O)=O)=O)[H])=O)=O)=O)CCCCN[H])=O)CC3=CNC4=C3C=CC=C4)=O)NC([C@H](CC(C)C)NC(CNC([C@]([C@H](O)C)(NC(CNC([C@@H](NC(CNC([C@@H](N2[H])CC5=CNC6=C5C=CC=C6)=O)=O)CC(N)=O)=O)=O)[H])=O)=O)=O)=O.C/C=C(C)/C,"InChI=1S/C92H138N24O27.C5H10/c1-12-47(8)75-91(142)111-65(42-117)87(138)102-48(9)78(129)112-66(43-118)92(143)116-27-19-25-67(116)88(139)110-61(31-51-35-95-55-22-15-13-20-53(51)55)79(130)98-39-70(123)104-63(33-68(94)121)80(131)99-41-73(126)114-76(49(10)119)89(140)101-40-71(124)103-58(28-44(2)3)82(133)109-64(34-74(127)128)85(136)108-62(32-52-36-96-56-23-16-14-21-54(52)56)84(135)105-57(24-17-18-26-93)81(132)106-59(29-45(4)5)83(134)107-60(30-46(6)7)86(137)115-77(50(11)120)90(141)100-37-69(122)97-38-72(125)113-75;1-4-5(2)3/h13-16,20-23,35-36,44-50,57-67,75-77,95-96,117-120H,12,17-19,24-34,37-43,93H2,1-11H3,(H2,94,121)(H,97,122)(H,98,130)(H,99,131)(H,100,141)(H,101,140)(H,102,138)(H,103,124)(H,104,123)(H,105,135)(H,106,132)(H,107,134)(H,108,136)(H,109,133)(H,110,139)(H,111,142)(H,112,129)(H,113,125)(H,114,126)(H,115,137)(H,127,128);4H,1-3H3/t47-,48-,49+,50+,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,75-,76-,77-;/m0./s1",ITMKNOSOIPQAMC-SMFJBORESA-N,,no,Anabaena,n.a.,"1TU28S13, SYKE844C"
CyanoMetDB_0055,Anacyclamide A20PP,,other cyclic peptide,,C102H154N24O27,2147.141526,OC(C[C@@H](C(N[C@H](C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@]([C@H](O)C)(C(NCC(NCC(N[C@@]([H])([C@@H](C)CC)C(N[C@H](C(N[C@@H](C)C(N[C@H](C(N1CCC[C@H]1C2=O)=O)CO)=O)=O)CO)=O)=O)=O)=O)[H])=O)=O)=O)CCCCN[H])=O)CC3=CNC4=C3C=CC=C4)=O)NC([C@H](CC(C)C)NC(CNC([C@]([C@H](O)C)(NC(CNC([C@@H](NC(CNC([C@@H](N2[H])CC5=CNC6=C5C=CC=C6)=O)=O)CC(N)=O)=O)=O)[H])=O)=O)=O)=O.C/C=C(C)/C.C/C=C(C)/C,"InChI=1S/C92H138N24O27.2C5H10/c1-12-47(8)75-91(142)111-65(42-117)87(138)102-48(9)78(129)112-66(43-118)92(143)116-27-19-25-67(116)88(139)110-61(31-51-35-95-55-22-15-13-20-53(51)55)79(130)98-39-70(123)104-63(33-68(94)121)80(131)99-41-73(126)114-76(49(10)119)89(140)101-40-71(124)103-58(28-44(2)3)82(133)109-64(34-74(127)128)85(136)108-62(32-52-36-96-56-23-16-14-21-54(52)56)84(135)105-57(24-17-18-26-93)81(132)106-59(29-45(4)5)83(134)107-60(30-46(6)7)86(137)115-77(50(11)120)90(141)100-37-69(122)97-38-72(125)113-75;2*1-4-5(2)3/h13-16,20-23,35-36,44-50,57-67,75-77,95-96,117-120H,12,17-19,24-34,37-43,93H2,1-11H3,(H2,94,121)(H,97,122)(H,98,130)(H,99,131)(H,100,141)(H,101,140)(H,102,138)(H,103,124)(H,104,123)(H,105,135)(H,106,132)(H,107,134)(H,108,136)(H,109,133)(H,110,139)(H,111,142)(H,112,129)(H,113,125)(H,114,126)(H,115,137)(H,127,128);2*4H,1-3H3/t47-,48-,49+,50+,57-,58-,59-,60-,61-,62-,63-,64-,65-,66-,67-,75-,76-,77-;;/m0../s1",LKFPHTSVLFIWKQ-XCPLSQDPSA-N,,no,Anabaena,n.a.,"1TU28S13, SYKE844C"
CyanoMetDB_0056,Anacyclamide B7,,other cyclic peptide,Nostocyclopeptide,C36H59N9O7S,761.4258165,O=C([C@H](CC(C)C)N1[H])N[C@@H]([C@@H](C)CC)C(NCC(N[C@@H]([C@@H](C)CC)C(N[C@@H](CCSC)C(N[C@@H](CC2=CN=CN2)C(N3[C@@H](CCC3)C1=O)=O)=O)=O)=O)=O,"InChI=1S/C36H59N9O7S/c1-8-21(5)29-34(50)38-18-28(46)43-30(22(6)9-2)35(51)40-24(12-14-53-7)31(47)42-26(16-23-17-37-19-39-23)36(52)45-13-10-11-27(45)33(49)41-25(15-20(3)4)32(48)44-29/h17,19-22,24-27,29-30H,8-16,18H2,1-7H3,(H,37,39)(H,38,50)(H,40,51)(H,41,49)(H,42,47)(H,43,46)(H,44,48)/t21-,22-,24-,25-,26-,27-,29-,30-/m0/s1",XCHQWQBZWWDLDN-PTYPHENBSA-N,146684866,no,Anabaena,n.a.,SYKE844B
CyanoMetDB_0057,Bisebromoamide,,other linear peptide,,C51H72BrN7O8S,1021.434646,CCC(=O)[C@@H]1CCCN1C(=O)[C@H](CC2=CC=CC=C2)N(C)C(=O)[C@@H](CC(C)C)NC(=O)[C@@]3(CSC(=N3)[C@@H]4C[C@@H](CN4C(=O)[C@@H](CC5=CC(=C(C=C5)O)Br)N(C)C(=O)[C@H](C)NC(=O)C(C)(C)C)C)C,"InChI=1S/C51H72BrN7O8S/c1-12-41(60)37-19-16-22-58(37)46(64)39(26-33-17-14-13-15-18-33)57(11)45(63)36(23-30(2)3)54-49(67)51(9)29-68-43(55-51)38-24-31(4)28-59(38)47(65)40(27-34-20-21-42(61)35(52)25-34)56(10)44(62)32(5)53-48(66)50(6,7)8/h13-15,17-18,20-21,25,30-32,36-40,61H,12,16,19,22-24,26-29H2,1-11H3,(H,53,66)(H,54,67)/t31-,32-,36+,37-,38-,39-,40+,51-/m0/s1",XNEWSWFKSIOKDS-VUFZTDKHSA-N,46861903,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0058,Anacyclamide B8,,other cyclic peptide,,C46H60N12O11,956.4504508,O=C([C@H](CC1=CC=CC=C1)N2[H])N[C@@H](CO)C(N3[C@@H](CCC3)C(N[C@@H](CC(O)=O)C(N[C@@H](CC4=CNC5=C4C=CC=C5)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C)C(N6[C@@H](CCC6)C2=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C46H60N12O11/c1-25-44(68)57-18-8-15-35(57)42(66)54-31(20-26-10-3-2-4-11-26)39(63)56-34(24-59)45(69)58-19-9-16-36(58)43(67)55-33(22-37(60)61)41(65)53-32(21-27-23-50-29-13-6-5-12-28(27)29)40(64)52-30(38(62)51-25)14-7-17-49-46(47)48/h2-6,10-13,23,25,30-36,50,59H,7-9,14-22,24H2,1H3,(H,51,62)(H,52,64)(H,53,65)(H,54,66)(H,55,67)(H,56,63)(H,60,61)(H4,47,48,49)/t25-,30-,31-,32-,33-,34-,35-,36-/m0/s1",SGWSHCDZVROXAU-PMKQEARUSA-N,146684867,no,Anabaena,n.a.,SYKE816
CyanoMetDB_0059,Anacyclamide B10,,other cyclic peptide,,C48H71N11O13,1009.523281,O=C([C@H](CO)N1[H])N[C@@H](CO)C(N[C@@H](C(C)C)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](CC2=CNC3=C2C=CC=C3)C(NCC(N[C@@H](CO)C(N4[C@@H](CCC4)C(N[C@@H](C(C)C)C(N5[C@@H](CCC5)C1=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C48H71N11O13/c1-7-26(6)39-46(70)52-30(18-27-19-49-29-13-9-8-12-28(27)29)40(64)50-20-36(63)51-33(23-62)47(71)58-16-10-15-35(58)44(68)56-38(25(4)5)48(72)59-17-11-14-34(59)43(67)54-31(21-60)41(65)53-32(22-61)42(66)55-37(24(2)3)45(69)57-39/h8-9,12-13,19,24-26,30-35,37-39,49,60-62H,7,10-11,14-18,20-23H2,1-6H3,(H,50,64)(H,51,63)(H,52,70)(H,53,65)(H,54,67)(H,55,66)(H,56,68)(H,57,69)/t26-,30-,31-,32-,33-,34-,35-,37-,38-,39-/m0/s1",MCCUWDDIGYHSMP-JQDZCNFNSA-N,146684865,no,Anabaena,n.a.,"1TU31S9, SYKE763A"
CyanoMetDB_0060,Anacyclamide C8,,other cyclic peptide,,C51H71N11O10,997.5385375,O=C([C@H](C(C)C)N1[H])N[C@@H]([C@@H](C)CC)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC2=CN=CN2)C(N[C@@H](CC3=CC=C(C=C3)O)C(N[C@@H](CC(C)C)C(N[C@@H](CC4=CC=CC=C4)C(N5[C@@H](CCC5)C1=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C51H71N11O10/c1-7-30(6)43-50(71)55-35(19-20-41(52)64)44(65)58-38(25-33-26-53-27-54-33)47(68)57-37(23-32-15-17-34(63)18-16-32)46(67)56-36(22-28(2)3)45(66)59-39(24-31-12-9-8-10-13-31)51(72)62-21-11-14-40(62)48(69)60-42(29(4)5)49(70)61-43/h8-10,12-13,15-18,26-30,35-40,42-43,63H,7,11,14,19-25H2,1-6H3,(H2,52,64)(H,53,54)(H,55,71)(H,56,67)(H,57,68)(H,58,65)(H,59,66)(H,60,69)(H,61,70)/t30-,35-,36-,37-,38-,39-,40-,42-,43-/m0/s1",FQIGKVHTFVHDQG-NXJJEAEESA-N,146684869,no,Anabaena,n.a.,PH262
CyanoMetDB_0061,Anacyclamide C10,,other cyclic peptide,,C52H70N14O14,1114.519593,O=C([C@H](CO)N1[H])N[C@@H](C)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC2=CNC3=C2C=CC=C3)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC(N)=O)C(N[C@@H](CC4=CC=CC=C4)C(NCC(N[C@@H](C(C)C)C(N5[C@@H](CCC5)C1=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C52H70N14O14/c1-26(2)43-52(80)66-19-9-14-38(66)51(79)64-37(25-67)50(78)58-27(3)44(72)59-32(15-17-39(53)68)46(74)62-35(21-29-23-56-31-13-8-7-12-30(29)31)48(76)60-33(16-18-40(54)69)47(75)63-36(22-41(55)70)49(77)61-34(20-28-10-5-4-6-11-28)45(73)57-24-42(71)65-43/h4-8,10-13,23,26-27,32-38,43,56,67H,9,14-22,24-25H2,1-3H3,(H2,53,68)(H2,54,69)(H2,55,70)(H,57,73)(H,58,78)(H,59,72)(H,60,76)(H,61,77)(H,62,74)(H,63,75)(H,64,79)(H,65,71)/t27-,32-,33-,34-,35-,36-,37-,38-,43-/m0/s1",COQVACBVGPOPNC-PNZSFUNOSA-N,146684868,no,Anabaena,n.a.,"299A, SYKE748A"
CyanoMetDB_0062,Anacyclamide D10,,other cyclic peptide,,C54H70N16O13,1150.530826,O=C([C@H](CC(N)=O)N1[H])N[C@@H](C)C(N[C@@H](CC2=CN=CN2)C(N[C@@H](CC3=CNC4=C3C=CC=C4)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC(N)=O)C(N[C@@H](CC5=CC=CC=C5)C(NCC(N[C@@H](C(C)C)C(N6[C@@H](CCC6)C1=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C54H70N16O13/c1-27(2)45-54(83)70-17-9-14-40(70)53(82)68-38(21-42(56)72)49(78)62-28(3)46(75)64-37(20-31-24-58-26-61-31)51(80)66-36(19-30-23-59-33-13-8-7-12-32(30)33)50(79)63-34(15-16-41(55)71)48(77)67-39(22-43(57)73)52(81)65-35(18-29-10-5-4-6-11-29)47(76)60-25-44(74)69-45/h4-8,10-13,23-24,26-28,34-40,45,59H,9,14-22,25H2,1-3H3,(H2,55,71)(H2,56,72)(H2,57,73)(H,58,61)(H,60,76)(H,62,78)(H,63,79)(H,64,75)(H,65,81)(H,66,80)(H,67,77)(H,68,82)(H,69,74)/t28-,34-,35-,36-,37-,38-,39-,40-,45-/m0/s1",HNUXFUMWJWYVHO-BEFHOLDESA-N,146684870,no,Anabaena,n.a.,1TU44S9
CyanoMetDB_0063,Anacyclamide E10,,other cyclic peptide,,C53H74N12O13,1086.549831,O=C([C@H](CC1=CC=C(O)C=C1)N2[H])N[C@@H](C)C(N3[C@@H](CCC3)C(N[C@@H](CC(C)C)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC(N)=O)C(N[C@@H](CC4=CC=CC=C4)C(NCC(N[C@@H](C(C)C)C(N5[C@@H](CCC5)C2=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C53H74N12O13/c1-28(2)23-35-48(73)58-34(19-20-41(54)67)46(71)60-38(26-42(55)68)49(74)59-36(24-31-11-7-6-8-12-31)45(70)56-27-43(69)63-44(29(3)4)53(78)65-22-10-14-40(65)51(76)62-37(25-32-15-17-33(66)18-16-32)47(72)57-30(5)52(77)64-21-9-13-39(64)50(75)61-35/h6-8,11-12,15-18,28-30,34-40,44,66H,9-10,13-14,19-27H2,1-5H3,(H2,54,67)(H2,55,68)(H,56,70)(H,57,72)(H,58,73)(H,59,74)(H,60,71)(H,61,75)(H,62,76)(H,63,69)/t30-,34-,35-,36-,37-,38-,39-,40-,44-/m0/s1",IECYCJGUKYTYQQ-KICVKIPVSA-N,146684871,no,Anabaena,n.a.,PH256
CyanoMetDB_0064,Anacyclamide E10P,,other cyclic peptide,,C58H82N12O13,1154.612431,O=C([C@H](CC1=CC=C(OC/C=C(C)/C)C=C1)N2[H])N[C@@H](C)C(N3[C@@H](CCC3)C(N[C@@H](CC(C)C)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC(N)=O)C(N[C@@H](CC4=CC=CC=C4)C(NCC(N[C@@H](C(C)C)C(N5[C@@H](CCC5)C2=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C58H82N12O13/c1-32(2)23-26-83-38-19-17-37(18-20-38)29-42-52(76)62-35(7)57(81)69-24-11-15-44(69)55(79)66-40(27-33(3)4)53(77)63-39(21-22-46(59)71)51(75)65-43(30-47(60)72)54(78)64-41(28-36-13-9-8-10-14-36)50(74)61-31-48(73)68-49(34(5)6)58(82)70-25-12-16-45(70)56(80)67-42/h8-10,13-14,17-20,23,33-35,39-45,49H,11-12,15-16,21-22,24-31H2,1-7H3,(H2,59,71)(H2,60,72)(H,61,74)(H,62,76)(H,63,77)(H,64,78)(H,65,75)(H,66,79)(H,67,80)(H,68,73)/t35-,39-,40-,41-,42-,43-,44-,45-,49-/m0/s1",CQMWIKXUHZWYQN-NBASOOGUSA-N,146684872,no,Anabaena,n.a.,PH256
CyanoMetDB_0065,Anacyclamide F10P,,other cyclic peptide,,C56H78N12O17,1190.560789,[H]NCCCC[C@H](NC([C@H](CC(N)=O)NC([C@H](CO)NC([C@@H](CC1=CC=C(O)C=C1)N2[H])=O)=O)=O)C(N3CCC[C@H]3C(N[C@@H](CO)C(N[C@@H](CC(O)=O)C(N[C@H](C(N[C@@H](CO)C(N4CCC[C@H]4C2=O)=O)=O)CC5=CC=CC=C5)=O)=O)=O)=O.C/C=C(C)/C,"InChI=1S/C51H70N12O17.C5H10/c52-17-5-4-10-30-50(79)62-18-6-12-39(62)49(78)60-36(25-65)47(76)57-34(23-41(69)70)45(74)55-31(20-27-8-2-1-3-9-27)43(72)61-37(26-66)51(80)63-19-7-11-38(63)48(77)58-32(21-28-13-15-29(67)16-14-28)42(71)59-35(24-64)46(75)56-33(22-40(53)68)44(73)54-30;1-4-5(2)3/h1-3,8-9,13-16,30-39,64-67H,4-7,10-12,17-26,52H2,(H2,53,68)(H,54,73)(H,55,74)(H,56,75)(H,57,76)(H,58,77)(H,59,71)(H,60,78)(H,61,72)(H,69,70);4H,1-3H3/t30-,31-,32+,33-,34-,35-,36-,37-,38-,39-;/m0./s1",XCBXIGBSNGOZDS-IXWNAUIESA-N,,no,Anabaena,n.a.,1TU32S11
CyanoMetDB_0066,Nostocyclopeptide,,other cyclic peptide,,C47H59N7O10,881.4323411,O=C(NC(CC1=CC=C(O)C=C1)/C([H])=N/C(CC2=CC=C(O)C=C2)C(NC(CC3=CC=C(O)C=C3)C(N4)=O)=O)C5C[C@H](C)CN5C([C@@H](NC([C@H](CCC6)N6C([C@H]4CCO)=O)=O)C(C)C)=O,"InChI=1S/C47H59N7O10/c1-27(2)41-47(64)54-26-28(3)21-40(54)45(62)49-32(22-29-6-12-33(56)13-7-29)25-48-37(23-30-8-14-34(57)15-9-30)42(59)51-38(24-31-10-16-35(58)17-11-31)43(60)50-36(18-20-55)46(63)53-19-4-5-39(53)44(61)52-41/h6-17,25,27-28,32,36-41,55-58H,4-5,18-24,26H2,1-3H3,(H,49,62)(H,50,60)(H,51,59)(H,52,61)/b48-25+/t28-,32?,36+,37?,38?,39-,40?,41-/m0/s1",DVUWQGYGLZYWGL-NETKURJCSA-N,,yes,Nostoc,n.a.,XPORK13A
CyanoMetDB_0067,Nostophycin B,,other cyclic peptide,,C45H62N8O10,874.4588903,O=C([C@@H](NC(C(C(CC(CCCC1=CC=CC=C1)O)NC([C@H]2CCCN2C(C(N3)C(C)C)=O)=O)O)=O)CCC(N)=O)NCC(N4CCC[C@@H]4C(N[C@@H](C3=O)CC5=CC=CC=C5)=O)=O,"InChI=1S/C45H62N8O10/c1-27(2)38-45(63)53-23-11-19-35(53)43(61)49-32(25-30(54)17-9-16-28-12-5-3-6-13-28)39(57)44(62)48-31(20-21-36(46)55)40(58)47-26-37(56)52-22-10-18-34(52)42(60)50-33(41(59)51-38)24-29-14-7-4-8-15-29/h3-8,12-15,27,30-35,38-39,54,57H,9-11,16-26H2,1-2H3,(H2,46,55)(H,47,58)(H,48,62)(H,49,61)(H,50,60)(H,51,59)/t30?,31-,32?,33+,34+,35+,38?,39?/m0/s1",PLGIVKLVRGIMTH-URPROHAVSA-N,146683735,no,Nostoc,n.a.,152
CyanoMetDB_0068,Credneramide A,,other linear non-peptide,,C19H26ClNO,319.1702922,Cl/C=C(CCC)/C/C=C/CCC(NCCC1=CC=CC=C1)=O,"InChI=1S/C19H26ClNO/c1-2-9-18(16-20)12-7-4-8-13-19(22)21-15-14-17-10-5-3-6-11-17/h3-7,10-11,16H,2,8-9,12-15H2,1H3,(H,21,22)/b7-4+,18-16+",OJYMBSRQFFWVDQ-DYLVBWQHSA-N,57332910,yes,Trichodesmium,n.a.,PNG-05/19/05-13
CyanoMetDB_0069,Nostophycin C,,other cyclic peptide,,C46H64N8O9,872.4796257,O=C(NCC(N1CCC[C@@H]1C(N[C@@H]2CC3=CC=CC=C3)=O)=O)[C@H](CCC(N)=O)NC(C(O)C(NC([C@H]4CCCN4C([C@@H]([C@@H](C)CC)NC2=O)=O)=O)CCCCCC5=CC=CC=C5)=O,"InChI=1S/C46H64N8O9/c1-3-29(2)39-46(63)54-26-14-22-36(54)44(61)49-32(20-12-6-9-17-30-15-7-4-8-16-30)40(57)45(62)50-33(23-24-37(47)55)41(58)48-28-38(56)53-25-13-21-35(53)43(60)51-34(42(59)52-39)27-31-18-10-5-11-19-31/h4-5,7-8,10-11,15-16,18-19,29,32-36,39-40,57H,3,6,9,12-14,17,20-28H2,1-2H3,(H2,47,55)(H,48,58)(H,49,61)(H,50,62)(H,51,60)(H,52,59)/t29-,32?,33-,34+,35+,36+,39+,40?/m0/s1",JBCVJFHMINXNLJ-HPUWJYQJSA-N,146683736,no,Nostoc,n.a.,152
CyanoMetDB_0077,Anabaenolysin C,,other linear peptide,,C31H45N5O9,631.321728,OC(C(NC(CNC([C@H](CCC(N)=O)NC1=O)=O)=O)C/C=C/C=C/C=C/CCCCCCC=C)C(NC2CC(OC2C1O)=O)=O,"InChI=1S/C31H45N5O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26(40)30(43)36-22-18-25(39)45-28(22)27(41)31(44)35-21(16-17-23(32)37)29(42)33-19-24(38)34-20/h2,9-14,20-22,26-28,40-41H,1,3-8,15-19H2,(H2,32,37)(H,33,42)(H,34,38)(H,35,44)(H,36,43)/b10-9+,12-11+,14-13+/t20?,21-,22?,26?,27?,28?/m0/s1",LRCNGMYPFPDQLQ-IYYVNUIDSA-N,146683717,yes,Anabaena,n.a.,XPORK13A
CyanoMetDB_0078,Credneramide B,,other linear non-peptide,,C16H28ClNO,285.1859422,Cl/C=C(CCC)/C/C=C/CCC(NCCC(C)C)=O,"InChI=1S/C16H28ClNO/c1-4-8-15(13-17)9-6-5-7-10-16(19)18-12-11-14(2)3/h5-6,13-14H,4,7-12H2,1-3H3,(H,18,19)/b6-5+,15-13+",WHDZTXRZTFGPRJ-HQYXJCMVSA-N,57332911,yes,Trichodesmium,n.a.,PNG-05/19/05-13
CyanoMetDB_0079,Anabaenolysin D,,other linear peptide,,C31H47N5O9,633.3373781,OC(C(NC(CNC([C@H](CCC(N)=O)NC1=O)=O)=O)C/C=C/C=C/C=C/CCCCCCCC)C(NC2CC(OC2C1O)=O)=O,"InChI=1S/C31H47N5O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26(40)30(43)36-22-18-25(39)45-28(22)27(41)31(44)35-21(16-17-23(32)37)29(42)33-19-24(38)34-20/h9-14,20-22,26-28,40-41H,2-8,15-19H2,1H3,(H2,32,37)(H,33,42)(H,34,38)(H,35,44)(H,36,43)/b10-9+,12-11+,14-13+/t20?,21-,22?,26?,27?,28?/m0/s1",BIUCFVAFOCEXJD-IYYVNUIDSA-N,146683718,no,Anabaena,n.a.,XPORK13A
CyanoMetDB_0080,6-O-acetyl-?-cyclodextrin,,other cyclic non-peptide,cyclodextrin,C38H62O31,1014.327505,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C6O[C@@H]5COC(C)=O)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](OC7[C@@H]([C@H]([C@@H]([C@@H](CO)O7)O6)O)O)[C@@H]1O,"InChI=1S/C38H62O31/c1-8(44)57-7-14-32-20(50)26(56)38(63-14)68-31-13(6-43)61-36(24(54)18(31)48)66-29-11(4-41)59-34(22(52)16(29)46)64-27-9(2-39)58-33(21(51)15(27)45)65-28-10(3-40)60-35(23(53)17(28)47)67-30-12(5-42)62-37(69-32)25(55)19(30)49/h9-43,45-56H,2-7H2,1H3/t9-,10-,11-,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?/m1/s1",YWBCZVONXLGWHV-SDVIBVGKSA-N,146683719,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0081,"6-O-diacetyl(A,B)-?-cyclodextrin",,other cyclic non-peptide,cyclodextrin,C40H64O32,1056.33807,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C6O[C@@H]5COC(C)=O)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)O6)O)O)[C@@H]1O,"InChI=1S/C40H64O32/c1-9(45)59-7-15-33-22(52)28(58)40(66-15)72-34-16(8-60-10(2)46)65-39(27(57)21(34)51)70-32-14(6-44)63-37(25(55)19(32)49)68-30-12(4-42)61-35(23(53)17(30)47)67-29-11(3-41)62-36(24(54)18(29)48)69-31-13(5-43)64-38(71-33)26(56)20(31)50/h11-44,47-58H,3-8H2,1-2H3/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?,40?/m1/s1",VLCCEAXCRNFUDB-YNDJXNPESA-N,146683720,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0082,"6-O-diacetyl(A,C)-?-cyclodextrin",,other cyclic non-peptide,cyclodextrin,C40H64O32,1056.33807,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C6O[C@@H]5COC(C)=O)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](COC(C)=O)[C@@H](OC7[C@@H]([C@H]([C@@H]([C@@H](CO)O7)O6)O)O)[C@@H]1O,"InChI=1S/C40H64O32/c1-9(45)59-7-15-33-22(52)28(58)40(66-15)70-32-14(6-44)64-38(26(56)20(32)50)72-34-16(8-60-10(2)46)65-39(27(57)21(34)51)69-31-13(5-43)62-36(24(54)18(31)48)67-29-11(3-41)61-35(23(53)17(29)47)68-30-12(4-42)63-37(71-33)25(55)19(30)49/h11-44,47-58H,3-8H2,1-2H3/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?,40?/m1/s1",GZKGLPMRRGJCSZ-YNDJXNPESA-N,146683721,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0083,"6-O-triacetyl(A,B,C)-?-cyclodextrin",,other cyclic non-peptide,cyclodextrin,C42H66O33,1098.348635,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C6O[C@@H]5COC(C)=O)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](COC(C)=O)[C@@H](OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)O6)O)O)[C@@H]1O,"InChI=1S/C42H66O33/c1-10(46)61-7-16-34-23(53)29(59)41(68-16)75-36-18(9-63-12(3)48)69-42(30(60)24(36)54)74-35-17(8-62-11(2)47)67-40(28(58)22(35)52)72-33-15(6-45)65-38(26(56)20(33)50)70-31-13(4-43)64-37(25(55)19(31)49)71-32-14(5-44)66-39(73-34)27(57)21(32)51/h13-45,49-60H,4-9H2,1-3H3/t13-,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?/m1/s1",WHFOCKDBMPPPNF-YFUQKLGGSA-N,146683722,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0084,"6-O-triacetyl(A,C,E)-?-cyclodextrin",,other cyclic non-peptide,cyclodextrin,C42H66O33,1098.348635,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C6O[C@@H]5COC(C)=O)O[C@@H]4CO)O[C@@H]3COC(C)=O)O[C@@H]2CO)O[C@H](COC(C)=O)[C@@H](OC7[C@@H]([C@H]([C@@H]([C@@H](CO)O7)O6)O)O)[C@@H]1O,"InChI=1S/C42H66O33/c1-10(46)61-7-16-34-22(52)28(58)40(67-16)70-31-13(4-43)65-38(26(56)20(31)50)74-35-17(8-62-11(2)47)69-42(30(60)24(35)54)72-33-15(6-45)66-39(27(57)21(33)51)75-36-18(9-63-12(3)48)68-41(29(59)23(36)53)71-32-14(5-44)64-37(73-34)25(55)19(32)49/h13-45,49-60H,4-9H2,1-3H3/t13-,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?/m1/s1",ZWWTTYVCIMKBRR-YFUQKLGGSA-N,146683723,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0085,"6-O-tetraacetyl(A,B,C,E)-?-cyclodextrin",,other cyclic non-peptide,cyclodextrin,C44H68O34,1140.359199,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C6O[C@@H]5COC(C)=O)O[C@@H]4CO)O[C@@H]3COC(C)=O)O[C@@H]2CO)O[C@H](COC(C)=O)[C@@H](OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)O6)O)O)[C@@H]1O,"InChI=1S/C44H68O34/c1-11(47)63-7-17-35-23(53)29(59)41(69-17)73-33-15(5-45)68-40(28(58)22(33)52)76-36-18(8-64-12(2)48)71-43(31(61)25(36)55)78-38-20(10-66-14(4)50)72-44(32(62)26(38)56)77-37-19(9-65-13(3)49)70-42(30(60)24(37)54)74-34-16(6-46)67-39(75-35)27(57)21(34)51/h15-46,51-62H,5-10H2,1-4H3/t15-,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?/m1/s1",LTWPNGUXWAVWAG-PPLKITMRSA-N,146683724,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0086,"6-O-tetraacetyl(A,B,D,E)-?-cyclodextrin",,other cyclic non-peptide,cyclodextrin,C44H68O34,1140.359199,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C6O[C@@H]5COC(C)=O)O[C@@H]4CO)O[C@@H]3COC(C)=O)O[C@@H]2COC(C)=O)O[C@H](CO)[C@@H](OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)O6)O)O)[C@@H]1O,"InChI=1S/C44H68O34/c1-11(47)63-7-17-35-25(55)31(61)43(71-17)77-37-19(9-65-13(3)49)69-41(29(59)23(37)53)74-34-16(6-46)68-40(28(58)22(34)52)76-36-18(8-64-12(2)48)72-44(32(62)26(36)56)78-38-20(10-66-14(4)50)70-42(30(60)24(38)54)73-33-15(5-45)67-39(75-35)27(57)21(33)51/h15-46,51-62H,5-10H2,1-4H3/t15-,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?/m1/s1",KOIRDIRHUBAJKP-PPLKITMRSA-N,146683725,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0087,?-cyclodextrin,,other cyclic non-peptide,cyclodextrin,C42H70O35,1134.369764,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C5O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](OC6[C@@H]([C@H]([C@@H]([C@@H](CO)O6)OC7[C@@H]([C@H]([C@@H]([C@@H](CO)O7)OC8[C@@H]([C@H]([C@@H]([C@@H](CO)O8)O5)O)O)O)O)O)O)[C@@H]1O,"InChI=1S/C42H70O35/c43-1-8-29-15(50)22(57)36(64-8)72-30-9(2-44)66-38(24(59)17(30)52)74-32-11(4-46)68-40(26(61)19(32)54)76-34-13(6-48)70-42(28(63)21(34)56)77-35-14(7-49)69-41(27(62)20(35)55)75-33-12(5-47)67-39(25(60)18(33)53)73-31-10(3-45)65-37(71-29)23(58)16(31)51/h8-63H,1-7H2/t8-,9-,10-,11-,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?,40?,41?,42?/m1/s1",WHGYBXFWUBPSRW-VOXAOYDDSA-N,90384115,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0088,Grassystatin A,,other linear peptide,linear depsipeptide,C58H95N9O16,1173.689678,O=C(O[C@@H](C(C)C)C(O[C@H](C(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CC(N)=O)C(N[C@@H](CC(C)C)[C@@H](O)CC(N[C@@H]([C@H](O)C)C(N[C@@H](C)C(N(C)[C@H](CC1=CC=CC=C1)C(N2[C@H](C(OC)=O)CCC2)=O)=O)=O)=O)=O)=O)=O)=O)[C@H](C(C)C)N(C)C,"InChI=1S/C58H95N9O16/c1-30(2)25-38(43(69)29-45(71)64-46(36(12)68)52(74)60-35(11)54(76)66(15)42(27-37-21-18-17-19-22-37)55(77)67-24-20-23-41(67)56(78)81-16)61-51(73)40(28-44(59)70)62-50(72)39(26-31(3)4)63-53(75)48(33(7)8)82-58(80)49(34(9)10)83-57(79)47(32(5)6)65(13)14/h17-19,21-22,30-36,38-43,46-49,68-69H,20,23-29H2,1-16H3,(H2,59,70)(H,60,74)(H,61,73)(H,62,72)(H,63,75)(H,64,71)/t35-,36+,38-,39-,40-,41-,42+,43-,46-,47-,48+,49-/m0/s1",JZYWSTGTBRHGTL-BIXXXADNSA-N,44255320,yes,Lyngbya,confervoides   ,n.a.
CyanoMetDB_0089,6-O-acetyl-?-cyclodextrin,,other cyclic non-peptide,linear depsipeptide,C44H72O36,1176.380329,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C5O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](OC6[C@@H]([C@H]([C@@H]([C@@H](CO)O6)OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)OC8[C@@H]([C@H]([C@@H]([C@@H](CO)O8)O5)O)O)O)O)O)O)[C@@H]1O,"InChI=1S/C44H72O36/c1-9(51)66-8-16-37-23(58)30(65)44(73-16)79-36-15(7-50)71-42(28(63)21(36)56)77-34-13(5-48)69-40(26(61)19(34)54)75-32-11(3-46)67-38(24(59)17(32)52)74-31-10(2-45)68-39(25(60)18(31)53)76-33-12(4-47)70-41(27(62)20(33)55)78-35-14(6-49)72-43(80-37)29(64)22(35)57/h10-50,52-65H,2-8H2,1H3/t10-,11-,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?,40?,41?,42?,43?,44?/m1/s1",HECSPEHQYGRENG-XHEUZJRWSA-N,146683726,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0090,"6-O-diacetyl(A,B)-?-cyclodextrin",,other cyclic non-peptide,linear depsipeptide,C46H74O37,1218.390893,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C5O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](OC6[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O6)OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)OC8[C@@H]([C@H]([C@@H]([C@@H](CO)O8)O5)O)O)O)O)O)O)[C@@H]1O,"InChI=1S/C46H74O37/c1-10(52)68-8-17-38-25(60)32(67)46(76-17)83-39-18(9-69-11(2)53)75-45(31(66)24(39)59)81-37-16(7-51)73-43(29(64)22(37)57)79-35-14(5-49)71-41(27(62)20(35)55)77-33-12(3-47)70-40(26(61)19(33)54)78-34-13(4-48)72-42(28(63)21(34)56)80-36-15(6-50)74-44(82-38)30(65)23(36)58/h12-51,54-67H,3-9H2,1-2H3/t12-,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?,46?/m1/s1",UCUNWKDZYBIYIT-CHTQTTGYSA-N,146683727,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0091,"6-O-triacetyl(A,B,D)-?-cyclodextrin",,other cyclic non-peptide,linear depsipeptide,C48H76O38,1260.401458,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C5O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2COC(C)=O)O[C@H](CO)[C@@H](OC6[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O6)OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)OC8[C@@H]([C@H]([C@@H]([C@@H](CO)O8)O5)O)O)O)O)O)O)[C@@H]1O,"InChI=1S/C48H76O38/c1-11(53)70-8-18-39-25(60)32(67)46(77-18)82-37-16(6-51)74-43(29(64)22(37)57)80-35-14(4-49)73-42(28(63)21(35)56)81-36-15(5-50)75-44(30(65)23(36)58)85-40-19(9-71-12(2)54)79-48(34(69)27(40)62)86-41-20(10-72-13(3)55)78-47(33(68)26(41)61)83-38-17(7-52)76-45(84-39)31(66)24(38)59/h14-52,56-69H,4-10H2,1-3H3/t14-,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?,46?,47?,48?/m1/s1",QODXNYIDQROXPI-BWHFUXPYSA-N,146683728,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0092,"6-O-triacetyl(A,B,E)-?-cyclodextrin",,other cyclic non-peptide,linear depsipeptide,C48H76O38,1260.401458,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C5O[C@@H]4CO)O[C@@H]3COC(C)=O)O[C@@H]2CO)O[C@H](CO)[C@@H](OC6[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O6)OC7[C@@H]([C@H]([C@@H]([C@@H](COC(C)=O)O7)OC8[C@@H]([C@H]([C@@H]([C@@H](CO)O8)O5)O)O)O)O)O)O)[C@@H]1O,"InChI=1S/C48H76O38/c1-11(53)70-8-18-39-25(60)32(67)46(77-18)82-37-16(6-51)73-42(28(63)21(37)56)81-36-15(5-50)76-45(31(66)24(36)59)85-40-19(9-71-12(2)54)79-48(34(69)27(40)62)86-41-20(10-72-13(3)55)78-47(33(68)26(41)61)83-38-17(7-52)74-43(29(64)22(38)57)80-35-14(4-49)75-44(84-39)30(65)23(35)58/h14-52,56-69H,4-10H2,1-3H3/t14-,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?,46?,47?,48?/m1/s1",GBARYFASYLCMEH-BWHFUXPYSA-N,146683729,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0093,?-cyclodextrin,,other cyclic non-peptide,linear depsipeptide,C48H80O40,1296.422587,O[C@H]1C(O[C@H]2[C@H](O)[C@@H](O)C(O[C@H]3[C@H](O)[C@@H](O)C(O[C@H]4[C@H](O)[C@@H](O)C(O[C@H]5[C@H](O)[C@@H](O)C(O[C@H]6[C@H](O)[C@@H](O)C(O[C@H]7[C@H](O)[C@@H](O)C8O[C@@H]7CO)O[C@@H]6CO)O[C@@H]5CO)O[C@@H]4CO)O[C@@H]3CO)O[C@@H]2CO)O[C@H](CO)[C@@H](OC9[C@@H]([C@H]([C@@H]([C@@H](CO)O9)O8)O)O)[C@@H]1O,"InChI=1S/C48H80O40/c49-1-9-33-17(57)25(65)41(73-9)82-34-10(2-50)75-43(27(67)19(34)59)84-36-12(4-52)77-45(29(69)21(36)61)86-38-14(6-54)79-47(31(71)23(38)63)88-40-16(8-56)80-48(32(72)24(40)64)87-39-15(7-55)78-46(30(70)22(39)62)85-37-13(5-53)76-44(28(68)20(37)60)83-35-11(3-51)74-42(81-33)26(66)18(35)58/h9-72H,1-8H2/t9-,10-,11-,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-,40-,41?,42?,43?,44?,45?,46?,47?,48?/m1/s1",GDSRMADSINPKSL-KFWIRYAQSA-N,121486197,yes (partly),Anabaena,n.a.,XSPORK2A
CyanoMetDB_0094,Viridisamide A,,other linear non-peptide,linear depsipeptide,C24H33N3O3S,443.2242631,C=CC(C)(C)NC(CC1=CC=CC=C1)C(NC(C2=NC(C(OC)=O)=CS2)C(C)CC)=O,"InChI=1S/C24H33N3O3S/c1-7-16(3)20(22-25-19(15-31-22)23(29)30-6)26-21(28)18(27-24(4,5)8-2)14-17-12-10-9-11-13-17/h8-13,15-16,18,20,27H,2,7,14H2,1,3-6H3,(H,26,28)",BHCCHKMYTWNSMQ-UHFFFAOYSA-N,,yes,Oscillatoria/Planktothrix,nigro-viridis ,PCC 7112
CyanoMetDB_0095,Aeruginosamide B,,Cyclamide,linear depsipeptide,C32H38N4O4S,574.2613769,C=CC(C)(C)N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CC2=CC=CC=C2)C(N3CCCC3C4=NC(C(OC)=O)=CS4)=O)=O,"InChI=1S/C32H38N4O4S/c1-5-32(2,3)35-24(19-22-13-8-6-9-14-22)28(37)33-25(20-23-15-10-7-11-16-23)30(38)36-18-12-17-27(36)29-34-26(21-41-29)31(39)40-4/h5-11,13-16,21,24-25,27,35H,1,12,17-20H2,2-4H3,(H,33,37)/t24-,25-,27?/m0/s1",JQFBTQXBHCKSHR-MVAOMIMOSA-N,,no,Microcystis,n.a.,PCC 9432
CyanoMetDB_0096,Aeruginosamide C,,other linear peptide,linear depsipeptide,C37H47N5O5S,673.3297908,C=CC(C)(C)N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CC2=CC=CC=C2)C(N3CCC[C@H]3C(N[C@@H](C4=NC(C(OC)=O)=CS4)C(C)C)=O)=O)=O,"InChI=1S/C37H47N5O5S/c1-7-37(4,5)41-27(21-25-15-10-8-11-16-25)32(43)38-28(22-26-17-12-9-13-18-26)35(45)42-20-14-19-30(42)33(44)40-31(24(2)3)34-39-29(23-48-34)36(46)47-6/h7-13,15-18,23-24,27-28,30-31,41H,1,14,19-22H2,2-6H3,(H,38,43)(H,40,44)/t27-,28-,30-,31+/m0/s1",VQKFDOYHMWYHTG-UOPKXQBNSA-N,,yes,Microcystis,n.a.,PCC 9432
CyanoMetDB_0097,Piricyclamide 7005E1,,other cyclic peptide,linear depsipeptide,C56H78N10O15S,1162.536883,OC(C[C@H](NC([C@H](C(C)C)NC(CNC([C@H](CO)NC([C@H](CCSC)N1[H])=O)=O)=O)=O)C(N[C@@H](CC(C=C2)=CC=C2OC/C=C(CC/C=C(C)/C)/C)C(N[C@@H](CC(C=C3)=CC=C3O)C(N[C@@H](CC(N)=O)C(N4CCC[C@H]4C1=O)=O)=O)=O)=O)=O,"InChI=1S/C56H78N10O15S/c1-31(2)9-7-10-33(5)20-23-81-37-18-14-35(15-19-37)26-39-51(75)60-40(25-34-12-16-36(68)17-13-34)52(76)63-42(27-45(57)69)56(80)66-22-8-11-44(66)54(78)59-38(21-24-82-6)50(74)64-43(30-67)49(73)58-29-46(70)65-48(32(3)4)55(79)62-41(28-47(71)72)53(77)61-39/h9,12-20,32,38-44,48,67-68H,7-8,10-11,21-30H2,1-6H3,(H2,57,69)(H,58,73)(H,59,78)(H,60,75)(H,61,77)(H,62,79)(H,63,76)(H,64,74)(H,65,70)(H,71,72)/b33-20-/t38-,39-,40-,41-,42-,43-,44-,48-/m0/s1",MBNLEZMNFKCZCT-LASRUHJTSA-N,146684880,yes,Microcystis,n.a.,PCC 7005
CyanoMetDB_0098,Piricyclamide 7005E1-M(O),,other cyclic peptide,,C56H78N10O16S,1178.531798,OC(C[C@H](NC([C@H](C(C)C)NC(CNC([C@H](CO)NC([C@H](CCS(C)=O)N1[H])=O)=O)=O)=O)C(N[C@@H](CC(C=C2)=CC=C2OC/C=C(CC/C=C(C)/C)/C)C(N[C@@H](CC(C=C3)=CC=C3O)C(N[C@@H](CC(N)=O)C(N4CCC[C@H]4C1=O)=O)=O)=O)=O)=O,"InChI=1S/C56H78N10O16S/c1-31(2)9-7-10-33(5)20-23-82-37-18-14-35(15-19-37)26-39-51(75)60-40(25-34-12-16-36(68)17-13-34)52(76)63-42(27-45(57)69)56(80)66-22-8-11-44(66)54(78)59-38(21-24-83(6)81)50(74)64-43(30-67)49(73)58-29-46(70)65-48(32(3)4)55(79)62-41(28-47(71)72)53(77)61-39/h9,12-20,32,38-44,48,67-68H,7-8,10-11,21-30H2,1-6H3,(H2,57,69)(H,58,73)(H,59,78)(H,60,75)(H,61,77)(H,62,79)(H,63,76)(H,64,74)(H,65,70)(H,71,72)/b33-20-/t38-,39-,40-,41-,42-,43-,44-,48-,83?/m0/s1",GTLMUNVPVPGMMM-BHZAYHJKSA-N,146684881,no,Microcystis,n.a.,PCC 7005
CyanoMetDB_0099,Grassystatin B,,other linear peptide,,C59H97N9O16,1187.705328,O=C(O[C@@H](C(C)C)C(O[C@H](C(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CC(N)=O)C(N[C@@H](CC(C)C)[C@@H](O)CC(N[C@@H]([C@H](O)C)C(N[C@@H](CC)C(N(C)[C@H](CC1=CC=CC=C1)C(N2[C@H](C(OC)=O)CCC2)=O)=O)=O)=O)=O)=O)=O)=O)[C@H](C(C)C)N(C)C,"InChI=1S/C59H97N9O16/c1-17-38(55(77)67(15)43(28-37-22-19-18-20-23-37)56(78)68-25-21-24-42(68)57(79)82-16)61-53(75)47(36(12)69)65-46(72)30-44(70)39(26-31(2)3)62-52(74)41(29-45(60)71)63-51(73)40(27-32(4)5)64-54(76)49(34(8)9)83-59(81)50(35(10)11)84-58(80)48(33(6)7)66(13)14/h18-20,22-23,31-36,38-44,47-50,69-70H,17,21,24-30H2,1-16H3,(H2,60,71)(H,61,75)(H,62,74)(H,63,73)(H,64,76)(H,65,72)/t36-,38+,39+,40+,41+,42+,43-,44+,47+,48+,49-,50+/m1/s1",ICOVQVRWYNMTQP-UXVOKYIZSA-N,44253976,yes,Lyngbya,confervoides   ,n.a.
CyanoMetDB_0100,Piricyclamide 7005E2,,other cyclic peptide,,C71H112N20O18,1532.846347,OC(C[C@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@](NC([C@H](CC1=CNC2=C1C=CC=C2)N3[H])=O)([H])[C@H](CC)C)=O)CC(C)C)=O)CC(C)C)=O)C)=O)C(NCC(N[C@@]([H])([C@@H](C)O)C(N[C@@H](CCCNC(N)=N)C(N4CCC[C@H]4C(N[C@@H](CCCCN[H])C(N[C@@H](CC(N)=O)C(N[C@H](C(N5CCC[C@H]5C3=O)=O)C)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C71H112N20O18/c1-10-37(6)56-67(106)87-47(29-36(4)5)63(102)84-46(28-35(2)3)61(100)79-38(7)58(97)83-50(32-55(95)96)59(98)78-34-54(94)88-57(40(9)92)68(107)82-45(21-15-25-76-71(74)75)70(109)91-27-17-23-52(91)65(104)81-44(20-13-14-24-72)60(99)85-49(31-53(73)93)62(101)80-39(8)69(108)90-26-16-22-51(90)66(105)86-48(64(103)89-56)30-41-33-77-43-19-12-11-18-42(41)43/h11-12,18-19,33,35-40,44-52,56-57,77,92H,10,13-17,20-32,34,72H2,1-9H3,(H2,73,93)(H,78,98)(H,79,100)(H,80,101)(H,81,104)(H,82,107)(H,83,97)(H,84,102)(H,85,99)(H,86,105)(H,87,106)(H,88,94)(H,89,103)(H,95,96)(H4,74,75,76)/t37-,38-,39-,40+,44-,45-,46-,47-,48-,49-,50-,51-,52-,56-,57-/m0/s1",PNRKJHCHLDBNFZ-UOFFNAEQSA-N,146684882,no,Microcystis,n.a.,PCC 7005
CyanoMetDB_0101,Piricyclamide 7005E3,,other cyclic peptide,,C66H94N14O20S,1434.648952,OC(CC[C@@H](NC([C@H](CC(N)=O)N1[H])=O)C(N[C@H](C(N[C@@H](CCSC)C(N[C@@H](CCC(N)=O)C(N[C@@]([H])([C@@H](C)O)C(NCC(N[C@@H](CO)C(N[C@@H](CC(C=C2)=CC=C2O)C(N[C@@H](CO)C(NCC(N3CCC[C@H]3C1=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)CC4=CC=CC=C4)=O)=O.C/C=C(C)/CC/C=C(C)/C,"InChI=1S/C56H78N14O20S.C10H18/c1-28(73)46-56(90)59-24-43(77)61-39(27-72)54(88)66-36(22-30-10-12-31(74)13-11-30)52(86)68-38(26-71)47(81)60-25-44(78)70-19-6-9-40(70)55(89)67-37(23-42(58)76)53(87)63-33(15-17-45(79)80)48(82)65-35(21-29-7-4-3-5-8-29)51(85)64-34(18-20-91-2)49(83)62-32(50(84)69-46)14-16-41(57)75;1-5-10(4)8-6-7-9(2)3/h3-5,7-8,10-13,28,32-40,46,71-74H,6,9,14-27H2,1-2H3,(H2,57,75)(H2,58,76)(H,59,90)(H,60,81)(H,61,77)(H,62,83)(H,63,87)(H,64,85)(H,65,82)(H,66,88)(H,67,89)(H,68,86)(H,69,84)(H,79,80);5,7H,6,8H2,1-4H3/b;10-5+/t28-,32+,33-,34+,35+,36+,37+,38+,39+,40+,46+;/m1./s1",KVVDLEALZYVHON-LCFRYKHNSA-N,,no,Microcystis,n.a.,PCC 7005
CyanoMetDB_0102,Piricyclamide 7005E3-M(O),,other cyclic peptide,,C66H94N14O21S,1450.643867,OC(CC[C@H](C(N[C@@H](CC1=CC=CC=C1)C(N[C@H](C(N[C@H](C(N[C@@]([C@H](O)C)(C(NCC(N[C@H](C(N[C@H](C(N[C@H](C(NCC(N2CCC[C@H]2C3=O)=O)=O)CO)=O)CC4=CC=C(O)C=C4)=O)CO)=O)=O)[H])=O)CCC(N)=O)=O)CCS(C)=O)=O)=O)NC([C@@H](N3[H])CC(N)=O)=O)=O.C/C=C(CC/C=C(C)/C)\C,"InChI=1S/C56H78N14O21S.C10H18/c1-28(73)46-56(90)59-24-43(77)61-39(27-72)54(88)66-36(22-30-10-12-31(74)13-11-30)52(86)68-38(26-71)47(81)60-25-44(78)70-19-6-9-40(70)55(89)67-37(23-42(58)76)53(87)63-33(15-17-45(79)80)48(82)65-35(21-29-7-4-3-5-8-29)51(85)64-34(18-20-92(2)91)49(83)62-32(50(84)69-46)14-16-41(57)75;1-5-10(4)8-6-7-9(2)3/h3-5,7-8,10-13,28,32-40,46,71-74H,6,9,14-27H2,1-2H3,(H2,57,75)(H2,58,76)(H,59,90)(H,60,81)(H,61,77)(H,62,83)(H,63,87)(H,64,85)(H,65,82)(H,66,88)(H,67,89)(H,68,86)(H,69,84)(H,79,80);5,7H,6,8H2,1-4H3/b;10-5+/t28-,32+,33-,34+,35+,36+,37+,38+,39+,40+,46+,92?;/m1./s1",IXJTZTKXKNKIQP-WFVTYMKUSA-N,,no,Microcystis,n.a.,PCC 7005
CyanoMetDB_0103,Piricyclamide 7005E4,,other cyclic peptide,,C61H88N14O18S2,1368.584244,OC(C[C@H](NC([C@H](CSSC[C@@H]1C(N[C@@H](CC2=CC=C(O)C=C2)C(N3CCC[C@H]3C4=O)=O)=O)NC([C@@H](NC([C@]([C@H](O)C)([H])N4[H])=O)CC5=CC=CC=C5)=O)=O)C(N[C@H](C(N[C@H](C(N[C@@]([H])([C@@H](C)O)C(N[C@H](CCCCN[H])C(N[C@@H](CCC(N)=O)C(N1)=O)=O)=O)=O)C)=O)CC(C)C)=O)=O,"InChI=1S/C61H88N14O18S2/c1-30(2)24-39-53(85)64-31(3)50(82)73-48(32(4)76)59(91)66-37(14-9-10-22-62)51(83)65-38(20-21-46(63)79)52(84)71-44-29-95-94-28-43(56(88)68-41(27-47(80)81)55(87)67-39)72-54(86)40(25-34-12-7-6-8-13-34)69-60(92)49(33(5)77)74-58(90)45-15-11-23-75(45)61(93)42(70-57(44)89)26-35-16-18-36(78)19-17-35/h6-8,12-13,16-19,30-33,37-45,48-49,76-78H,9-11,14-15,20-29,62H2,1-5H3,(H2,63,79)(H,64,85)(H,65,83)(H,66,91)(H,67,87)(H,68,88)(H,69,92)(H,70,89)(H,71,84)(H,72,86)(H,73,82)(H,74,90)(H,80,81)/t31-,32+,33+,37+,38-,39-,40-,41-,42-,43-,44+,45-,48-,49+/m0/s1",XARKTZSFRNJZPJ-FREXBYPZSA-N,146684884,no,Microcystis,n.a.,PCC 7005
CyanoMetDB_0104,Piricyclamide TLGCMNGTERCLGLP,,other cyclic peptide,,C63H105N19O20S3,1543.69454,OC(CC[C@H](NC([C@]([H])([C@@H](C)O)NC(CNC([C@H](CC(N)=O)NC([C@H](CCSC)NC([C@@H](CSSC[C@H]1C(N[C@H](C(NCC(N[C@H](C(N2CCC[C@H]2C3=O)=O)CC(C)C)=O)=O)CC(C)C)=O)NC(CNC([C@@H](NC([C@@]([C@H](O)C)([H])N3[H])=O)CC(C)C)=O)=O)=O)=O)=O)=O)=O)C(N[C@@H](CCCNC(N)=N)C(N1)=O)=O)=O,"InChI=1S/C63H105N19O20S3/c1-29(2)20-37-51(91)68-24-45(86)71-40(22-31(5)6)62(102)82-18-11-13-43(82)59(99)81-50(33(8)84)61(101)78-38(21-30(3)4)52(92)69-25-46(87)72-41-27-104-105-28-42(58(98)76-37)79-54(94)34(12-10-17-67-63(65)66)73-55(95)35(14-15-48(89)90)75-60(100)49(32(7)83)80-47(88)26-70-53(93)39(23-44(64)85)77-56(96)36(16-19-103-9)74-57(41)97/h29-43,49-50,83-84H,10-28H2,1-9H3,(H2,64,85)(H,68,91)(H,69,92)(H,70,93)(H,71,86)(H,72,87)(H,73,95)(H,74,97)(H,75,100)(H,76,98)(H,77,96)(H,78,101)(H,79,94)(H,80,88)(H,81,99)(H,89,90)(H4,65,66,67)/t32-,33-,34+,35+,36+,37+,38+,39+,40+,41-,42+,43+,49+,50+/m1/s1",CCULVWMSKMCNLG-UUKVWBFRSA-N,146684890,no,Microcystis,Izancya ,36 and 41
CyanoMetDB_0105,Piricyclamide TLGCM(O)NGTERCLGLP,,other cyclic peptide,,C63H105N19O21S3,1559.69,O=C(N[C@@H](CC(C)C)C(NCC(N[C@H](C(N[C@H](C(N[C@H](C(NCC(N[C@]([H])(C(N[C@H](C(N[C@H](C(N1)=O)CCCNC(N)=N)=O)CCC(O)=O)=O)[C@@H](C)O)=O)=O)CC(N)=O)=O)CCS(C)=O)=O)CSSC[C@H]1C(N[C@@H](CC(C)C)C(NCC(N[C@@H](CC(C)C)C(N2CCC[C@H]2C3=O)=O)=O)=O)=O)=O)=O)[C@]([H])(N3[H])[C@@H](C)O,"InChI=1S/C62H103N19O21S3/c1-28(2)19-36-50(90)67-23-44(85)70-39(21-30(5)6)61(101)81-17-10-12-42(81)58(98)80-49(32(8)83)60(100)77-37(20-29(3)4)51(91)68-24-45(86)71-40-26-104-105-27-41(57(97)75-36)78-53(93)33(11-9-16-66-62(64)65)72-54(94)34(13-14-47(88)89)74-59(99)48(31(7)82)79-46(87)25-69-52(92)38(22-43(63)84)76-55(95)35(15-18-103-102)73-56(40)96/h28-42,48-49,82-83,103H,9-27H2,1-8H3,(H2,63,84)(H,67,90)(H,68,91)(H,69,92)(H,70,85)(H,71,86)(H,72,94)(H,73,96)(H,74,99)(H,75,97)(H,76,95)(H,77,100)(H,78,93)(H,79,87)(H,80,98)(H,88,89)(H4,64,65,66)/t31-,32-,33+,34+,35+,36+,37+,38+,39+,40-,41+,42+,48+,49+/m1/s1",HKTGOHWWTGIELG-LCMDXHSNSA-N,,no,Microcystis,Izancya ,36 and 41
CyanoMetDB_0106,Piricyclamide GTHLYTITP,,other cyclic peptide,,C46H69N11O13,983.5076313,O=C(CN1[H])N[C@@]([H])([C@@H](C)O)C(N[C@@H](CC2=CNC=N2)C(N[C@H](C(N[C@@H](CC(C=C3)=CC=C3O)C(N[C@@]([H])([C@@H](C)O)C(N[C@@](C(N[C@@]([H])([C@@H](C)O)C(N4CCC[C@H]4C1=O)=O)=O)([H])[C@H](CC)C)=O)=O)=O)CC(C)C)=O)=O,"InChI=1S/C46H69N11O13/c1-8-23(4)35-43(67)56-38(26(7)60)46(70)57-15-9-10-33(57)42(66)48-20-34(62)53-36(24(5)58)44(68)52-32(18-28-19-47-21-49-28)40(64)50-30(16-22(2)3)39(63)51-31(17-27-11-13-29(61)14-12-27)41(65)55-37(25(6)59)45(69)54-35/h11-14,19,21-26,30-33,35-38,58-61H,8-10,15-18,20H2,1-7H3,(H,47,49)(H,48,66)(H,50,64)(H,51,63)(H,52,68)(H,53,62)(H,54,69)(H,55,65)(H,56,67)/t23-,24+,25+,26+,30-,31-,32-,33-,35-,36-,37-,38-/m0/s1",IDMPBPQZEDEBJM-BUGBWIRWSA-N,146684886,no,Microcystis,n.a.,SYKE 764
CyanoMetDB_0107,Piricyclamide ILGEGEGWNYNP+prenyl,,other cyclic peptide,,C66H91N15O19,1397.661566,OC(CC[C@H](NC(CNC([C@@H](NC([C@](N1[H])([H])[C@@H](C)CC)=O)CC(C)C)=O)=O)C(NCC(N[C@@H](CCC(O)=O)C(NCC(N[C@@H](CC2=CNC3=C2C=CC=C3)C(N[C@@H](CC(N)=O)C(N[C@@H](CC(C=C4)=CC=C4O)C(N[C@@H](CC(N)=O)C(N5CCC[C@H]5C1=O)=O)=O)=O)=O)=O)=O)=O)=O)=O.C/C=C(C)/C,"InChI=1S/C61H83N15O19.C5H10/c1-5-31(4)52-60(94)73-39(21-30(2)3)55(89)67-28-48(81)69-37(16-18-50(83)84)53(87)65-27-47(80)68-38(17-19-51(85)86)54(88)66-29-49(82)70-41(23-33-26-64-36-10-7-6-9-35(33)36)57(91)72-42(24-45(62)78)58(92)71-40(22-32-12-14-34(77)15-13-32)56(90)74-43(25-46(63)79)61(95)76-20-8-11-44(76)59(93)75-52;1-4-5(2)3/h6-7,9-10,12-15,26,30-31,37-44,52,64,77H,5,8,11,16-25,27-29H2,1-4H3,(H2,62,78)(H2,63,79)(H,65,87)(H,66,88)(H,67,89)(H,68,80)(H,69,81)(H,70,82)(H,71,92)(H,72,91)(H,73,94)(H,74,90)(H,75,93)(H,83,84)(H,85,86);4H,1-3H3/t31-,37-,38-,39-,40-,41-,42-,43-,44-,52-;/m0./s1",ISLPJGXMCVHZFD-QFYBDREESA-N,,no,Microcystis,n.a.,SYKE 764
CyanoMetDB_0108,Piricyclamide FAIFLLLP,,other cyclic peptide,,C50H74N8O8,914.5629614,O=C([C@@H](N1[H])CC2=CC=CC=C2)N[C@H](C(N[C@@](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N3CCC[C@H]3C1=O)=O)CC(C)C)=O)CC(C)C)=O)CC(C)C)=O)CC4=CC=CC=C4)=O)([H])[C@H](CC)C)=O)C,"InChI=1S/C50H74N8O8/c1-10-32(8)42-49(65)55-39(28-35-20-15-12-16-21-35)47(63)53-36(24-29(2)3)45(61)52-37(25-30(4)5)46(62)56-40(26-31(6)7)50(66)58-23-17-22-41(58)48(64)54-38(27-34-18-13-11-14-19-34)44(60)51-33(9)43(59)57-42/h11-16,18-21,29-33,36-42H,10,17,22-28H2,1-9H3,(H,51,60)(H,52,61)(H,53,63)(H,54,64)(H,55,65)(H,56,62)(H,57,59)/t32-,33-,36-,37-,38-,39-,40-,41-,42-/m0/s1",PSONGBSQTWWKPY-RCWXPUQQSA-N,146684885,no,Microcystis,Izancya ,42
CyanoMetDB_0109,Piricyclamide SQWGWRGLSDP,,other cyclic peptide,,C58H79N17O16,1269.58907,OC(C[C@H](NC([C@H](CO)NC([C@@H](NC(CNC([C@H](CCCNC(N)=N)NC([C@H](CC1=CNC2=C1C=CC=C2)NC(CNC([C@H](CC3=CNC4=C3C=CC=C4)NC([C@H](CCC(N)=O)NC([C@@H](CO)N5[H])=O)=O)=O)=O)=O)=O)=O)CC(C)C)=O)=O)C(N6CCC[C@H]6C5=O)=O)=O,"InChI=1S/C58H79N17O16/c1-29(2)19-38-52(86)73-42(27-76)55(89)72-41(22-48(81)82)57(91)75-18-8-14-44(75)56(90)74-43(28-77)54(88)70-37(15-16-45(59)78)51(85)71-39(20-30-23-63-34-11-5-3-9-32(30)34)50(84)66-26-47(80)68-40(21-31-24-64-35-12-6-4-10-33(31)35)53(87)69-36(13-7-17-62-58(60)61)49(83)65-25-46(79)67-38/h3-6,9-12,23-24,29,36-44,63-64,76-77H,7-8,13-22,25-28H2,1-2H3,(H2,59,78)(H,65,83)(H,66,84)(H,67,79)(H,68,80)(H,69,87)(H,70,88)(H,71,85)(H,72,89)(H,73,86)(H,74,90)(H,81,82)(H4,60,61,62)/t36-,37-,38-,39-,40-,41-,42-,43+,44-/m0/s1",JZZUYXCMSCYHMW-YSUREIBVSA-N,146684888,no,Microcystis,n.a.,SYKE 764
CyanoMetDB_0110,Ambiguine A isonitrile,,other linear non-peptide,,C26H31ClN2,406.2175767,CC1(C)C2=C3C(NC(C(C)(C=C)C)=C3[C@@]4([H])[C@@H]([N+]#[C-])[C@@](C)(C=C)[C@H](Cl)C[C@@]41[H])=CC=C2,"InChI=1S/C26H31ClN2/c1-9-24(3,4)22-21-19-15(12-11-13-17(19)29-22)25(5,6)16-14-18(27)26(7,10-2)23(28-8)20(16)21/h9-13,16,18,20,23,29H,1-2,14H2,3-7H3/t16-,18+,20-,23?,26-/m0/s1",GHYIJWADNLIVDB-UMIISBCRSA-N,21610112,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_0111,Grassystatin C,,other linear peptide,,C50H82N8O12,986.6052201,O[C@H]([C@@H](C)CC)C(N[C@@H](CC(C)C)C(N(C)[C@@H](CCC(N)=O)C(N[C@@H](CC(C)C)[C@@H](O)CC(N[C@@H]([C@H](CC)C)C(NCC(N(C)[C@H](CC1=CC=CC=C1)C(N2[C@H](C(OC)=O)CCC2)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C50H82N8O12/c1-12-31(7)43(46(65)52-28-42(62)56(9)38(26-33-18-15-14-16-19-33)49(68)58-23-17-20-37(58)50(69)70-11)55-41(61)27-39(59)34(24-29(3)4)53-45(64)36(21-22-40(51)60)57(10)48(67)35(25-30(5)6)54-47(66)44(63)32(8)13-2/h14-16,18-19,29-32,34-39,43-44,59,63H,12-13,17,20-28H2,1-11H3,(H2,51,60)(H,52,65)(H,53,64)(H,54,66)(H,55,61)/t31-,32-,34-,35-,36-,37-,38+,39-,43-,44+/m0/s1",CRTPOZWNLFMWPB-YQGVOMCUSA-N,44253975,yes,Lyngbya,confervoides   ,n.a.
CyanoMetDB_0112,Aeruginosin NOL1,,Aeruginosin,,C26H40N6O6,532.300933,CC(N[C@@H](CC1=CC=C(O)C=C1)C(N2[C@H](C(NC(CO)CCCNC(N)=N)=O)C[C@H]3[C@@H]2CC(O)CC3)=O)=O,"InChI=1S/C26H40N6O6/c1-15(34)30-21(11-16-4-7-19(35)8-5-16)25(38)32-22-13-20(36)9-6-17(22)12-23(32)24(37)31-18(14-33)3-2-10-29-26(27)28/h4-5,7-8,17-18,20-23,33,35-36H,2-3,6,9-14H2,1H3,(H,30,34)(H,31,37)(H4,27,28,29)/t17-,18?,20?,21-,22-,23-/m0/s1",KOYXPKZSNNFPER-CUTKURBCSA-N,146683739,no,Nodularia,spumigena,"AV1, CY9414 and CH307"
CyanoMetDB_0113,Aeruginosin NOL2,,Aeruginosin,,C28H44N6O6,560.3322332,O=C(N[C@@H](CC1=CC=C(O)C=C1)C(N2[C@H](C(NC(CO)CCCNC(N)=N)=O)C[C@H]3[C@@H]2CC(O)CC3)=O)CCC,"InChI=1S/C28H44N6O6/c1-2-4-25(38)33-22(13-17-6-9-20(36)10-7-17)27(40)34-23-15-21(37)11-8-18(23)14-24(34)26(39)32-19(16-35)5-3-12-31-28(29)30/h6-7,9-10,18-19,21-24,35-37H,2-5,8,11-16H2,1H3,(H,32,39)(H,33,38)(H4,29,30,31)/t18-,19?,21?,22-,23-,24-/m0/s1",ANEUECWYDFNRPB-FYNJCVRDSA-N,146683740,no,Nodularia,spumigena,"AV1, CY9414 and CH307"
CyanoMetDB_0114,Nostosin C,,other linear peptide,,C22H35N5O4,433.2689046,OC(C=C1)=CC=C1CCCC(N[C@@H]([C@@H](C)CC)C(N[C@H](C=O)CCCNC(N)=N)=O)=O,"InChI=1S/C22H35N5O4/c1-3-15(2)20(21(31)26-17(14-28)7-5-13-25-22(23)24)27-19(30)8-4-6-16-9-11-18(29)12-10-16/h9-12,14-15,17,20,29H,3-8,13H2,1-2H3,(H,26,31)(H,27,30)(H4,23,24,25)/t15-,17-,20-/m0/s1",QJGKRJNQRBRVMM-KNBMTAEXSA-N,146683694,no,Nostoc,n.a.,FSN
CyanoMetDB_0115,Nostosin D,,other linear peptide,,C21H33N5O5,435.2481692,OC(C=C1)=CC=C1CCC(O)C(NC(C(C)C)C(N[C@H](C=O)CCCNC(N)=N)=O)=O,"InChI=1S/C21H33N5O5/c1-13(2)18(20(31)25-15(12-27)4-3-11-24-21(22)23)26-19(30)17(29)10-7-14-5-8-16(28)9-6-14/h5-6,8-9,12-13,15,17-18,28-29H,3-4,7,10-11H2,1-2H3,(H,25,31)(H,26,30)(H4,22,23,24)/t15-,17?,18?/m0/s1",GIWXUZBXVFQIOQ-ZLPCBKJTSA-N,146683695,no,Nostoc,n.a.,FSN
CyanoMetDB_0116,Nostosin E,,other linear peptide,,C22H37N5O4,435.2845547,OC(C=C1)=CC=C1CCCC(N[C@@H]([C@@H](C)CC)C(N[C@H](CO)CCCNC(N)=N)=O)=O,"InChI=1S/C22H37N5O4/c1-3-15(2)20(21(31)26-17(14-28)7-5-13-25-22(23)24)27-19(30)8-4-6-16-9-11-18(29)12-10-16/h9-12,15,17,20,28-29H,3-8,13-14H2,1-2H3,(H,26,31)(H,27,30)(H4,23,24,25)/t15-,17-,20-/m0/s1",ARPVOKGUKHKXHI-KNBMTAEXSA-N,146683696,no,Nostoc,n.a.,FSN
CyanoMetDB_0117,Nostosin F,,other linear peptide,,C21H35N5O5,437.2638192,OC(C=C1)=CC=C1CCC(O)C(NC(C(C)C)C(N[C@H](CO)CCCNC(N)=N)=O)=O,"InChI=1S/C21H35N5O5/c1-13(2)18(20(31)25-15(12-27)4-3-11-24-21(22)23)26-19(30)17(29)10-7-14-5-8-16(28)9-6-14/h5-6,8-9,13,15,17-18,27-29H,3-4,7,10-12H2,1-2H3,(H,25,31)(H,26,30)(H4,22,23,24)/t15-,17?,18?/m0/s1",WFCKWHXGWWUNJB-ZLPCBKJTSA-N,146683697,no,Nostoc,n.a.,FSN
CyanoMetDB_0118,Pseudoaeruginosin NS2,,other linear peptide,,C27H44N6O5,532.3373185,C[C@@H]1CN(C([C@H](CC2=CC=C(O)C=C2)NC(CCCCC)=O)=O)[C@H](C(NC(CO)CCCNC(N)=N)=O)C1,"InChI=1S/C27H44N6O5/c1-3-4-5-8-24(36)32-22(15-19-9-11-21(35)12-10-19)26(38)33-16-18(2)14-23(33)25(37)31-20(17-34)7-6-13-30-27(28)29/h9-12,18,20,22-23,34-35H,3-8,13-17H2,1-2H3,(H,31,37)(H,32,36)(H4,28,29,30)/t18-,20?,22-,23-/m0/s1",FWZWNDYYSSVPMN-JLWWHIBLSA-N,146683669,yes,Nodularia,n.a.,AV1
CyanoMetDB_0119,23-Ac-tolytoxin A,,other linear non-peptide,,C48H77NO14,891.5344062,CC(C(C(C)C(OC(C)=O)C(C)CCC(C(C)C(OC)C(C)/C=C/N(C([H])=O)C)=O)O1)C(OC)CC(OC)C2(CO2)C(OC)CC3OC(CC(OC)C(O)/C=C(C)/C=C/C1=O)C=CC3,"InChI=1S/C48H77NO14/c1-29-17-20-44(54)63-47(34(6)46(61-35(7)51)30(2)18-19-38(52)32(4)45(59-13)31(3)21-22-49(8)28-50)33(5)40(55-9)26-43(58-12)48(27-60-48)42(57-11)25-37-16-14-15-36(62-37)24-41(56-10)39(53)23-29/h14-15,17,20-23,28,30-34,36-37,39-43,45-47,53H,16,18-19,24-27H2,1-13H3/b20-17+,22-21+,29-23+",XRFUHBYDYDAOID-SOQXAOFBSA-N,10605718,yes,n.a.,n.a.,n.a.
CyanoMetDB_0120,6-OH-scytophycin B,,other cyclic non-peptide,,C45H73NO13,835.5081914,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)[C@@H](O)/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]3(OC3)[C@@H](OC)C2)=O,"InChI=1S/C45H73NO13/c1-27-15-18-41(51)59-44(32(6)42(52)28(2)16-17-35(48)30(4)43(56-11)29(3)19-20-46(7)26-47)31(5)38(53-8)24-40(55-10)45(25-57-45)39(54-9)23-34-14-12-13-33(58-34)22-37(50)36(49)21-27/h12-13,15,18-21,26,28-34,36-40,42-44,49-50,52H,14,16-17,22-25H2,1-11H3/b18-15+,20-19+,27-21+/t28-,29+,30-,31-,32-,33-,34-,36-,37+,38+,39-,40-,42-,43+,44-,45-/m0/s1",ZTRATTIWNXCURD-YRCXACEXSA-N,6449864,yes,Scytonema,n.a.,n.a.
CyanoMetDB_0121,7-Ac-scytophycin B,,other cyclic non-peptide,,C47H75NO13,861.5238415,CC(/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]1(OC1)[C@@H](OC)C2)=O)=C\C[C@H](OC(C)=O)C[C@]3([H])C=CC[C@]2([H])O3,"InChI=1S/C47H75NO13/c1-29-16-19-38(59-35(7)50)24-36-14-13-15-37(60-36)25-41(55-10)47(27-58-47)42(56-11)26-40(54-9)33(5)46(61-43(52)21-17-29)34(6)44(53)30(2)18-20-39(51)32(4)45(57-12)31(3)22-23-48(8)28-49/h13-14,16-17,21-23,28,30-34,36-38,40-42,44-46,53H,15,18-20,24-27H2,1-12H3/b21-17+,23-22+,29-16+/t30-,31+,32-,33-,34-,36-,37-,38-,40+,41-,42-,44-,45+,46-,47-/m0/s1",HGFMDHSRILZYKW-ZZKPJCGTSA-N,,yes,Scytonema,pseudo hofmannii Bharadwaja,n.a.
CyanoMetDB_0122,Hassallidin A,,other cyclic peptide,other cyclic depsipeptide,C62H99N11O24,1381.686443,O=C(NC(C(O)C)C(NC(C(C)OC1=O)C(NC(C(C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CCC(N)=O)=O)C(C)OC2[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O2)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC3=CC=C(O)C=C3)=O)=O)=O)C(O)C(O)CCCCCCCCCCC,"InChI=1S/C62H99N11O24/c1-8-10-11-12-13-14-15-16-17-18-40(78)49(82)60(93)71-46(31(4)76)57(90)72-47-32(5)95-61(94)38(24-26-43(64)80)68-59(92)48(33(6)96-62-52(85)51(84)50(83)41(29-74)97-62)73(7)44(81)28-65-53(86)37(23-25-42(63)79)67-54(87)36(9-2)66-55(88)39(27-34-19-21-35(77)22-20-34)69-56(89)45(30(3)75)70-58(47)91/h9,19-22,30-33,37-41,45-52,62,74-78,82-85H,8,10-18,23-29H2,1-7H3,(H2,63,79)(H2,64,80)(H,65,86)(H,66,88)(H,67,87)(H,68,92)(H,69,89)(H,70,91)(H,71,93)(H,72,90)/b36-9-/t30?,31?,32?,33?,37-,38+,39-,40?,41+,45?,46?,47?,48?,49?,50+,51-,52-,62?/m1/s1",TZKSEIAJQMPEJX-TZSXGBMXSA-N,,yes,Hassallia,n.a.,n.a.
CyanoMetDB_0123,7-OMe-scytophycin B,,other cyclic non-peptide,,C46H75NO12,833.5289269,CC(/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]1(OC1)[C@@H](OC)C2)=O)=C\C[C@H](OC)C[C@]3([H])C=CC[C@]2([H])O3,"InChI=1S/C46H75NO12/c1-29-16-19-35(52-8)24-36-14-13-15-37(58-36)25-40(54-10)46(27-57-46)41(55-11)26-39(53-9)33(5)45(59-42(50)21-17-29)34(6)43(51)30(2)18-20-38(49)32(4)44(56-12)31(3)22-23-47(7)28-48/h13-14,16-17,21-23,28,30-37,39-41,43-45,51H,15,18-20,24-27H2,1-12H3/b21-17+,23-22+,29-16+/t30-,31+,32-,33-,34-,35-,36-,37-,39+,40-,41-,43-,44+,45-,46-/m0/s1",KCNFUDIOBWGOFU-OMSORFKMSA-N,,no,Nostoc,n.a.,May-96
CyanoMetDB_0124,19-O-deMe-scytophycin C,,other cyclic non-peptide,,C44H73NO11,791.5183622,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)C/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](O)C[C@H](OC)[C@H](C)[C@@H](OC)C2)=O,"InChI=1S/C44H73NO11/c1-27-15-18-34(47)23-35-13-12-14-36(55-35)24-39(52-9)32(6)40(53-10)25-38(49)31(5)44(56-41(50)20-16-27)33(7)42(51)28(2)17-19-37(48)30(4)43(54-11)29(3)21-22-45(8)26-46/h12-13,15-16,20-22,26,28-36,38-40,42-44,47,49,51H,14,17-19,23-25H2,1-11H3/b20-16+,22-21+,27-15+/t28-,29+,30-,31-,32+,33-,34-,35-,36-,38+,39-,40-,42-,43+,44-/m0/s1",MVOGRRKBWLHPTF-FUNNEDHOSA-N,23428136,yes,Scytonema,n.a.,n.a.
CyanoMetDB_0125,6-OH-7-OMe-scytophycin E,,other cyclic non-peptide,,C46H77NO13,851.5394915,CC(/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@H](CO)[C@@H](OC)C1)=O)=C\[C@H](O)[C@H](OC)C[C@]2([H])C=CC[C@]1([H])O2,"InChI=1S/C46H77NO13/c1-28-16-19-43(52)60-46(33(6)44(53)29(2)17-18-37(50)31(4)45(58-12)30(3)20-21-47(7)27-49)32(5)39(54-8)25-41(56-10)36(26-48)40(55-9)23-34-14-13-15-35(59-34)24-42(57-11)38(51)22-28/h13,15-16,19-22,27,29-36,38-42,44-46,48,51,53H,14,17-18,23-26H2,1-12H3/b19-16+,21-20+,28-22+/t29-,30+,31-,32-,33-,34-,35-,36+,38-,39+,40-,41-,42+,44-,45+,46-/m0/s1",HKSURPHWRMGDOZ-NKHCFBCYSA-N,14782637,yes,Scytonema,n.a.,n.a.
CyanoMetDB_0126,6-OH-scytophycin D/E,,other cyclic non-peptide,,C45H75NO13,837.5238415,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)[C@@H](O)/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@H](CO)[C@@H](OC)C2)=O.O[C@H](C[C@]3([H])C=CC[C@]4([H])O3)[C@@H](O)/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@](C)(O)[C@@H](OC)C4)=O,"InChI=1S/2C45H75NO13/c1-27-16-19-41(51)59-44(32(6)42(52)28(2)17-18-35(48)30(4)43(57-12)29(3)20-21-46(8)26-47)31(5)38(54-9)25-40(56-11)45(7,53)39(55-10)24-34-15-13-14-33(58-34)23-37(50)36(49)22-27;1-27-15-18-42(52)59-45(32(6)43(53)28(2)16-17-36(49)30(4)44(57-11)29(3)19-20-46(7)26-48)31(5)39(54-8)24-41(56-10)35(25-47)40(55-9)23-34-14-12-13-33(58-34)22-38(51)37(50)21-27/h13-14,16,19-22,26,28-34,36-40,42-44,49-50,52-53H,15,17-18,23-25H2,1-12H3;12-13,15,18-21,26,28-35,37-41,43-45,47,50-51,53H,14,16-17,22-25H2,1-11H3/b19-16+,21-20+,27-22+;18-15+,20-19+,27-21+/t28-,29+,30-,31-,32-,33-,34-,36-,37+,38+,39-,40-,42-,43+,44-,45-;28-,29+,30-,31-,32-,33-,34-,35+,37-,38+,39+,40-,41-,43-,44+,45-/m00/s1",IZFWMVSTQLYDFQ-FZGPPDHXSA-N,,no,Nostoc,n.a.,May-96
CyanoMetDB_0127,7-OMe-19-deMe-scytophycin D/E,,other cyclic non-peptide,,C45H75NO12,821.5289268,CC(/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](O)C[C@H](OC)[C@H](CO)[C@@H](OC)C1)=O)=C\C[C@H](OC)C[C@]2([H])C=CC[C@]1([H])O2.CC(/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](O)C[C@H](OC)[C@@](C)(O)[C@@H](OC)C3)=O)=C\C[C@H](OC)C[C@]4([H])C=CC[C@]3([H])O4,"InChI=1S/2C45H75NO12/c1-28-16-19-34(53-9)24-35-14-13-15-36(57-35)25-39(54-10)45(7,52)40(55-11)26-38(49)32(5)44(58-41(50)21-17-28)33(6)42(51)29(2)18-20-37(48)31(4)43(56-12)30(3)22-23-46(8)27-47;1-28-15-18-34(53-8)23-35-13-12-14-36(57-35)24-40(54-9)37(26-47)41(55-10)25-39(50)32(5)45(58-42(51)20-16-28)33(6)43(52)29(2)17-19-38(49)31(4)44(56-11)30(3)21-22-46(7)27-48/h13-14,16-17,21-23,27,29-36,38-40,42-44,49,51-52H,15,18-20,24-26H2,1-12H3;12-13,15-16,20-22,27,29-37,39-41,43-45,47,50,52H,14,17-19,23-26H2,1-11H3/b21-17+,23-22+,28-16+;20-16+,22-21+,28-15+/t29-,30+,31-,32-,33-,34-,35-,36-,38+,39-,40-,42-,43+,44-,45-;29-,30+,31-,32-,33-,34-,35-,36-,37+,39+,40-,41-,43-,44+,45-/m00/s1",BSBBBPXMBNMOCM-VRGPUQHYSA-N,,no,Nostoc,n.a.,May-96
CyanoMetDB_0128,6-OH-7-Ome-15-O-deMe-scytophycin B,,other cyclic non-peptide,,C45H73NO13,835.5081914,CC(/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]1(OC1)[C@@H](O)C2)=O)=C\[C@H](O)[C@H](OC)C[C@]3([H])C=CC[C@]2([H])O3,"InChI=1S/C45H73NO13/c1-27-15-18-41(51)59-44(32(6)42(52)28(2)16-17-35(48)30(4)43(56-11)29(3)19-20-46(7)26-47)31(5)37(53-8)24-40(55-10)45(25-57-45)39(50)23-34-14-12-13-33(58-34)22-38(54-9)36(49)21-27/h12-13,15,18-21,26,28-34,36-40,42-44,49-50,52H,14,16-17,22-25H2,1-11H3/b18-15+,20-19+,27-21+/t28-,29+,30-,31-,32-,33-,34-,36-,37+,38+,39-,40-,42-,43+,44-,45-/m0/s1",REUYTMKASWACIB-YRCXACEXSA-N,,no,Nostoc,n.a.,HAN11/1
CyanoMetDB_0129,7-OMe-29-OAc-scytophycin B,,other cyclic non-peptide,,C47H75NO13,861.5238415,CC(/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC(C)=O)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]1(OC1)[C@@H](OC)C2)=O)=C\C[C@H](OC)C[C@]3([H])C=CC[C@]2([H])O3,"InChI=1S/C47H75NO13/c1-29-16-19-36(54-9)24-37-14-13-15-38(60-37)25-41(56-11)47(27-58-47)42(57-12)26-40(55-10)33(5)46(61-43(52)21-17-29)34(6)44(53)30(2)18-20-39(51)32(4)45(59-35(7)50)31(3)22-23-48(8)28-49/h13-14,16-17,21-23,28,30-34,36-38,40-42,44-46,53H,15,18-20,24-27H2,1-12H3/b21-17+,23-22+,29-16+/t30-,31+,32-,33-,34-,36-,37-,38-,40+,41-,42-,44-,45+,46-,47-/m0/s1",IAGFSHQIORKUKX-ZZKPJCGTSA-N,,no,Anabaena,n.a.,HAN21/1
CyanoMetDB_0130,Oscillacyclamide A,,other cyclic peptide,,C87H109N21O22S3,1895.721818,O=C([C@@H](NC(C1=CSC([C@@H](C(C)C)NC([C@@H](C(C)C)NC(C2=CSC([C@H](NC(CNC([C@H](NC([C@@H]([C@H](C)OC/C=C(C)/C)NC([C@@H](CC(N)=O)NC([C@@H](CO)NC(C3=CSC([C@@H](NC([C@H](NC([C@@H](CCCCN)N4)=O)CC5=CC=C(O)C=C5)=O)C)=N3)=O)=O)=O)=O)CC6=CNC7=C6C=CC=C7)=O)=O)CC(O)=O)=N2)=O)=O)=N1)=O)CC8=CNC9=C8C=CC=C9)NCC(N[C@@H](C4=O)CC(O)=O)=O,"InChI=1S/C87H109N21O22S3/c1-41(2)24-26-130-45(8)72-84(129)101-57(29-48-34-91-53-18-12-10-16-51(48)53)74(119)93-36-67(113)96-60(32-69(116)117)86-104-64(39-132-86)82(127)106-70(42(3)4)83(128)107-71(43(5)6)87-105-63(40-133-87)80(125)99-56(28-47-33-90-52-17-11-9-15-50(47)52)73(118)92-35-66(112)95-59(31-68(114)115)77(122)97-54(19-13-14-25-88)75(120)98-55(27-46-20-22-49(110)23-21-46)76(121)94-44(7)85-103-62(38-131-85)81(126)102-61(37-109)79(124)100-58(30-65(89)111)78(123)108-72/h9-12,15-18,20-24,33-34,38-40,42-45,54-61,70-72,90-91,109-110H,13-14,19,25-32,35-37,88H2,1-8H3,(H2,89,111)(H,92,118)(H,93,119)(H,94,121)(H,95,112)(H,96,113)(H,97,122)(H,98,120)(H,99,125)(H,100,124)(H,101,129)(H,102,126)(H,106,127)(H,107,128)(H,108,123)(H,114,115)(H,116,117)/t44-,45-,54+,55+,56-,57+,58+,59+,60+,61+,70+,71+,72+/m0/s1",DECBPJPIDHVROG-LEKXQQIESA-N,146683709,no,Oscillatoria/Planktothrix,,PCC 6506
CyanoMetDB_0131,Oscillacyclamide B,,other linear peptide,,C113H147N29O34S3,2549.982736,O=C(CNC1=O)N[C@@H](CCC(N)=O)C(N[C@@H](CC2=CC=CC=C2)C(NCC(N[C@@H](CO)C3=NC(C(N[C@@H](CC(N)=O)C4=NC(C(N[C@@H](CO)C(N[C@@H](C(C)C)C(N[C@@H](CO)C(N[C@@H](CO)C(NCC(N[C@@H](CC(O)=O)C(N[C@@H](CC5=CC=C(O)C=C5)C(N[C@@H](CC6=CNC7=C6C=CC=C7)C(N[C@@H](CO)C(N[C@@H]([C@@H](C)O)C(N[C@@H](CC8=CC=CC=C8)C(N[C@@H](CC(N)=O)C(N[C@@H](CC(C)C)C(NCC(N9[C@@H](CCC9)C(N[C@@H](CC(C)C)C%10=NC1=CS%10)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=CS4)=O)=CS3)=O)=O)=O,"InChI=1S/C113H147N29O34S3/c1-53(2)31-65-93(159)121-44-89(156)142-30-16-23-82(142)108(174)132-72(32-54(3)4)111-137-79(50-177-111)96(162)120-41-86(153)122-64(28-29-83(114)150)97(163)126-66(33-57-17-10-8-11-18-57)94(160)118-43-88(155)124-78(49-147)113-139-80(52-179-113)106(172)131-73(38-85(116)152)112-138-81(51-178-112)107(173)135-76(47-145)104(170)140-91(55(5)6)109(175)136-75(46-144)103(169)133-74(45-143)95(161)119-42-87(154)123-71(39-90(157)158)102(168)127-67(35-59-24-26-61(149)27-25-59)98(164)128-69(36-60-40-117-63-22-15-14-21-62(60)63)100(166)134-77(48-146)105(171)141-92(56(7)148)110(176)130-68(34-58-19-12-9-13-20-58)99(165)129-70(37-84(115)151)101(167)125-65/h8-15,17-22,24-27,40,50-56,64-78,82,91-92,117,143-149H,16,23,28-39,41-49H2,1-7H3,(H2,114,150)(H2,115,151)(H2,116,152)(H,118,160)(H,119,161)(H,120,162)(H,121,159)(H,122,153)(H,123,154)(H,124,155)(H,125,167)(H,126,163)(H,127,168)(H,128,164)(H,129,165)(H,130,176)(H,131,172)(H,132,174)(H,133,169)(H,134,166)(H,135,173)(H,136,175)(H,140,170)(H,141,171)(H,157,158)/t56-,64+,65+,66+,67+,68+,69+,70+,71+,72+,73+,74+,75+,76+,77+,78+,82+,91+,92+/m1/s1",RZFSXQCTAPBBLA-CNENNZGJSA-N,146683710,no,Oscillatoria/Planktothrix,,PCC 6506
CyanoMetDB_0132,Nostamide B,Na B,Anabaenopeptin,,C43H63N7O8,805.473812,O=C(NC(CCCCNC(C(CCC1=CC=CC=C1)NC(C(C)N2C)=O)=O)C(NC(C(C)CC)C(NC(C2=O)CCC3=CC=CC=C3)=O)=O)NC(C(O)=O)C(CC)C,"InChI=1S/C43H63N7O8/c1-7-27(3)35-40(54)46-34(25-23-31-19-13-10-14-20-31)41(55)50(6)29(5)37(51)45-33(24-22-30-17-11-9-12-18-30)38(52)44-26-16-15-21-32(39(53)48-35)47-43(58)49-36(42(56)57)28(4)8-2/h9-14,17-20,27-29,32-36H,7-8,15-16,21-26H2,1-6H3,(H,44,52)(H,45,51)(H,46,54)(H,48,53)(H,56,57)(H2,47,49,58)",WHFXVNGDVHVYFT-UHFFFAOYSA-N,146683656,no,Nostoc,n.a.,CENA543
CyanoMetDB_0133,Hassallidin B,,other cyclic peptide,other cyclic depsipeptide,C68H109N11O28,1527.744352,O=C(NC(C(O)C)C(NC(C(C)OC1=O)C(NC(C(C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CCC(N)=O)=O)C(C)OC2[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O2)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC3=CC=C(O)C=C3)=O)=O)=O)C(O)C(OC4[C@H]([C@H]([C@@H]([C@@H](C)O4)O)O)O)CCCCCCCCCCC,"InChI=1S/C68H109N11O28/c1-9-11-12-13-14-15-16-17-18-19-42(106-68-56(92)54(90)51(87)35(7)105-68)53(89)65(101)77-48(32(4)82)62(98)78-49-33(5)103-66(102)40(25-27-45(70)85)74-64(100)50(34(6)104-67-57(93)55(91)52(88)43(30-80)107-67)79(8)46(86)29-71-58(94)39(24-26-44(69)84)73-59(95)38(10-2)72-60(96)41(28-36-20-22-37(83)23-21-36)75-61(97)47(31(3)81)76-63(49)99/h10,20-23,31-35,39-43,47-57,67-68,80-83,87-93H,9,11-19,24-30H2,1-8H3,(H2,69,84)(H2,70,85)(H,71,94)(H,72,96)(H,73,95)(H,74,100)(H,75,97)(H,76,99)(H,77,101)(H,78,98)/b38-10-/t31?,32?,33?,34?,35-,39-,40+,41-,42?,43+,47?,48?,49?,50?,51-,52+,53?,54+,55-,56+,57-,67?,68?/m1/s1",NXXPOVNJKQHHHA-ZKRJIJTJSA-N,,yes,Hassallia,n.a.,n.a.
CyanoMetDB_0134,Nostamide C,Na C,Anabaenopeptin,,C41H59N7O8,777.4425119,O=C(NC(CCCCNC(C(CC1=CC=CC=C1)NC(C(C)N2C)=O)=O)C(NC(C(C)C)C(NC(C2=O)CCC3=CC=CC=C3)=O)=O)NC(C(O)=O)C(CC)C,"InChI=1S/C41H59N7O8/c1-7-26(4)34(40(54)55)47-41(56)45-30-20-14-15-23-42-36(50)32(24-29-18-12-9-13-19-29)44-35(49)27(5)48(6)39(53)31(22-21-28-16-10-8-11-17-28)43-38(52)33(25(2)3)46-37(30)51/h8-13,16-19,25-27,30-34H,7,14-15,20-24H2,1-6H3,(H,42,50)(H,43,52)(H,44,49)(H,46,51)(H,54,55)(H2,45,47,56)",KGFUYDMPOJTFDW-UHFFFAOYSA-N,146683657,no,Nostoc,n.a.,CENA543
CyanoMetDB_0135,Nostamide D,Na D,Anabaenopeptin,,C41H59N7O8,777.4425119,O=C(NC(CCCCNC(C(CC1=CC=CC=C1)NC(C(C)N2C)=O)=O)C(NC(C(C)CC)C(NC(C2=O)CCC3=CC=CC=C3)=O)=O)NC(C(O)=O)C(C)C,"InChI=1S/C41H59N7O8/c1-7-26(4)34-38(52)43-31(22-21-28-16-10-8-11-17-28)39(53)48(6)27(5)35(49)44-32(24-29-18-12-9-13-19-29)36(50)42-23-15-14-20-30(37(51)46-34)45-41(56)47-33(25(2)3)40(54)55/h8-13,16-19,25-27,30-34H,7,14-15,20-24H2,1-6H3,(H,42,50)(H,43,52)(H,44,49)(H,46,51)(H,54,55)(H2,45,47,56)",DPIGYJZDLCREAR-UHFFFAOYSA-N,146683658,no,Nostoc,n.a.,CENA543
CyanoMetDB_0136,Nostamide E,Na E,Anabaenopeptin,,C41H59N7O8,777.4425119,O=C(NC(CCCCNC(C(CC1=CC=CC=C1)NC(C(C)NC2=O)=O)=O)C(NC(C(C)CC)C(NC2CCC3=CC=CC=C3)=O)=O)NC(C(O)=O)C(CC)C,"InChI=1S/C41H59N7O8/c1-6-25(3)33-39(53)44-31(22-21-28-16-10-8-11-17-28)37(51)43-27(5)35(49)45-32(24-29-18-12-9-13-19-29)36(50)42-23-15-14-20-30(38(52)47-33)46-41(56)48-34(40(54)55)26(4)7-2/h8-13,16-19,25-27,30-34H,6-7,14-15,20-24H2,1-5H3,(H,42,50)(H,43,51)(H,44,53)(H,45,49)(H,47,52)(H,54,55)(H2,46,48,56)",HTIYBOWAXIGUGD-UHFFFAOYSA-N,146683659,no,Nostoc,n.a.,CENA543
CyanoMetDB_0137,Namalide D,,other cyclic peptide,,C29H45N5O6,559.3369842,O=C(C(C(C)CC)NC(C(CCCCN1)NC(NC(C(O)=O)C(CC)C)=O)=O)NC(C1=O)CCC2=CC=CC=C2,"InChI=1S/C29H45N5O6/c1-5-18(3)23-27(37)31-22(16-15-20-12-8-7-9-13-20)25(35)30-17-11-10-14-21(26(36)33-23)32-29(40)34-24(28(38)39)19(4)6-2/h7-9,12-13,18-19,21-24H,5-6,10-11,14-17H2,1-4H3,(H,30,35)(H,31,37)(H,33,36)(H,38,39)(H2,32,34,40)",YLSOIPHOXMRWGW-UHFFFAOYSA-N,146683660,no,Nostoc,n.a.,CENA543
CyanoMetDB_0138,Namalide E,,other cyclic peptide,,C28H43N5O6,545.3213341,O=C(C(C(C)C)NC(C(CCCCN1)NC(NC(C(O)=O)C(CC)C)=O)=O)NC(C1=O)CCC2=CC=CC=C2,"InChI=1S/C28H43N5O6/c1-5-18(4)23(27(37)38)33-28(39)31-20-13-9-10-16-29-24(34)21(15-14-19-11-7-6-8-12-19)30-26(36)22(17(2)3)32-25(20)35/h6-8,11-12,17-18,20-23H,5,9-10,13-16H2,1-4H3,(H,29,34)(H,30,36)(H,32,35)(H,37,38)(H2,31,33,39)",KSERJDNPRNPELX-UHFFFAOYSA-N,146683661,no,Nostoc,n.a.,CENA543
CyanoMetDB_0139,Namalide F,,other cyclic peptide,,C28H43N5O6,545.3213341,O=C(C(C(C)CC)NC(C(CCCCN1)NC(NC(C(O)=O)C(C)C)=O)=O)NC(C1=O)CCC2=CC=CC=C2,"InChI=1S/C28H43N5O6/c1-5-18(4)23-26(36)30-21(15-14-19-11-7-6-8-12-19)24(34)29-16-10-9-13-20(25(35)32-23)31-28(39)33-22(17(2)3)27(37)38/h6-8,11-12,17-18,20-23H,5,9-10,13-16H2,1-4H3,(H,29,34)(H,30,36)(H,32,35)(H,37,38)(H2,31,33,39)",QTCHCQNUOWJCTH-UHFFFAOYSA-N,146683662,no,Nostoc,n.a.,CENA543
CyanoMetDB_0140,Pseudospumigin A,,other linear peptide,,C31H44N6O7,612.3271478,O=C(N[C@@H](C(N[C@H](C(NC(CCCNC(N)=N)C=O)=O)[C@@H](C)CC)=O)CCC1=CC=C(C=C1)O)C(CC2=CC=C(C=C2)O)O,"InChI=1S/C31H44N6O7/c1-3-19(2)27(30(44)35-22(18-38)5-4-16-34-31(32)33)37-28(42)25(15-10-20-6-11-23(39)12-7-20)36-29(43)26(41)17-21-8-13-24(40)14-9-21/h6-9,11-14,18-19,22,25-27,39-41H,3-5,10,15-17H2,1-2H3,(H,35,44)(H,36,43)(H,37,42)(H4,32,33,34)/t19-,22?,25+,26?,27-/m0/s1",QACTZPSCGSGUNG-GYWLOTNVSA-N,,yes,Nostoc,n.a.,CENA543
CyanoMetDB_0141,Pseudospumigin B,,other linear peptide,,C31H44N6O7,612.3271478,O=C(C(O)CC1=CC=C(O)C=C1)N[C@H](CCC2=CC=C(O)C=C2)C(N[C@@H](CC(C)C)C(NC(C=O)CCCNC(N)=N)=O)=O,"InChI=1S/C31H44N6O7/c1-19(2)16-26(29(43)35-22(18-38)4-3-15-34-31(32)33)37-28(42)25(14-9-20-5-10-23(39)11-6-20)36-30(44)27(41)17-21-7-12-24(40)13-8-21/h5-8,10-13,18-19,22,25-27,39-41H,3-4,9,14-17H2,1-2H3,(H,35,43)(H,36,44)(H,37,42)(H4,32,33,34)/t22?,25-,26+,27?/m1/s1",NGBBDYSACOVTOR-UOIHDSSCSA-N,146683752,no,Nostoc,n.a.,CENA543
CyanoMetDB_0142,Pseudospumigin C,,other linear peptide,,C30H42N6O7,598.3114977,O=C(C(O)CC1=CC=C(O)C=C1)N[C@H](CCC2=CC=C(O)C=C2)C(N[C@@H](C(C)C)C(NC(C=O)CCCNC(N)=N)=O)=O,"InChI=1S/C30H42N6O7/c1-18(2)26(29(43)34-21(17-37)4-3-15-33-30(31)32)36-27(41)24(14-9-19-5-10-22(38)11-6-19)35-28(42)25(40)16-20-7-12-23(39)13-8-20/h5-8,10-13,17-18,21,24-26,38-40H,3-4,9,14-16H2,1-2H3,(H,34,43)(H,35,42)(H,36,41)(H4,31,32,33)/t21?,24-,25?,26+/m1/s1",ZSCHPQBYWNYITD-RWLGUYTISA-N,146683753,no,Nostoc,n.a.,CENA543
CyanoMetDB_0143,Pseudospumigin D,,other linear peptide,,C31H44N6O6,596.3322332,O=C(NC(C(N[C@H](C(NC(CCCNC(N)=N)C=O)=O)[C@@H](C)CC)=O)CCC1=CC=CC=C1)C(CC2=CC=C(C=C2)O)O,"InChI=1S/C31H44N6O6/c1-3-20(2)27(30(43)35-23(19-38)10-7-17-34-31(32)33)37-28(41)25(16-13-21-8-5-4-6-9-21)36-29(42)26(40)18-22-11-14-24(39)15-12-22/h4-6,8-9,11-12,14-15,19-20,23,25-27,39-40H,3,7,10,13,16-18H2,1-2H3,(H,35,43)(H,36,42)(H,37,41)(H4,32,33,34)/t20-,23?,25?,26?,27-/m0/s1",WVQVWUCJRVUECI-DKTDNSISSA-N,,no,Nostoc,n.a.,CENA543
CyanoMetDB_0144,Hassallidin C,,other cyclic peptide,other cyclic depsipeptide,C82H132N12O34,1828.896889,OC1C(CO)OC(OC2C(O)C(OC(C(O)C(NC(C(C)O)C(NC(C(OC3=O)C)C(N[C@H]([C@@H](C)O)C(N[C@@H](C(NC(C(N[C@H](CCC(N)=O)C(NCC(N(C(C(OC4C(O)C(O)C(O)C(CO)O4)C)C(NC3CCCCN)=O)C)=O)=O)=O)=CC)=O)CC5=CC=C(O)C=C5)=O)=O)=O)=O)CCCCCCCCCCCCC)OC([H])C2O)C(NC(C)=O)C1O.O=CC.CC=O,"InChI=1S/C78H128N12O32.2C2H4O/c1-9-11-12-13-14-15-16-17-18-19-20-24-49(119-77-65(106)66(48(97)36-116-77)122-76-57(82-41(7)95)62(103)59(100)50(34-91)120-76)61(102)74(114)88-55(38(4)94)71(111)89-56-39(5)117-75(115)46(23-21-22-31-79)85-73(113)58(40(6)118-78-64(105)63(104)60(101)51(35-92)121-78)90(8)53(99)33-81-67(107)45(29-30-52(80)98)84-68(108)44(10-2)83-69(109)47(32-42-25-27-43(96)28-26-42)86-70(110)54(37(3)93)87-72(56)112;2*1-2-3/h10,25-28,37-40,45-51,54-66,76-78,91-94,96-97,100-106H,9,11-24,29-36,79H2,1-8H3,(H2,80,98)(H,81,107)(H,82,95)(H,83,109)(H,84,108)(H,85,113)(H,86,110)(H,87,112)(H,88,114)(H,89,111);2*2H,1H3/t37-,38?,39?,40?,45-,46?,47-,48?,49?,50?,51?,54-,55?,56?,57?,58?,59?,60?,61?,62?,63?,64?,65?,66?,76?,77?,78?;;/m1../s1",DIFPYBGSTQKMMW-VDEYPMAQSA-N,,yes,Anabaena,n.a.,SYKE 748A 
CyanoMetDB_0145,Pseudospumigin E,,other linear peptide,,C31H44N6O6,596.3322332,O=C(C(O)CC1=CC=C(O)C=C1)NC(CCC2=CC=CC=C2)C(N[C@@H](CC(C)C)C(NC(C=O)CCCNC(N)=N)=O)=O,"InChI=1S/C31H44N6O6/c1-20(2)17-26(29(42)35-23(19-38)9-6-16-34-31(32)33)37-28(41)25(15-12-21-7-4-3-5-8-21)36-30(43)27(40)18-22-10-13-24(39)14-11-22/h3-5,7-8,10-11,13-14,19-20,23,25-27,39-40H,6,9,12,15-18H2,1-2H3,(H,35,42)(H,36,43)(H,37,41)(H4,32,33,34)/t23?,25?,26-,27?/m0/s1",CFKHCDRISBRUFQ-COKUGGSTSA-N,146683755,no,Nostoc,n.a.,CENA543
CyanoMetDB_0146,Pseudospumigin F,,other linear peptide,,C30H42N6O6,582.3165831,O=C(C(O)CC1=CC=C(O)C=C1)NC(CCC2=CC=CC=C2)C(N[C@@H](C(C)C)C(NC(C=O)CCCNC(N)=N)=O)=O,"InChI=1S/C30H42N6O6/c1-19(2)26(29(42)34-22(18-37)9-6-16-33-30(31)32)36-27(40)24(15-12-20-7-4-3-5-8-20)35-28(41)25(39)17-21-10-13-23(38)14-11-21/h3-5,7-8,10-11,13-14,18-19,22,24-26,38-39H,6,9,12,15-17H2,1-2H3,(H,34,42)(H,35,41)(H,36,40)(H4,31,32,33)/t22?,24?,25?,26-/m0/s1",ZCYAPDWORPSULN-WSXXUSQGSA-N,146683756,no,Nostoc,n.a.,CENA543
CyanoMetDB_0147,Cusperin A,,other linear peptide,,C26H42N4O8,538.3002643,C=C1[C@@H](C)[C@@H](C)O[C@]([C@H](O)C(N/C=C/C(C)[C@@H](O)C(C)C(N2[C@H](C(NCC(N)=O)=O)CCC2)=O)=O)(OC)C1,"InChI=1S/C26H42N4O8/c1-14(9-10-28-24(35)22(33)26(37-6)12-15(2)16(3)18(5)38-26)21(32)17(4)25(36)30-11-7-8-19(30)23(34)29-13-20(27)31/h9-10,14,16-19,21-22,32-33H,2,7-8,11-13H2,1,3-6H3,(H2,27,31)(H,28,35)(H,29,34)/b10-9+/t14?,16-,17?,18-,19+,21-,22-,26-/m1/s1",VANNEGUZJFATRF-ZXJKYMOHSA-N,138319181,yes,Cuspidothrix,issatschenkoi ,CHARLIE-1
CyanoMetDB_0148,Cusperin B,,other linear peptide,,C25H40N4O8,524.2846143,C=C1[C@@H](C)[C@@H](C)O[C@]([C@H](O)C(N/C=C/C(C)[C@@H](O)C(C)C(N2[C@H](C(NCC(N)=O)=O)CCC2)=O)=O)(O)C1,"InChI=1S/C25H40N4O8/c1-13(8-9-27-23(34)21(32)25(36)11-14(2)15(3)17(5)37-25)20(31)16(4)24(35)29-10-6-7-18(29)22(33)28-12-19(26)30/h8-9,13,15-18,20-21,31-32,36H,2,6-7,10-12H2,1,3-5H3,(H2,26,30)(H,27,34)(H,28,33)/b9-8+/t13?,15-,16?,17-,18+,20-,21-,25-/m1/s1",FRVCGSZIVNIXOO-GYXPDKRDSA-N,146683663,yes,Cuspidothrix,issatschenkoi ,CHARLIE-1
CyanoMetDB_0149,Sphaerocyclamide,,other cyclic peptide,,C46H63N9O11,917.4647039,C[C@@H](C(N[C@@H](CCC(N)=O)C(NCC(N[C@@H](C(C)C)C(N[C@@H](CO)C(N[C@@H](CC(C=C1)=CC=C1OC/C=C(C)/C)C(N[C@H](C(N2CCC[C@H]2C3=O)=O)CC4=CC=CC=C4)=O)=O)=O)=O)=O)=O)N3[H],"InChI=1S/C46H63N9O11/c1-26(2)19-21-66-31-15-13-30(14-16-31)22-33-42(61)52-34(23-29-10-7-6-8-11-29)46(65)55-20-9-12-36(55)44(63)49-28(5)40(59)50-32(17-18-37(47)57)41(60)48-24-38(58)54-39(27(3)4)45(64)53-35(25-56)43(62)51-33/h6-8,10-11,13-16,19,27-28,32-36,39,56H,9,12,17-18,20-25H2,1-5H3,(H2,47,57)(H,48,60)(H,49,63)(H,50,59)(H,51,62)(H,52,61)(H,53,64)(H,54,58)/t28-,32-,33-,34-,35-,36-,39-/m0/s1",JKBXTXMXBDJJQA-SJHSMXDOSA-N,146683708,yes,Sphaerospermopsis,n.a.,LEGE 00249
CyanoMetDB_0150,Deprenylmuscoride A,,other linear non-peptide,,C23H32N4O5,444.2372701,CC(C)[C@@H](C(N1CCC[C@H]1C2=NC(C3=NC(C(O)=O)=C(C)O3)=C(C)O2)=O)NC(C)(C)C=C,"InChI=1S/C23H32N4O5/c1-8-23(6,7)26-16(12(2)3)21(28)27-11-9-10-15(27)19-24-17(13(4)31-19)20-25-18(22(29)30)14(5)32-20/h8,12,15-16,26H,1,9-11H2,2-7H3,(H,29,30)/t15-,16-/m0/s1",ZKFLQWQJCKJLMF-HOTGVXAUSA-N,21592945,yes (partly),Nostoc,n.a.,PCC 7906
CyanoMetDB_0151,Deprenylmuscoride B,,other linear non-peptide,,C26H33N5O6,511.2430838,O=C(N1CCC[C@H]1C2=NC(C3=NC(C4=NC(C(O)=O)=CO4)=C(C)O3)=CO2)[C@H]([C@@H](C)CC)NC/C=C(C)/C,"InChI=1S/C26H33N5O6/c1-6-15(4)20(27-10-9-14(2)3)25(32)31-11-7-8-19(31)23-28-17(12-35-23)22-30-21(16(5)37-22)24-29-18(13-36-24)26(33)34/h9,12-13,15,19-20,27H,6-8,10-11H2,1-5H3,(H,33,34)/t15-,19-,20-/m0/s1",ZIUWXSVNWOCDAE-YSSFQJQWSA-N,,yes (partly),Nostoc,n.a.,UHCC 0398
CyanoMetDB_0152,Balticidin A,,other linear peptide,,C75H120ClN11O36,1785.758597,O=C(C(C(CCCCCCCCCC(Cl)CCC)O[C@H]1[C@H]([C@@H]([C@@H](CO1)O)O[C@H]2O[C@H]([C@H]([C@H]([C@@H]2O)O)O)C(O)=O)O)O)NC(C(NC(C(NC(C(NC(C(C3=CC=C(C=C3)O)O)C(N/C(C(N[C@@H](CCC(N)=O)C(NCC(N(C)C(C(O[C@@H]4[C@@H]([C@@H]([C@H]([C@@H](O4)CO)O)O)O)C)C(N[C@@H](C(O)=O)CCC(N)=O)=O)=O)=O)=O)=C\C)=O)=O)C(O)C)=O)C(O)C)=O)C(C)O,"InChI=1S/C75H120ClN11O36/c1-8-17-36(76)18-15-13-11-10-12-14-16-19-42(120-73-60(105)61(41(93)30-118-73)122-75-59(104)56(101)57(102)62(123-75)72(116)117)54(99)70(113)85-49(33(5)91)66(109)83-47(31(3)89)65(108)84-48(32(4)90)67(110)86-50(52(97)35-20-22-37(92)23-21-35)68(111)80-38(9-2)64(107)81-39(24-26-44(77)94)63(106)79-28-46(96)87(7)51(69(112)82-40(71(114)115)25-27-45(78)95)34(6)119-74-58(103)55(100)53(98)43(29-88)121-74/h9,20-23,31-34,36,39-43,47-62,73-75,88-93,97-105H,8,10-19,24-30H2,1-7H3,(H2,77,94)(H2,78,95)(H,79,106)(H,80,111)(H,81,107)(H,82,112)(H,83,109)(H,84,108)(H,85,113)(H,86,110)(H,114,115)(H,116,117)/b38-9-/t31?,32?,33?,34?,36?,39-,40+,41+,42?,43-,47?,48?,49?,50?,51?,52?,53-,54?,55+,56+,57-,58+,59-,60-,61+,62+,73-,74-,75-/m0/s1",MZBSSWIGTROORG-IDUONOJXSA-N,,yes,Anabaena,cylindrica,Bio33
CyanoMetDB_0154,Balticidin B,,other cyclic peptide,other cyclic depsipeptide,C75H118ClN11O35,1767.748032,O=C(NC(C(O)C)C(NC(C(C)OC1=O)C(NC(C(C)O)C(NC(C(N/C(C(N[C@H](C(NCC(N(C(C(N[C@@H]1CCC(N)=O)=O)C(C)O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O2)C)=O)=O)CCC(N)=O)=O)=C\C)=O)C(O)C3=CC=C(O)C=C3)=O)=O)=O)C(O)C(O[C@H]4[C@@H](O)[C@H](O[C@H]5O[C@@H](C(O)=O)[C@@H](O)[C@@H](O)[C@@H]5O)[C@H](O)CO4)CCCCCCCCCC(Cl)CCC,"InChI=1S/C75H118ClN11O35/c1-8-17-36(76)18-15-13-11-10-12-14-16-19-42(119-73-60(104)61(41(92)30-116-73)121-75-59(103)56(100)57(101)62(122-75)71(113)114)54(98)70(112)84-48(32(4)90)65(107)85-49-33(5)117-72(115)40(25-27-45(78)94)82-69(111)51(34(6)118-74-58(102)55(99)53(97)43(29-88)120-74)87(7)46(95)28-79-63(105)39(24-26-44(77)93)81-64(106)38(9-2)80-68(110)50(52(96)35-20-22-37(91)23-21-35)86-66(108)47(31(3)89)83-67(49)109/h9,20-23,31-34,36,39-43,47-62,73-75,88-92,96-104H,8,10-19,24-30H2,1-7H3,(H2,77,93)(H2,78,94)(H,79,105)(H,80,110)(H,81,106)(H,82,111)(H,83,109)(H,84,112)(H,85,107)(H,86,108)(H,113,114)/b38-9-/t31?,32?,33?,34?,36?,39-,40+,41+,42?,43-,47?,48?,49?,50?,51?,52?,53-,54?,55+,56+,57-,58+,59-,60-,61+,62+,73-,74-,75-/m0/s1",WIWYCHBUTVJEHX-IDUONOJXSA-N,146683688,yes,Anabaena,cylindrica,Bio33
CyanoMetDB_0155,Balticidin C,,other linear peptide,,C75H121N11O36,1751.797569,O=C(NC(C(O)C)C(NC(C(C)O)C(NC(C(C)O)C(NC(C(N/C(C(N[C@H](C(NCC(N(C(C(N[C@H](CCC(N)=O)C(O)=O)=O)C(C)O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O1)C)=O)=O)CCC(N)=O)=O)=C\C)=O)C(O)C2=CC=C(O)C=C2)=O)=O)=O)C(O)C(O[C@H]3[C@@H](O)[C@H](O[C@H]4O[C@@H](C(O)=O)[C@@H](O)[C@@H](O)[C@@H]4O)[C@H](O)CO3)CCCCCCCCCCCCC,"InChI=1S/C75H121N11O36/c1-8-10-11-12-13-14-15-16-17-18-19-20-42(119-73-60(104)61(41(92)31-117-73)121-75-59(103)56(100)57(101)62(122-75)72(115)116)54(98)70(112)84-49(34(5)90)66(108)82-47(32(3)88)65(107)83-48(33(4)89)67(109)85-50(52(96)36-21-23-37(91)24-22-36)68(110)79-38(9-2)64(106)80-39(25-27-44(76)93)63(105)78-29-46(95)86(7)51(69(111)81-40(71(113)114)26-28-45(77)94)35(6)118-74-58(102)55(99)53(97)43(30-87)120-74/h9,21-24,32-35,39-43,47-62,73-75,87-92,96-104H,8,10-20,25-31H2,1-7H3,(H2,76,93)(H2,77,94)(H,78,105)(H,79,110)(H,80,106)(H,81,111)(H,82,108)(H,83,107)(H,84,112)(H,85,109)(H,113,114)(H,115,116)/b38-9-/t32?,33?,34?,35?,39-,40+,41+,42?,43-,47?,48?,49?,50?,51?,52?,53-,54?,55+,56+,57-,58+,59-,60-,61+,62+,73-,74-,75-/m0/s1",CXWFWZQJPYLHFZ-GGBPWVLZSA-N,146683689,yes,Anabaena,cylindrica,Bio33
CyanoMetDB_0156,Balticidin D,,other cyclic peptide,other cyclic depsipeptide,C75H119N11O35,1733.787005,O=C(NC(C(O)C)C(NC(C(C)OC1=O)C(NC(C(C)O)C(NC(C(N/C(C(N[C@H](C(NCC(N(C(C(N[C@@H]1CCC(N)=O)=O)C(C)O[C@@H]2[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O2)C)=O)=O)CCC(N)=O)=O)=C\C)=O)C(O)C3=CC=C(O)C=C3)=O)=O)=O)C(O)C(O[C@H]4[C@@H](O)[C@H](O[C@H]5O[C@@H](C(O)=O)[C@@H](O)[C@@H](O)[C@@H]5O)[C@H](O)CO4)CCCCCCCCCCCCC,"InChI=1S/C75H119N11O35/c1-8-10-11-12-13-14-15-16-17-18-19-20-42(118-73-60(103)61(41(91)31-115-73)120-75-59(102)56(99)57(100)62(121-75)71(112)113)54(97)70(111)83-48(33(4)89)65(106)84-49-34(5)116-72(114)40(26-28-45(77)93)81-69(110)51(35(6)117-74-58(101)55(98)53(96)43(30-87)119-74)86(7)46(94)29-78-63(104)39(25-27-44(76)92)80-64(105)38(9-2)79-68(109)50(52(95)36-21-23-37(90)24-22-36)85-66(107)47(32(3)88)82-67(49)108/h9,21-24,32-35,39-43,47-62,73-75,87-91,95-103H,8,10-20,25-31H2,1-7H3,(H2,76,92)(H2,77,93)(H,78,104)(H,79,109)(H,80,105)(H,81,110)(H,82,108)(H,83,111)(H,84,106)(H,85,107)(H,112,113)/b38-9-/t32?,33?,34?,35?,39-,40+,41+,42?,43-,47?,48?,49?,50?,51?,52?,53-,54?,55+,56+,57-,58+,59-,60-,61+,62+,73-,74-,75-/m0/s1",SVWZKSCWSWYLPR-GGBPWVLZSA-N,146683690,yes,Anabaena,cylindrica,Bio33
CyanoMetDB_0157,"[C141, Man]Hassallidin D","[C14^1, Man]Hassallidin D",other cyclic peptide,Hassallidin,C79H121N11O33,1751.812825,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCC,"InChI=1S/C79H121N11O33/c1-9-11-12-13-14-15-16-17-18-19-50(120-78-66(107)67(49(98)35-117-78)123-77-58(82-40(7)95)63(104)60(101)51(33-91)121-77)62(103)75(115)88-56(37(4)94)72(112)89-57-38(5)118-76(116)48(31-42-22-26-44(97)27-23-42)86-74(114)59(39(6)119-79-65(106)64(105)61(102)52(34-92)122-79)90(8)54(100)32-81-68(108)46(28-29-53(80)99)84-69(109)45(10-2)83-70(110)47(30-41-20-24-43(96)25-21-41)85-71(111)55(36(3)93)87-73(57)113/h10,20-27,36-39,46-52,55-67,77-79,91-94,96-98,101-107H,9,11-19,28-35H2,1-8H3,(H2,80,99)(H,81,108)(H,82,95)(H,83,110)(H,84,109)(H,85,111)(H,86,114)(H,87,113)(H,88,115)(H,89,112)/b45-10-/t36-,37?,38+,39?,46+,47+,48-,49+,50?,51-,52-,55-,56?,57-,58-,59?,60-,61-,62?,63-,64+,65+,66-,67+,77+,78-,79+/m0/s1",KGEGUUFEUVXAID-QTPIYKRHSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0158,"[C141, ManAc1]Hassallidin D","[C14^1, ManAc1]Hassallidin D",other cyclic peptide,Hassallidin,C81H123N11O34,1793.82339,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCC.CC=O,"InChI=1S/C79H121N11O33.C2H4O/c1-9-11-12-13-14-15-16-17-18-19-50(120-78-66(107)67(49(98)35-117-78)123-77-58(82-40(7)95)63(104)60(101)51(33-91)121-77)62(103)75(115)88-56(37(4)94)72(112)89-57-38(5)118-76(116)48(31-42-22-26-44(97)27-23-42)86-74(114)59(39(6)119-79-65(106)64(105)61(102)52(34-92)122-79)90(8)54(100)32-81-68(108)46(28-29-53(80)99)84-69(109)45(10-2)83-70(110)47(30-41-20-24-43(96)25-21-41)85-71(111)55(36(3)93)87-73(57)113;1-2-3/h10,20-27,36-39,46-52,55-67,77-79,91-94,96-98,101-107H,9,11-19,28-35H2,1-",LUHDVBJBVCEING-LZYVJPCLSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0159,"[C141, ManAc2]Hassallidin D","[C14^1, ManAc2]Hassallidin D",other cyclic peptide,Hassallidin,C83H125N11O35,1835.833955,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCC.CC=O.CC=O,"InChI=1S/C79H121N11O33.2C2H4O/c1-9-11-12-13-14-15-16-17-18-19-50(120-78-66(107)67(49(98)35-117-78)123-77-58(82-40(7)95)63(104)60(101)51(33-91)121-77)62(103)75(115)88-56(37(4)94)72(112)89-57-38(5)118-76(116)48(31-42-22-26-44(97)27-23-42)86-74(114)59(39(6)119-79-65(106)64(105)61(102)52(34-92)122-79)90(8)54(100)32-81-68(108)46(28-29-53(80)99)84-69(109)45(10-2)83-70(110)47(30-41-20-24-43(96)25-21-41)85-71(111)55(36(3)93)87-73(57)113;2*1-2-3/h10,20-27,36-39,46-52,55-67,77-79,91-94,96-98,101-107H,9,11-19,28-35H2,1-8H3,(H2,80,99)(H,81,108)(H,82,95)(H,83,110)(H,84,109)(H,85,111)(H,86,114)(H,87,113)(H,88,115)(H,89,112);2*2H,1H3/b45-10-;;/t36-,37?,38+,39?,46+,47+,48-,49+,50?,51-,52-,55-,56?,57-,58-,59?,60-,61-,62?,63-,64+,65+,66-,67+,77+,78-,79+;;/m0../s1",NXPFGHBSRQXGOW-YKVXSAAFSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0160,"[C141, ManAc3]Hassallidin D","[C14^1, ManAc3]Hassallidin D",other cyclic peptide,Hassallidin,C85H127N11O36,1877.845,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCC.CC=O.CC=O.CC=O,"InChI=1S/C79H121N11O33.3C2H4O/c1-9-11-12-13-14-15-16-17-18-19-50(120-78-66(107)67(49(98)35-117-78)123-77-58(82-40(7)95)63(104)60(101)51(33-91)121-77)62(103)75(115)88-56(37(4)94)72(112)89-57-38(5)118-76(116)48(31-42-22-26-44(97)27-23-42)86-74(114)59(39(6)119-79-65(106)64(105)61(102)52(34-92)122-79)90(8)54(100)32-81-68(108)46(28-29-53(80)99)84-69(109)45(10-2)83-70(110)47(30-41-20-24-43(96)25-21-41)85-71(111)55(36(3)93)87-73(57)113;3*1-2-3/h10,20-27,36-39,46-52,55-67,77-79,91-94,96-98,101-107H,9,11-19,28-35H2,1-8H3,(H2,80,99)(H,81,108)(H,82,95)(H,83,110)(H,84,109)(H,85,111)(H,86,114)(H,87,113)(H,88,115)(H,89,112);3*2H,1H3/b45-10-;;;/t36-,37?,38+,39?,46+,47+,48-,49+,50?,51-,52-,55-,56?,57-,58-,59?,60-,61-,62?,63-,64+,65+,66-,67+,77+,78-,79+;;;/m0.../s1",ONVVKBLVYFJGFN-DLLUWQEJSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0161,"[C141, ManAc4]Hassallidin D","[C14^1, ManAc4]Hassallidin D",other cyclic peptide,Hassallidin,C87H129N11O37,1919.855084,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COC(C)=O)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCC,"InChI=1S/C87H129N11O37/c1-13-15-16-17-18-19-20-21-22-23-58(132-86-71(115)72(57(109)38-126-86)135-85-66(90-44(7)102)70(114)68(112)59(37-99)133-85)69(113)83(123)96-64(41(4)101)80(120)97-65-42(5)127-84(124)56(35-50-26-30-52(108)31-27-50)94-82(122)67(43(6)128-87-75(131-48(11)106)74(130-47(10)105)73(129-46(9)104)60(134-87)39-125-45(8)103)98(12)62(111)36-89-76(116)54(32-33-61(88)110)92-77(117)53(14-2)91-78(118)55(34-49-24-28-51(107)29-25-49)93-79(119)63(40(3)100)95-81(65)121/h14,24-31,40-43,54-60,63-75,85-87,99-101,107-109,112-115H,13,15-23,32-39H2,1-12H3,(H2,88,110)(H,89,116)(H,90,102)(H,91,118)(H,92,117)(H,93,119)(H,94,122)(H,95,121)(H,96,123)(H,97,120)/b53-14-/t40-,41?,42+,43?,54+,55+,56-,57+,58?,59-,60-,63-,64?,65-,66-,67?,68-,69?,70-,71-,72+,73-,74+,75+,85+,86-,87+/m0/s1",HMSALCHBAGFTDY-VYUMTOBRSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0162,[Man]Hassallidin D,[Man]Hassallidin D,other cyclic peptide,Hassallidin,C81H125N11O33,1779.844126,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCC,"InChI=1S/C81H125N11O33/c1-9-11-12-13-14-15-16-17-18-19-20-21-52(122-80-68(109)69(51(100)37-119-80)125-79-60(84-42(7)97)65(106)62(103)53(35-93)123-79)64(105)77(117)90-58(39(4)96)74(114)91-59-40(5)120-78(118)50(33-44-24-28-46(99)29-25-44)88-76(116)61(41(6)121-81-67(108)66(107)63(104)54(36-94)124-81)92(8)56(102)34-83-70(110)48(30-31-55(82)101)86-71(111)47(10-2)85-72(112)49(32-43-22-26-45(98)27-23-43)87-73(113)57(38(3)95)89-75(59)115/h10,22-29,38-41,48-54,57-69,79-81,93-96,98-100,103-109H,9,11-21,30-37H2,1-8H3,(H2,82,101)(H,83,110)(H,84,97)(H,85,112)(H,86,111)(H,87,113)(H,88,116)(H,89,115)(H,90,117)(H,91,114)/b47-10-/t38-,39?,40+,41?,48+,49+,50-,51+,52?,53-,54-,57-,58?,59-,60-,61?,62-,63-,64?,65-,66+,67+,68-,69+,79+,80-,81+/m0/s1",AYELXTBYKCDRNR-IAOQKTDDSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0163,Hassallidin E,,other cyclic peptide,other cyclic depsipeptide,C64H103N11O24,1409.717743,O=C(NC(C(O)C)C(NC(C(C)OC1=O)C(NC(C(C)O)C(NC(C(N/C(C(NC(C(NCC(N(C(C(NC1CCC(N)=O)=O)C(C)OC2C(O)C(O)C(O)C(CO)O2)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC3=CC=C(O)C=C3)=O)=O)=O)C(O)C(O)CCCCCCCCCCCCC,"InChI=1S/C64H103N11O24/c1-8-10-11-12-13-14-15-16-17-18-19-20-42(80)51(84)62(95)73-48(33(4)78)59(92)74-49-34(5)97-63(96)40(26-28-45(66)82)70-61(94)50(35(6)98-64-54(87)53(86)52(85)43(31-76)99-64)75(7)46(83)30-67-55(88)39(25-27-44(65)81)69-56(89)38(9-2)68-57(90)41(29-36-21-23-37(79)24-22-36)71-58(91)47(32(3)77)72-60(49)93/h9,21-24,32-35,39-43,47-54,64,76-80,84-87H,8,10-20,25-31H2,1-7H3,(H2,65,81)(H2,66,82)(H,67,88)(H,68,90)(H,69,89)(H,70,94)(H,71,91)(H,72,93)(H,73,95)(H,74,92)/b38-9-",OGTUEIHKAQMBTH-JOEVVLMGSA-N,146683655,no,Oscillatoria/Planktothrix,serta ,PCC 8927 
CyanoMetDB_0164,[ManAc1]Hassallidin D,[ManAc_1]Hassallidin D,other cyclic peptide,Hassallidin,C83H127N11O34,1821.85469,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCC.CC=O,"InChI=1S/C81H125N11O33.C2H4O/c1-9-11-12-13-14-15-16-17-18-19-20-21-52(122-80-68(109)69(51(100)37-119-80)125-79-60(84-42(7)97)65(106)62(103)53(35-93)123-79)64(105)77(117)90-58(39(4)96)74(114)91-59-40(5)120-78(118)50(33-44-24-28-46(99)29-25-44)88-76(116)61(41(6)121-81-67(108)66(107)63(104)54(36-94)124-81)92(8)56(102)34-83-70(110)48(30-31-55(82)101)86-71(111)47(10-2)85-72(112)49(32-43-22-26-45(98)27-23-43)87-73(113)57(38(3)95)89-75(59)115;1-2-3/h10,22-29,38-41,48-54,57-69,79-81,93-96,98-100,103-109H,9,11-21,30-37H2,1-8H3,(H2,82,101)(H,83,110)(H,84,97)(H,85,112)(H,86,111)(H,87,113)(H,88,116)(H,89,115)(H,90,117)(H,91,114);2H,1H3/b47-10-;/t38-,39?,40+,41?,48+,49+,50-,51+,52?,53-,54-,57-,58?,59-,60-,61?,62-,63-,64?,65-,66+,67+,68-,69+,79+,80-,81+;/m0./s1",HIWPUVRSFLIUDB-GNEHOMDSSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0165,[ManAc3]Hassallidin D,[ManAc_3]Hassallidin D,other cyclic peptide,Hassallidin,C87H131N11O36,1905.87582,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCC.CC=O.CC=O.CC=O,"InChI=1S/C81H125N11O33.3C2H4O/c1-9-11-12-13-14-15-16-17-18-19-20-21-52(122-80-68(109)69(51(100)37-119-80)125-79-60(84-42(7)97)65(106)62(103)53(35-93)123-79)64(105)77(117)90-58(39(4)96)74(114)91-59-40(5)120-78(118)50(33-44-24-28-46(99)29-25-44)88-76(116)61(41(6)121-81-67(108)66(107)63(104)54(36-94)124-81)92(8)56(102)34-83-70(110)48(30-31-55(82)101)86-71(111)47(10-2)85-72(112)49(32-43-22-26-45(98)27-23-43)87-73(113)57(38(3)95)89-75(59)115;3*1-2-3/h10,22-29,38-41,48-54,57-69,79-81,93-96,98-100,103-109H,9,11-21,30-37H2,1-8H3,(H2,82,101)(H,83,110)(H,84,97)(H,85,112)(H,86,111)(H,87,113)(H,88,116)(H,89,115)(H,90,117)(H,91,114);3*2H,1H3/b47-10-;;;/t38-,39?,40+,41?,48+,49+,50-,51+,52?,53-,54-,57-,58?,59-,60-,61?,62-,63-,64?,65-,66+,67+,68-,69+,79+,80-,81+;;;/m0.../s1",OMWPCMUXARMXOZ-SGZZIHJUSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0166,[ManAc4]Hassallidin D,,other cyclic peptide,other cyclic depsipeptide,C89H133N11O37,1947.886384,O[C@@H]1[C@@H](CO)O[C@@H](O[C@H]2[C@H](O)[C@H](OC(C(O)C(NC(C(C)O)C(NC(C(OC3=O)C)C(N[C@H]([C@@H](C)O)C(N[C@@H](C(NC(C(N[C@H](CCC(N)=O)C(NCC(N(C(C(O[C@@H]4[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O4)C)C(N[C@H]3CC5=CC=C(O)C=C5)=O)C)=O)=O)=O)=CC)=O)CC6=CC=C(O)C=C6)=O)=O)=O)=O)CCCCCCCCCCCCC)OC([H])[C@H]2O)[C@H](NC(C)=O)[C@H]1O,"InChI=1S/C89H133N11O37/c1-13-15-16-17-18-19-20-21-22-23-24-25-60(134-88-73(117)74(59(111)40-128-88)137-87-68(92-46(7)104)72(116)70(114)61(39-101)135-87)71(115)85(125)98-66(43(4)103)82(122)99-67-44(5)129-86(126)58(37-52-28-32-54(110)33-29-52)96-84(124)69(45(6)130-89-77(133-50(11)108)76(132-49(10)107)75(131-48(9)106)62(136-89)41-127-47(8)105)100(12)64(113)38-91-78(118)56(34-35-63(90)112)94-79(119)55(14-2)93-80(120)57(36-51-26-30-53(109)31-27-51)95-81(121)65(42(3)102)97-83(67)123/h14,26-33,42-45,56-62,65-77,87-89,101-103,109-111,114-117H,13,15-25,34-41H2,1-12H3,(H2,90,112)(H,91,118)(H,92,104)(H,93,120)(H,94,119)(H,95,121)(H,96,124)(H,97,123)(H,98,125)(H,99,122)/t42-,43?,44?,45?,56-,57-,58+,59-,60?,61-,62-,65-,66?,67?,68-,69?,70-,71?,72-,73+,74-,75?,76?,77?,87+,88+,89+/m1/s1",YKDZQOPOUKWYEO-IOTBUUFSSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0167,"[C181, Man]Hassallidin D","[C18^1, Man]Hassallidin D",other cyclic peptide,Hassallidin,C83H129N11O33,1807.875426,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCCCC,"InChI=1S/C83H129N11O33/c1-9-11-12-13-14-15-16-17-18-19-20-21-22-23-54(124-82-70(111)71(53(102)39-121-82)127-81-62(86-44(7)99)67(108)64(105)55(37-95)125-81)66(107)79(119)92-60(41(4)98)76(116)93-61-42(5)122-80(120)52(35-46-26-30-48(101)31-27-46)90-78(118)63(43(6)123-83-69(110)68(109)65(106)56(38-96)126-83)94(8)58(104)36-85-72(112)50(32-33-57(84)103)88-73(113)49(10-2)87-74(114)51(34-45-24-28-47(100)29-25-45)89-75(115)59(40(3)97)91-77(61)117/h10,24-31,40-43,50-56,59-71,81-83,95-98,100-102,105-111H,9,11-23,32-39H2,1-8H3,(H2,84,103)(H,85,112)(H,86,99)(H,87,114)(H,88,113)(H,89,115)(H,90,118)(H,91,117)(H,92,119)(H,93,116)/b49-10-/t40-,41?,42+,43?,50+,51+,52-,53+,54?,55-,56-,59-,60?,61-,62-,63?,64-,65-,66?,67-,68+,69+,70-,71+,81+,82-,83+/m0/s1",ILFSMTKMUGCNDF-AXNQZFIKSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0168,"[C181, ManAc1]Hassallidin D","[C18^1, ManAc1]Hassallidin D",other cyclic peptide,Hassallidin,C85H131N11O34,1849.88599,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCCCC.CC=O,"InChI=1S/C83H129N11O33.C2H4O/c1-9-11-12-13-14-15-16-17-18-19-20-21-22-23-54(124-82-70(111)71(53(102)39-121-82)127-81-62(86-44(7)99)67(108)64(105)55(37-95)125-81)66(107)79(119)92-60(41(4)98)76(116)93-61-42(5)122-80(120)52(35-46-26-30-48(101)31-27-46)90-78(118)63(43(6)123-83-69(110)68(109)65(106)56(38-96)126-83)94(8)58(104)36-85-72(112)50(32-33-57(84)103)88-73(113)49(10-2)87-74(114)51(34-45-24-28-47(100)29-25-45)89-75(115)59(40(3)97)91-77(61)117;1-2-3/h10,24-31,40-43,50-56,59-71,81-83,95-98,100-102,105-111H,9,11-23,32-39H2,1-8H3,(H2,84,103)(H,85,112)(H,86,99)(H,87,114)(H,88,113)(H,89,115)(H,90,118)(H,91,117)(H,92,119)(H,93,116);2H,1H3/b49-10-;/t40-,41?,42+,43?,50+,51+,52-,53+,54?,55-,56-,59-,60?,61-,62-,63?,64-,65-,66?,67-,68+,69+,70-,71+,81+,82-,83+;/m0./s1",DLFNJMIGYDEFKM-MLRJRJFSSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0169,"[C181, ManAc2]Hassallidin D","[C18^1, ManAc2]Hassallidin D",other cyclic peptide,Hassallidin,C87H133N11O35,1891.896555,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCCCC.CC=O.CC=O,"InChI=1S/C83H129N11O33.2C2H4O/c1-9-11-12-13-14-15-16-17-18-19-20-21-22-23-54(124-82-70(111)71(53(102)39-121-82)127-81-62(86-44(7)99)67(108)64(105)55(37-95)125-81)66(107)79(119)92-60(41(4)98)76(116)93-61-42(5)122-80(120)52(35-46-26-30-48(101)31-27-46)90-78(118)63(43(6)123-83-69(110)68(109)65(106)56(38-96)126-83)94(8)58(104)36-85-72(112)50(32-33-57(84)103)88-73(113)49(10-2)87-74(114)51(34-45-24-28-47(100)29-25-45)89-75(115)59(40(3)97)91-77(61)117;2*1-2-3/h10,24-31,40-43,50-56,59-71,81-83,95-98,100-102,105-111H,9,11-23,32-39H2,1-8H3,(H2,84,103)(H,85,112)(H,86,99)(H,87,114)(H,88,113)(H,89,115)(H,90,118)(H,91,117)(H,92,119)(H,93,116);2*2H,1H3/b49-10-;;/t40-,41?,42+,43?,50+,51+,52-,53+,54?,55-,56-,59-,60?,61-,62-,63?,64-,65-,66?,67-,68+,69+,70-,71+,81+,82-,83+;;/m0../s1",AZMBZHGOSYCQRR-QZKJUJIJSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0170,"[C181, ManAc3]Hassallidin D","[C18^1, ManAc3]Hassallidin D",other cyclic peptide,Hassallidin,C89H135N11O36,1933.90712,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](CO)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCCCC.CC=O.CC=O.CC=O,"InChI=1S/C83H129N11O33.3C2H4O/c1-9-11-12-13-14-15-16-17-18-19-20-21-22-23-54(124-82-70(111)71(53(102)39-121-82)127-81-62(86-44(7)99)67(108)64(105)55(37-95)125-81)66(107)79(119)92-60(41(4)98)76(116)93-61-42(5)122-80(120)52(35-46-26-30-48(101)31-27-46)90-78(118)63(43(6)123-83-69(110)68(109)65(106)56(38-96)126-83)94(8)58(104)36-85-72(112)50(32-33-57(84)103)88-73(113)49(10-2)87-74(114)51(34-45-24-28-47(100)29-25-45)89-75(115)59(40(3)97)91-77(61)117;3*1-2-3/h10,24-31,40-43,50-56,59-71,81-83,95-98,100-102,105-111H,9,11-23,32-39H2,1-8H3,(H2,84,103)(H,85,112)(H,86,99)(H,87,114)(H,88,113)(H,89,115)(H,90,118)(H,91,117)(H,92,119)(H,93,116);3*2H,1H3/b49-10-;;;/t40-,41?,42+,43?,50+,51+,52-,53+,54?,55-,56-,59-,60?,61-,62-,63?,64-,65-,66?,67-,68+,69+,70-,71+,81+,82-,83+;;;/m0.../s1",JAEFTIGHEVBHAN-NAOOPYJCSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0171,"[C181, ManAc4]Hassallidin D","[C18^1, ManAc4]Hassallidin D",other cyclic peptide,Hassallidin,C91H137N11O37,1975.917684,O=C(NC(C(O)C)C(N[C@@H]([C@@H](C)OC1=O)C(N[C@@H]([C@H](C)O)C(N[C@@H](C(N/C(C(N[C@@H](C(NCC(N(C(C(N[C@H]1CC2=CC=C(O)C=C2)=O)C(C)O[C@H]3[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](COC(C)=O)O3)C)=O)=O)CCC(N)=O)=O)=C\C)=O)CC4=CC=C(O)C=C4)=O)=O)=O)C(O)C(O[C@H]5[C@@H](O)[C@H](O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6NC(C)=O)[C@H](O)CO5)CCCCCCCCCCCCCCC,"InChI=1S/C91H137N11O37/c1-13-15-16-17-18-19-20-21-22-23-24-25-26-27-62(136-90-75(119)76(61(113)42-130-90)139-89-70(94-48(7)106)74(118)72(116)63(41-103)137-89)73(117)87(127)100-68(45(4)105)84(124)101-69-46(5)131-88(128)60(39-54-30-34-56(112)35-31-54)98-86(126)71(47(6)132-91-79(135-52(11)110)78(134-51(10)109)77(133-50(9)108)64(138-91)43-129-49(8)107)102(12)66(115)40-93-80(120)58(36-37-65(92)114)96-81(121)57(14-2)95-82(122)59(38-53-28-32-55(111)33-29-53)97-83(123)67(44(3)104)99-85(69)125/h14,28-35,44-47,58-64,67-79,89-91,103-105,111-113,116-119H,13,15-27,36-43H2,1-12H3,(H2,92,114)(H,93,120)(H,94,106)(H,95,122)(H,96,121)(H,97,123)(H,98,126)(H,99,125)(H,100,127)(H,101,124)/b57-14-/t44-,45?,46+,47?,58+,59+,60-,61+,62?,63-,64-,67-,68?,69-,70-,71?,72-,73?,74-,75-,76+,77-,78+,79+,89+,90-,91+/m0/s1",GKYIJIRKACVFGI-CBDJWSQGSA-N,,no,Anabaena,n.a.,SYKE748A
CyanoMetDB_0172,Honaucin A,,other linear non-peptide,,C8H9ClO4,204.0189365,O=C(/C=C/CCl)O[C@@H](C1)COC1=O,"InChI=1S/C8H9ClO4/c9-3-1-2-7(10)13-6-4-8(11)12-5-6/h1-2,6H,3-5H2/b2-1+/t6-/m0/s1",UINAZEUJWWJECT-IPWVHJGXSA-N,54759250,yes,Leptolyngbya,crossbyana   ,HI09-1
CyanoMetDB_0173,Portoamide C,,other cyclic peptide,,C62H96N12O19,1312.691469,O=C([C@@H](CCC(N)=O)NC1=O)NCC(N2[C@@H](CCC2)C(N3[C@@H](CCC3)C(N[C@H]([C@@H](C)CC)C(N[C@@H](CO)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](CCC4=CC=C(OC)C=C4)C(N5[C@@H](CCC5)C(NC(CC(O)CC(O)C(O)CC(C)C)C1O)=O)=O)=O)=O)=C/C)=O)=O)=O)=O)=O,"InChI=1S/C62H96N12O19/c1-8-33(5)50-58(88)69-42(31-75)55(85)65-38(9-2)54(84)71-51(34(6)76)59(89)67-40(21-18-35-16-19-37(93-7)20-17-35)61(91)73-25-10-13-43(73)56(86)68-41(28-36(77)29-47(79)46(78)27-32(3)4)52(82)60(90)66-39(22-23-48(63)80)53(83)64-30-49(81)72-24-12-15-45(72)62(92)74-26-11-14-44(74)57(87)70-50/h9,16-17,19-20,32-34,36,39-47,50-52,75-79,82H,8,10-15,18,21-31H2,1-7H3,(H2,63,80)(H,64,83)(H,65,85)(H,66,90)(H,67,89)(H,68,86)(H,69,88)(H,70,87)(H,71,84)/b38-9+/t33-,34+,36?,39+,40+,41?,42-,43-,44-,45-,46?,47?,50+,51-,52?/m0/s1",ACFCYNJDAMJVRV-SFBMPHMPSA-N,146683715,yes,Oscillatoria/Planktothrix,,LEGE 5292 
CyanoMetDB_0174,Portoamide D,,other cyclic peptide,,C61H94N12O18,1282.680904,O=C([C@@H](CCC(N)=O)NC1=O)NCC(N2[C@@H](CCC2)C(N3[C@@H](CCC3)C(N[C@H]([C@@H](C)CC)C(N[C@@H](CO)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](CCC4=CC=CC=C4)C(N5[C@@H](CCC5)C(NC(CC(O)CC(O)C(O)CC(C)C)C1O)=O)=O)=O)=O)=C/C)=O)=O)=O)=O)=O,"InChI=1S/C61H94N12O18/c1-7-33(5)49-57(87)68-41(31-74)54(84)64-37(8-2)53(83)70-50(34(6)75)58(88)66-39(21-20-35-15-10-9-11-16-35)60(90)72-25-12-17-42(72)55(85)67-40(28-36(76)29-46(78)45(77)27-32(3)4)51(81)59(89)65-38(22-23-47(62)79)52(82)63-30-48(80)71-24-14-19-44(71)61(91)73-26-13-18-43(73)56(86)69-49/h8-11,15-16,32-34,36,38-46,49-51,74-78,81H,7,12-14,17-31H2,1-6H3,(H2,62,79)(H,63,82)(H,64,84)(H,65,89)(H,66,88)(H,67,85)(H,68,87)(H,69,86)(H,70,83)/b37-8+/t33-,34+,36?,38+,39+,40?,41-,42-,43-,44-,45?,46?,49+,50-,51?/m0/s1",OCPKVHKLLYWOOG-FIAGRJNLSA-N,146683716,yes,Oscillatoria/Planktothrix,,LEGE 5292 
CyanoMetDB_0175,Pahayokolide A,,other cyclic peptide,other cyclic depsipeptide,C72H105N13O20,1471.759883,O=C(C(CCC(N)=O)NC1=O)NCC(N2C(CCC2)C(NC(CC3=CC=CC=C3)C(N/C(C(NC(CO)C(N/C(C(NC(C(C)O)C(NC(CCC4=CC=CC=C4)C(N5C(CCC5)C(NC(CC(OC(C(N(C(C)=O)C)CC(C)C)=O)CC(O)C(O)CC(C)C)C1O)=O)=O)=O)=O)=C/C)=O)=O)=C\C)=O)=O)=O,"InChI=1S/C72H105N13O20/c1-10-46-63(95)81-52(38-86)66(98)76-47(11-2)64(96)82-60(41(7)87)69(101)78-49(27-26-43-20-14-12-15-21-43)71(103)85-31-19-25-54(85)68(100)79-50(35-45(36-57(90)56(89)33-40(5)6)105-72(104)55(32-39(3)4)83(9)42(8)88)61(93)70(102)77-48(28-29-58(73)91)62(94)74-37-59(92)84-30-18-24-53(84)67(99)80-51(65(97)75-46)34-44-22-16-13-17-23-44/h10-17,20-23,39-41,45,48-57,60-61,86-87,89-90,93H,18-19,24-38H2,1-9H3,(H2,73,91)(H,74,94)(H,75,97)(H,76,98)(H,77,102)(H,78,101)(H,79,100)(H,80,99)(H,81,95)(H,82,96)/b46-10-,47-11+",KAWIJJOWYRPPRV-XNHNMQOCSA-N,,yes,Lyngbya,n.a.,strain 15-2
CyanoMetDB_0176,Pahayokolide B,,other cyclic peptide,,C63H90N12O18,1302.649604,O=C(C(CCC(N)=O)NC1=O)NCC(N2C(CCC2)C(NC(CC3=CC=CC=C3)C(N/C(C(NC(CO)C(N/C(C(NC(C(C)O)C(NC(CCC4=CC=CC=C4)C(N5C(CCC5)C(NC(CC(O)CC(O)C(O)CC(C)C)C1O)=O)=O)=O)=O)=C/C)=O)=O)=C\C)=O)=O)=O,"InChI=1S/C63H90N12O18/c1-6-39-55(85)72-45(33-76)58(88)67-40(7-2)56(86)73-52(35(5)77)61(91)69-42(23-22-36-16-10-8-11-17-36)63(93)75-27-15-21-47(75)60(90)70-43(30-38(78)31-49(80)48(79)28-34(3)4)53(83)62(92)68-41(24-25-50(64)81)54(84)65-32-51(82)74-26-14-20-46(74)59(89)71-44(57(87)66-39)29-37-18-12-9-13-19-37/h6-13,16-19,34-35,38,41-49,52-53,76-80,83H,14-15,20-33H2,1-5H3,(H2,64,81)(H,65,84)(H,66,87)(H,67,88)(H,68,92)(H,69,91)(H,70,90)(H,71,89)(H,72,85)(H,73,86)/b39-6-,40-7+",OIVBMJYHGKIQDX-PLLOCQCISA-N,,yes,Lyngbya,n.a.,strain 15-2
CyanoMetDB_0177,Muscotoxin A,,other cyclic peptide,,C58H90N12O16,1210.659775,O=C([C@@H](CCC(N)=O)NC1=O)NCC(N2[C@@H](CCC2)C(N[C@@H](CC3=CC=CC=C3)C(N[C@H]([C@@H](C)CC)C(N[C@@H](CO)C(N/C(C(N[C@@H](CO)C(N[C@H]([C@H](CC)C)C(N4[C@@H](CCC4)C(NC(CC(O)CCCCC)C1O)=O)=O)=O)=O)=C/C)=O)=O)=O)=O)=O,"InChI=1S/C58H90N12O16/c1-7-11-13-20-35(73)28-38-48(76)57(85)62-37(23-24-44(59)74)49(77)60-29-45(75)69-25-16-21-42(69)54(82)64-39(27-34-18-14-12-15-19-34)51(79)67-46(32(5)8-2)56(84)66-40(30-71)52(80)61-36(10-4)50(78)65-41(31-72)53(81)68-47(33(6)9-3)58(86)70-26-17-22-43(70)55(83)63-38/h10,12,14-15,18-19,32-33,35,37-43,46-48,71-73,76H,7-9,11,13,16-17,20-31H2,1-6H3,(H2,59,74)(H,60,77)(H,61,80)(H,62,85)(H,63,83)(H,64,82)(H,65,78)(H,66,84)(H,67,79)(H,68,81)/b36-10+/t32-,33-,35?,37+,38?,39-,40-,41-,42-,43-,46+,47+,48?/m0/s1",WYLYXGBHDIWORI-OJRIBGMLSA-N,146683706,yes,Desmonostoc,muscorum,n.a.
CyanoMetDB_0178,Muscotoxin B,,other cyclic peptide,,C59H92N12O16,1224.675425,O=C([C@@H](CCC(N)=O)NC1=O)NCC(N2[C@@H](CC(C)C2)C(N[C@@H](CC3=CC=CC=C3)C(N[C@H]([C@@H](C)CC)C(N[C@@H](CO)C(N/C(C(N[C@@H](CO)C(N[C@H]([C@H](CC)C)C(N4[C@@H](CCC4)C(NC(CC(O)CCCCC)C1O)=O)=O)=O)=O)=C/C)=O)=O)=O)=O)=O,"InChI=1S/C59H92N12O16/c1-8-12-14-20-36(74)27-39-49(77)58(86)63-38(22-23-45(60)75)50(78)61-28-46(76)71-29-32(5)25-44(71)56(84)65-40(26-35-18-15-13-16-19-35)52(80)68-47(33(6)9-2)57(85)67-41(30-72)53(81)62-37(11-4)51(79)66-42(31-73)54(82)69-48(34(7)10-3)59(87)70-24-17-21-43(70)55(83)64-39/h11,13,15-16,18-19,32-34,36,38-44,47-49,72-74,77H,8-10,12,14,17,20-31H2,1-7H3,(H2,60,75)(H,61,78)(H,62,81)(H,63,86)(H,64,83)(H,65,84)(H,66,79)(H,67,85)(H,68,80)(H,69,82)/b37-11+/t32?,33-,34-,36?,38+,39?,40-,41-,42-,43-,44-,47+,48+,49?/m0/s1",IENVYLXDLCRGRL-SIGWKKDNSA-N,146683707,yes,Desmonostoc,muscorum,n.a.
CyanoMetDB_0180,Minutissamide H,,other cyclic peptide,,C60H102N12O16,1246.753675,C[C@H]([C@@H]1[C@@H](O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H](C(C)C)C(N[C@H](C(N[C@@H](CCC(N)=O)C(N[C@H](C)C(N[C@@H]([C@@H](C)OC)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)=C/C)=O)=O)CCCCCCCCCCC(CCC)=O,"InChI=1S/C60H102N12O16/c1-13-24-38(74)26-22-20-18-16-15-17-19-21-25-34(7)47-50(77)58(85)67-45(32(3)4)55(82)64-39(14-2)52(79)66-46(33(5)6)56(83)69-48(36(9)73)57(84)65-40(28-29-43(61)75)53(80)63-35(8)51(78)70-49(37(10)88-12)60(87)71(11)42(31-44(62)76)59(86)72-30-23-27-41(72)54(81)68-47/h14,32-37,40-42,45-50,73,77H,13,15-31H2,1-12H3,(H2,61,75)(H2,62,76)(H,63,80)(H,64,82)(H,65,84)(H,66,79)(H,67,85)(H,68,81)(H,69,83)(H,70,78)/b39-14+/t34-,35+,36+,37+,40-,41-,42-,45-,46-,47+,48-,49-,50+/m0/s1",ATLSVDMFFMPPRZ-RAQHCFLESA-N,146683774,yes,Anabaena,n.a.,UIC 10035 
CyanoMetDB_0181,Minutissamide I,,other cyclic peptide,,C58H98N12O17,1234.71729,C[C@H]([C@@H]1[C@@H](O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC(N[C@@H]([C@@H](C)OC)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)=C/C)=O)=O)CCCCCCCCCCC(CCC)=O,"InChI=1S/C58H98N12O17/c1-11-22-36(73)24-20-18-16-14-13-15-17-19-23-32(5)45-49(77)56(84)65-44(31(3)4)53(81)62-37(12-2)51(79)67-47(34(7)72)55(83)68-46(33(6)71)54(82)63-38(26-27-41(59)74)50(78)61-30-43(76)64-48(35(8)87-10)58(86)69(9)40(29-42(60)75)57(85)70-28-21-25-39(70)52(80)66-45/h12,31-35,38-40,44-49,71-72,77H,11,13-30H2,1-10H3,(H2,59,74)(H2,60,75)(H,61,78)(H,62,81)(H,63,82)(H,64,76)(H,65,84)(H,66,80)(H,67,79)(H,68,83)/b37-12+/t32-,33+,34+,35+,38-,39-,40-,44-,45+,46-,47-,48-,49+/m0/s1",AMMOFLIZXVOQED-SQXQCVBBSA-N,71460174,yes,Anabaena,n.a.,UIC 10035 
CyanoMetDB_0182,Minutissamide J,,other cyclic peptide,,C54H91ClN12O16,1198.636453,C[C@H]([C@@H]1[C@@H](O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC(N[C@@H]([C@@H](C)OC)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)=C/C)=O)=O)CCCCCCCC(Cl)CC,"InChI=1S/C54H91ClN12O16/c1-11-32(55)20-17-15-13-14-16-19-28(5)41-45(73)52(80)62-40(27(3)4)49(77)59-33(12-2)47(75)64-43(30(7)69)51(79)65-42(29(6)68)50(78)60-34(22-23-37(56)70)46(74)58-26-39(72)61-44(31(8)83-10)54(82)66(9)36(25-38(57)71)53(81)67-24-18-21-35(67)48(76)63-41/h12,27-32,34-36,40-45,68-69,73H,11,13-26H2,1-10H3,(H2,56,70)(H2,57,71)(H,58,74)(H,59,77)(H,60,78)(H,61,72)(H,62,80)(H,63,76)(H,64,75)(H,65,79)/b33-12+/t28-,29+,30+,31+,32?,34-,35-,36-,40-,41+,42-,43-,44-,45+/m0/s1",NIDDARZGUNVVRQ-ORFYYFLYSA-N,71458332,yes,Anabaena,n.a.,UIC 10035 
CyanoMetDB_0183,Honaucin B,,other linear non-peptide,,C10H15ClO5,250.0608013,O=C(/C=C/CCl)OC[C@@H](O)CC(OCC)=O,"InChI=1S/C10H15ClO5/c1-2-15-10(14)6-8(12)7-16-9(13)4-3-5-11/h3-4,8,12H,2,5-7H2,1H3/b4-3+/t8-/m0/s1",YQZICEWUDHFMQN-RTMURIBGSA-N,71744718,yes,Leptolyngbya,crossbyana   ,HI09-1
CyanoMetDB_0184,Minutissamide K,,other cyclic peptide,,C58H100N12O17,1236.73294,C[C@H]([C@@H]1[C@@H](O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC(N[C@@H]([C@@H](C)OC)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)=C/C)=O)=O)CCCCCCCCCCC(O)CCC,"InChI=1S/C58H100N12O17/c1-11-22-36(73)24-20-18-16-14-13-15-17-19-23-32(5)45-49(77)56(84)65-44(31(3)4)53(81)62-37(12-2)51(79)67-47(34(7)72)55(83)68-46(33(6)71)54(82)63-38(26-27-41(59)74)50(78)61-30-43(76)64-48(35(8)87-10)58(86)69(9)40(29-42(60)75)57(85)70-28-21-25-39(70)52(80)66-45/h12,31-36,38-40,44-49,71-73,77H,11,13-30H2,1-10H3,(H2,59,74)(H2,60,75)(H,61,78)(H,62,81)(H,63,82)(H,64,76)(H,65,84)(H,66,80)(H,67,79)(H,68,83)/b37-12+/t32-,33+,34+,35+,36?,38-,39-,40-,44-,45+,46-,47-,48-,49+/m0/s1",YMEOXEZESXAOCK-NBWKXUPJSA-N,71473253,yes,Anabaena,n.a.,UIC 10035 
CyanoMetDB_0185,Minutissamide L,,other cyclic peptide,,C59H100N12O16,1232.738025,C[C@H]([C@@H]1[C@@H](O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H](C(C)C)C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC(N[C@@H]([C@@H](C)OC)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)=C/C)=O)=O)CCCCCCCCCCC(CCC)=O,"InChI=1S/C59H100N12O16/c1-12-23-37(73)25-21-19-17-15-14-16-18-20-24-34(7)47-50(77)57(84)67-45(32(3)4)54(81)63-38(13-2)52(79)66-46(33(5)6)55(82)69-48(35(8)72)56(83)64-39(27-28-42(60)74)51(78)62-31-44(76)65-49(36(9)87-11)59(86)70(10)41(30-43(61)75)58(85)71-29-22-26-40(71)53(80)68-47/h13,32-36,39-41,45-50,72,77H,12,14-31H2,1-11H3,(H2,60,74)(H2,61,75)(H,62,78)(H,63,81)(H,64,83)(H,65,76)(H,66,79)(H,67,84)(H,68,80)(H,69,82)/b38-13+/t34-,35+,36+,39-,40-,41-,45-,46-,47+,48-,49-,50+/m0/s1",OEHRGVTZXOKCIX-UTYYAIRYSA-N,146683775,yes,Anabaena,n.a.,UIC 10035 
CyanoMetDB_0186,[D-Val9]Laxaphycin A,,other cyclic peptide,Laxaphycins,C59H95N11O14,1181.705997,O=C(C[C@H](NC(CNC([C@H](CC(C)C)NC([C@H](NC([C@H]([C@H](CC)C)NC([C@@H](CC(C)C)NC([C@H](NC([C@H](CCO)NC([C@H]1N2C[C@H](O)C1)=O)=O)CC3=CC=CC=C3)=O)=O)=O)C(C)C)=O)=O)=O)CCCCC)N[C@@H](CCO)C(N/C(C2=O)=C/C)=O,"InChI=1S/C59H95N11O14/c1-11-14-16-21-38-29-47(74)62-41(22-24-71)52(77)63-40(13-3)59(84)70-32-39(73)30-46(70)56(81)64-42(23-25-72)53(78)66-45(28-37-19-17-15-18-20-37)54(79)65-44(27-34(6)7)55(80)69-50(36(10)12-2)58(83)68-49(35(8)9)57(82)67-43(26-33(4)5)51(76)60-31-48(75)61-38/h13,15,17-20,33-36,38-39,41-46,49-50,71-73H,11-12,14,16,21-32H2,1-10H3,(H,60,76)(H,61,75)(H,62,74)(H,63,77)(H,64,81)(H,65,79)(H,66,78)(H,67,82)(H,68,83)(H,69,80)/b40-13+/t36-,38+,39+,41-,42-,43-,44+,45+,46-,49+,50-/m0/s1",SVJZMRXSYHBCBV-VJDBXJDMSA-N,146682311,yes,Anabaena,torulosa,n.a.
CyanoMetDB_0187,Acyclolaxaphycin B,,other linear peptide,Laxaphycins,C65H116N14O20,1412.849032,O=C(C[C@H](NC([C@H]([C@@H](C)O)NC([C@H](NC([C@H]1N(CCC1)C([C@H]([C@@H](C)O)NC([C@@H]([C@@H](O)C(N)=O)NC([C@H]([C@@H](C)CC)N(C)C([C@H](CCC(N)=O)NC([C@@H]([C@@H](O)C(C)C)NC([C@H](C)N)=O)=O)=O)=O)=O)=O)=O)CC(C)C)=O)=O)CCCCCCC)N[C@@H](C(C)C)C(N[C@H]([C@@H](O)C(C)C)C(O)=O)=O,"InChI=1S/C65H116N14O20/c1-16-18-19-20-21-23-38(29-43(83)72-44(31(5)6)58(91)77-49(65(98)99)52(85)33(9)10)69-59(92)45(36(13)80)73-56(89)40(28-30(3)4)71-57(90)41-24-22-27-79(41)64(97)46(37(14)81)74-61(94)48(53(86)54(68)87)76-62(95)50(34(11)17-2)78(15)63(96)39(25-26-42(67)82)70-60(93)47(51(84)32(7)8)75-55(88)35(12)66/h30-41,44-53,80-81,84-86H,16-29,66H2,1-15H3,(H2,67,82)(H2,68,87)(H,69,92)(H,70,93)(H,71,90)(H,72,83)(H,73,89)(H,74,94)(H,75,88)(H,76,95)(H,77,91)(H,98,99)/t34-,35-,36+,37+,38+,39-,40+,41-,44-,45-,46-,47+,48+,49+,50-,51-,52-,53+/m0/s1",ARBTXEGGGLHUPG-FYHKVEBYSA-N,,yes,Anabaena,torulosa,n.a.
CyanoMetDB_0188,Acyclolaxaphycin B3,,other linear peptide,Laxaphycins,C66H118N14O20,1426.864682,O=C(C[C@H](NC([C@H]([C@@H](C)O)NC([C@H](NC([C@H]1N(C[C@H](C)C1)C([C@H]([C@@H](C)O)NC([C@@H]([C@@H](O)C(N)=O)NC([C@H]([C@@H](C)CC)N(C)C([C@H](CCC(N)=O)NC([C@@H]([C@@H](O)C(C)C)NC([C@H](C)N)=O)=O)=O)=O)=O)=O)=O)CC(C)C)=O)=O)CCCCCCC)N[C@@H](C(C)C)C(N[C@H]([C@@H](O)C(C)C)C(O)=O)=O,"InChI=1S/C66H118N14O20/c1-17-19-20-21-22-23-39(28-44(84)73-45(31(5)6)59(92)78-50(66(99)100)53(86)33(9)10)70-60(93)46(37(14)81)74-57(90)41(26-30(3)4)72-58(91)42-27-34(11)29-80(42)65(98)47(38(15)82)75-62(95)49(54(87)55(69)88)77-63(96)51(35(12)18-2)79(16)64(97)40(24-25-43(68)83)71-61(94)48(52(85)32(7)8)76-56(89)36(13)67/h30-42,45-54,81-82,85-87H,17-29,67H2,1-16H3,(H2,68,83)(H2,69,88)(H,70,93)(H,71,94)(H,72,91)(H,73,84)(H,74,90)(H,75,95)(H,76,89)(H,77,96)(H,78,92)(H,99,100)/t34-,35+,36+,37-,38-,39-,40+,41-,42+,45+,46+,47+,48-,49-,50-,51+,52+,53+,54-/m1/s1",SDKDQGYLPSSDTQ-HRJBWAHDSA-N,,yes,Anabaena,torulosa,n.a.
CyanoMetDB_0189,Scytocyclamide A,,other cyclic peptide,,C61H98N12O14,1222.732546,O=C(N[C@@H](C(N/C(C1=O)=C/C)=O)CCC(N)=O)CC(CCCCC)NC(CNC([C@H](NC([C@H]([C@@H](CC)C)NC([C@@H](NC([C@H](NC([C@@H](CC2=CC=CC=C2)NC([C@H](NC([C@H]3N1C[C@@H](C3)O)=O)CCO)=O)=O)CC(C)C)=O)[C@H](C)CC)=O)=O)CC(C)C)=O)=O,"InChI=1S/C61H98N12O14/c1-11-15-17-22-39-30-49(77)65-42(23-24-48(62)76)54(80)66-41(14-4)61(87)73-33-40(75)31-47(73)58(84)67-43(25-26-74)55(81)69-46(29-38-20-18-16-19-21-38)56(82)68-45(28-35(7)8)57(83)71-52(37(10)13-3)60(86)72-51(36(9)12-2)59(85)70-44(27-34(5)6)53(79)63-32-50(78)64-39/h14,16,18-21,34-37,39-40,42-47,51-52,74-75H,11-13,15,17,22-33H2,1-10H3,(H2,62,76)(H,63,79)(H,64,78)(H,65,77)(H,66,80)(H,67,84)(H,68,82)(H,69,81)(H,70,85)(H,71,83)(H,72,86)/b41-14+/t36-,37-,39?,40-,42-,43-,44-,45-,46-,47+,51+,52+/m1/s1",FXNSTMGRWLTKFF-YKUYVWFBSA-N,,yes,Scytonema,hofmannii ,PCC 7110
CyanoMetDB_0190,Scytocyclamide B,,other cyclic peptide,,C63H110N14O19,1366.807167,O=C(N[C@H](C(N[C@@H](C(N[C@@H](C(N[C@@H](C(N[C@H](C(N([C@@H](C(N[C@@H](C(N[C@H](C(N1CCC[C@H]1C(N[C@@H]2CC(C)C)=O)=O)[C@@H](O)C)=O)C(C(N)=O)O)=O)[C@@H](CC)C)C)=O)CCC(N)=O)=O)C(C(C)C)O)=O)C)=O)C(C(C)C)O)=O)C(C)C)CC(CCCCC)NC([C@@H](NC2=O)[C@H](O)C)=O,"InChI=1S/C63H110N14O19/c1-16-18-19-21-36-27-41(81)70-42(29(5)6)56(89)74-45(49(82)30(7)8)58(91)66-33(12)53(86)73-46(50(83)31(9)10)59(92)68-37(23-24-40(64)80)62(95)76(15)48(32(11)17-2)61(94)75-47(51(84)52(65)85)60(93)72-44(35(14)79)63(96)77-25-20-22-39(77)55(88)69-38(26-28(3)4)54(87)71-43(34(13)78)57(90)67-36/h28-39,42-51,78-79,82-84H,16-27H2,1-15H3,(H2,64,80)(H2,65,85)(H,66,91)(H,67,90)(H,68,92)(H,69,88)(H,70,81)(H,71,87)(H,72,93)(H,73,86)(H,74,89)(H,75,94)/t32-,33-,34-,35+,36?,37+,38-,39+,42+,43+,44+,45-,46-,47-,48-,49?,50?,51?/m1/s1",OIXICRGCRLGQCN-OBKLPJIUSA-N,,yes,Scytonema,hofmannii ,PCC 7110
CyanoMetDB_0191,Scytocyclamide C,,other cyclic peptide,,C63H110N14O18,1350.812253,O=C(N[C@H](C(N[C@@H](C(N[C@@H](C(N[C@@H](C(N[C@H](C(N([C@@H](C(N[C@@H](C(N[C@H](C(N1CCC[C@H]1C(N[C@@H]2CC(C)C)=O)=O)[C@@H](O)C)=O)C(C(N)=O)O)=O)[C@@H](CC)C)C)=O)CCC(N)=O)=O)CC(C)C)=O)C)=O)C(C(C)C)O)=O)C(C)C)CC(CCCCC)NC([C@@H](NC2=O)[C@H](O)C)=O,"InChI=1S/C63H110N14O18/c1-16-18-19-21-37-28-43(81)71-44(31(7)8)57(89)74-47(50(82)32(9)10)59(91)66-34(12)53(85)69-39(26-29(3)4)54(86)68-38(23-24-42(64)80)62(94)76(15)49(33(11)17-2)61(93)75-48(51(83)52(65)84)60(92)73-46(36(14)79)63(95)77-25-20-22-41(77)56(88)70-40(27-30(5)6)55(87)72-45(35(13)78)58(90)67-37/h29-41,44-51,78-79,82-83H,16-28H2,1-15H3,(H2,64,80)(H2,65,84)(H,66,91)(H,67,90)(H,68,86)(H,69,85)(H,70,88)(H,71,81)(H,72,87)(H,73,92)(H,74,89)(H,75,93)/t33-,34-,35-,36+,37?,38+,39-,40-,41+,44+,45+,46+,47-,48-,49-,50?,51?/m1/s1",MXJFACMBSIQIJG-RAVCUMSJSA-N,,yes,Scytonema,hofmannii ,PCC 7110
CyanoMetDB_0192,Laxaphycin A2,[D-Val8]Laxaphycin A,other cyclic peptide,Laxaphycins,C59H95N11O14,1181.705997,O=C(C[C@H](NC(CNC([C@H](CC(C)C)NC([C@H](NC([C@H](C(C)C)NC([C@@H](CC(C)C)NC([C@H](NC([C@H](CCO)NC([C@H]1N2C[C@H](O)C1)=O)=O)CC3=CC=CC=C3)=O)=O)=O)[C@@H](C)CC)=O)=O)=O)CCCCC)N[C@@H](CCO)C(N/C(C2=O)=C/C)=O,"InChI=1S/C59H95N11O14/c1-11-14-16-21-38-29-47(74)62-41(22-24-71)52(77)63-40(13-3)59(84)70-32-39(73)30-46(70)56(81)64-42(23-25-72)53(78)66-45(28-37-19-17-15-18-20-37)54(79)65-44(27-34(6)7)55(80)68-49(35(8)9)57(82)69-50(36(10)12-2)58(83)67-43(26-33(4)5)51(76)60-31-48(75)61-38/h13,15,17-20,33-36,38-39,41-46,49-50,71-73H,11-12,14,16,21-32H2,1-10H3,(H,60,76)(H,61,75)(H,62,74)(H,63,77)(H,64,81)(H,65,79)(H,66,78)(H,67,83)(H,68,80)(H,69,82)/b40-13+/t36-,38+,39+,41-,42-,43-,44+,45+,46-,49-,50+/m0/s1",IMWMAZYOIVRRPT-OBCLSNTFSA-N,145969879,yes,Hormothamnion,enteromorphoides,n.a.
CyanoMetDB_0193,Laxaphycin B4,,other cyclic peptide,Laxaphycins,C66H116N14O21,1440.843947,O=C(C[C@H](NC([C@H]([C@@H](C)O)N1)=O)CCCCCCC)N[C@@H](C(C)C)C(N[C@H]([C@@H](O)C(C)C)C(N[C@@H](CCO)C(N[C@H]([C@@H](O)C(C)C)C(N[C@@H](CCC(N)=O)C(N(C)[C@@H]([C@@H](C)CC)C(N[C@H]([C@@H](O)C(N)=O)C(N[C@@H]([C@@H](C)O)C(N(C[C@H](O)C2)[C@@H]2C(N[C@@H](C1=O)CC(C)C)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C66H116N14O21/c1-15-17-18-19-20-21-37-27-44(86)73-45(31(5)6)59(94)77-49(53(88)33(9)10)61(96)70-39(24-25-81)56(91)76-48(52(87)32(7)8)62(97)71-40(22-23-43(67)85)65(100)79(14)51(34(11)16-2)64(99)78-50(54(89)55(68)90)63(98)75-47(36(13)83)66(101)80-29-38(84)28-42(80)58(93)72-41(26-30(3)4)57(92)74-46(35(12)82)60(95)69-37/h30-42,45-54,81-84,87-89H,15-29H2,1-14H3,(H2,67,85)(H2,68,90)(H,69,95)(H,70,96)(H,71,97)(H,72,93)(H,73,86)(H,74,92)(H,75,98)(H,76,91)(H,77,94)(H,78,99)/t34-,35+,36+,37+,38+,39-,40-,41+,42-,45-,46-,47-,48+,49+,50+,51-,52-,53-,54+/m0/s1",NNKYQEVQQULDSP-VUOJQXDJSA-N,145970553,yes,Hormothamnion,enteromorphoides,n.a.
CyanoMetDB_0194,Honaucin C,,other linear non-peptide,,C9H13ClO5,236.0451512,O=C(/C=C/CCl)OC[C@@H](O)CC(OC)=O,"InChI=1S/C9H13ClO5/c1-14-9(13)5-7(11)6-15-8(12)3-2-4-10/h2-3,7,11H,4-6H2,1H3/b3-2+/t7-/m0/s1",GLWKWBIUIXELQR-AIYRYJHASA-N,71744755,yes,Leptolyngbya,crossbyana   ,HI09-1
CyanoMetDB_0195,Kimbeamide A,,other linear non-peptide,,C17H23Cl2NO,327.1156698,C/C(C/C=C/C=C/C(N[C@H](/C=C\CC/C=C/Cl)C)=O)=C\Cl,"InChI=1S/C17H23Cl2NO/c1-15(14-19)10-6-5-8-12-17(21)20-16(2)11-7-3-4-9-13-18/h5-9,11-14,16H,3-4,10H2,1-2H3,(H,20,21)/b6-5+,11-7-,12-8+,13-9+,15-14+/t16-/m0/s1",VOWNHWSVEUWZQX-HUVZLFSQSA-N,57415038,yes,Symploca,   ,PCC 8002
CyanoMetDB_0196,Ambiguine B isonitrile,,other linear non-peptide,,C26H31ClN2O,422.2124913,CC1(C)C2=C3C(NC(C(C)(C=C)C)=C3[C@@]4(O)[C@@H]([N+]#[C-])[C@@](C)(C=C)[C@H](Cl)C[C@@]41[H])=CC=C2,"InChI=1S/C26H31ClN2O/c1-9-23(3,4)21-20-19-15(12-11-13-16(19)29-21)24(5,6)17-14-18(27)25(7,10-2)22(28-8)26(17,20)30/h9-13,17-18,22,29-30H,1-2,14H2,3-7H3/t17-,18-,22+,25+,26-/m1/s1",XNSXDDHLEKKURV-PJYKFWTKSA-N,21610113,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_0197,Kimbeamide B,,other linear non-peptide,,C17H23Cl2NO,327.1156698,C/C(C/C=C\C=C\C(N[C@H](/C=C\CC/C=C/Cl)C)=O)=C\Cl,"InChI=1S/C17H23Cl2NO/c1-15(14-19)10-6-5-8-12-17(21)20-16(2)11-7-3-4-9-13-18/h5-9,11-14,16H,3-4,10H2,1-2H3,(H,20,21)/b6-5-,11-7-,12-8+,13-9+,15-14+/t16-/m0/s1",VOWNHWSVEUWZQX-SLMJHOPOSA-N,57415039,yes,Symploca,   ,PCC 8002
CyanoMetDB_0198,Kimbeamide C,,other linear non-peptide,,C17H23Cl2NO,327.1156698,C/C(C/C=C\C=C\C(N[C@H](/C=C/CC/C=C/Cl)C)=O)=C\Cl,"InChI=1S/C17H23Cl2NO/c1-15(14-19)10-6-5-8-12-17(21)20-16(2)11-7-3-4-9-13-18/h5-9,11-14,16H,3-4,10H2,1-2H3,(H,20,21)/b6-5-,11-7+,12-8+,13-9+,15-14+/t16-/m0/s1",VOWNHWSVEUWZQX-RWZASHGDSA-N,57415040,yes,Symploca,   ,PCC 8002
CyanoMetDB_0199,Janthielamide A,,other linear non-peptide,,C18H28ClNO,309.1859422,C/C(C)=C\C(NCC[C@@H](C)/C=C/C[C@H](/C=C/C=C\Cl)C)=O,"InChI=1S/C18H28ClNO/c1-15(2)14-18(21)20-13-11-17(4)10-7-9-16(3)8-5-6-12-19/h5-8,10,12,14,16-17H,9,11,13H2,1-4H3,(H,20,21)/b8-5+,10-7+,12-6-/t16-,17-/m0/s1",MOHXYZAMHAZRDC-GXVZJEIESA-N,57415037,yes,Symploca,   ,PCC 8002
CyanoMetDB_0200,Kimbelactone A,,other linear non-peptide,,C19H25ClO3,336.1492224,Cl/C=C(C)/C=C/C(/C=C\C=C\CCC1CC(OC)=CC(O1)=O)C,"InChI=1S/C19H25ClO3/c1-15(10-11-16(2)14-20)8-6-4-5-7-9-17-12-18(22-3)13-19(21)23-17/h4-6,8,10-11,13-15,17H,7,9,12H2,1-3H3/b5-4+,8-6-,11-10+,16-14+",FFQPDMLQLMDNCB-OOYZWKPBSA-N,57415163,yes,Symploca,   ,PCC 8002
CyanoMetDB_0201,Majusculamide A,,other linear peptide,,C28H45N3O5,503.3359216,CCCCCCCC([C@@H](C)C(N(C)[C@H](CC1=CC=C(OC)C=C1)C(N(C)[C@@H](C(C)C)C(N)=O)=O)=O)=O,"InChI=1S/C28H45N3O5/c1-8-9-10-11-12-13-24(32)20(4)27(34)30(5)23(18-21-14-16-22(36-7)17-15-21)28(35)31(6)25(19(2)3)26(29)33/h14-17,19-20,23,25H,8-13,18H2,1-7H3,(H2,29,33)/t20-,23-,25+/m1/s1",KKNYIFDIQAVMQG-XRODADMRSA-N,23425795,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0202,Majusculamide B,,other linear peptide,,C28H45N3O5,503.3359216,COc1ccc(C[C@H](C(=O)N(C)[C@@H](C(C)C)C(N)=O)N(C)C(=O)[C@@H](C)C(=O)CCCCCCC)cc1,"InChI=1S/C28H45N3O5/c1-8-9-10-11-12-13-24(32)20(4)27(34)30(5)23(18-21-14-16-22(36-7)17-15-21)28(35)31(6)25(19(2)3)26(29)33/h14-17,19-20,23,25H,8-13,18H2,1-7H3,(H2,29,33)/t20-,23+,25-/m0/s1",KKNYIFDIQAVMQG-ZWSUVBHBSA-N,23425796,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0203,Microcarbonin A,,other linear non-peptide,,C25H36O2,368.2715304,CCCCCCCCCCC1=C(O)C=C(C#CC#CCCCCC)C=C1O,"InChI=1S/C25H36O2/c1-3-5-7-9-11-13-15-17-19-23-24(26)20-22(21-25(23)27)18-16-14-12-10-8-6-4-2/h20-21,26-27H,3-11,13,15,17,19H2,1-2H3",SIKKSDHUYNQRBH-UHFFFAOYSA-N,71445464,yes,Microcystis,n.a.,MB-K  
CyanoMetDB_0204,Minutissamide E,,other cyclic peptide,,C59H100N12O17,1248.73294,C[C@H]([C@@H]1[C@@H](O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](C(N[C@@H](CCC(N)=O)C(N[C@H](C)C(N[C@@H]([C@@H](C)OC)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)=C/C)=O)=O)CCCCCCCCCCC(CCC)=O,"InChI=1S/C59H100N12O17/c1-12-23-37(74)25-21-19-17-15-14-16-18-20-24-32(5)45-49(77)57(85)65-44(31(3)4)54(82)63-38(13-2)51(79)67-47(35(8)73)56(84)68-46(34(7)72)55(83)64-39(27-28-42(60)75)52(80)62-33(6)50(78)69-48(36(9)88-11)59(87)70(10)41(30-43(61)76)58(86)71-29-22-26-40(71)53(81)66-45/h13,31-36,39-41,44-49,72-73,77H,12,14-30H2,1-11H3,(H2,60,75)(H2,61,76)(H,62,80)(H,63,82)(H,64,83)(H,65,85)(H,66,81)(H,67,79)(H,68,84)(H,69,78)/b38-13+/t32-,33+,34+,35+,36+,39-,40-,41-,44-,45+,46-,47-,48-,49+/m0/s1",MUPONHUIXXXUHO-KLTDWDBASA-N,71458331,yes,Anabaena,n.a.,UIC 10035 
CyanoMetDB_0205,Minutissamide F,,other cyclic peptide,,C55H93ClN12O16,1212.652103,C[C@H]([C@@H]1[C@@H](O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](C(N[C@@H](CCC(N)=O)C(N[C@H](C)C(N[C@@H]([C@@H](C)OC)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)=C/C)=O)=O)CCCCCCCC(Cl)CC,"InChI=1S/C55H93ClN12O16/c1-12-33(56)21-18-16-14-15-17-20-28(5)41-45(73)53(81)62-40(27(3)4)50(78)60-34(13-2)47(75)64-43(31(8)70)52(80)65-42(30(7)69)51(79)61-35(23-24-38(57)71)48(76)59-29(6)46(74)66-44(32(9)84-11)55(83)67(10)37(26-39(58)72)54(82)68-25-19-22-36(68)49(77)63-41/h13,27-33,35-37,40-45,69-70,73H,12,14-26H2,1-11H3,(H2,57,71)(H2,58,72)(H,59,76)(H,60,78)(H,61,79)(H,62,81)(H,63,77)(H,64,75)(H,65,80)(H,66,74)/b34-13+/t28-,29+,30+,31+,32+,33?,35-,36-,37-,40-,41+,42-,43-,44-,45+/m0/s1",QDBDOUAQHHPCNC-SOYRVYTOSA-N,71461884,yes,Anabaena,n.a.,UIC 10035 
CyanoMetDB_0206,Mirabilene A isonitrile,,other linear non-peptide,,C24H41NO4,407.3035588,C[C@H]([N+]#[C-])C/C=C(C)/C=C(C)/[C@@H](OC)C[C@@H](OC)C[C@@H](OC)C[C@@H](OC)CC=C,"InChI=1S/C24H41NO4/c1-10-11-21(26-6)15-22(27-7)16-23(28-8)17-24(29-9)19(3)14-18(2)12-13-20(4)25-5/h10,12,14,20-24H,1,11,13,15-17H2,2-4,6-9H3/b18-12+,19-14+/t20-,21-,22-,23-,24-/m0/s1",HLKNQLQCOZENND-GAAPUSCWSA-N,102060995,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_0207,Ambiguine C isonitrile,,other linear non-peptide,,C26H32N2O,388.2514637,CC1(C)C2=C3C(NC(C(C)(C=C)C)=C3[C@@]4(O)[C@@H]([N+]#[C-])[C@@](C)(C=C)CC[C@@]41[H])=CC=C2,"InChI=1S/C26H32N2O/c1-9-23(3,4)21-20-19-16(12-11-13-17(19)28-21)24(5,6)18-14-15-25(7,10-2)22(27-8)26(18,20)29/h9-13,18,22,28-29H,1-2,14-15H2,3-7H3/t18-,22+,25+,26-/m1/s1",FDEFKOBGABILIC-XQHQYKGYSA-N,21610114,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_0208,Mirabilene B isonitrile,,other linear non-peptide,,C24H39NO4,405.2879087,C/C([N+]#[C-])=C\C=C(C)\C=C(C)\[C@@H](OC)C[C@@H](OC)C[C@@H](OC)C[C@@H](OC)CC=C,"InChI=1S/C24H39NO4/c1-10-11-21(26-6)15-22(27-7)16-23(28-8)17-24(29-9)19(3)14-18(2)12-13-20(4)25-5/h10,12-14,21-24H,1,11,15-17H2,2-4,6-9H3/b18-12+,19-14+,20-13+/t21-,22-,23-,24-/m0/s1",DXDWWQYVFWGLPI-MRHINEGBSA-N,146683685,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_0209,Mirabilene C isonitrile,,other linear non-peptide,,C24H39NO4,405.2879087,C=CC[C@H](OC)C[C@H](OC)C[C@H](OC)C[C@H](OC)/C(C)=C/C(C)=C\C=C(C)\[N+]#[C-],"InChI=1S/C24H39NO4/c1-10-11-21(26-6)15-22(27-7)16-23(28-8)17-24(29-9)19(3)14-18(2)12-13-20(4)25-5/h10,12-14,21-24H,1,11,15-17H2,2-4,6-9H3/b18-12-,19-14+,20-13+/t21-,22-,23-,24-/m0/s1",DXDWWQYVFWGLPI-DFHGXFDKSA-N,146683686,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_0210,Mirabilene D isonitrile,,other linear non-peptide,,C24H39NO4,405.2879087,C/C([N+]#[C-])=C/C=C(C)/C=C(C)/[C@@H](OC)C[C@@H](OC)C[C@@H](OC)C[C@@H](OC)CC=C,"InChI=1S/C24H39NO4/c1-10-11-21(26-6)15-22(27-7)16-23(28-8)17-24(29-9)19(3)14-18(2)12-13-20(4)25-5/h10,12-14,21-24H,1,11,15-17H2,2-4,6-9H3/b18-12+,19-14+,20-13-/t21-,22-,23-,24-/m0/s1",DXDWWQYVFWGLPI-IRWIXJHFSA-N,102060996,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_0211,Mirabilene E isonitrile,,other linear non-peptide,,C24H39NO4,405.2879087,C/C(C/C=C([N+]#[C-])\C)=C/C([C@@H](OC)C[C@@H](OC)C[C@@H](OC)C[C@@H](OC)CC=C)=C,"InChI=1S/C24H39NO4/c1-10-11-21(26-6)15-22(27-7)16-23(28-8)17-24(29-9)19(3)14-18(2)12-13-20(4)25-5/h10,13-14,21-24H,1,3,11-12,15-17H2,2,4,6-9H3/b18-14-,20-13+",RHXUBRKEEFJAPK-MFKITDCOSA-N,,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_0212,Mirabilene F isonitrile,,other linear non-peptide,,C27H47NO5,465.3454236,C[C@H]([N+]#[C-])C/C=C(C)/C=C(C)/[C@@H](OC)C[C@@H](OC)C[C@@H](OC)C[C@@H](OC)C[C@@H](OC)CC=C,"InChI=1S/C27H47NO5/c1-11-12-23(29-6)16-24(30-7)17-25(31-8)18-26(32-9)19-27(33-10)21(3)15-20(2)13-14-22(4)28-5/h11,13,15,22-27H,1,12,14,16-19H2,2-4,6-10H3/b20-13+,21-15+/t22-,23-,24-,25-,26-,27-/m0/s1",ZPVKYVUDKSAXRS-GKAJUAEBSA-N,102060998,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_0213,Mitsoamide,,other linear peptide,,C55H95N9O11,1057.7151,CC[C@H](C)[C@@H](C(=O)NC(C)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)OC)NC(=O)[C@H](C(C)C)NC(=O)CC(CC(C)CC(CC(=O)NCCCCCC(C(=O)NC2CCCCN2)N)OC)OC,"InChI=1S/C55H95N9O11/c1-13-36(6)48(53(70)59-38(8)50(67)60-43(31-39-23-17-15-18-24-39)54(71)64(9)49(37(7)14-2)55(72)75-12)63-52(69)47(34(3)4)62-46(66)33-41(74-11)30-35(5)29-40(73-10)32-45(65)58-28-21-16-19-25-42(56)51(68)61-44-26-20-22-27-57-44/h15,17-18,23-24,34-38,40-44,47-49,57H,13-14,16,19-22,25-33,56H2,1-12H3,(H,58,65)(H,59,70)(H,60,67)(H,61,68)(H,62,66)(H,63,69)/t35?,36-,37-,38?,40?,41?,42?,43+,44?,47-,48-,49-/m0/s1",OCWCDHLQBIMUAZ-NRRJZDTMSA-N,139587492,yes,Geitlerinema,n.a.,n.a.
CyanoMetDB_0214,Molassamide,,other cyclic peptide,other cyclic depsipeptide,C48H66N8O13,962.4749342,C/C=C(NC1=O)/C(N[C@@H]2C(N([C@@H](CC3=CC=CC=C3)C(N(C)[C@H](C(N[C@@H](C(C)C)C(O[C@H](C)[C@@H]1NC([C@H]([C@@H](C)O)NC([C@H](C)NC(CCC)=O)=O)=O)=O)=O)CC4=CC=C(O)C=C4)=O)[C@H](O)CC2)=O)=O,"InChI=1S/C48H66N8O13/c1-9-14-36(59)49-26(5)41(61)53-39(27(6)57)44(64)54-40-28(7)69-48(68)38(25(3)4)52-43(63)34(23-30-17-19-31(58)20-18-30)55(8)47(67)35(24-29-15-12-11-13-16-29)56-37(60)22-21-33(46(56)66)51-42(62)32(10-2)50-45(40)65/h10-13,15-20,25-28,33-35,37-40,57-58,60H,9,14,21-24H2,1-8H3,(H,49,59)(H,50,65)(H,51,62)(H,52,63)(H,53,61)(H,54,64)/b32-10-/t26-,27+,28+,33-,34-,35-,37+,38-,39-,40-/m0/s1",KXSGCAPYMUMVSH-VFYPFKDGSA-N,45379965,yes,Dichothrix,n.a.,n.a.
CyanoMetDB_0215,Mooreamide A,,other linear non-peptide,,C24H39NO3,389.2929941,C=CCCC/C=C/C=C(C)/CCCC/C=C/CC/C=C\C(NC(CO)CO)=O,"InChI=1S/C24H39NO3/c1-3-4-5-6-11-14-17-22(2)18-15-12-9-7-8-10-13-16-19-24(28)25-23(20-26)21-27/h3,7-8,11,14,16-17,19,23,26-27H,1,4-6,9-10,12-13,15,18,20-21H2,2H3,(H,25,28)/b8-7+,14-11+,19-16-,22-17+",QZDRALHHNJQOTA-ZWMNDHQQSA-N,102339340,yes,Moorea,bouillonii   ,n.a.
CyanoMetDB_0216,Nostopeptolide L1,,other cyclic peptide,other cyclic depsipeptide,C53H77N9O14,1063.558998,[H]N([C@H]([C@@H](OC([C@H]1N2C[C@@H](C1)O)=O)C)C(N[C@@H](COC)C(NC(C(C(C(N([C@@H]3C(N/C(C(N[C@H](C(N[C@@H](CCC(N)=O)C2=O)=O)[C@@H](C)CC)=O)=C/C)=O)C[C@H](C3)C)=O)C)=O)CC4=CC=CC=C4)=O)=O)C(/C(C)=C\CCC)=O,"InChI=1S/C53H77N9O14/c1-10-13-17-30(6)45(66)60-43-32(8)76-53(74)40-24-34(63)26-62(40)52(73)36(20-21-41(54)64)56-49(70)42(29(5)11-2)59-46(67)35(12-3)55-48(69)39-22-28(4)25-61(39)51(72)31(7)44(65)37(23-33-18-15-14-16-19-33)57-47(68)38(27-75-9)58-50(43)71/h12,14-19,28-29,31-32,34,36-40,42-43,63H,10-11,13,20-27H2,1-9H3,(H2,54,64)(H,55,69)(H,56,70)(H,57,68)(H,58,71)(H,59,67)(H,60,66)/b30-17-,35-12+/t28-,29-,31?,32-,34+,36-,37?,38-,39-,40-,42-,43+/m0/s1",YBUKCWICWKQCSF-UDXWXPJYSA-N,146683671,yes,Nostoc,n.a.,UK2aImI  
CyanoMetDB_0217,Nostopeptolide L2,,other cyclic peptide,other cyclic depsipeptide,C53H77N9O13,1047.564084,[H]N([C@H]([C@@H](OC([C@H]1N2CCC1)=O)C)C(N[C@@H](COC)C(NC(C(C(C(N([C@@H]3C(N/C(C(N[C@H](C(N[C@@H](CCC(N)=O)C2=O)=O)[C@@H](C)CC)=O)=C/C)=O)C[C@H](C3)C)=O)C)=O)CC4=CC=CC=C4)=O)=O)C(/C(C)=C\CCC)=O,"InChI=1S/C53H77N9O13/c1-10-13-18-31(6)45(65)60-43-33(8)75-53(73)39-21-17-24-61(39)52(72)36(22-23-41(54)63)56-49(69)42(30(5)11-2)59-46(66)35(12-3)55-48(68)40-25-29(4)27-62(40)51(71)32(7)44(64)37(26-34-19-15-14-16-20-34)57-47(67)38(28-74-9)58-50(43)70/h12,14-16,18-20,29-30,32-33,36-40,42-43H,10-11,13,17,21-28H2,1-9H3,(H2,54,63)(H,55,68)(H,56,69)(H,57,67)(H,58,70)(H,59,66)(H,60,65)/b31-18-,35-12+/t29-,30-,32?,33-,36-,37?,38-,39-,40-,42-,43+/m0/s1",SDUXPNUDPUMSEL-WOYAIKJDSA-N,146683672,no,Nostoc,n.a.,UK2aImI  
CyanoMetDB_0218,Ambiguine D isonitrile,,other linear non-peptide,,C26H29ClN2O3,452.1866705,CC1(C)C2=C3C(N=C(C(C)(C)[C@H]4[C@@H]5O4)[C@@]3(O)[C@@]6(O)[C@@]5([N+]#[C-])[C@@](C)(C=C)[C@H](Cl)C[C@@]61[H])=CC=C2,"InChI=1S/C26H29ClN2O3/c1-8-23(6)16(27)12-15-21(2,3)13-10-9-11-14-17(13)24(30)20(29-14)22(4,5)18-19(32-18)25(23,28-7)26(15,24)31/h8-11,15-16,18-19,30-31H,1,12H2,2-6H3/t15-,16-,18-,19+,23+,24-,25+,26-/m1/s1",BEUWKFSFCQGVEY-QJQSJIDVSA-N,21610115,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_0219,Nostopeptolide L3,,other cyclic peptide,other cyclic depsipeptide,C52H75N9O14,1049.543348,[H]N([C@H]([C@@H](OC([C@H]1N2C[C@@H](C1)O)=O)C)C(N[C@@H](COC)C(NC(C(C(C(N3CCC[C@H]3C(N/C(C(N[C@H](C(N[C@@H](CCC(N)=O)C2=O)=O)[C@@H](C)CC)=O)=C/C)=O)=O)C)=O)CC4=CC=CC=C4)=O)=O)C(/C(C)=C\CCC)=O,"InChI=1S/C52H75N9O14/c1-9-12-17-29(5)44(65)59-42-31(7)75-52(73)39-25-33(62)26-61(39)51(72)35(21-22-40(53)63)55-48(69)41(28(4)10-2)58-45(66)34(11-3)54-47(68)38-20-16-23-60(38)50(71)30(6)43(64)36(24-32-18-14-13-15-19-32)56-46(67)37(27-74-8)57-49(42)70/h11,13-15,17-19,28,30-31,33,35-39,41-42,62H,9-10,12,16,20-27H2,1-8H3,(H2,53,63)(H,54,68)(H,55,69)(H,56,67)(H,57,70)(H,58,66)(H,59,65)/b29-17-,34-11+/t28-,30?,31-,33+,35-,36?,37-,38-,39-,41-,42+/m0/s1",MIJXOMVHUJDACZ-UHGSSAQESA-N,146683673,no,Nostoc,n.a.,UK2aImI  
CyanoMetDB_0220,Nostopeptolide L4,,other cyclic peptide,other cyclic depsipeptide,C52H75N9O13,1033.548434,[H]N([C@H]([C@@H](OC([C@H]1N2CCC1)=O)C)C(N[C@@H](COC)C(NC(C(C(C(N3CCC[C@H]3C(N/C(C(N[C@H](C(N[C@@H](CCC(N)=O)C2=O)=O)[C@@H](C)CC)=O)=C/C)=O)=O)C)=O)CC4=CC=CC=C4)=O)=O)C(/C(C)=C\CCC)=O,"InChI=1S/C52H75N9O13/c1-9-12-18-30(5)44(64)59-42-32(7)74-52(72)39-22-17-26-61(39)51(71)35(23-24-40(53)62)55-48(68)41(29(4)10-2)58-45(65)34(11-3)54-47(67)38-21-16-25-60(38)50(70)31(6)43(63)36(27-33-19-14-13-15-20-33)56-46(66)37(28-73-8)57-49(42)69/h11,13-15,18-20,29,31-32,35-39,41-42H,9-10,12,16-17,21-28H2,1-8H3,(H2,53,62)(H,54,67)(H,55,68)(H,56,66)(H,57,69)(H,58,65)(H,59,64)/b30-18-,34-11+/t29-,31?,32-,35-,36?,37-,38-,39-,41-,42+/m0/s1",NNSKEWLXNDVFJI-YYNINNBHSA-N,146683674,no,Nostoc,n.a.,UK2aImI  
CyanoMetDB_0221,Nostoweipeptin W1,,other cyclic peptide,other cyclic depsipeptide,C61H86N10O16,1214.622327,C[C@@H](C1)CN([C@@H]1C(N[C@H](CC(C)C)C(N[C@H](C(N[C@H](C(NC(CO)C(N([C@@H]2C(N([C@@H]3C4=O)C[C@@H](C3)O)=O)C[C@@H](C2)O)=O)=O)CC5=CC=C(O)C=C5)=O)[C@@H](C)CC)=O)=O)C(C(COC([C@H]6N4C[C@H](C6)C)=O)NC([C@@H](N(C(C)=O)C)CC7=CC=CC=C7)=O)=O,"InChI=1S/C61H86N10O16/c1-9-35(6)51-56(81)63-43(22-38-15-17-39(74)18-16-38)52(77)64-44(30-72)57(82)70-28-40(75)24-48(70)60(85)71-29-41(76)25-49(71)59(84)69-27-34(5)21-50(69)61(86)87-31-45(65-54(79)46(67(8)36(7)73)23-37-13-11-10-12-14-37)58(83)68-26-33(4)20-47(68)55(80)62-42(19-32(2)3)53(78)66-51/h10-18,32-35,40-51,72,74-76H,9,19-31H2,1-8H3,(H,62,80)(H,63,81)(H,64,77)(H,65,79)(H,66,78)/t33-,34-,35-,40+,41+,42+,43-,44?,45?,46-,47-,48-,49-,50-,51-/m0/s1",MMBXLTIUUMSPLR-VRJRVMSLSA-N,146683675,yes,Nostoc,n.a.,PCC 6910
CyanoMetDB_0222,Nostoweipeptin W2,,other cyclic peptide,other cyclic depsipeptide,C61H86N10O15,1198.627412,C[C@@H](C1)CN([C@@H]1C(N[C@H](CC(C)C)C(N[C@H](C(N[C@H](C(NC(CO)C(N([C@@H]2C(N3CCC[C@H]3C4=O)=O)C[C@@H](C2)O)=O)=O)CC5=CC=C(O)C=C5)=O)[C@@H](C)CC)=O)=O)C(C(COC([C@H]6N4C[C@H](C6)C)=O)NC([C@@H](N(C(C)=O)C)CC7=CC=CC=C7)=O)=O,"InChI=1S/C61H86N10O15/c1-9-36(6)51-56(80)63-43(25-39-17-19-40(74)20-18-39)52(76)64-44(31-72)57(81)71-30-41(75)27-49(71)60(84)68-21-13-16-46(68)59(83)70-29-35(5)24-50(70)61(85)86-32-45(65-54(78)47(67(8)37(7)73)26-38-14-11-10-12-15-38)58(82)69-28-34(4)23-48(69)55(79)62-42(22-33(2)3)53(77)66-51/h10-12,14-15,17-20,33-36,41-51,72,74-75H,9,13,16,21-32H2,1-8H3,(H,62,79)(H,63,80)(H,64,76)(H,65,78)(H,66,77)/t34-,35-,36-,41+,42+,43-,44?,45?,46-,47-,48-,49-,50-,51-/m0/s1",UXXDXIYOJRIUQT-YMDMZXMDSA-N,146683676,no,Nostoc,n.a., XPORK 5A 
CyanoMetDB_0223,Nostoweipeptin W3,,other cyclic peptide,other cyclic depsipeptide,C61H86N10O15,1198.627412,C[C@@H](C1)CN([C@@H]1C(N[C@H](CC(C)C)C(N[C@H](C(N[C@H](C(NC(CO)C(N2CCC[C@H]2C(N([C@@H]3C4=O)C[C@@H](C3)O)=O)=O)=O)CC5=CC=C(O)C=C5)=O)[C@@H](C)CC)=O)=O)C(C(COC([C@H]6N4C[C@H](C6)C)=O)NC([C@@H](N(C(C)=O)C)CC7=CC=CC=C7)=O)=O,"InChI=1S/C61H86N10O15/c1-9-36(6)51-56(80)63-43(25-39-17-19-40(74)20-18-39)52(76)64-44(31-72)57(81)68-21-13-16-46(68)59(83)71-30-41(75)27-49(71)60(84)70-29-35(5)24-50(70)61(85)86-32-45(65-54(78)47(67(8)37(7)73)26-38-14-11-10-12-15-38)58(82)69-28-34(4)23-48(69)55(79)62-42(22-33(2)3)53(77)66-51/h10-12,14-15,17-20,33-36,41-51,72,74-75H,9,13,16,21-32H2,1-8H3,(H,62,79)(H,63,80)(H,64,76)(H,65,78)(H,66,77)/t34-,35-,36-,41+,42+,43-,44?,45?,46-,47-,48-,49-,50-,51-/m0/s1",UXEZMCALZBHGKN-YMDMZXMDSA-N,146683677,no,Nostoc,n.a., XPORK 5A 
CyanoMetDB_0224,Nostoweipeptin W4,,other cyclic peptide,other cyclic depsipeptide,C60H84N10O16,1200.606677,C[C@@H](C1)CN([C@@H]1C(N[C@H](CC(C)C)C(N[C@H](C(N[C@H](C(NC(CO)C(N([C@@H]2C(N([C@@H]3C4=O)C[C@@H](C3)O)=O)C[C@@H](C2)O)=O)=O)CC5=CC=C(O)C=C5)=O)[C@@H](C)CC)=O)=O)C(C(COC([C@H]6N4C[C@H](C6)C)=O)NC([C@@H](NC(C)=O)CC7=CC=CC=C7)=O)=O,"InChI=1S/C60H84N10O16/c1-8-34(6)50-55(80)63-43(22-37-14-16-38(73)17-15-37)52(77)64-44(29-71)56(81)69-27-39(74)23-47(69)59(84)70-28-40(75)24-48(70)58(83)68-26-33(5)20-49(68)60(85)86-30-45(65-51(76)42(61-35(7)72)21-36-12-10-9-11-13-36)57(82)67-25-32(4)19-46(67)54(79)62-41(18-31(2)3)53(78)66-50/h9-17,31-34,39-50,71,73-75H,8,18-30H2,1-7H3,(H,61,72)(H,62,79)(H,63,80)(H,64,77)(H,65,76)(H,66,78)/t32-,33-,34-,39+,40+,41+,42-,43-,44?,45?,46-,47-,48-,49-,50-/m0/s1",VZRGRTLNYUOHNX-DPFCJGTLSA-N,146683678,no,Nostoc,n.a., XPORK 5A 
CyanoMetDB_0225,Nostoweipeptin W5,,other cyclic peptide,other cyclic depsipeptide,C60H84N10O16,1200.606677,C[C@@H](C1)CN([C@@H]1C(N[C@H](CC(C)C)C(N[C@H](C(N[C@H](C(NC(CO)C(N([C@@H]2C(N([C@@H]3C4=O)C[C@@H](C3)O)=O)C[C@@H](C2)O)=O)=O)CC5=CC=C(O)C=C5)=O)[C@@H](C)CC)=O)=O)C(C(COC([C@H]6N4CCC6)=O)NC([C@@H](N(C(C)=O)C)CC7=CC=CC=C7)=O)=O,"InChI=1S/C60H84N10O16/c1-8-34(5)50-55(80)62-42(23-37-16-18-38(73)19-17-37)51(76)63-43(30-71)56(81)69-28-39(74)26-49(69)59(84)70-29-40(75)25-48(70)58(83)67-20-12-15-45(67)60(85)86-31-44(64-53(78)46(66(7)35(6)72)24-36-13-10-9-11-14-36)57(82)68-27-33(4)22-47(68)54(79)61-41(21-32(2)3)52(77)65-50/h9-11,13-14,16-19,32-34,39-50,71,73-75H,8,12,15,20-31H2,1-7H3,(H,61,79)(H,62,80)(H,63,76)(H,64,78)(H,65,77)/t33-,34-,39+,40+,41+,42-,43?,44?,45-,46-,47-,48-,49-,50-/m0/s1",QBRYIOPFZPBWEV-JSKPIKICSA-N,146683679,no,Nostoc,n.a., XPORK 5A 
CyanoMetDB_0226,Nostoweipeptin W6,,other cyclic peptide,other cyclic depsipeptide,C60H84N10O16,1200.606677,O[C@H](C1)CN([C@@H]1C(N([C@@H]2C3=O)C[C@@H](C2)O)=O)C(C(CO)NC([C@@H](NC([C@@H](NC([C@@H](CC(C)C)NC([C@H]4N(CCC4)C(C(COC([C@H]5N3C[C@H](C5)C)=O)NC([C@@H](N(C(C)=O)C)CC6=CC=CC=C6)=O)=O)=O)=O)[C@@H](C)CC)=O)CC7=CC=C(O)C=C7)=O)=O,"InChI=1S/C60H84N10O16/c1-8-34(5)50-55(80)62-42(23-37-16-18-38(73)19-17-37)51(76)63-43(30-71)56(81)69-28-39(74)25-47(69)59(84)70-29-40(75)26-48(70)58(83)68-27-33(4)22-49(68)60(85)86-31-44(64-54(79)46(66(7)35(6)72)24-36-13-10-9-11-14-36)57(82)67-20-12-15-45(67)53(78)61-41(21-32(2)3)52(77)65-50/h9-11,13-14,16-19,32-34,39-50,71,73-75H,8,12,15,20-31H2,1-7H3,(H,61,78)(H,62,80)(H,63,76)(H,64,79)(H,65,77)/t33-,34-,39+,40+,41+,42-,43?,44?,45-,46-,47-,48-,49-,50-/m0/s1",MGLFPTQIPUMCNR-JSKPIKICSA-N,146683680,no,Nostoc,n.a., XPORK 5A 
CyanoMetDB_0227,Nostoweipeptin W7,,other cyclic peptide,other cyclic depsipeptide,C59H84N10O15,1172.611762,O[C@H](C1)CN([C@@H]1C(N([C@@H]2C3=O)C[C@@H](C2)O)=O)C(C(CO)NC([C@@H](NC([C@@H](NC([C@@H](CC(C)C)NC([C@H]4N(C[C@@H](C)C4)C(C(COC([C@H]5N3C[C@H](C5)C)=O)NC([C@@H](NC)CC6=CC=CC=C6)=O)=O)=O)=O)[C@@H](C)CC)=O)CC7=CC=C(O)C=C7)=O)=O,"InChI=1S/C59H84N10O15/c1-8-34(6)49-54(78)62-42(22-36-14-16-37(71)17-15-36)51(75)63-43(29-70)55(79)68-27-38(72)23-46(68)58(82)69-28-39(73)24-47(69)57(81)67-26-33(5)20-48(67)59(83)84-30-44(64-50(74)40(60-7)21-35-12-10-9-11-13-35)56(80)66-25-32(4)19-45(66)53(77)61-41(18-31(2)3)52(76)65-49/h9-17,31-34,38-49,60,70-73H,8,18-30H2,1-7H3,(H,61,77)(H,62,78)(H,63,75)(H,64,74)(H,65,76)/t32-,33-,34-,38+,39+,40-,41+,42-,43?,44?,45-,46-,47-,48-,49-/m0/s1",FTYAKOGTZYSZNO-NEUPUXGDSA-N,146683681,no,Nostoc,n.a., XPORK 5A 
CyanoMetDB_0228,Precarriebowmide,,other cyclic peptide,other cyclic depsipeptide,C46H68N6O8S,864.4819343,O=C(N[C@H](C(N([C@@H](CC(C)C)C(N[C@H]1C)=O)C)=O)CC2=CC=CC=C2)[C@@H](NC([C@@H](CC3=CC=CC=C3)N(C)C([C@@H](C(C)C)OC([C@H]([C@@H](CCC)NC1=O)C)=O)=O)=O)CCSC,"InChI=1S/C46H68N6O8S/c1-11-18-34-30(6)46(59)60-39(29(4)5)45(58)52(9)38(27-33-21-16-13-17-22-33)43(56)49-35(23-24-61-10)41(54)50-36(26-32-19-14-12-15-20-32)44(57)51(8)37(25-28(2)3)42(55)47-31(7)40(53)48-34/h12-17,19-22,28-31,34-39H,11,18,23-27H2,1-10H3,(H,47,55)(H,48,53)(H,49,56)(H,50,54)/t30-,31-,34+,35-,36-,37-,38+,39+/m0/s1",KCYRWQKOIZHYNX-ARSHIWEASA-N,73356797,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0229,Ambiguine E isonitrile,,other linear non-peptide,,C26H29ClN2O2,436.1917559,CC1(C)C2=C3C(NC(C(C)(C)[C@H]4[C@@H]5O4)=C3[C@@]6(O)[C@@]5([N+]#[C-])[C@@](C)(C=C)[C@H](Cl)C[C@@]61[H])=CC=C2,"InChI=1S/C26H29ClN2O2/c1-8-24(6)16(27)12-15-22(2,3)13-10-9-11-14-17(13)18-19(29-14)23(4,5)20-21(31-20)26(24,28-7)25(15,18)30/h8-11,15-16,18,20-21,30H,1,12H2,2-6H3/t15-,16-,18?,20-,21+,24+,25-,26+/m1/s1",SOAHLJSBWOMIQR-WKDVAIRMSA-N,,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_0230,Parguerene,,other linear non-peptide,,C26H39NO2,397.2980795,OC[C@H](C)NC(/C(C)=C/C/C=C(C)/CCCC(C)C/C=C/CC1=CC=CC=C1)=O,"InChI=1S/C26H39NO2/c1-21(12-8-9-19-25-17-6-5-7-18-25)13-10-14-22(2)15-11-16-23(3)26(29)27-24(4)20-28/h5-9,15-18,21,24,28H,10-14,19-20H2,1-4H3,(H,27,29)/b9-8+,22-15+,23-16+/t21?,24-/m0/s1",WPEONPKBEAMEPE-JJJYXDOVSA-N,139585718,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0231,Puwainaphycin F,,other cyclic peptide,,C53H87N13O15,1145.644459,CCCCCCCCCCC(C1C(O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H](CC(N)=O)C(N/C(C(N[C@@H](CC(N)=O)C(N[C@@H](C)C(N[C@H]([C@@H](O)C)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)=C/C)=O)=O)=C/C)=O)=O)C,"InChI=1S/C53H87N13O15/c1-10-13-14-15-16-17-18-19-21-28(6)41-43(71)51(79)62-40(27(4)5)50(78)59-32(12-3)46(74)61-34(25-38(55)69)48(76)58-31(11-2)45(73)60-33(24-37(54)68)47(75)57-29(7)44(72)64-42(30(8)67)53(81)65(9)36(26-39(56)70)52(80)66-23-20-22-35(66)49(77)63-41/h11-12,27-30,33-36,40-43,67,71H,10,13-26H2,1-9H3,(H2,54,68)(H2,55,69)(H2,56,70)(H,57,75)(H,58,76)(H,59,78)(H,60,73)(H,61,74)(H,62,79)(H,63,77)(H,64,72)/b31-11+,32-12+/t28?,29-,30-,33-,34-,35-,36-,40-,41?,42+,43?/m0/s1",OGEPEQGQPSWALS-BMIHFYDPSA-N,146683704,yes,Cylindrospermopsis,alatosporum ,C24/89  
CyanoMetDB_0232,Puwainaphycin G,,other cyclic peptide,,C54H89N13O15,1159.660109,CCCCCCCCCCC(C1C(O)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H](CCC(N)=O)C(N/C(C(N[C@@H](CC(N)=O)C(N[C@@H](C)C(N[C@H]([C@@H](O)C)C(N(C)[C@@H](CC(N)=O)C(N2CCC[C@H]2C(N1)=O)=O)=O)=O)=O)=O)=C/C)=O)=O)=C/C)=O)=O)C,"InChI=1S/C54H89N13O15/c1-10-13-14-15-16-17-18-19-21-29(6)42-44(72)52(80)63-41(28(4)5)51(79)60-33(12-3)46(74)61-34(23-24-38(55)69)48(76)59-32(11-2)47(75)62-35(26-39(56)70)49(77)58-30(7)45(73)65-43(31(8)68)54(82)66(9)37(27-40(57)71)53(81)67-25-20-22-36(67)50(78)64-42/h11-12,28-31,34-37,41-44,68,72H,10,13-27H2,1-9H3,(H2,55,69)(H2,56,70)(H2,57,71)(H,58,77)(H,59,76)(H,60,79)(H,61,74)(H,62,75)(H,63,80)(H,64,78)(H,65,73)/b32-11+,33-12+/t29?,30-,31-,34-,35-,36-,37-,41-,42?,43+,44?/m0/s1",AHLZFNFPKBUJRB-BJLHTMEBSA-N,146683705,yes,Cylindrospermopsis,alatosporum ,C24/89  
CyanoMetDB_0233,Santacruzamate A,,other linear non-peptide,,C15H22N2O3,278.1630426,CCOC(=O)NCCCC(=O)NCCc1ccccc1,"InChI=1S/C15H22N2O3/c1-2-20-15(19)17-11-6-9-14(18)16-12-10-13-7-4-3-5-8-13/h3-5,7-8H,2,6,9-12H2,1H3,(H,16,18)(H,17,19)",HTOYBIILVCHURC-UHFFFAOYSA-N,72946782,yes,Symploca,n.a.,PAC-03/03/2007-1
CyanoMetDB_0234,Scytophycin A,,other cyclic non-peptide,,C45H75NO12,821.5289269,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)C/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC(O)[C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]3(OC3)[C@@H](OC)C2)=O,"InChI=1S/C45H75NO12/c1-28-15-18-34(48)23-35-13-12-14-36(57-35)24-39(53-9)45(26-56-45)40(54-10)25-38(52-8)32(5)44(58-41(50)20-16-28)33(6)42(51)29(2)17-19-37(49)31(4)43(55-11)30(3)21-22-46(7)27-47/h12-13,15-16,20-22,27,29-40,42-44,48-49,51H,14,17-19,23-26H2,1-11H3/b20-16+,22-21+,28-15+/t29-,30+,31-,32-,33-,34-,35-,36-,37?,38+,39-,40-,42-,43+,44-,45-/m0/s1",CYZZFSCFKCNCLO-XMPFBODESA-N,21637907,yes,Scytonema,pseudo hofmannii,BC-1-2  
CyanoMetDB_0235,Scytophycin B,,other cyclic non-peptide,,C45H73NO12,819.5132768,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)C/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@@]3(OC3)[C@@H](OC)C2)=O,"InChI=1S/C45H73NO12/c1-28-15-18-34(48)23-35-13-12-14-36(57-35)24-39(53-9)45(26-56-45)40(54-10)25-38(52-8)32(5)44(58-41(50)20-16-28)33(6)42(51)29(2)17-19-37(49)31(4)43(55-11)30(3)21-22-46(7)27-47/h12-13,15-16,20-22,27,29-36,38-40,42-44,48,51H,14,17-19,23-26H2,1-11H3/b20-16+,22-21+,28-15+/t29-,30+,31-,32-,33-,34-,35-,36-,38+,39-,40-,42-,43+,44-,45-/m0/s1",LGYQYCWMQRMLJJ-DAAXTDNESA-N,10079145,yes,Scytonema,pseudo hofmannii,BC-1-2  
CyanoMetDB_0236,Scytophycin C,,other cyclic non-peptide,,C45H75NO11,805.5340122,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)C/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@H](C)[C@@H](OC)C2)=O,"InChI=1S/C45H75NO11/c1-28-16-19-35(48)24-36-14-13-15-37(56-36)25-39(52-9)32(5)40(53-10)26-41(54-11)33(6)45(57-42(50)21-17-28)34(7)43(51)29(2)18-20-38(49)31(4)44(55-12)30(3)22-23-46(8)27-47/h13-14,16-17,21-23,27,29-37,39-41,43-45,48,51H,15,18-20,24-26H2,1-12H3/b21-17+,23-22+,28-16+/t29-,30+,31-,32+,33-,34-,35-,36-,37-,39-,40-,41+,43-,44+,45-/m0/s1",PNDDYPOQKFXUHY-JOSACIENSA-N,10328022,yes,Scytonema,pseudo hofmannii,BC-1-2  
CyanoMetDB_0237,Scytophycin D,,other cyclic non-peptide,,C45H75NO12,821.5289269,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)C/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@](O)(C)[C@@H](OC)C2)=O,"InChI=1S/C45H75NO12/c1-28-16-19-34(48)24-35-14-13-15-36(57-35)25-39(54-10)45(7,52)40(55-11)26-38(53-9)32(5)44(58-41(50)21-17-28)33(6)42(51)29(2)18-20-37(49)31(4)43(56-12)30(3)22-23-46(8)27-47/h13-14,16-17,21-23,27,29-36,38-40,42-44,48,51-52H,15,18-20,24-26H2,1-12H3/b21-17+,23-22+,28-16+/t29-,30+,31-,32-,33-,34-,35-,36-,38+,39-,40-,42-,43+,44-,45-/m0/s1",DWQQWNRHLJPIDV-OAJWNAMCSA-N,44567032,yes,Scytonema,pseudo hofmannii,BC-1-2  
CyanoMetDB_0238,Scytophycin E,,other cyclic non-peptide,,C45H75NO12,821.5289269,O[C@H](C[C@]1([H])C=CC[C@]2([H])O1)C/C=C(C)/C=C/C(O[C@@]([C@@H](C)[C@@H](O)[C@@H](C)CCC([C@H](C)[C@H](OC)[C@H](C)/C=C/N(C)C=O)=O)([H])[C@@H](C)[C@H](OC)C[C@H](OC)[C@H](CO)[C@@H](OC)C2)=O,"InChI=1S/C45H75NO12/c1-28-15-18-34(49)23-35-13-12-14-36(57-35)24-40(54-9)37(26-47)41(55-10)25-39(53-8)32(5)45(58-42(51)20-16-28)33(6)43(52)29(2)17-19-38(50)31(4)44(56-11)30(3)21-22-46(7)27-48/h12-13,15-16,20-22,27,29-37,39-41,43-45,47,49,52H,14,17-19,23-26H2,1-11H3/b20-16+,22-21+,28-15+/t29-,30+,31-,32-,33-,34-,35-,36-,37+,39+,40-,41-,43-,44+,45-/m0/s1",DSHVEBDLSYMWSX-MRGDGBMUSA-N,6440810,yes,Scytonema,pseudo hofmannii,BC-1-2  
CyanoMetDB_0239,Swinholide A,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C78H132O20,1388.931197,C[C@@H]([C@H]([C@H](CC[C@@H]1O[C@H](C[C@@H](OC)C1)C)C)O)C([C@H](C)[C@@H](O)C[C@@H](O)[C@@H](C)[C@H](OC)C[C@@]2(O[C@]([H])(C=CC2)C[C@H](O)C/C=C(C)/C=C/C(OC([C@@H]3C)[C@H]([C@H]([C@H](CC[C@@H]4O[C@H](C[C@@H](OC)C4)C)C)O)C)=O)[H])OC(/C=C/C(C)=C/C[C@@H](O)C[C@@]5([H])C=CC[C@]([H])(C[C@@H](OC)[C@H](C)[C@H](O)C[C@@H]3O)O5)=O,"InChI=1S/C78H132O20/c1-45-23-29-57(79)37-59-19-17-21-61(95-59)41-71(91-15)52(8)68(82)44-70(84)54(10)78(56(12)76(88)48(4)28-32-64-40-66(90-14)36-50(6)94-64)98-74(86)34-26-46(2)24-30-58(80)38-60-20-18-22-62(96-60)42-72(92-16)51(7)67(81)43-69(83)53(9)77(97-73(85)33-25-45)55(11)75(87)47(3)27-31-63-39-65(89-13)35-49(5)93-63/h17-20,23-26,33-34,47-72,75-84,87-88H,21-22,27-32,35-44H2,1-16H3/b33-25+,34-26+,45-23+,46-24+/t47-,48-,49-,50-,51+,52+,53+,54+,55-,56-,57+,58+,59+,60+,61+,62+,63-,64-,65+,66+,67+,68+,69-,70-,71+,72+,75-,76-,77?,78?/m0/s1",RJVBVECTCMRNFG-YGHILOOQSA-N,146684549,yes,Nostoc,n.a.,UHCC 0450 (previously 107.3)
CyanoMetDB_0240,Ambiguine F isonitrile,Ambiguine isonitrile F,other linear non-peptide,,C26H31ClN2O3,454.2023206,C[C@@]1([C@@H](C[C@H]2[C@@]3([C@@]1([C@H]([C@@H](C(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)O)O)[N+]#[C-])O)Cl)C=C,"InChI=1S/C26H31ClN2O3/c1-8-24(6)16(27)12-15-22(2,3)13-10-9-11-14-17(13)18-19(29-14)23(4,5)20(30)21(31)26(24,28-7)25(15,18)32/h8-11,15-16,20-21,29-32H,1,12H2,2-6H3/t15-,16-,20+,21+,24+,25-,26+/m1/s1",UZVWRTZJFCDKBF-OODLVNIASA-N,21610117,yes,Fischerella,ambigua ,UTEX 1903
CyanoMetDB_0241,Tjipanazole A1,,other linear non-peptide,,C24H20Cl2N2O4,470.0800125,ClC(C=C1)=CC(C2=C3C4=C(C5=C(C=CC(Cl)=C5)N4)C=C2)=C1N3[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@@H](C)O6,"InChI=1S/C24H20Cl2N2O4/c1-10-21(29)22(30)23(31)24(32-10)28-18-7-3-12(26)9-16(18)14-5-4-13-15-8-11(25)2-6-17(15)27-19(13)20(14)28/h2-10,21-24,27,29-31H,1H3/t10-,21-,22+,23-,24-/m1/s1",FDYWPCLQYXMCJD-XJZYXNLRSA-N,146683632,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0242,Tjipanazole A2,,other linear non-peptide,,C24H20Cl2N2O4,470.0800125,ClC(C=C1)=CC(C2=C3C4=C(C5=C(C=CC(Cl)=C5)N4)C=C2)=C1N3[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@H](C)O6,"InChI=1S/C24H20Cl2N2O4/c1-10-21(29)22(30)23(31)24(32-10)28-18-7-3-12(26)9-16(18)14-5-4-13-15-8-11(25)2-6-17(15)27-19(13)20(14)28/h2-10,21-24,27,29-31H,1H3/t10-,21+,22-,23+,24+/m0/s1",FDYWPCLQYXMCJD-WVNFPBABSA-N,146683633,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0243,Tjipanazole B,,other linear non-peptide,,C23H18Cl2N2O4,456.0643625,ClC(C=C1)=CC(C2=C3C4=C(C5=C(C=CC(Cl)=C5)N4)C=C2)=C1N3[C@H]6[C@H](O)[C@@H](O)[C@H](O)CO6,"InChI=1S/C23H18Cl2N2O4/c24-10-1-5-16-14(7-10)12-3-4-13-15-8-11(25)2-6-17(15)27(20(13)19(12)26-16)23-22(30)21(29)18(28)9-31-23/h1-8,18,21-23,26,28-30H,9H2/t18-,21+,22-,23-/m1/s1",JEOAJYYDZYNEAH-YJSIEXFISA-N,11340058,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0244,Tjipanazole C1,,other linear non-peptide,,C24H21ClN2O4,436.1189849,ClC(C=C1)=CC(C2=C3C4=C(C5=C(C=CC=C5)N4)C=C2)=C1N3[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@@H](C)O6,"InChI=1S/C24H21ClN2O4/c1-11-21(28)22(29)23(30)24(31-11)27-18-9-6-12(25)10-16(18)15-8-7-14-13-4-2-3-5-17(13)26-19(14)20(15)27/h2-11,21-24,26,28-30H,1H3/t11-,21-,22+,23-,24-/m1/s1",LBDPGQPRGMVQFN-ISBJQNSRSA-N,146683634,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0245,Tjipanazole C2,,other linear non-peptide,,C24H21ClN2O4,436.1189849,ClC1=CC2=C(C=C1)NC3=C2C=CC4=C3N(C5=C4C=CC=C5)[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@@H](C)O6,"InChI=1S/C24H21ClN2O4/c1-11-21(28)22(29)23(30)24(31-11)27-18-5-3-2-4-13(18)15-8-7-14-16-10-12(25)6-9-17(16)26-19(14)20(15)27/h2-11,21-24,26,28-30H,1H3/t11-,21-,22+,23-,24-/m1/s1",XRSXGTRHWJQWIW-ISBJQNSRSA-N,146683635,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0246,Tjipanazole C3,,other linear non-peptide,,C24H21ClN2O4,436.1189849,ClC(C=C1)=CC(C2=C3C4=C(C5=C(C=CC=C5)N4)C=C2)=C1N3[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@H](C)O6,"InChI=1S/C24H21ClN2O4/c1-11-21(28)22(29)23(30)24(31-11)27-18-9-6-12(25)10-16(18)15-8-7-14-13-4-2-3-5-17(13)26-19(14)20(15)27/h2-11,21-24,26,28-30H,1H3/t11-,21+,22-,23+,24+/m0/s1",LBDPGQPRGMVQFN-ZWEYCGOPSA-N,146683636,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0247,Tjipanazole C4,,other linear non-peptide,,C24H21ClN2O4,436.1189849,ClC1=CC2=C(C=C1)NC3=C2C=CC4=C3N(C5=C4C=CC=C5)[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@H](C)O6,"InChI=1S/C24H21ClN2O4/c1-11-21(28)22(29)23(30)24(31-11)27-18-5-3-2-4-13(18)15-8-7-14-16-10-12(25)6-9-17(16)26-19(14)20(15)27/h2-11,21-24,26,28-30H,1H3/t11-,21+,22-,23+,24+/m0/s1",XRSXGTRHWJQWIW-ZWEYCGOPSA-N,146683637,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0248,Tjipanazole D,,other linear non-peptide,,C18H10Cl2N2,324.0221037,ClC1=CC2=C(C=C1)NC3=C2C=CC4=C3NC5=C4C=C(Cl)C=C5,"InChI=1S/C18H10Cl2N2/c19-9-1-5-15-13(7-9)11-3-4-12-14-8-10(20)2-6-16(14)22-18(12)17(11)21-15/h1-8,21-22H",NNZIVRYPHRMPQM-UHFFFAOYSA-N,10087661,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0249,Tjipanazole E,,other linear non-peptide,,C24H20Cl2N2O5,486.0749272,ClC(C=C1)=CC(C2=C3C4=C(C5=C(C=CC(Cl)=C5)N4)C=C2)=C1N3[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O6,"InChI=1S/C24H20Cl2N2O5/c25-10-1-5-16-14(7-10)12-3-4-13-15-8-11(26)2-6-17(15)28(20(13)19(12)27-16)24-23(32)22(31)21(30)18(9-29)33-24/h1-8,18,21-24,27,29-32H,9H2/t18-,21-,22+,23-,24-/m1/s1",SZUVYWLTIGVGME-REXJZNOJSA-N,11420375,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0250,Tjipanazole F1,,other linear non-peptide,,C23H19ClN2O4,422.1033348,ClC(C=C1)=CC(C2=C3C4=C(C5=C(C=CC=C5)N4)C=C2)=C1N3[C@H]6[C@H](O)[C@@H](O)[C@H](O)CO6,"InChI=1S/C23H19ClN2O4/c24-11-5-8-17-15(9-11)14-7-6-13-12-3-1-2-4-16(12)25-19(13)20(14)26(17)23-22(29)21(28)18(27)10-30-23/h1-9,18,21-23,25,27-29H,10H2/t18-,21+,22-,23-/m1/s1",OYTSBTTZMCNVKQ-YJSIEXFISA-N,9979670,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0251,Anachelin,anachelin-1,other linear peptide,,C35H49N6O13,761.3352121,OC(CC(O)C1N=C(C2=CC=CC=C2O)OC1)CC(N[C@@H]([C@H](O)C)C(N[C@H](CO)C(N[C@@H](CO)C(NC3CC(C=C(O)C(O)=C4)=C4[N+](C)(C)C3)=O)=O)=O)=O,"InChI=1S/C35H48N6O13/c1-17(44)31(40-30(50)11-20(45)10-27(47)24-16-54-35(39-24)21-6-4-5-7-26(21)46)34(53)38-23(15-43)33(52)37-22(14-42)32(51)36-19-8-18-9-28(48)29(49)12-25(18)41(2,3)13-19/h4-7,9,12,17,19-20,22-24,27,31,42-45,47H,8,10-11,13-16H2,1-3H3,(H6-,36,37,38,39,40,46,48,49,50,51,52,53)/p+1/t17-,19?,20?,22+,23-,24?,27?,31+/m1/s1",OCPGDSBMGHZPQN-ZFHRVURNSA-O,135759450,yes,Anabaena,cylindrica ,NIES 19  
CyanoMetDB_0252,Tjipanazole F2,,other linear non-peptide,,C23H19ClN2O4,422.1033348,ClC1=CC2=C(C=C1)NC3=C2C=CC4=C3N(C5=C4C=CC=C5)[C@H]6[C@H](O)[C@@H](O)[C@H](O)CO6,"InChI=1S/C23H19ClN2O4/c24-11-5-8-16-15(9-11)13-6-7-14-12-3-1-2-4-17(12)26(20(14)19(13)25-16)23-22(29)21(28)18(27)10-30-23/h1-9,18,21-23,25,27-29H,10H2/t18-,21+,22-,23-/m1/s1",SYACLHGRMBPYAS-YJSIEXFISA-N,10320075,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0253,Tjipanazole G1,,other linear non-peptide,,C24H22N2O4,402.1579572,O[C@@H]1[C@@H](O)[C@H](O)[C@@H](C)O[C@H]1N2C3=C(C4=C2C5=C(C6=C(C=CC=C6)N5)C=C4)C=CC=C3,"InChI=1S/C24H22N2O4/c1-12-21(27)22(28)23(29)24(30-12)26-18-9-5-3-7-14(18)16-11-10-15-13-6-2-4-8-17(13)25-19(15)20(16)26/h2-12,21-25,27-29H,1H3/t12-,21-,22+,23-,24-/m1/s1",WAYQLPDVCJWOAA-HMEBCMRKSA-N,146683638,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0254,Tjipanazole G2,,other linear non-peptide,,C24H22N2O4,402.1579572,O[C@@H]1[C@@H](O)[C@H](O)[C@H](C)O[C@H]1N2C3=C(C4=C2C5=C(C6=C(C=CC=C6)N5)C=C4)C=CC=C3,"InChI=1S/C24H22N2O4/c1-12-21(27)22(28)23(29)24(30-12)26-18-9-5-3-7-14(18)16-11-10-15-13-6-2-4-8-17(13)25-19(15)20(16)26/h2-12,21-25,27-29H,1H3/t12-,21+,22-,23+,24+/m0/s1",WAYQLPDVCJWOAA-VZZWKMCISA-N,146683639,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0255,Tjipanazole I,,other linear non-peptide,,C18H11ClN2,290.0610761,ClC(C=C1)=CC2=C1NC3=C2C=CC4=C3NC5=C4C=CC=C5,"InChI=1S/C18H11ClN2/c19-10-5-8-16-14(9-10)13-7-6-12-11-3-1-2-4-15(11)20-17(12)18(13)21-16/h1-9,20-21H",FTMOEUBKRZXYEX-UHFFFAOYSA-N,10755969,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0256,Tjipanazole J,,other linear non-peptide,,C20H11Cl2N3O2,395.022832,ClC1=CC2=C(C=C1)NC3=C2C4=C(C(O)NC4=O)C5=C3NC6=C5C=C(Cl)C=C6,"InChI=1S/C20H11Cl2N3O2/c21-7-1-3-11-9(5-7)13-15-16(20(27)25-19(15)26)14-10-6-8(22)2-4-12(10)24-18(14)17(13)23-11/h1-6,19,23-24,26H,(H,25,27)",VPAUHAGHNLTFEI-UHFFFAOYSA-N,15705741,yes,Tolypothrix,tjipanasensis   ,n.a.
CyanoMetDB_0257,Trichormamide B,,other cyclic peptide,,C69H115N13O20,1445.838133,O=C(C[C@H](NC([C@H]([C@@H](C)O)N1)=O)CCCCCCC)N[C@@H]([C@H](CC)C)C(N[C@H]([C@@H](O)C(C)C)C(N[C@@H](CCO)C(N[C@H]([C@@H](O)C(C)C)C(N[C@@H](CCC(N)=O)C(N(C)[C@@H]([C@@H](C)CC)C(N[C@H](CO)C(N[C@@H]([C@@H](C)O)C(N(CCC2)[C@@H]2C(N[C@@H](C1=O)CC(C=C3)=CC=C3O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C69H115N13O20/c1-13-16-17-18-19-21-42-33-50(89)76-51(37(8)14-2)63(96)80-55(58(91)36(6)7)65(98)72-44(29-31-83)59(92)79-54(57(90)35(4)5)66(99)73-45(27-28-49(70)88)68(101)81(12)56(38(9)15-3)67(100)75-47(34-84)61(94)78-53(40(11)86)69(102)82-30-20-22-48(82)62(95)74-46(32-41-23-25-43(87)26-24-41)60(93)77-52(39(10)85)64(97)71-42/h23-26,35-40,42,44-48,51-58,83-87,90-91H,13-22,27-34H2,1-12H3,(H2,70,88)(H,71,97)(H,72,98)(H,73,99)(H,74,95)(H,75,100)(H,76,89)(H,77,93)(H,78,94)(H,79,92)(H,80,96)/t37-,38-,39+,40+,42+,44-,45-,46+,47+,48-,51-,52-,53-,54+,55+,56-,57-,58-/m0/s1",MSGPXZILSHWDOB-ZXSGCDKOSA-N,118711962,yes,Trichormus,n.a.,UIC 10339 
CyanoMetDB_0258,Tychonamide A,,other cyclic peptide,other cyclic depsipeptide,C73H107N13O20,1485.775533,O=C([C@@H](CCC(N)=O)NC1=O)NCC(N2[C@@H](CCC2)C(N3[C@@H](CCC3)C(N[C@H]([C@@H](C)CC)C(N[C@@H](CO)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](CCC4=CC=C(OC)C=C4)C(N5[C@@H](CCC5)C(NC(CC(OC([C@H](CC(C)C)N(C)C(C)=O)=O)CC(O)CC6=CC=CC=C6)C1O)=O)=O)=O)=O)=C/C)=O)=O)=O)=O)=O,"InChI=1S/C73H107N13O20/c1-10-41(5)60-68(99)80-53(39-87)65(96)76-49(11-2)64(95)82-61(42(6)88)69(100)78-51(28-25-44-23-26-47(105-9)27-24-44)71(102)85-32-15-20-54(85)66(97)79-52(37-48(36-46(90)35-45-18-13-12-14-19-45)106-73(104)57(34-40(3)4)83(8)43(7)89)62(93)70(101)77-50(29-30-58(74)91)63(94)75-38-59(92)84-31-17-22-56(84)72(103)86-33-16-21-55(86)67(98)81-60/h11-14,18-19,23-24,26-27,40-42,46,48,50-57,60-62,87-88,90,93H,10,15-17,20-22,25,28-39H2,1-9H3,(H2,74,91)(H,75,94)(H,76,96)(H,77,101)(H,78,100)(H,79,97)(H,80,99)(H,81,98)(H,82,95)/b49-11+/t41-,42+,46?,48?,50+,51+,52?,53-,54-,55-,56-,57-,60+,61-,62?/m0/s1",ODQWSGPULNHBGL-MCIOLPHXSA-N,139586415,yes,Tychonema,n.a.,CCAP 1462/13 
CyanoMetDB_0259,Tychonamide B,,other cyclic peptide,other cyclic depsipeptide,C72H105N13O19,1455.764968,O=C([C@@H](CCC(N)=O)NC1=O)NCC(N2[C@@H](CCC2)C(N3[C@@H](CCC3)C(N[C@H]([C@@H](C)CC)C(N[C@@H](CO)C(N/C(C(N[C@@H]([C@@H](C)O)C(N[C@H](CCC4=CC=CC=C4)C(N5[C@@H](CCC5)C(NC(CC(OC([C@H](CC(C)C)N(C)C(C)=O)=O)CC(O)CC6=CC=CC=C6)C1O)=O)=O)=O)=O)=C/C)=O)=O)=O)=O)=O,"InChI=1S/C72H105N13O19/c1-9-41(5)59-67(98)79-52(39-86)64(95)75-48(10-2)63(94)81-60(42(6)87)68(99)77-50(28-27-44-20-13-11-14-21-44)70(101)84-32-17-24-53(84)65(96)78-51(37-47(36-46(89)35-45-22-15-12-16-23-45)104-72(103)56(34-40(3)4)82(8)43(7)88)61(92)69(100)76-49(29-30-57(73)90)62(93)74-38-58(91)83-31-19-26-55(83)71(102)85-33-18-25-54(85)66(97)80-59/h10-16,20-23,40-42,46-47,49-56,59-61,86-87,89,92H,9,17-19,24-39H2,1-8H3,(H2,73,90)(H,74,93)(H,75,95)(H,76,100)(H,77,99)(H,78,96)(H,79,98)(H,80,97)(H,81,94)/b48-10+/t41-,42+,46?,47?,49+,50+,51?,52-,53-,54-,55-,56-,59+,60-,61?/m0/s1",MTUBMTPWQGVXCG-UDDZTRNDSA-N,,yes,Tychonema,n.a.,CCAP 1462/13 
CyanoMetDB_0260,Muscoride B,,other linear non-peptide,,C31H41N5O6,579.3056841,O=C([C@@H](NC/C=C(C)\C)[C@H](CC)C)N1CCC[C@H]1C2=NC(C3=NC(C4=NC(C(OC/C=C(C)/C)=O)=CO4)=C(O3)C)=CO2,"InChI=1S/C31H41N5O6/c1-8-20(6)25(32-13-11-18(2)3)30(37)36-14-9-10-24(36)28-33-22(16-40-28)27-35-26(21(7)42-27)29-34-23(17-41-29)31(38)39-15-12-19(4)5/h11-12,16-17,20,24-25,32H,8-10,13-15H2,1-7H3/t20-,24-,25-/m0/s1",RYLVRVUEEVJKJO-OPXMRZJTSA-N,146682347,yes,Nostoc,n.a.,UHCC 398 
CyanoMetDB_0261,Aestuaramide A,Aesturamide 1 ;; Aesturamide,other cyclic peptide,,C40H51N7O6S3,821.3062959,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC(C(N[C@H](C3=O)CCSC)=O)=CS2)C(C)C)=O)CCC1)=O)CC4=CC=C(C=C4)OC(C)(C=C)C)C5=CSC([C@H]6N3CCC6)=N5,"InChI=1S/C40H51N7O6S3/c1-7-40(4,5)53-25-14-12-24(13-15-25)20-27-39(52)46-17-8-10-30(46)35(50)45-32(23(2)3)37-44-29(22-56-37)33(48)41-26(16-19-54-6)38(51)47-18-9-11-31(47)36-43-28(21-55-36)34(49)42-27/h7,12-15,21-23,26-27,30-32H,1,8-11,16-20H2,2-6H3,(H,41,48)(H,42,49)(H,45,50)/t26-,27-,30-,31-,32-/m0/s1",YOYNSTWQXPGTNJ-SYUOHOBJSA-N,146683667,yes,Lyngbya,aestuarii   ,n.a.
CyanoMetDB_0262,Anachelin-2,,other linear peptide,,C35H49N6O13,761.3352121,OC(CC(N[C@@H]([C@H](O)C)C(N[C@H](CO)C(N[C@@H](CO)C(NC1CC(C=C(O)C(O)=C2)=C2[N+](C)(C)C1)=O)=O)=O)=O)CC3OC(C4=CC=CC=C4O)=NC3CO,"InChI=1S/C35H48N6O13/c1-17(45)31(40-30(50)11-20(46)10-29-22(14-42)39-35(54-29)21-6-4-5-7-26(21)47)34(53)38-24(16-44)33(52)37-23(15-43)32(51)36-19-8-18-9-27(48)28(49)12-25(18)41(2,3)13-19/h4-7,9,12,17,19-20,22-24,29,31,42-46H,8,10-11,13-16H2,1-3H3,(H6-,36,37,38,39,40,47,48,49,50,51,52,53)/p+1/t17-,19?,20?,22?,23+,24-,29?,31+/m1/s1",BXTHEZGZPKLTGV-YCBLZRCGSA-O,135759449,yes,Anabaena,cylindrica ,NIES 19  
CyanoMetDB_0263,Aestuaramide B,Aesturamide 2,other cyclic peptide,,C35H43N7O6S3,753.2436957,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC(C(N[C@H](C3=O)CCSC)=O)=CS2)C(C)C)=O)CCC1)=O)CC4=CC=C(C=C4)O)C5=CSC([C@H]6N3CCC6)=N5,"InChI=1S/C35H43N7O6S3/c1-19(2)28-33-39-25(18-51-33)29(44)36-22(12-15-49-3)34(47)42-14-5-7-27(42)32-38-24(17-50-32)30(45)37-23(16-20-8-10-21(43)11-9-20)35(48)41-13-4-6-26(41)31(46)40-28/h8-11,17-19,22-23,26-28,43H,4-7,12-16H2,1-3H3,(H,36,44)(H,37,45)(H,40,46)/t22-,23-,26-,27-,28-/m0/s1",HASVRKZRWCGMOX-CINPPDSJSA-N,146683668,yes,Lyngbya,aestuarii   ,n.a.
CyanoMetDB_0264,Amantelide A,,other cyclic non-peptide,,C44H84O11,788.6013635,OC(CCCC(O)CC(C(C)(C)C)O1)CCCC(O)CCCC(O)CCCC(CCCC(O)CCCC(CCC[C@@H](O)C[C@@H](O)CCC/C(C)=C([H])\C1=O)O)O,"InChI=1S/C44H84O11/c1-32-13-5-26-39(51)30-40(52)27-11-24-37(49)22-9-20-35(47)18-7-16-33(45)14-6-15-34(46)17-8-19-36(48)21-10-23-38(50)25-12-28-41(53)31-42(44(2,3)4)55-43(54)29-32/h29,33-42,45-53H,5-28,30-31H2,1-4H3/b32-29-/t33?,34?,35?,36?,37?,38?,39-,40+,41?,42?/m0/s1",KOLKKRHAEDKYEF-UVLQLYQISA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0265,Amantelide B,,other cyclic non-peptide,,C46H86O12,830.6119282,OC(CCCC(O)CCCC(CCC[C@@H](O)C[C@@H](O)CCC/C(C)=C([H])\C1=O)O)CCCC(O)CCCC(O)CCCC(CCCC(O)CC(C(C)(C)C)O1)OC(C)=O,"InChI=1S/C46H86O12/c1-33-14-6-25-40(53)31-41(54)26-11-23-38(51)21-9-19-36(49)17-7-15-35(48)16-8-18-37(50)20-10-22-39(52)24-12-28-43(57-34(2)47)29-13-27-42(55)32-44(46(3,4)5)58-45(56)30-33/h30,35-44,48-55H,6-29,31-32H2,1-5H3/b33-30-/t35?,36?,37?,38?,39?,40-,41+,42?,43?,44?/m0/s1",ZNTCNTCXAOQVBB-ZRHQNVPFSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0266,Anabaenolysin A,,other linear peptide,,C28H38N4O8,558.2689642,OC(C(NC(CNC(CNC1=O)=O)=O)C/C=C/C=C/C=C/CC/C=C/C=C/CC)C(NC2CC(OC2C1O)=O)=O,"InChI=1S/C28H38N4O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(36)28(39)32-20-16-23(35)40-26(20)25(37)27(38)30-17-21(33)29-18-22(34)31-19/h3-6,9-14,19-20,24-26,36-37H,2,7-8,15-18H2,1H3,(H,29,33)(H,30,38)(H,31,34)(H,32,39)/b4-3+,6-5+,10-9+,12-11+,14-13+",XQWGCUIJOHQMPI-FLYMKIDMSA-N,146683737,yes,Anabaena,n.a.,XPORK 15F 
CyanoMetDB_0267,Anabaenolysin B,,other cyclic peptide,,C28H40N4O8,560.2846143,OC(C(NC(CNC(CNC1=O)=O)=O)C/C=C/C=C/C=C/CC/C=C/CCCC)C(NC2CC(OC2C1O)=O)=O,"InChI=1S/C28H40N4O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24(36)28(39)32-20-16-23(35)40-26(20)25(37)27(38)30-17-21(33)29-18-22(34)31-19/h5-6,9-14,19-20,24-26,36-37H,2-4,7-8,15-18H2,1H3,(H,29,33)(H,30,38)(H,31,34)(H,32,39)/b6-5+,10-9+,12-11+,14-13+",LGUAYVFDTSZKFQ-XFKWXGNNSA-N,146683738,yes,Anabaena,n.a.,XSPORK 27C 
CyanoMetDB_0268,Bastimolide A,,other cyclic non-peptide,,C44H84O11,788.6013635,O[C@H](CCC[C@@H](O)CCC[C@@H](O)CCC[C@@H](O)CCC[C@@H](C(C)(C)C)OC1=O)C[C@@H](O)C[C@H](CCC[C@@H](O)CCC[C@@H](O)C[C@@H](O)CCCCC/C(C)=C\1)O,"InChI=1S/C44H84O11/c1-32-14-6-5-7-15-37(49)29-38(50)24-10-20-35(47)22-12-26-40(52)31-41(53)30-39(51)25-11-21-34(46)18-8-16-33(45)17-9-19-36(48)23-13-27-42(44(2,3)4)55-43(54)28-32/h28,33-42,45-53H,5-27,29-31H2,1-4H3/b32-28-/t33-,34+,35+,36-,37+,38-,39-,40+,41-,42+/m1/s1",GMYBARKHHWBGAC-IFYMMUEESA-N,,yes,Okeania,hirsuta   ,n.a.
CyanoMetDB_0269,Biseokeaniamide A,,other linear peptide,,C42H65N7O6S,795.471704,CCCC(N(C)[C@@H](C(C)C)C(N1[C@H](C(N(C)[C@@H](CC2=CC=CC=C2)C(N[C@H](C(N(C)[C@@H](C(C)C)C(N(C)CC3=NC=CS3)=O)=O)CC(C)C)=O)=O)CCC1)=O)=O,"InChI=1S/C42H65N7O6S/c1-12-17-35(50)47(10)37(29(6)7)42(55)49-22-16-20-32(49)40(53)46(9)33(25-30-18-14-13-15-19-30)38(51)44-31(24-27(2)3)39(52)48(11)36(28(4)5)41(54)45(8)26-34-43-21-23-56-34/h13-15,18-19,21,23,27-29,31-33,36-37H,12,16-17,20,22,24-26H2,1-11H3,(H,44,51)/t31-,32-,33-,36-,37-/m0/s1",XNASEKUWNLNRSN-LMUGUXCZSA-N,137628581,yes,Okeania,n.a.,n.a.
CyanoMetDB_0270,Biseokeaniamide B,,other linear peptide,,C41H63N7O6S,781.456054,CCCC(N(C)[C@@H](C(C)C)C(N1[C@H](C(N(C)[C@@H](CC2=CC=CC=C2)C(N[C@H](C(N[C@@H](C(C)C)C(N(C)CC3=NC=CS3)=O)=O)CC(C)C)=O)=O)CCC1)=O)=O,"InChI=1S/C41H63N7O6S/c1-11-16-34(49)47(10)36(28(6)7)41(54)48-21-15-19-31(48)39(52)46(9)32(24-29-17-13-12-14-18-29)38(51)43-30(23-26(2)3)37(50)44-35(27(4)5)40(53)45(8)25-33-42-20-22-55-33/h12-14,17-18,20,22,26-28,30-32,35-36H,11,15-16,19,21,23-25H2,1-10H3,(H,43,51)(H,44,50)/t30-,31-,32-,35-,36-/m0/s1",CHXLGCMMIDZPRB-XGQIDOAOSA-N,139589700,yes,Okeania,n.a.,n.a.
CyanoMetDB_0271,Biseokeaniamide C,,other linear peptide,,C41H63N7O6S,781.456054,CCCC(N[C@@H](C(C)C)C(N1[C@H](C(N(C)[C@@H](CC2=CC=CC=C2)C(N[C@H](C(N(C)[C@@H](C(C)C)C(N(C)CC3=NC=CS3)=O)=O)CC(C)C)=O)=O)CCC1)=O)=O,"InChI=1S/C41H63N7O6S/c1-11-16-33(49)44-35(27(4)5)40(53)48-21-15-19-31(48)39(52)46(9)32(24-29-17-13-12-14-18-29)37(50)43-30(23-26(2)3)38(51)47(10)36(28(6)7)41(54)45(8)25-34-42-20-22-55-34/h12-14,17-18,20,22,26-28,30-32,35-36H,11,15-16,19,21,23-25H2,1-10H3,(H,43,50)(H,44,49)/t30-,31-,32-,35-,36-/m0/s1",YUSHRJINPQIDME-XGQIDOAOSA-N,139589701,yes,Okeania,n.a.,n.a.
CyanoMetDB_0272,Columbamide A,,other linear non-peptide,Columbamide,C23H41Cl2NO4,465.2412642,ClCCCCCCC(Cl)CCCC/C=C/CCC(N(C)[C@@H](COC)COC(C)=O)=O,"InChI=1S/C23H41Cl2NO4/c1-20(27)30-19-22(18-29-3)26(2)23(28)16-12-7-5-4-6-10-14-21(25)15-11-8-9-13-17-24/h5,7,21-22H,4,6,8-19H2,1-3H3/b7-5+/t21?,22-/m0/s1",VFUSKSIAISUKGN-DUNCQPMOSA-N,122183469,yes,Lyngbya/Moorea,bouillonii   ,PNG
CyanoMetDB_0273,Bromoanaindolone,,other linear non-peptide,,C9H8BrNO2,240.973842,C[C@]1(C2=C(C=C(C=C2)Br)NC1=O)O,"InChI=1S/C9H8BrNO2/c1-9(13)6-3-2-5(10)4-7(6)11-8(9)12/h2-4,13H,1H3,(H,11,12)/t9-/m1/s1",IGRQAUGYEAXYJY-SECBINFHSA-N,124428811,yes,Anabaena,constricta,n.a.
CyanoMetDB_0274,11?-hydroxysaxitoxin,11?-OH-STX; M2,Saxitoxin,other linear non-peptide,C10H17N7O5,315.1291167,N=C1N[C@@H](COC(N)=O)[C@@]2([H])[C@]3(NC(N2)=N)N1C[C@@]([H])(O)C3(O)O,"InChI=1S/C10H17N7O5/c11-6-15-5-3(2-22-8(13)19)14-7(12)17-1-4(18)10(20,21)9(5,17)16-6/h3-5,18,20-21H,1-2H2,(H2,12,14)(H2,13,19)(H3,11,15,16)/t3-,4+,5-,9-/m0/s1",IQOJXRIZTPZJOY-XXKOCQOQSA-N,102373714,no ,Aphanizomenon,flos aquae,n.a.
CyanoMetDB_0275,11?-hydroxysaxitoxin,11?-OH-STX; M2,Saxitoxin,other linear non-peptide,C10H17N7O5,315.1291167,OC1([C@@](O)(CN2C(N)=N[C@@H](COC(N)=O)[C@]3([H])N=C(N[C@]123)N)[H])O,"InChI=1S/C10H17N7O5/c11-6-15-5-3(2-22-8(13)19)14-7(12)17-1-4(18)10(20,21)9(5,17)16-6/h3-5,18,20-21H,1-2H2,(H2,12,14)(H2,13,19)(H3,11,15,16)/t3-,4-,5-,9-/m0/s1",IQOJXRIZTPZJOY-LJRZAWCWSA-N,60135304,yes,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_0276,Neosaxitoxin,NEO,Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O5,315.1291,[H][C@@]12[C@]3(NC(N2)=N)N(CCC3(O)O)C(N(O)[C@H]1COC(N)=O)=N,"InChI=1S/C10H17N7O5/c11-6-14-5-4(3-22-8(13)18)17(21)7(12)16-2-1-9(19,20)10(5,16)15-6/h4-5,12,19-21H,1-3H2,(H2,13,18)(H3,11,14,15)/t4-,5-,10-/m0/s1",PPEKGEBBBBNZKS-HGRQIUPRSA-N,21117946,yes,Aphanizomenon; Cylindrospermopsis,[Aphanizomenon]flos aquae,n.a.
CyanoMetDB_0277,Saxitoxin,STX,Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O4,299.1342,[H][C@@]12[C@]3(NC(N2)=N)N(CCC3(O)O)C(N[C@H]1COC(N)=O)=N,"InChI=1S/C10H17N7O4/c11-6-15-5-4(3-21-8(13)18)14-7(12)17-2-1-9(19,20)10(5,17)16-6/h4-5,19-20H,1-3H2,(H2,12,14)(H2,13,18)(H3,11,15,16)/p+1/t4-,5-,10-/m0/s1",RPQXVSUAYFXFJA-HGRQIUPRSA-N,56947150,yes,Aphanizomenon; Anabaena; Cylindrospermopsis; Planktothrix,[Aphanizomenon]flos aquae,n.a.
CyanoMetDB_0279,Decarbamoylgonyautoxin-2,dcGTX2,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O7S,352.0801,N=C(N(C[C@@]([H])(OS(=O)(O)=O)C1(O)O)[C@@]1(N2)[C@@]3([H])NC2=N)N([H])[C@H]3CO,"InChI=1S/C9H16N6O7S/c10-6-13-5-3(2-16)12-7(11)15-1-4(22-23(19,20)21)9(17,18)8(5,15)14-6/h3-5,16-18H,1-2H2,(H2,11,12)(H3,10,13,14)(H,19,20,21)/t3-,4+,5-,8-/m1/s1",AJLCXXKDNUGKKH-LIIKNNTCSA-N,49789095,yes,Lyngbya,[Lyngbya]wollei,n.a.
CyanoMetDB_0280,Decarbamoylgonyautoxin-3,dcGTX3,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O7S,352.0801,OC[C@@H]1N([H])C(N(C[C@]([H])(OS(=O)(O)=O)C(O)2O)[C@@]2(N3)[C@@]1([H])NC3=N)=N,"InChI=1S/C9H16N6O7S/c10-6-13-5-3(2-16)12-7(11)15-1-4(22-23(19,20)21)9(17,18)8(5,15)14-6/h3-5,16-18H,1-2H2,(H2,11,12)(H3,10,13,14)(H,19,20,21)/t3-,4-,5-,8-/m0/s1",AJLCXXKDNUGKKH-LIIKNNTCSA-N,49789095,yes,Lyngbya,[Lyngbya]wollei,n.a.
CyanoMetDB_0282,Decarbamoylneosaxitoxin,dcNEO,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O4,272.1233,OC([C@@]12NC(N[C@@]2([H])[C@H](CO)N3O)=N)(O)CCN1C3=N,"InChI=1S/C9H16N6O4/c10-6-12-5-4(3-16)15(19)7(11)14-2-1-8(17,18)9(5,14)13-6/h4-5,11,16-19H,1-3H2,(H3,10,12,13)/t4-,5-,9-/m0/s1",KUMXVBFFVVLQFX-PJPYAQQDSA-N,21119311,yes,n.a.,n.a.,n.a.
CyanoMetDB_0283,Decarbamoylgonyautoxin-1,dcGTX1,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O8S,368.075,OC1(O)[C@@]2(N3C[C@]([H])1OS(=O)(O)=O)[C@]([C@@H](N(C3=N)O)CO)(NC(N2)=N)[H],"InChI=1S/C9H16N6O8S/c10-6-12-5-3(2-16)15(19)7(11)14-1-4(23-24(20,21)22)9(17,18)8(5,14)13-6/h3-5,11,16-19H,1-2H2,(H3,10,12,13)(H,20,21,22)/t3-,4+,5-,8-/m0/s1",AXKNFGCPJPRVCA-WVBYAZCYSA-N,101917557,yes,Aphanizomenon,catenatum,n.a.
CyanoMetDB_0284,Decarbamoyloxylgonyautoxin-2,doGTX2,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O6S,336.0852,C[C@H]1[C@@]2([H])[C@]3(NC(N2)=N)N(C[C@@H](OS(=O)(O)=O)C3(O)O)C(N1)=N,"InChI=1S/C9H16N6O6S/c1-3-5-8(14-6(10)13-5)9(16,17)4(21-22(18,19)20)2-15(8)7(11)12-3/h3-5,16-17H,2H2,1H3,(H2,11,12)(H3,10,13,14)(H,18,19,20)/t3-,4?,5-,8-/m0/s1",MOUJHDRSWLPUSR-LIIKNNTCSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0285,Decarbamoylgonyautoxin-4,dcGTX4,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O8S,368.075,OC[C@@H]1N(O)C(N(C[C@]([H])(OS(=O)(O)=O)C(O)2O)[C@@]2(N3)[C@@]1([H])NC3=N)=N,"InChI=1S/C9H16N6O8S/c10-6-12-5-3(2-16)15(19)7(11)14-1-4(23-24(20,21)22)9(17,18)8(5,14)13-6/h3-5,11,16-19H,1-2H2,(H3,10,12,13)(H,20,21,22)/t3-,4-,5-,8-/m0/s1",AXKNFGCPJPRVCA-LIIKNNTCSA-N,92029435,yes,Aphanizomenon,catenatum,n.a.
CyanoMetDB_0286,Lyngbyacarbonate,,other linear non-peptide,,C9H12O7,232.0583027,COC(=O)CC1(COC(=O)O1)CC(=O)OC,"InChI=1S/C9H12O7/c1-13-6(10)3-9(4-7(11)14-2)5-15-8(12)16-9/h3-5H2,1-2H3",VXJKZPFTLIABMM-UHFFFAOYSA-N,10263319,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0287,Samholide A,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C96H160O34,1857.079102,C[C@@H]1O[C@H](C[C@@H](C1)OC)CC[C@@H]([C@H](O)[C@@H]([C@H]2OC(=O)/C=C/C(=C/C[C@@H](C[C@H]3O[C@H](C[C@@H]([C@H]([C@H](C[C@H](C[C@H](OC(=O)/C=C/C(=C/C[C@@H](C[C@H]4O[C@H](C[C@@H]([C@H]([C@H](C[C@H](C2)O)O)C)OC)CC=C4)O[C@H]5OC[C@@H]([C@H]([C@@H]5OC(=O)[C@H](O)CO)OC)OC)/C)[C@H]([C@@H](O)[C@H](CC[C@@H]6O[C@H](C[C@H](C6)OC)C)C)C)O)O)C)OC)CC=C3)O[C@H]7OC[C@@H]([C@H]([C@@H]7OC(=O)[C@H](O)CO)OC)OC)/C)C)C,"InChI=1S/C96H160O34/c1-53-25-31-71(125-95-91(129-93(109)77(103)49-97)89(117-17)83(115-15)51-119-95)43-65-21-19-23-67(123-65)47-79(113-13)60(8)76(102)40-64(100)42-82(62(10)88(108)56(4)30-34-70-46-74(112-12)38-58(6)122-70)128-86(106)36-28-54(2)26-32-72(126-96-92(130-94(110)78(104)50-98)90(118-18)84(116-16)52-120-96)44-66-22-20-24-68(124-66)48-80(114-14)59(7)75(101)39-63(99)41-81(127-85(105)35-27-53)61(9)87(107)55(3)29-33-69-45-73(111-11)37-57(5)121-69/h19-22,25-28,35-36,55-84,87-92,95-104,107-108H,23-24,29-34,37-52H2,1-18H3/b35-27+,36-28+,53-25+,54-26+/t55-,56-,57-,58-,59-,60-,61+,62+,63+,64+,65-,66-,67-,68-,69-,70-,71-,72-,73+,74+,75-,76-,77+,78+,79-,80-,81-,82-,83-,84-,87-,88-,89+,90+,91-,92-,95+,96+/m0/s1",WLZDJBOPVJQGLD-YXPINYNESA-N,139591433,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0288,Samholide B,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C96H160O34,1857.079102,C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C=C\C(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](C/C=C(/C=C/C(=O)O2)\C)O[C@@H]5[C@H]([C@@H]([C@H](CO5)OC)OC)OC(=O)[C@@H](CO)O)OC)C)O)O)[C@@H](C)[C@H]([C@@H](C)CC[C@H]6C[C@@H](C[C@@H](O6)C)OC)O)\C)O[C@@H]7[C@H]([C@@H]([C@H](CO7)OC)OC)OC(=O)[C@@H](CO)O)OC)C)O)O)O)OC,"InChI=1S/C96H160O34/c1-53-25-31-71(125-95-91(129-93(109)77(103)49-97)89(117-17)83(115-15)51-119-95)43-65-21-19-23-67(123-65)47-79(113-13)60(8)76(102)40-64(100)42-82(62(10)88(108)56(4)30-34-70-46-74(112-12)38-58(6)122-70)128-86(106)36-28-54(2)26-32-72(126-96-92(130-94(110)78(104)50-98)90(118-18)84(116-16)52-120-96)44-66-22-20-24-68(124-66)48-80(114-14)59(7)75(101)39-63(99)41-81(127-85(105)35-27-53)61(9)87(107)55(3)29-33-69-45-73(111-11)37-57(5)121-69/h19-22,25-28,35-36,55-84,87-92,95-104,107-108H,23-24,29-34,37-52H2,1-18H3/b35-27-,36-28+,53-25+,54-26+/t55-,56-,57-,58-,59-,60-,61+,62+,63+,64+,65-,66-,67-,68-,69-,70-,71-,72-,73+,74+,75-,76-,77+,78+,79-,80-,81-,82-,83-,84-,87-,88-,89+,90+,91-,92-,95+,96+/m0/s1",WLZDJBOPVJQGLD-BCWNCVGDSA-N,139591434,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0289,Samholide E,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C93H156O31,1769.063058,C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C=C/C(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](C/C=C(/C=C/C(=O)O2)\C)O[C@@H]5[C@H]([C@@H]([C@H](CO5)OC)OC)O)OC)C)O)O)[C@@H](C)[C@H]([C@@H](C)CC[C@H]6C[C@@H](C[C@@H](O6)C)OC)O)\C)O[C@@H]7[C@H]([C@@H]([C@H](CO7)OC)OC)OC(=O)[C@@H](CO)O)OC)C)O)O)O)OC,"InChI=1S/C93H156O31/c1-52-25-31-70(120-92-87(104)88(112-17)81(110-15)50-114-92)43-64-21-19-23-66(118-64)47-77(108-13)58(7)74(97)39-62(95)42-80(61(10)86(103)55(4)30-34-69-46-73(107-12)38-57(6)117-69)123-84(101)36-28-53(2)26-32-71(121-93-90(124-91(105)76(99)49-94)89(113-18)82(111-16)51-115-93)44-65-22-20-24-67(119-65)48-78(109-14)59(8)75(98)40-63(96)41-79(122-83(100)35-27-52)60(9)85(102)54(3)29-33-68-45-72(106-11)37-56(5)116-68/h19-22,25-28,35-36,54-82,85-90,92-99,102-104H,23-24,29-34,37-51H2,1-18H3/b35-27+,36-28+,52-25+,53-26+/t54-,55-,56-,57-,58-,59-,60+,61+,62+,63+,64-,65-,66-,67-,68-,69-,70-,71-,72+,73+,74-,75-,76+,77-,78-,79-,80-,81-,82-,85-,86-,87-,88+,89+,90-,92+,93+/m0/s1",PJILNYZHCHGJIN-BGEIPISBSA-N,139591437,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0290,Samholide F,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C93H156O31,1769.063058,C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C=C\C(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](C/C=C(/C=C/C(=O)O2)\C)O[C@@H]5[C@H]([C@@H]([C@H](CO5)OC)OC)O)OC)C)O)O)[C@@H](C)[C@H]([C@@H](C)CC[C@H]6C[C@@H](C[C@@H](O6)C)OC)O)\C)O[C@@H]7[C@H]([C@@H]([C@H](CO7)OC)OC)OC(=O)[C@@H](CO)O)OC)C)O)O)O)OC,"InChI=1S/C93H156O31/c1-52-25-31-70(120-92-87(104)88(112-17)81(110-15)50-114-92)43-64-21-19-23-66(118-64)47-77(108-13)58(7)74(97)39-62(95)42-80(61(10)86(103)55(4)30-34-69-46-73(107-12)38-57(6)117-69)123-84(101)36-28-53(2)26-32-71(121-93-90(124-91(105)76(99)49-94)89(113-18)82(111-16)51-115-93)44-65-22-20-24-67(119-65)48-78(109-14)59(8)75(98)40-63(96)41-79(122-83(100)35-27-52)60(9)85(102)54(3)29-33-68-45-72(106-11)37-56(5)116-68/h19-22,25-28,35-36,54-82,85-90,92-99,102-104H,23-24,29-34,37-51H2,1-18H3/b35-27+,36-28-,52-25+,53-26+/t54-,55-,56-,57-,58-,59-,60+,61+,62+,63+,64-,65-,66-,67-,68-,69-,70-,71-,72+,73+,74-,75-,76+,77-,78-,79-,80-,81-,82-,85-,86-,87-,88+,89+,90-,92+,93+/m0/s1",PJILNYZHCHGJIN-KGZGFBQDSA-N,139591438,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0291,Samholide G,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C93H156O31,1769.063058,C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C=C/C(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](C/C=C(/C=C\C(=O)O2)\C)O[C@@H]5[C@H]([C@@H]([C@H](CO5)OC)OC)O)OC)C)O)O)[C@@H](C)[C@H]([C@@H](C)CC[C@H]6C[C@@H](C[C@@H](O6)C)OC)O)\C)O[C@@H]7[C@H]([C@@H]([C@H](CO7)OC)OC)OC(=O)[C@@H](CO)O)OC)C)O)O)O)OC,"InChI=1S/C93H156O31/c1-52-25-31-70(120-92-87(104)88(112-17)81(110-15)50-114-92)43-64-21-19-23-66(118-64)47-77(108-13)58(7)74(97)39-62(95)42-80(61(10)86(103)55(4)30-34-69-46-73(107-12)38-57(6)117-69)123-84(101)36-28-53(2)26-32-71(121-93-90(124-91(105)76(99)49-94)89(113-18)82(111-16)51-115-93)44-65-22-20-24-67(119-65)48-78(109-14)59(8)75(98)40-63(96)41-79(122-83(100)35-27-52)60(9)85(102)54(3)29-33-68-45-72(106-11)37-56(5)116-68/h19-22,25-28,35-36,54-82,85-90,92-99,102-104H,23-24,29-34,37-51H2,1-18H3/b35-27-,36-28+,52-25+,53-26+/t54-,55-,56-,57-,58-,59-,60+,61+,62+,63+,64-,65-,66-,67-,68-,69-,70-,71-,72+,73+,74-,75-,76+,77-,78-,79-,80-,81-,82-,85-,86-,87-,88+,89+,90-,92+,93+/m0/s1",PJILNYZHCHGJIN-CHHPEMCPSA-N,139591439,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0292,Samholide C,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C90H152O28,1681.047014,C[C@@H]1O[C@H](C[C@@H](C1)OC)CC[C@@H]([C@H](O)[C@@H]([C@H]2OC(=O)/C=C/C(=C/C[C@@H](C[C@H]3O[C@H](C[C@@H]([C@H]([C@H](C[C@H](C[C@H](OC(=O)/C=C/C(=C/C[C@@H](C[C@H]4O[C@H](C[C@@H]([C@H]([C@H](C[C@H](C2)O)O)C)OC)CC=C4)O[C@H]5OC[C@@H]([C@H]([C@@H]5O)OC)OC)/C)[C@H]([C@@H](O)[C@H](CC[C@@H]6O[C@H](C[C@H](C6)OC)C)C)C)O)O)C)OC)CC=C3)O[C@H]7OC[C@@H]([C@H]([C@@H]7O)OC)OC)/C)C)C,"InChI=1S/C90H152O28/c1-51-25-31-69(115-89-85(99)87(107-17)79(105-15)49-109-89)43-63-21-19-23-65(113-63)47-75(103-13)58(8)74(94)40-62(92)42-78(60(10)84(98)54(4)30-34-68-46-72(102-12)38-56(6)112-68)118-82(96)36-28-52(2)26-32-70(116-90-86(100)88(108-18)80(106-16)50-110-90)44-64-22-20-24-66(114-64)48-76(104-14)57(7)73(93)39-61(91)41-77(117-81(95)35-27-51)59(9)83(97)53(3)29-33-67-45-71(101-11)37-55(5)111-67/h19-22,25-28,35-36,53-80,83-94,97-100H,23-24,29-34,37-50H2,1-18H3/b35-27+,36-28+,51-25+,52-26+/t53-,54-,55-,56-,57-,58-,59+,60+,61+,62+,63-,64-,65-,66-,67-,68-,69-,70-,71+,72+,73-,74-,75-,76-,77-,78-,79-,80-,83-,84-,85-,86-,87+,88+,89+,90+/m0/s1",KBYZXUKIPLHREO-WEQIDFKDSA-N,139591435,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0293,Samholide D,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C90H152O28,1681.047014,C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C=C\C(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](C/C=C(/C=C/C(=O)O2)\C)O[C@@H]5[C@H]([C@@H]([C@H](CO5)OC)OC)O)OC)C)O)O)[C@@H](C)[C@H]([C@@H](C)CC[C@H]6C[C@@H](C[C@@H](O6)C)OC)O)\C)O[C@@H]7[C@H]([C@@H]([C@H](CO7)OC)OC)O)OC)C)O)O)O)OC,"InChI=1S/C90H152O28/c1-51-25-31-69(115-89-85(99)87(107-17)79(105-15)49-109-89)43-63-21-19-23-65(113-63)47-75(103-13)58(8)74(94)40-62(92)42-78(60(10)84(98)54(4)30-34-68-46-72(102-12)38-56(6)112-68)118-82(96)36-28-52(2)26-32-70(116-90-86(100)88(108-18)80(106-16)50-110-90)44-64-22-20-24-66(114-64)48-76(104-14)57(7)73(93)39-61(91)41-77(117-81(95)35-27-51)59(9)83(97)53(3)29-33-67-45-71(101-11)37-55(5)111-67/h19-22,25-28,35-36,53-80,83-94,97-100H,23-24,29-34,37-50H2,1-18H3/b35-27-,36-28+,51-25+,52-26+/t53-,54-,55-,56-,57-,58-,59+,60+,61+,62+,63-,64-,65-,66-,67-,68-,69-,70-,71+,72+,73-,74-,75-,76-,77-,78-,79-,80-,83-,84-,85-,86-,87+,88+,89+,90+/m0/s1",KBYZXUKIPLHREO-PGUAZCRZSA-N,139591436,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0294,N-butyryl-L-homoserine lactone, (+)-?(S)-butyramido-?-butyrolactone,other linear non-peptide,AHLs,C8H13NO3,171.0895433,O=C1OCCC1NC(CCC)=O,"InChI=1S/C8H13NO3/c1-2-3-7(10)9-6-4-5-12-8(6)11/h6H,2-5H2,1H3,(H,9,10)/t6-/m0/s1",VFFNZZXXTGXBOG-LURJTMIESA-N,10130163,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0295,Gadusol,,other linear non-peptide,Mycosporine?like amino acids,C8H12O6,204.0633881,O=C1C(OC)=C(O)CC(O)(CO)C1O,"InChI=1S/C8H12O6/c1-14-6-4(10)2-8(13,3-9)7(12)5(6)11/h7,9-10,12-13H,2-3H2,1H3",OPIUUJWCOWMEJN-UHFFFAOYSA-N,195955,no,n.a.,n.a.,n.a.
CyanoMetDB_0296,Deoxygadusol,4-Deoxygadusol; 6-Deoxygadusol,other linear non-peptide,Mycosporine?like amino acids,C8H12O5,188.0684735,COC1=C(O)CC(CO)(O)CC1=O,"InChI=1S/C8H12O5/c1-13-7-5(10)2-8(12,4-9)3-6(7)11/h9-10,12H,2-4H2,1H3",ZONRIYAALKITGT-UHFFFAOYSA-N,85926716,no,n.a.,n.a.,n.a.
CyanoMetDB_0297,Samholide H,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C89H150O28,1667.031364,C[C@H]1C[C@H](C[C@@H](O1)CC[C@H](C)[C@@H]([C@H](C)[C@@H]2C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]3CC=C[C@H](O3)C[C@H](C/C=C(/C=C/C(=O)O[C@@H](C[C@@H](C[C@@H]([C@@H]([C@H](C[C@@H]4CC=C[C@H](O4)C[C@H](C/C=C(/C=C/C(=O)O2)\C)O[C@@H]5[C@H]([C@@H]([C@H](CO5)O)OC)O)OC)C)O)O)[C@@H](C)[C@H]([C@@H](C)CC[C@H]6C[C@@H](C[C@@H](O6)C)OC)O)\C)O[C@@H]7[C@H]([C@@H]([C@H](CO7)OC)OC)O)OC)C)O)O)O)OC,"InChI=1S/C89H150O28/c1-50-24-30-68(114-88-84(99)86(106-16)74(94)48-108-88)42-62-20-18-22-64(112-62)46-75(103-13)56(7)72(92)38-60(90)41-78(59(10)83(98)53(4)29-33-67-45-71(102-12)37-55(6)111-67)117-81(96)35-27-51(2)25-31-69(115-89-85(100)87(107-17)79(105-15)49-109-89)43-63-21-19-23-65(113-63)47-76(104-14)57(8)73(93)39-61(91)40-77(116-80(95)34-26-50)58(9)82(97)52(3)28-32-66-44-70(101-11)36-54(5)110-66/h18-21,24-27,34-35,52-79,82-94,97-100H,22-23,28-33,36-49H2,1-17H3/b34-26+,35-27+,50-24+,51-25+/t52-,53-,54-,55-,56-,57-,58+,59+,60+,61+,62-,63-,64-,65-,66-,67-,68-,69-,70+,71+,72-,73-,74-,75-,76-,77-,78-,79-,82-,83-,84-,85-,86+,87+,88+,89+/m0/s1",HWBNYFMBFABIIO-YKKRSERTSA-N,139591440,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0298,Microviridin H,,Microviridin,Depsipeptide,C89H115N17O26,1837.819917,CC(N[C@H](C(N1CCC[C@H]1C(N[C@H](C(N[C@@H]([C@@H](C)OC(C[C@H](NC2=O)C(N[C@@H](CC3=CNC4=C3C=CC=C4)C(N[C@@H](CCC(OC)=O)C(N[C@H](C(N[C@@H](CC5=CC=C(O)C=C5)C(O)=O)=O)CCC(NCCCC[C@@H](C(N[C@@H](CC6=CC=C(O)C=C6)C(N7CCC[C@H]7C(N[C@H]2CO)=O)=O)=O)NC8=O)=O)=O)=O)=O)=O)C(N[C@H]8CC(C)C)=O)=O)CCC(N)=O)=O)=O)CC9=CC=C(O)C=C9)=O,"InChI=1S/C89H115N17O26/c1-46(2)38-62-80(120)94-58-14-8-9-35-91-72(113)33-30-60(78(118)102-67(89(129)130)41-51-21-27-55(111)28-22-51)95-77(117)61(31-34-73(114)131-5)96-81(121)63(42-52-44-92-57-13-7-6-12-56(52)57)98-82(122)64(99-83(123)68(45-107)103-85(125)70-16-11-37-106(70)88(128)66(101-76(58)116)40-50-19-25-54(110)26-20-50)43-74(115)132-47(3)75(86(126)100-62)104-79(119)59(29-32-71(90)112)97-84(124)69-15-10-36-105(69)87(127)65(93-48(4)108)39-49-17-23-53(109)24-18-49/h6-7,12-13,17-28,44,46-47,58-70,75,92,107,109-111H,8-11,14-16,29-43,45H2,1-5H3,(H2,90,112)(H,91,113)(H,93,108)(H,94,120)(H,95,117)(H,96,121)(H,97,124)(H,98,122)(H,99,123)(H,100,126)(H,101,116)(H,102,118)(H,103,125)(H,104,119)(H,129,130)/t47-,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,70+,75+/m1/s1",UGNBQCBVWHMOCX-PIDJHHABSA-N,16139228,yes,Nostoc,minutum,NIES 26
CyanoMetDB_0300,Microviridin G,,Microviridin,Depsipeptide,C88H111N17O25,1805.793702,CC(N[C@H](C(N1CCC[C@H]1C(N[C@H](C(N[C@@H]([C@@H](C)OC(C[C@H](NC2=O)C(N[C@@H](CC3=CNC4=C3C=CC=C4)C(N[C@@H](CCC(OC[C@@H]2NC5=O)=O)C(N[C@H](C(N[C@@H](CC6=CC=C(O)C=C6)C(O)=O)=O)CCC(NCCCC[C@@H](C(N[C@@H](CC7=CC=C(O)C=C7)C(N8CCC[C@H]85)=O)=O)NC9=O)=O)=O)=O)=O)=O)C(N[C@H]9CC(C)C)=O)=O)CCC(N)=O)=O)=O)CC%10=CC=C(O)C=C%10)=O,"InChI=1S/C88H111N17O25/c1-45(2)37-61-79(118)93-57-13-7-8-34-90-71(111)32-29-59(77(116)101-66(88(127)128)40-50-20-26-54(109)27-21-50)94-76(115)60-30-33-72(112)129-44-67(102-84(123)69-15-10-36-105(69)87(126)65(100-75(57)114)39-49-18-24-53(108)25-19-49)82(121)98-63(81(120)97-62(80(119)95-60)41-51-43-91-56-12-6-5-11-55(51)56)42-73(113)130-46(3)74(85(124)99-61)103-78(117)58(28-31-70(89)110)96-83(122)68-14-9-35-104(68)86(125)64(92-47(4)106)38-48-16-22-52(107)23-17-48/h5-6,11-12,16-27,43,45-46,57-69,74,91,107-109H,7-10,13-15,28-42,44H2,1-4H3,(H2,89,110)(H,90,111)(H,92,106)(H,93,118)(H,94,115)(H,95,119)(H,96,122)(H,97,120)(H,98,121)(H,99,124)(H,100,114)(H,101,116)(H,102,123)(H,103,117)(H,127,128)/t46-,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,74+/m1/s1",XHBISUXCZPXBOS-CZHVHIQZSA-N,16146906,yes,Nostoc,minutum,NIES 26
CyanoMetDB_0301,Microviridin I,,Microviridin,Depsipeptide,C86H108N16O25,1764.767153,CC(N[C@@H](CC1=CC=C(O)C=C1)C(N2CCC[C@H]2C(N[C@H](C(N[C@H](C(N[C@H]3CC(C)C)=O)[C@H](OC(C[C@H](N4)C(N[C@H](C(N[C@@H](CCC(OC[C@H](NC([C@H]5N(C([C@@H](NC6=O)CC7=CC=C(O)C=C7)=O)CCC5)=O)C4=O)=O)C(N[C@@H](CC(NCCCC[C@@H]6NC3=O)=O)C(N[C@H](C(O)=O)CC8=CC=C(O)C=C8)=O)=O)=O)CC9=CNC%10=C9C=CC=C%10)=O)=O)C)=O)[C@H](O)C)=O)=O)=O,"InChI=1S/C86H108N16O25/c1-43(2)34-58-75(113)90-56-14-8-9-31-87-68(108)39-60(77(115)97-64(86(124)125)37-49-21-27-53(107)28-22-49)93-74(112)57-29-30-69(109)126-42-65(98-80(118)66-15-10-32-101(66)85(123)63(96-73(56)111)36-48-19-25-52(106)26-20-48)79(117)94-61(78(116)92-59(76(114)91-57)38-50-41-88-55-13-7-6-12-54(50)55)40-70(110)127-45(4)72(83(121)95-58)100-82(120)71(44(3)103)99-81(119)67-16-11-33-102(67)84(122)62(89-46(5)104)35-47-17-23-51(105)24-18-47/h6-7,12-13,17-28,41,43-45,56-67,71-72,88,103,105-107H,8-11,14-16,29-40,42H2,1-5H3,(H,87,108)(H,89,104)(H,90,113)(H,91,114)(H,92,116)(H,93,112)(H,94,117)(H,95,121)(H,96,111)(H,97,115)(H,98,118)(H,99,119)(H,100,120)(H,124,125)/t44-,45-,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,71+,72+/m1/s1",QIXNFZOBUNPVTK-GZLXVXMUSA-N,,yes,Oscillatoria/Planktothrix,agardhii,"2, 18"
CyanoMetDB_0302,Microviridin C,,Microviridin,Depsipeptide,C85H110N16O25,1754.782803,CC(N[C@H](C(NCC(N[C@H](C(N[C@@H]([C@@H](C)OC(C[C@H](NC1=O)C(N[C@@H](CC2=CC(C=CC=C3)=C3N2)C(N[C@@H](CCC(OC)=O)C(N[C@H](C(N[C@@H](CC4=CC=C(O)C=C4)C(O)=O)=O)CCC(NCCCC[C@@H](C(N[C@@H](CC5=CC=C(O)C=C5)C(N6CCC[C@H]6C(N[C@H]1CO)=O)=O)=O)NC7=O)=O)=O)=O)=O)=O)C(N[C@H]7CC(C)C)=O)=O)[C@H](O)C)=O)=O)CC8=CC=CC=C8)=O,"InChI=1S/C85H110N16O25/c1-44(2)35-59-77(115)90-56-19-12-13-33-86-67(107)31-29-57(76(114)97-64(85(123)124)38-50-23-27-54(106)28-24-50)91-75(113)58(30-32-69(109)125-6)92-78(116)61(40-52-39-51-17-10-11-18-55(51)89-52)93-79(117)62(94-80(118)65(43-102)98-81(119)66-20-14-34-101(66)84(122)63(96-74(56)112)37-49-21-25-53(105)26-22-49)41-70(110)126-46(4)72(83(121)95-59)100-82(120)71(45(3)103)99-68(108)42-87-73(111)60(88-47(5)104)36-48-15-8-7-9-16-48/h7-11,15-18,21-28,39,44-46,56-66,71-72,89,102-103,105-106H,12-14,19-20,29-38,40-43H2,1-6H3,(H,86,107)(H,87,111)(H,88,104)(H,90,115)(H,91,113)(H,92,116)(H,93,117)(H,94,118)(H,95,121)(H,96,112)(H,97,114)(H,98,119)(H,99,108)(H,100,120)(H,123,124)/t45-,46-,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,71+,72+/m1/s1",WMSHUAZOBJFDIH-MJWXGQQYSA-N,16142910,yes,Microcystis,aeruginosa,NIES 298
CyanoMetDB_0303,Microviridin A,,Microviridin,Depsipeptide,C85H100N16O24,1728.709638,O=C(C)N[C@@](C(NCC(NCC(N[C@]([C@](C)([H])OC(C[C@@](NC([C@@](CO1)([H])NC([C@@]2([H])N(CCC2)C([C@@](CC3=CC=C(O)C=C3)([H])NC([C@@]4([H])N5)=O)=O)=O)=O)([H])C(N[C@](CC6=CNC7=C6C=CC=C7)([H])C(N[C@](CCC1=O)([H])C(N[C@]([H])(C(N[C@](CC8=CC=C(O)C=C8)([H])C(O)=O)=O)CCC(NCCCC4)=O)=O)=O)=O)=O)([H])C(N[C@](CC9=CC=CC=C9)([H])C5=O)=O)=O)=O)=O)([H])CC%10=CC=C(O)C=C%10,"InChI=1S/C85H100N16O24/c1-45-73(100-70(108)43-88-69(107)42-89-74(111)60(90-46(2)102)36-48-17-23-52(103)24-18-48)83(120)96-61(35-47-11-4-3-5-12-47)78(115)91-57-15-8-9-33-86-68(106)31-29-58(77(114)98-65(85(122)123)38-50-21-27-54(105)28-22-50)92-76(113)59-30-32-71(109)124-44-66(99-82(119)67-16-10-34-101(67)84(121)64(97-75(57)112)37-49-19-25-53(104)26-20-49)81(118)95-63(40-72(110)125-45)80(117)94-62(79(116)93-59)39-51-41-87-56-14-7-6-13-55(51)56/h3-7,11-14,17-28,41,45,57-67,73,87,103-105H,8-10,15-16,29-40,42-44H2,1-2H3,(H,86,106)(H,88,107)(H,89,111)(H,90,102)(H,91,115)(H,92,113)(H,93,116)(H,94,117)(H,95,118)(H,96,120)(H,97,112)(H,98,114)(H,99,119)(H,100,108)(H,122,123)/t45-,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,73+/m1/s1",GZWAMQUNOCFCLH-UXBLHMAISA-N,,yes,Microcystis,viridis,NIES I02
CyanoMetDB_0304,Microviridin L,,Microviridin,Depsipeptide,C84H98N16O24,1714.693988,CC(N[C@H](C(NCC(NCC(N[C@@H]([C@H](C)OC(C[C@H](N1)C(N[C@H](C(N[C@H](CCC(OC[C@H](NC2=O)C1=O)=O)C(N[C@H](C(N[C@@H](CC3=CC=C(O)C=C3)C(O)=O)=O)CC(NCCCC[C@H](NC([C@@H]4CC5=CC=CC=C5)=O)C(N[C@@H](CC6=CC=C(O)C=C6)C(N7CCC[C@H]72)=O)=O)=O)=O)=O)CC8=CNC9=C8C=CC=C9)=O)=O)C(N4)=O)=O)=O)=O)CC%10=CC=C(O)C=C%10)=O,"InChI=1S/C84H98N16O24/c1-44-72(99-69(107)42-87-68(106)41-88-73(110)58(89-45(2)101)34-47-17-23-51(102)24-18-47)82(119)95-59(33-46-11-4-3-5-12-46)76(113)90-56-15-8-9-31-85-67(105)38-61(78(115)97-64(84(121)122)36-49-21-27-53(104)28-22-49)93-75(112)57-29-30-70(108)123-43-65(98-81(118)66-16-10-32-100(66)83(120)63(96-74(56)111)35-48-19-25-52(103)26-20-48)80(117)94-62(39-71(109)124-44)79(116)92-60(77(114)91-57)37-50-40-86-55-14-7-6-13-54(50)55/h3-7,11-14,17-28,40,44,56-66,72,86,102-104H,8-10,15-16,29-39,41-43H2,1-2H3,(H,85,105)(H,87,106)(H,88,110)(H,89,101)(H,90,113)(H,91,114)(H,92,116)(H,93,112)(H,94,117)(H,95,119)(H,96,111)(H,97,115)(H,98,118)(H,99,107)(H,121,122)/t44-,56-,57+,58-,59-,60-,61-,62-,63-,64-,65-,66-,72-/m0/s1",WLHHUMSPNLZREI-WLNUAIIISA-N,146683734,no,Microcystis,aeruginosa,n.a.
CyanoMetDB_0305,Microviridin D,,Microviridin,Depsipeptide,C84H107N17O26S,1801.729388,CC(N[C@H](C(NCC(N[C@@H](CC(N)=O)C(N[C@@H]([C@@H](C)OC(C[C@H](NC1=O)C(N[C@@H](CC2=CNC3=C2C=CC=C3)C(N[C@@H](CCC(OC)=O)C(N[C@@H]4C(N[C@@H](CC5=CC=C(O)C=C5)C(O)=O)=O)=O)=O)=O)=O)C(N[C@H](C(N[C@@H](CCCCNC(CC4)=O)C(N[C@@H](CC6=CC=C(O)C=C6)C(N7CCC[C@H]7C(N[C@H]1CO)=O)=O)=O)=O)CCSC)=O)=O)=O)=O)CC8=CC=C(O)C=C8)=O,"InChI=1S/C84H107N17O26S/c1-43-71(100-79(119)60(38-66(85)107)90-68(109)41-88-72(112)58(89-44(2)103)34-45-14-20-49(104)21-15-45)82(122)94-57(30-33-128-4)76(116)91-54-12-7-8-31-86-67(108)28-26-55(75(115)98-63(84(124)125)36-47-18-24-51(106)25-19-47)92-74(114)56(27-29-69(110)126-3)93-77(117)59(37-48-40-87-53-11-6-5-10-52(48)53)95-78(118)61(39-70(111)127-43)96-80(120)64(42-102)99-81(121)65-13-9-32-101(65)83(123)62(97-73(54)113)35-46-16-22-50(105)23-17-46/h5-6,10-11,14-25,40,43,54-65,71,87,102,104-106H,7-9,12-13,26-39,41-42H2,1-4H3,(H2,85,107)(H,86,108)(H,88,112)(H,89,103)(H,90,109)(H,91,116)(H,92,114)(H,93,117)(H,94,122)(H,95,118)(H,96,120)(H,97,113)(H,98,115)(H,99,121)(H,100,119)(H,124,125)/t43-,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,71+/m1/s1",YEJXJFKDCRKSRQ-LBHOYRLISA-N,16146311,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0306,Microviridin B,,Microviridin,Depsipeptide,C84H106N16O24,1722.756588,CC(N[C@H](C(NCC(N[C@H](C(N[C@@H]([C@@H](C)OC(C[C@H](NC1=O)C(N[C@@H](CC2=CC(C=CC=C3)=C3N2)C(N[C@@H](CCC(OC[C@@H]1NC4=O)=O)C(N[C@H](C(N[C@@H](CC5=CC=C(O)C=C5)C(O)=O)=O)CCC(NCCCC[C@@H](C(N[C@@H](CC6=CC=C(O)C=C6)C(N7CCC[C@H]74)=O)=O)NC8=O)=O)=O)=O)=O)=O)C(N[C@H]8CC(C)C)=O)=O)[C@H](O)C)=O)=O)CC9=CC=CC=C9)=O,"InChI=1S/C84H106N16O24/c1-43(2)34-58-76(113)89-55-18-11-12-32-85-66(105)30-28-56(75(112)96-63(84(121)122)37-49-22-26-53(104)27-23-49)90-74(111)57-29-31-68(107)123-42-64(97-80(117)65-19-13-33-100(65)83(120)62(95-73(55)110)36-48-20-24-52(103)25-21-48)79(116)93-61(78(115)92-60(77(114)91-57)39-51-38-50-16-9-10-17-54(50)88-51)40-69(108)124-45(4)71(82(119)94-58)99-81(118)70(44(3)101)98-67(106)41-86-72(109)59(87-46(5)102)35-47-14-7-6-8-15-47/h6-10,14-17,20-27,38,43-45,55-65,70-71,88,101,103-104H,11-13,18-19,28-37,39-42H2,1-5H3,(H,85,105)(H,86,109)(H,87,102)(H,89,113)(H,90,111)(H,91,114)(H,92,115)(H,93,116)(H,94,119)(H,95,110)(H,96,112)(H,97,117)(H,98,106)(H,99,118)(H,121,122)/t44-,45-,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,70+,71+/m1/s1",SSXIRHWTKBSKKV-DBBDCZJTSA-N,16138909,yes,Microcystis,aeruginosa,NIES 298
CyanoMetDB_0307,Microviridin K,,Microviridin,Depsipeptide,C83H103N17O25S,1769.703173,O=C(NC(CC1=CC=C(O)C=C1)C(O)=O)C(NC(C(CC2)NC(C(NC(C(NC3=O)CC(OC(C)C(NC(C(NC(CNC(C(CC4=CC=C(O)C=C4)NC(C)=O)=O)=O)CC(N)=O)=O)C(NC(CCSC)C(NC(CCCCN5)C(NC(CC6=CC=C(O)C=C6)C(N7CCCC7C(NC3COC2=O)=O)=O)=O)=O)=O)=O)=O)CC8=CNC9=C8C=CC=C9)=O)=O)CCC5=O ,"InChI=1S/C83H103N17O25S/c1-42-70(99-78(117)59(37-65(84)105)89-67(107)40-87-71(110)57(88-43(2)101)33-44-13-19-48(102)20-14-44)81(120)93-56(29-32-126-3)75(114)90-53-11-6-7-30-85-66(106)27-25-54(74(113)97-62(83(122)123)35-46-17-23-50(104)24-18-46)91-73(112)55-26-28-68(108)124-41-63(98-80(119)64-12-8-31-100(64)82(121)61(96-72(53)111)34-45-15-21-49(103)22-16-45)79(118)95-60(38-69(109)125-42)77(116)94-58(76(115)92-55)36-47-39-86-52-10-5-4-9-51(47)52/h4-5,9-10,13-24,39,42,53-64,70,86,102-104H,6-8,11-12,25-38,40-41H2,1-3H3,(H2,84,105)(H,85,106)(H,87,110)(H,88,101)(H,89,107)(H,90,114)(H,91,112)(H,92,115)(H,93,120)(H,94,116)(H,95,118)(H,96,111)(H,97,113)(H,98,119)(H,99,117)(H,122,123)/t42-,53+,54+,55+,56+,57-,58+,59+,60+,61+,62+,63+,64+,70+/m1/s1",FNVONONIUIBRLO-KDWSHUHMSA-N,,no,Oscillatoria/Planktothrix,agardhii ,n.a.
CyanoMetDB_0308,Microviridin F,,Microviridin,Depsipeptide,C82H102N14O25,1682.714055,CC(N[C@H](C(N[C@H](C(N[C@@H]([C@@H](C)O)C(N[C@H](C(N[C@@H](CCCCNC(C[C@H](NC([C@@H](NC([C@@H](NC([C@@H](NC1=O)CC(O)=O)=O)CC2=CC=CC=C2)=O)CCC(OC)=O)=O)C(N[C@@H](CC3=CC=CC=C3)C(O)=O)=O)=O)C(N[C@@H](CC4=CC=C(O)C=C4)C(N5CCC[C@H]5C(N[C@H]1CO)=O)=O)=O)=O)CC6=CC=C(O)C=C6)=O)=O)CO)=O)CC7=CC=CC=C7)=O,"InChI=1S/C82H102N14O25/c1-45(99)69(95-78(115)64(44-98)93-72(109)56(84-46(2)100)36-47-16-7-4-8-17-47)80(117)90-58(38-50-24-28-52(101)29-25-50)74(111)85-54-22-13-14-34-83-66(103)41-59(75(112)92-62(82(119)120)40-49-20-11-6-12-21-49)88-71(108)55(32-33-68(106)121-3)86-73(110)57(37-48-18-9-5-10-19-48)87-76(113)60(42-67(104)105)89-77(114)63(43-97)94-79(116)65-23-15-35-96(65)81(118)61(91-70(54)107)39-51-26-30-53(102)31-27-51/h4-12,16-21,24-31,45,54-65,69,97-99,101-102H,13-15,22-23,32-44H2,1-3H3,(H,83,103)(H,84,100)(H,85,111)(H,86,110)(H,87,113)(H,88,108)(H,89,114)(H,90,117)(H,91,107)(H,92,112)(H,93,109)(H,94,116)(H,95,115)(H,104,105)(H,119,120)/t45-,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,69+/m1/s1",BFGWTGFCCHCPDG-FBBTTXGWSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0309,Microviridin E,,microviridin,Depsipeptide,C82H100N14O24,1664.70349,CC(N[C@H](C(N[C@H](C(N[C@@H]([C@@H](C)OC(C[C@H](NC1=O)C(N[C@@H](CC2=CC=CC=C2)C(N[C@@H](CCC(OC)=O)C(N[C@H](C(N[C@@H](CC3=CC=CC=C3)C(O)=O)=O)CC(NCCCC[C@@H](C(N[C@@H](CC4=CC=C(O)C=C4)C(N5CCC[C@H]5C(N[C@H]1CO)=O)=O)=O)NC6=O)=O)=O)=O)=O)=O)C(N[C@H]6CC7=CC=C(O)C=C7)=O)=O)CO)=O)CC8=CC=CC=C8)=O,"InChI=1S/C82H100N14O24/c1-45-69(95-78(113)64(44-98)93-72(107)56(84-46(2)99)36-47-16-7-4-8-17-47)80(115)90-58(38-50-24-28-52(100)29-25-50)74(109)85-54-22-13-14-34-83-66(102)41-59(75(110)92-62(82(117)118)40-49-20-11-6-12-21-49)88-71(106)55(32-33-67(103)119-3)86-73(108)57(37-48-18-9-5-10-19-48)87-76(111)60(42-68(104)120-45)89-77(112)63(43-97)94-79(114)65-23-15-35-96(65)81(116)61(91-70(54)105)39-51-26-30-53(101)31-27-51/h4-12,16-21,24-31,45,54-65,69,97-98,100-101H,13-15,22-23,32-44H2,1-3H3,(H,83,102)(H,84,99)(H,85,109)(H,86,108)(H,87,111)(H,88,106)(H,89,112)(H,90,115)(H,91,105)(H,92,110)(H,93,107)(H,94,114)(H,95,113)(H,117,118)/t45-,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,69+/m1/s1",BNCSFXKJMAWFSD-FBBTTXGWSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0310,Microviridin J,,Microviridin,Depsipeptide,C80H105N19O22,1683.768156,CC(NC(C(NC(C(NC(C(C)OC(CC(NC1=O)C(NC(CC2=CNC3=C2C=CC=C3)C(NC(CCC4=O)C(NC(C(NC(CC5=CNC6=C5C=CC=C6)C(O)=O)=O)CCC(NCCCCC(C(NC(CC7=CC=C(O)C=C7)C(N8CCCC8C(NC1CO4)=O)=O)=O)N9)=O)=O)=O)=O)=O)C(NC(CCCNC(N)=N)C9=O)=O)=O)CO)=O)C(C)CC)=O ,"InChI=1S/C80H105N19O22/c1-5-40(2)65(87-42(4)101)76(115)96-59(38-100)73(112)98-66-41(3)121-64(105)35-56-72(111)92-55(33-44-36-85-49-16-8-6-14-47(44)49)71(110)90-54-26-28-63(104)120-39-60(74(113)93-56)97-75(114)61-20-13-31-99(61)78(117)57(32-43-21-23-46(102)24-22-43)94-68(107)51(88-67(106)52(91-77(66)116)19-12-30-84-80(81)82)18-10-11-29-83-62(103)27-25-53(89-69(54)108)70(109)95-58(79(118)119)34-45-37-86-50-17-9-7-15-48(45)50/h6-9,14-17,21-24,36-37,40-41,51-61,65-66,85-86,100,102H,5,10-13,18-20,25-35,38-39H2,1-4H3,(H,83,103)(H,87,101)(H,88,106)(H,89,108)(H,90,110)(H,91,116)(H,92,111)(H,93,113)(H,94,107)(H,95,109)(H,96,115)(H,97,114)(H,98,112)(H,118,119)(H4,81,82,84)",UHZXWOOHTDKOIX-UHFFFAOYSA-N,,yes,Microcystis ,aeruginosa  ,UWOCC CBS
CyanoMetDB_0311,Microviridin LH1667,,Microviridin,,C80H100N14O23,1624.708576,CC(N[C@@H](CC1=CC=C(O)C=C1)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H](CCCCN2)C(N[C@H](C(N3CCC[C@H]3C(N[C@@H](CO4)C(N[C@@H](C5)C(N[C@H](C(N[C@@H](CCC4=O)C([C@@H](CCC2=O)N[C@@H](CC6=CC=C(O)C=C6)C(O)=O)=O)=O)CC7=CNC8=C7C=CC=C8)=O)=O)=O)=O)CC9=CC=C(O)C=C9)=O)=O)CC(C)C)=O)[C@@H](C)OC5=O)=O)CO)=O)=O,"InChI=1S/C80H100N14O23/c1-41(2)32-56-71(105)86-55-12-7-8-30-81-65(100)28-26-53(84-61(80(114)115)35-46-18-24-50(99)25-19-46)69(103)54-27-29-66(101)116-40-63(92-77(111)64-13-9-31-94(64)79(113)60(90-70(55)104)34-45-16-22-49(98)23-17-45)76(110)88-59(74(108)87-58(73(107)85-54)36-47-38-82-52-11-6-5-10-51(47)52)37-67(102)117-42(3)68(78(112)89-56)93-75(109)62(39-95)91-72(106)57(83-43(4)96)33-44-14-20-48(97)21-15-44/h5-6,10-11,14-25,38,41-42,53-64,68,82,84,95,97-99H,7-9,12-13,26-37,39-40H2,1-4H3,(H,81,100)(H,83,96)(H,85,107)(H,86,105)(H,87,108)(H,88,110)(H,89,112)(H,90,104)(H,91,106)(H,92,111)(H,93,109)(H,114,115)/t42-,53-,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,68+/m1/s1",NFNSLVJFCIPOAU-SOBUNMMOSA-N,146683627,yes,Microcystis,n.a.,n.a.
CyanoMetDB_0312,"2,4-dichlorobenzoic acid",,other linear non-peptide,,C7H4Cl2O2,189.9588348,C1=CC(=C(C=C1Cl)Cl)C(=O)O,"InChI=1S/C7H4Cl2O2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)",ATCRIUVQKHMXSH-UHFFFAOYSA-N,5787,yes,Fischerella,ambigua,n.a.
CyanoMetDB_0313,Guanitoxin,Anatoxin-a(s) ,other linear non-peptide,,C7H17N4O4P,252.098742,CN(C[C@H]1CN=C(N)N1OP(O)(OC)=O)C,"InChI=1S/C7H17N4O4P/c1-10(2)5-6-4-9-7(8)11(6)15-16(12,13)14-3/h6H,4-5H2,1-3H3,(H2,8,9)(H,12,13)/t6-/m1/s1",FYXHGVMFJYHPFX-ZCFIWIBFSA-N,114989,no,Anabaena,oumiana ,ITEP-025; ITEP-026
CyanoMetDB_0314,Y-lactone 2,,other linear non-peptide,,C7H10O5,174.0528234,COC(=O)CC1(CC(=O)OC1)O,"InChI=1S/C7H10O5/c1-11-5(8)2-7(10)3-6(9)12-4-7/h10H,2-4H2,1H3",HIYYVYGWCYYZJA-UHFFFAOYSA-N,21674240,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0315,Malevamide C,,other cyclic peptide,other cyclic depsipeptide,C79H125N13O16,1511.936725,CC[C@H](C)[C@H]1C(=O)NC(C(C(=O)O[C@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N(C(C(=O)N([C@H](C(=O)N([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N1C)CC(C)C)C(C)C)C)C)C)C)CC5=CC=CC=C5)C)COC)C)C(C)C)C)C)C(C)C)C)CCCC#C,"InChI=1S/C79H125N13O16/c1-23-25-27-35-55-50(12)79(106)108-65(48(9)10)69(96)81-52(14)71(98)90-39-30-36-57(90)73(100)88(20)63(47(7)8)78(105)86(18)61(44-107-22)76(103)85(17)60(43-54-33-28-26-29-34-54)75(102)84(16)53(15)66(93)80-51(13)70(97)87(19)62(46(5)6)67(94)83-56(42-45(3)4)72(99)91-40-32-38-59(91)77(104)92-41-31-37-58(92)74(101)89(21)64(49(11)24-2)68(95)82-55/h1,26,28-29,33-34,45-53,55-65H,24-25,27,30-32,35-44H2,2-22H3,(H,80,93)(H,81,96)(H,82,95)(H,83,94)/t49-,50?,51-,52-,53+,55?,56-,57-,58-,59-,60-,61?,62-,63-,64-,65-/m0/s1",AJYHEKJFCQXDSB-PDLWVTQISA-N,139585226,yes,Symploca,laete-viridis,n.a.
CyanoMetDB_0316,Samholide I,,other cyclic non-peptide,"check for substructure ""CC(O1)CC(OC)CC1C""",C76H128O18,1328.910067,C[C@@H]1O[C@H](C[C@@H](C1)OC)CC[C@@H]([C@H](O)[C@@H]([C@H]2OC(=O)/C=C/C(=C/CCC[C@H]3O[C@H](C[C@@H]([C@H]([C@H](C[C@H](C[C@H](OC(=O)/C=C/C(=C/CCC[C@H]4O[C@H](C[C@@H]([C@H]([C@H](C[C@H](C2)O)O)C)OC)CC=C4)/C)[C@H]([C@@H](O)[C@H](CC[C@@H]5O[C@H](C[C@H](C5)OC)C)C)C)O)O)C)OC)CC=C3)/C)C)C,"InChI=1S/C76H128O18/c1-47-21-15-17-23-59-25-19-27-61(91-59)45-69(87-13)54(8)68(80)40-58(78)42-72(56(10)76(84)50(4)32-34-64-44-66(86-12)38-52(6)90-64)94-74(82)36-30-48(2)22-16-18-24-60-26-20-28-62(92-60)46-70(88-14)53(7)67(79)39-57(77)41-71(93-73(81)35-29-47)55(9)75(83)49(3)31-33-63-43-65(85-11)37-51(5)89-63/h19-22,25-26,29-30,35-36,49-72,75-80,83-84H,15-18,23-24,27-28,31-34,37-46H2,1-14H3/b35-29+,36-30+,47-21+,48-22+/t49-,50-,51-,52-,53-,54-,55+,56+,57+,58+,59+,60+,61-,62-,63-,64-,65+,66+,67-,68-,69-,70-,71-,72-,75-,76-/m0/s1",YBQSARBLARAWIZ-VYRZQMCSSA-N,139591441,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0317,Malevamide B,,other cyclic peptide,other cyclic depsipeptide,C76H124N12O14,1428.935997,CCCC1C(C(=O)O[C@@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N(C(C(=O)N(C(C(=O)N2CCC[C@H]2C(=O)N(C(C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N(C(C(=O)N4CCC[C@H]4C(=O)N([C@H](C(=O)N1)CC5=CC=CC=C5)C)C(C)C)C)[C@@H](C)CC)C(C)C)C)C(C)C)C)C(C)C)C)C(C)C)C)C)C(C)C)C,"InChI=1S/C76H124N12O14/c1-24-32-52-49(16)76(101)102-63(47(13)14)75(100)80(18)50(17)64(89)78-57(42(3)4)70(95)84(22)60(44(7)8)72(97)85(23)62(46(11)12)74(99)88-40-31-37-55(88)68(93)82(20)59(43(5)6)66(91)79-58(48(15)25-2)71(96)86-38-29-36-54(86)69(94)83(21)61(45(9)10)73(98)87-39-30-35-53(87)67(92)81(19)56(65(90)77-52)41-51-33-27-26-28-34-51/h26-28,33-34,42-50,52-63H,24-25,29-32,35-41H2,1-23H3,(H,77,90)(H,78,89)(H,79,91)/t48-,49?,50-,52?,53-,54-,55-,56-,57-,58-,59?,60?,61?,62?,63+/m0/s1",IJCFPNODXKAIPP-DBABXTLQSA-N,21603460,yes,Symploca,laete-viridis,n.a.
CyanoMetDB_0318,Microviridin SD1684,Microviridin SD-1684,Microviridin,Depsipeptide,C76H104N18O26,1684.736916,O=C(N[C@@H](CCC(OC)=O)C(N[C@H](C(N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)=O)[C@@H]2O)=O)[C@@H](NC([C@@H](NC([C@H](CO)NC([C@@H]3CCCN3C([C@@H](NC([C@H](CCCCNC2=O)NC([C@H](CCCNC(N)=N)NC(C([C@H](O)C)NC([C@H](C)NC([C@@H](NC(C)=O)[C@H](O)C)=O)=O)=O)=O)=O)CC4=CC=C(O)C=C4)=O)=O)=O)CC(O)=O)=O)CC5=CNC6=C5C=CC=C6,"InChI=1S/C76H104N18O26/c1-36(82-70(113)58(37(2)96)83-39(4)98)62(105)92-59(38(3)97)71(114)86-48(15-10-28-80-76(77)78)63(106)84-47-14-8-9-27-79-73(116)61(104)60(72(115)90-53(75(118)119)31-41-19-23-44(100)24-20-41)93-65(108)49(25-26-57(103)120-5)85-66(109)50(32-42-34-81-46-13-7-6-12-45(42)46)87-67(110)51(33-56(101)102)88-68(111)54(35-95)91-69(112)55-16-11-29-94(55)74(117)52(89-64(47)107)30-40-17-21-43(99)22-18-40/h6-7,12-13,17-24,34,36-38,47-55,58-61,81,95-97,99-100,104H,8-11,14-16,25-33,35H2,1-5H3,(H,79,116)(H,82,113)(H,83,98)(H,84,106)(H,85,109)(H,86,114)(H,87,110)(H,88,111)(H,89,107)(H,90,115)(H,91,112)(H,92,105)(H,93,108)(H,101,102)(H,118,119)(H4,77,78,80)/t36-,37+,38+,47-,48-,49-,50-,51-,52-,53-,54-,55-,58-,59?,60-,61-/m0/s1",BLPICGNXOFWGDQ-AYVZUAPGSA-N,,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_0319,Microviridin SD1634,Microviridin SD-1634,Microviridin,,C75H98N18O24,1634.700136,OC1=CC=C(C[C@@H](N2)C(N3[C@H](C(N[C@@H](COC(CCC(C(N[C@@H]([C@H](O)C(NCCCC[C@H](NC([C@H](CCCNC(N)=N)N4)=O)C2=O)=O)C(N[C@@H](CC5=CC=C(O)C=C5)C(O)=O)=O)=O)NC6=O)=O)C(N[C@H](C(N[C@H]6CC7=CNC8=C7C=CC=C8)=O)CC(O[C@H](C)C(NC([C@H](C)NC([C@@H](NC(C)=O)[C@H](O)C)=O)=O)C4=O)=O)=O)=O)CCC3)=O)C=C1,"InChI=1S/C75H98N18O24/c1-35(81-69(109)57(36(2)94)82-38(4)95)61(101)91-58-37(3)117-56(99)32-50-66(106)86-49(31-41-33-80-45-12-6-5-11-44(41)45)65(105)84-48-24-25-55(98)116-34-53(67(107)87-50)90-68(108)54-15-10-28-93(54)73(113)51(29-39-16-20-42(96)21-17-39)88-63(103)46(83-62(102)47(85-70(58)110)14-9-27-79-75(76)77)13-7-8-26-78-72(112)60(100)59(92-64(48)104)71(111)89-52(74(114)115)30-40-18-22-43(97)23-19-40/h5-6,11-12,16-23,33,35-37,46-54,57-60,80,94,96-97,100H,7-10,13-15,24-32,34H2,1-4H3,(H,78,112)(H,81,109)(H,82,95)(H,83,102)(H,84,105)(H,85,110)(H,86,106)(H,87,107)(H,88,103)(H,89,111)(H,90,108)(H,91,101)(H,92,104)(H,114,115)(H4,76,77,79)/t35-,36+,37+,46-,47-,48?,49-,50-,51+,52-,53-,54-,57-,58?,59-,60-/m0/s1",GNOPPRRGDJSLDP-JPVKKRFYSA-N,,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_0320,tetraacyl-sulfo-quinovopyranosyl glycerol,,other linear non-peptide,Glycolipid,C75H138O14S,1294.98073,O=S(C[C@@H]1[C@@H](O)[C@H](OC(CCCCCCCCCCCCCCC)=O)[C@@H](OC(CCCCCCCCCCCCCCC)=O)[C@@H](OC[C@H](OC(CCCCCCCCCCCCCCC)=O)COC(CCCCCCC/C=C\C/C=C\CCCCC)=O)O1)(O)=O,"InChI=1S/C75H138O14S/c1-5-9-13-17-21-25-29-33-34-38-39-43-47-51-55-59-68(76)84-63-66(86-69(77)60-56-52-48-44-40-35-30-26-22-18-14-10-6-2)64-85-75-74(89-71(79)62-58-54-50-46-42-37-32-28-24-20-16-12-8-4)73(72(80)67(87-75)65-90(81,82)83)88-70(78)61-57-53-49-45-41-36-31-27-23-19-15-11-7-3/h21,25,33-34,66-67,72-75,80H,5-20,22-24,26-32,35-65H2,1-4H3,(H,81,82,83)/b25-21-,34-33-/t66-,67-,72-,73+,74-,75+/m1/s1",XKYXXXVGQYGUCV-AXWXJRNWSA-N,10630244,yes,Scytonema,n.a.,TAU SL-30-1-4
CyanoMetDB_0321,Microspinosamide,,other cyclic peptide,Depsipeptides (cyclic),C75H109BrN18O22S,1724.686791,[H]C(N[C@H](C)C(NC(C(O)C1=CC=C(Br)C=C1)C(N2CCC[C@H]2C(N[C@@H](C(C)(C)C)C(N[C@H](C(C)(C)CC)C(N[C@H](CC3=CNC4=C3C=CC=C4)C(N[C@@H](CCCNC(N)=N)C(N[C@H](CS(=O)(O)=O)C(N[C@H]([C@H](OC([C@@H](CC(O)=O)NC([C@@H]5CCCN5C([C@H](NC6=O)C(C)C)=O)=O)=O)C)C(N(C)[C@H]6CCC(N)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C75H109BrN18O22S/c1-12-75(9,10)59(91-67(107)58(74(6,7)8)90-66(106)51-22-17-31-94(51)71(111)56(89-60(100)38(4)82-36-95)57(99)40-23-25-42(76)26-24-40)68(108)84-46(32-41-34-81-44-19-14-13-18-43(41)44)62(102)83-45(20-15-29-80-73(78)79)61(101)86-48(35-117(113,114)115)63(103)88-55-39(5)116-72(112)47(33-53(97)98)85-65(105)50-21-16-30-93(50)70(110)54(37(2)3)87-64(104)49(27-28-52(77)96)92(11)69(55)109/h13-14,18-19,23-26,34,36-39,45-51,54-59,81,99H,12,15-17,20-22,27-33,35H2,1-11H3,(H2,77,96)(H,82,95)(H,83,102)(H,84,108)(H,85,105)(H,86,101)(H,87,104)(H,88,103)(H,89,100)(H,90,106)(H,91,107)(H,97,98)(H4,78,79,80)(H,113,114,115)/t38-,39-,45+,46-,47-,48-,49+,50+,51+,54-,55-,56?,57?,58-,59+/m1/s1",GUGALNGMVNRENE-MXBNAZQTSA-N,,yes,Microseira,n.a.,UIC 10445
CyanoMetDB_0322,Microviridin SD1652,Microviridin SD-1652,Microviridin,Depsipeptide,C75H100N18O25,1652.710701,O=C(N[C@H]1C(N[C@H](C(N[C@@H](CC2=CC=C(O)C=C2)C(O)=O)=O)[C@H](O)C(NCCCC[C@@H](C(N[C@H](CC3=CC=C(O)C=C3)C4=O)=O)NC([C@H](CCCNC(N)=N)NC(C([C@H](O)C)NC([C@H](C)NC([C@H]([C@H](O)C)NC(C)=O)=O)=O)=O)=O)=O)=O)[C@@H](NC([C@@H](NC([C@H](COC(CC1)=O)NC([C@@H]5CCCN54)=O)=O)CC(O)=O)=O)CC6=CNC7=C6C=CC=C7,"InChI=1S/C75H100N18O25/c1-35(81-69(111)57(36(2)94)82-38(4)96)61(103)91-58(37(3)95)70(112)85-47(14-9-27-79-75(76)77)62(104)83-46-13-7-8-26-78-72(114)60(102)59(71(113)89-52(74(116)117)30-40-18-22-43(98)23-19-40)92-64(106)48-24-25-56(101)118-34-53(90-68(110)54-15-10-28-93(54)73(115)51(88-63(46)105)29-39-16-20-42(97)21-17-39)67(109)87-50(32-55(99)100)66(108)86-49(65(107)84-48)31-41-33-80-45-12-6-5-11-44(41)45/h5-6,11-12,16-23,33,35-37,46-54,57-60,80,94-95,97-98,102H,7-10,13-15,24-32,34H2,1-4H3,(H,78,114)(H,81,111)(H,82,96)(H,83,104)(H,84,107)(H,85,112)(H,86,108)(H,87,109)(H,88,105)(H,89,113)(H,90,110)(H,91,103)(H,92,106)(H,99,100)(H,116,117)(H4,76,77,79)/t35-,36+,37+,46-,47-,48+,49-,50-,51+,52-,53-,54-,57-,58?,59-,60-/m0/s1",XALWEAUOGIUOSS-JTOVNIPUSA-N,,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_0323,Lyngbyaureidamide A,,other cyclic peptide,other cyclic depsipeptide,C74H109N13O22,1531.781012,OC(CC(CC(NC([C@@H]1CCCN1C(C(CCC2=CC=C(C=C2)OC)NC([C@@H](NC(/C(N3)=C\C)=O)[C@H](O)C)=O)=O)=O)C(O)C(N[C@@H](CCC(N)=O)C(NCC(N4CCC[C@@H]4C(N5[C@@H](CCC5)C(N[C@H]([C@@H](C)CC)C(N[C@@H](C3=O)CO)=O)=O)=O)=O)=O)=O)OC([C@H](CC6=CC=C(C=C6)O)N(C(C)=O)C)=O)C(CC(C)C)O,"InChI=1S/C74H109N13O22/c1-10-40(5)61-69(102)81-52(38-88)66(99)77-48(11-2)65(98)83-62(41(6)89)70(103)79-50(27-22-43-20-25-46(108-9)26-21-43)72(105)86-31-12-15-53(86)67(100)80-51(35-47(36-58(93)57(92)33-39(3)4)109-74(107)56(84(8)42(7)90)34-44-18-23-45(91)24-19-44)63(96)71(104)78-49(28-29-59(75)94)64(97)76-37-60(95)85-30-14-17-55(85)73(106)87-32-13-16-54(87)68(101)82-61/h11,18-21,23-26,39-41,47,49-58,61-63,88-89,91-93,96H,10,12-17,22,27-38H2,1-9H3,(H2,75,94)(H,76,97)(H,77,99)(H,78,104)(H,79,103)(H,80,100)(H,81,102)(H,82,101)(H,83,98)/b48-11+",IURIYLBJXOYFRR-TYMOTJJMSA-N,,yes,Lyngbya,n.a.,SAG 36.91
CyanoMetDB_0324,Lyngbyazothrin C,,other cyclic peptide,other cyclic depsipeptide,C74H109N13O22,1531.781012,CC[C@H](C)[C@@H]1C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)NC(C(=O)N2CCC[C@H]2C(=O)NC(C(C(=O)N[C@H](C(=O)NCC(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N1)CCC(=O)N)O)CC(CC(C(CC(C)C)O)O)OC(=O)C(CC5=CC=C(C=C5)O)N(C)C(=O)C)CCC6=CC=C(C=C6)OC)[C@@H](C)O)CO,"InChI=1S/C74H109N13O22/c1-10-40(5)61-69(102)81-52(38-88)66(99)77-48(11-2)65(98)83-62(41(6)89)70(103)79-50(27-22-43-20-25-46(108-9)26-21-43)72(105)86-31-12-15-53(86)67(100)80-51(35-47(36-58(93)57(92)33-39(3)4)109-74(107)56(84(8)42(7)90)34-44-18-23-45(91)24-19-44)63(96)71(104)78-49(28-29-59(75)94)64(97)76-37-60(95)85-30-14-17-55(85)73(106)87-32-13-16-54(87)68(101)82-61/h11,18-21,23-26,39-41,47,49-58,61-63,88-89,91-93,96H,10,12-17,22,27-38H2,1-9H3,(H2,75,94)(H,76,97)(H,77,99)(H,78,104)(H,79,103)(H,80,100)(H,81,102)(H,82,101)(H,83,98)/b48-11+/t40-,41+,47?,49-,50?,51?,52-,53-,54-,55-,56?,57?,58?,61+,62-,63?/m0/s1",IURIYLBJXOYFRR-RWODJXAHSA-N,44254510,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0325,Lyngbyaureidamide B,,other cyclic peptide,other cyclic depsipeptide,C73H107N13O21,1501.770448,OC(CC(CC(NC([C@@H]1CCCN1C(C(CCC2=CC=CC=C2)NC([C@@H](NC(/C(N3)=C\C)=O)[C@H](O)C)=O)=O)=O)C(O)C(N[C@@H](CCC(N)=O)C(NCC(N4CCC[C@@H]4C(N5[C@@H](CCC5)C(N[C@H]([C@@H](C)CC)C(N[C@@H](C3=O)CO)=O)=O)=O)=O)=O)=O)OC(C(CC6=CC=C(C=C6)O)N(C(C)=O)C)=O)C(CC(C)C)O,"InChI=1S/C73H107N13O21/c1-9-40(5)60-68(101)80-51(38-87)65(98)76-47(10-2)64(97)82-61(41(6)88)69(102)78-49(27-24-43-17-12-11-13-18-43)71(104)85-31-14-19-52(85)66(99)79-50(35-46(36-57(92)56(91)33-39(3)4)107-73(106)55(83(8)42(7)89)34-44-22-25-45(90)26-23-44)62(95)70(103)77-48(28-29-58(74)93)63(96)75-37-59(94)84-30-16-21-54(84)72(105)86-32-15-20-53(86)67(100)81-60/h10-13,17-18,22-23,25-26,39-41,46,48-57,60-62,87-88,90-92,95H,9,14-16,19-21,24,27-38H2,1-8H3,(H2,74,93)(H,75,96)(H,76,98)(H,77,103)(H,78,102)(H,79,99)(H,80,101)(H,81,100)(H,82,97)/b47-10+",XCGGFKXEWPNQFS-HGRJMTOVSA-N,,yes,Lyngbya,n.a.,SAG 36.91
CyanoMetDB_0326,Lyngbyazothrin D,,other cyclic peptide,other cyclic depsipeptide,C73H107N13O21,1501.770448,CC[C@H](C)[C@@H]1C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)NC(C(=O)N2CCC[C@H]2C(=O)NC(C(C(=O)N[C@H](C(=O)NCC(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N1)CCC(=O)N)O)CC(CC(C(CC(C)C)O)O)OC(=O)C(CC5=CC=C(C=C5)O)N(C)C(=O)C)CCC6=CC=CC=C6)[C@@H](C)O)CO,"InChI=1S/C73H107N13O21/c1-9-40(5)60-68(101)80-51(38-87)65(98)76-47(10-2)64(97)82-61(41(6)88)69(102)78-49(27-24-43-17-12-11-13-18-43)71(104)85-31-14-19-52(85)66(99)79-50(35-46(36-57(92)56(91)33-39(3)4)107-73(106)55(83(8)42(7)89)34-44-22-25-45(90)26-23-44)62(95)70(103)77-48(28-29-58(74)93)63(96)75-37-59(94)84-30-16-21-54(84)72(105)86-32-15-20-53(86)67(100)81-60/h10-13,17-18,22-23,25-26,39-41,46,48-57,60-62,87-88,90-92,95H,9,14-16,19-21,24,27-38H2,1-8H3,(H2,74,93)(H,75,96)(H,76,98)(H,77,103)(H,78,102)(H,79,99)(H,80,101)(H,81,100)(H,82,97)/b47-10+/t40-,41+,46?,48-,49?,50?,51-,52-,53-,54-,55?,56?,57?,60+,61-,62?/m0/s1",XCGGFKXEWPNQFS-CRPGRYFWSA-N,44254511,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0327,Microviridin M,,Microviridin,Depsipeptide,C72H94N14O19,1458.681967,O=C(N[C@@H]1C(N[C@@H](CCC(NCCCC[C@@H](C(N[C@@H](CC2=CC=C(O)C=C2)C(N3CCC[C@H]3C(N[C@@H](COC(CC1)=O)C(N4)=O)=O)=O)=O)NC([C@H](CC(C)C)NC([C@@]([C@@H](C)OC(C[C@H]4C(N5)=O)=O)([H])NC([C@H](C(C)C)N)=O)=O)=O)=O)C(N[C@@H](CC6=CC=CC=C6)C(O)=O)=O)=O)[C@@H]5CC7=CNC8=C7C=CC=C8,"InChI=1S/C72H94N14O19/c1-37(2)30-49-64(94)76-46-18-11-12-28-74-56(88)26-24-47(63(93)83-53(72(102)103)32-40-14-7-6-8-15-40)77-62(92)48-25-27-57(89)104-36-54(84-68(98)55-19-13-29-86(55)71(101)52(82-61(46)91)31-41-20-22-43(87)23-21-41)67(97)80-51(34-58(90)105-39(5)60(70(100)81-49)85-69(99)59(73)38(3)4)66(96)79-50(65(95)78-48)33-42-35-75-45-17-10-9-16-44(42)45/h6-10,14-17,20-23,35,37-39,46-55,59-60,75,87H,11-13,18-19,24-34,36,73H2,1-5H3,(H,74,88)(H,76,94)(H,77,92)(H,78,95)(H,79,96)(H,80,97)(H,81,100)(H,82,91)(H,83,93)(H,84,98)(H,85,99)(H,102,103)/t39-,46+,47+,48+,49+,50+,51+,52+,53+,54+,55+,59+,60+/m1/s1",VORFWDWWIMRFMG-YIXBORKCSA-N,146684897,no,n.a.,n.a.,n.a.
CyanoMetDB_0328,Tolybyssidin B,,other cyclic peptide,,C72H114N16O16S,1490.831943,CCC([C@H]1C(N[C@@H]([C@@H](O)C)C(N[C@H](C(C)C)C(N[C@@H](C(C)C)C(N[C@@H](C(C)C)C(N[C@H](CC2=CC=CC=C2)C(N[C@@H](C(C)C)C(N/C(C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC3=CC=C(O)C=C3)C(N[C@@H](CCSC)C(N[C@@H](C(C)C)C(N[C@H]([C@H](O)C)C(N1)=O)=O)=O)=O)=O)=O)=C\C)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C72H114N16O16S/c1-17-40(13)56-69(102)88-57(41(14)89)70(103)85-55(39(11)12)67(100)84-54(38(9)10)66(99)83-52(36(5)6)65(98)80-50(33-43-23-20-19-21-24-43)63(96)82-51(35(3)4)64(97)76-46(18-2)59(92)77-47(25-22-31-75-72(73)74)60(93)79-49(34-44-26-28-45(91)29-27-44)62(95)78-48(30-32-105-16)61(94)81-53(37(7)8)68(101)87-58(42(15)90)71(104)86-56/h18-21,23-24,26-29,35-42,47-58,89-91H,17,22,25,30-34H2,1-16H3,(H,76,97)(H,77,92)(H,78,95)(H,79,93)(H,80,98)(H,81,94)(H,82,96)(H,83,99)(H,84,100)(H,85,103)(H,86,104)(H,87,101)(H,88,102)(H4,73,74,75)/b46-18-/t40?,41-,42+,47-,48-,49-,50+,51-,52-,53-,54-,55+,56-,57-,58+/m0/s1",QONBOMKYCJJCSL-WLKXNXGUSA-N,,yes,Tolypothrix,byssoidea,EAWAG 195
CyanoMetDB_0329,Schizotrin A,,other cyclic peptide,other cyclic depsipeptide,C72H107N13O21,1489.770448,CCCC(=O)N(C)[C@@H](C)C(=O)OC(CC1C(C(=O)N[C@H](C(=O)NCC(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)NC(C(=O)N3CCC[C@H]3C(=O)N1)CCC4=CC=C(C=C4)OC)CO)CO)C(C)C)CC5=CC=CC=C5)CCC(=O)N)O)CC(C(CC(C)C)O)O,"InChI=1S/C72H107N13O21/c1-10-17-58(91)83(8)41(7)72(104)106-45(35-56(89)55(88)32-39(3)4)34-49-61(93)70(102)76-47(28-29-57(73)90)62(94)74-36-59(92)84-30-15-20-53(84)67(99)79-50(33-43-18-13-12-14-19-43)64(96)82-60(40(5)6)69(101)81-52(38-87)65(97)75-46(11-2)63(95)80-51(37-86)66(98)77-48(27-24-42-22-25-44(105-9)26-23-42)71(103)85-31-16-21-54(85)68(100)78-49/h11-14,18-19,22-23,25-26,39-41,45,47-56,60-61,86-89,93H,10,15-17,20-21,24,27-38H2,1-9H3,(H2,73,90)(H,74,94)(H,75,97)(H,76,102)(H,77,98)(H,78,100)(H,79,99)(H,80,95)(H,81,101)(H,82,96)/b46-11+/t41-,45?,47-,48?,49?,50-,51-,52-,53-,54-,55?,56?,60-,61?/m0/s1",WQUIFMUZEMMABK-PLYNYAALSA-N,139585869,yes,Schizothrix,n.a.,TAU IL-89-2
CyanoMetDB_0331,Tolybyssidin A,,other linear peptide,,C71H116N16O17,1464.870436,CC[C@@H]([C@H]1C(N[C@@H]([C@H](CC)C)C(N[C@@H](CC2=CC=CC=C2)C(N/C(C(N[C@@H](C(C)C)C(N[C@@H]([C@H](OC(C)=O)C)C(N[C@@H]([C@H](O)C)C(N[C@@H](C(C)C)C(N[C@@H](C(C)C)C(N3CCC[C@H]3C(N[C@@H](CCC/N=C(N)\N)C(N[C@H](CC(C)C)C(N[C@@H]([C@H](O)C)C(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=C\C)=O)=O)=O)C,"InChI=1S/C71H116N16O17/c1-18-38(12)53-65(98)78-48(33-44-26-22-21-23-27-44)60(93)75-45(20-3)58(91)79-50(35(6)7)64(97)86-57(42(16)104-43(17)90)69(102)85-56(41(15)89)67(100)80-51(36(8)9)63(96)81-52(37(10)11)70(103)87-31-25-29-49(87)62(95)76-46(28-24-30-74-71(72)73)59(92)77-47(32-34(4)5)61(94)84-55(40(14)88)68(101)83-54(39(13)19-2)66(99)82-53/h20-23,26-27,34-42,46-57,88-89H,18-19,24-25,28-33H2,1-17H3,(H,75,93)(H,76,95)(H,77,92)(H,78,98)(H,79,91)(H,80,100)(H,81,96)(H,82,99)(H,83,101)(H,84,94)(H,85,102)(H,86,97)(H4,72,73,74)/b45-20-/t38-,39-,40+,41+,42+,46-,47+,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-/m0/s1",ZWXCBGUTACBDRV-BAGIKNQXSA-N,10820359,yes,Tolypothrix,byssoidea,n.a.
CyanoMetDB_0332,Scytonemin A,,other cyclic peptide,other cyclic depsipeptide,C71H106N12O21,1462.759548,C[C@H]1CCN2[C@@H]1C(=O)N[C@@H]([C@@H](C(=O)N[C@@H](C(=O)NCC(=O)N3C[C@@H]([C@@H]([C@H]3C(=O)N4C[C@@H]([C@@H]([C@H]4C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)NCC(=O)N[C@@H](C2=O)[C@H](C(C)C)O)CC5=CC=CC=C5)CCO)CC(C)C)C)O)C)O)CO)O)C[C@H](CCCC(CC6=CC=CC=C6)O)OC(=O)[C@H](C)NC(=O)C,"InChI=1S/C71H106N12O21/c1-36(2)27-49-65(97)75-47(24-26-84)64(96)77-50(29-44-19-14-11-15-20-44)62(94)72-31-54(90)80-56(60(92)37(3)4)69(101)81-25-23-38(5)57(81)66(98)76-48(30-46(104-71(103)41(8)74-42(9)86)22-16-21-45(87)28-43-17-12-10-13-18-43)61(93)68(100)79-51(35-85)63(95)73-32-55(91)82-33-52(88)40(7)59(82)70(102)83-34-53(89)39(6)58(83)67(99)78-49/h10-15,17-20,36-41,45-53,56-61,84-85,87-89,92-93H,16,21-35H2,1-9H3,(H,72,94)(H,73,95)(H,74,86)(H,75,97)(H,76,98)(H,77,96)(H,78,99)(H,79,100)(H,80,90)/t38-,39-,40-,41-,45?,46-,47-,48+,49+,50+,51+,52-,53-,56+,57-,58-,59-,60-,61-/m0/s1",BQKZAAFVKZMCPR-XLXWSZPNSA-N,78325125,yes,Scytonema,n.a.,U-3-3
CyanoMetDB_0333,"(2S,4S)-5,5-dichloroleucine",,other linear non-peptide,,C6H11Cl2NO2,199.016684,C[C@@H](C(Cl)Cl)C[C@@H](N)C(O)=O,"InChI=1S/C6H11Cl2NO2/c1-3(5(7)8)2-4(9)6(10)11/h3-5H,2,9H2,1H3,(H,10,11)/t3-,4-/m1/s1",HFQHHPQIYDQWFY-QWWZWVQMSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0334,Lyngbyacyclamide B,,other cyclic peptide,,C69H114N14O20,1458.833382,CCCCCCCC1CC(N[C@H](C(C)C)C(NC([C@@H](O)C(C)C)C(/N=C(CCO)/C(N[C@@H](CC(C)C)C(N[C@@H](CCC(N)=O)C(N(C)[C@@H](C(CC)C)C(NC(C(O)C(N)=O)C(N[C@@H]([C@@H](O)C)C(N2C[C@H](O)C[C@H]2C(N[C@@H](CC3=CC=CC=C3)C(N[C@@H]([C@H](O)C)C(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C69H112N14O20/c1-13-15-16-17-21-24-41-31-49(89)77-50(35(5)6)63(97)80-53(56(90)36(7)8)65(99)73-43(27-28-84)59(93)75-45(29-34(3)4)60(94)74-44(25-26-48(70)88)68(102)82(12)55(37(9)14-2)67(101)81-54(57(91)58(71)92)66(100)79-52(39(11)86)69(103)83-33-42(87)32-47(83)62(96)76-46(30-40-22-19-18-20-23-40)61(95)78-51(38(10)85)64(98)72-41/h18-20,22-23,34-39,41-42,44-47,50-57,84-87,90-91H,13-17,21,24-33H2,1-12H3,(H2,70,88)(H2,71,92)(H,72,98)(H,74,94)(H,75,93)(H,76,96)(H,77,89)(H,78,95)(H,79,100)(H,80,97)(H,81,101)/b73-43+/t37?,38-,39+,41?,42-,44+,45+,46+,47+,50-,51+,52+,53?,54?,55+,56+,57?/m1/s1",ZQEJMIHHZHRPMS-YGNCAYBUSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0335,Lyngbyacyclamide A,,other cyclic peptide,,C69H114N14O19,1442.838468,CCCCCCCC1CC(N[C@H](C(C)C)C(NC([C@@H](O)C(C)C)C(/N=C(CCO)/C(N[C@@H](CC(C)C)C(N[C@@H](CCC(N)=O)C(N(C)[C@@H](C(CC)C)C(NC(C(O)C(N)=O)C(N[C@@H]([C@@H](O)C)C(N2CCC[C@H]2C(N[C@@H](CC3=CC=CC=C3)C(N[C@@H]([C@H](O)C)C(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C69H112N14O19/c1-13-15-16-17-21-25-42-34-49(88)77-50(36(5)6)63(96)80-53(56(89)37(7)8)65(98)73-43(29-31-84)59(92)75-45(32-35(3)4)60(93)74-44(27-28-48(70)87)68(101)82(12)55(38(9)14-2)67(100)81-54(57(90)58(71)91)66(99)79-52(40(11)86)69(102)83-30-22-26-47(83)62(95)76-46(33-41-23-19-18-20-24-41)61(94)78-51(39(10)85)64(97)72-42/h18-20,23-24,35-40,42,44-47,50-57,84-86,89-90H,13-17,21-22,25-34H2,1-12H3,(H2,70,87)(H2,71,91)(H,72,97)(H,74,93)(H,75,92)(H,76,95)(H,77,88)(H,78,94)(H,79,99)(H,80,96)(H,81,100)/b73-43+/t38?,39-,40+,42?,44+,45+,46+,47+,50-,51+,52+,53?,54?,55+,56+,57?/m1/s1",RTVQUIAQZLZXQQ-YOYNLNGNSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0336,Croissamide,,other cyclic peptide,,C68H94N12O11,1254.716502,C[C@H]1C(=O)NC(C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N4CCC[C@H]4C(=O)N5CCC[C@H]5C(=O)N[C@H](C(=O)N6CCC[C@H]6C(=O)N1)CC(C)C)CC7=CC=CC=C7)CC(C)C)CC8=CN(C9=CC=CC=C98)C(C)(C)C=C)C,"InChI=1S/C68H94N12O11/c1-10-68(8,9)80-39-45(46-23-14-15-24-51(46)80)38-48-59(83)71-47(35-40(2)3)58(82)73-50(37-44-21-12-11-13-22-44)65(89)79-34-20-29-56(79)67(91)77-32-18-27-54(77)62(86)74-49(36-41(4)5)64(88)75-30-16-25-52(75)60(84)69-42(6)57(81)70-43(7)63(87)78-33-19-28-55(78)66(90)76-31-17-26-53(76)61(85)72-48/h10-15,21-24,39-43,47-50,52-56H,1,16-20,25-38H2,2-9H3,(H,69,84)(H,70,81)(H,71,83)(H,72,85)(H,73,82)(H,74,86)/t42-,43?,47-,48-,49-,50-,52-,53-,54-,55-,56-/m0/s1",LUYWEMJRKVGFQI-AAEPAESSSA-N,139591276,yes,Symploca,n.a.,n.a.
CyanoMetDB_0337,Kawaguchipeptin A,,other cyclic peptide,,C68H92N16O18,1420.67755,C[C@H]([C@H]1C(=O)N2CCC[C@H]2C(=O)N3[C@@H](C[C@@]4([C@H]3NC5=CC=CC=C54)CC=C(C)C)C(=O)N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N6[C@@H](C[C@@]7([C@H]6NC8=CC=CC=C87)CC=C(C)C)C(=O)N[C@H](C(=O)N1)CO)CC(=O)N)CC(=O)N)CC(=O)O)CC(=O)N)CC(C)C)O,"InChI=1S/C68H92N16O18/c1-32(2)18-20-67-28-47-61(99)78-45(31-85)59(97)81-54(35(7)86)64(102)82-22-12-17-46(82)63(101)84-48(29-68(21-19-33(3)4)37-14-9-11-16-39(37)80-66(68)84)60(98)76-40(23-34(5)6)56(94)74-41(24-49(69)87)55(93)72-30-52(90)73-43(27-53(91)92)58(96)75-42(25-50(70)88)57(95)77-44(26-51(71)89)62(100)83(47)65(67)79-38-15-10-8-13-36(38)67/h8-11,13-16,18-19,34-35,40-48,54,65-66,79-80,85-86H,12,17,20-31H2,1-7H3,(H2,69,87)(H2,70,88)(H2,71,89)(H,72,93)(H,73,90)(H,74,94)(H,75,96)(H,76,98)(H,77,95)(H,78,99)(H,81,97)(H,91,92)/t35-,40-,41+,42+,43+,44+,45+,46+,47+,48+,54+,65-,66+,67+,68+/m1/s1",SZGKSIQFXTWZJY-MHYXRNQBSA-N,44566681,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0338,Aeruginazole DA1497,,other cyclic peptide,Aeruginazole,C68H91N17O14S4,1497.581425,CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C2=NC(=CS2)C(=O)NCC(=O)N3CCC[C@H]3C(=O)N[C@H](C4=NC(=CS4)C(=O)N[C@H](C(=O)NCC(=O)N5CCC[C@H]5C(=O)N[C@H](C6=NC(=CS6)C(=O)N[C@@H](C(=O)N[C@H](C7=NC(=CS7)C(=O)N1)C)CO)C(C)C)C(C)C)CC(C)C)CC8=CC=CC=C8)C,"InChI=1S/C68H91N17O14S4/c1-11-36(8)54-64(99)72-37(9)55(90)69-25-49(87)74-41(24-39-17-13-12-14-18-39)67-78-43(29-101-67)56(91)70-26-50(88)84-21-15-19-47(84)61(96)75-40(23-33(2)3)66-79-46(31-102-66)59(94)81-52(34(4)5)63(98)71-27-51(89)85-22-16-20-48(85)62(97)82-53(35(6)7)68-80-44(32-103-68)58(93)76-42(28-86)57(92)73-38(10)65-77-45(30-100-65)60(95)83-54/h12-14,17-18,29-38,40-42,47-48,52-54,86H,11,15-16,19-28H2,1-10H3,(H,69,90)(H,70,91)(H,71,98)(H,72,99)(H,73,92)(H,74,87)(H,75,96)(H,76,93)(H,81,94)(H,82,97)(H,83,95)/t36-,37-,38-,40-,41-,42+,47-,48-,52-,53-,54-/m0/s1",KXADSWRPKUGJMS-JMJNBSKCSA-N,57328170,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_0341,Laxaphycin B3,,other cyclic peptide,Laxaphycins,C65H114N14O20,1410.833382,CCCCCCC[C@@H]1CC(=O)N[C@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@@H](C(=O)NC(C(=O)N(C(C(=O)N[C@@H](C(=O)N[C@H](C(=O)N2C[C@@H](C[C@H]2C(=O)NC(C(=O)N[C@H](C(=O)N1)C(C)O)CC(C)C)O)[C@@H](C)O)[C@H](C(=O)N)O)[C@@H](C)CC)C)CCC(=O)N)C(C(C)C)O)C)[C@H](C(C)C)O)C(C)C,"InChI=1S/C65H114N14O20/c1-16-18-19-20-21-22-37-26-43(84)72-44(30(5)6)58(92)76-47(51(85)31(7)8)60(94)68-34(12)55(89)75-48(52(86)32(9)10)61(95)70-39(23-24-42(66)83)64(98)78(15)50(33(11)17-2)63(97)77-49(53(87)54(67)88)62(96)74-46(36(14)81)65(99)79-28-38(82)27-41(79)57(91)71-40(25-29(3)4)56(90)73-45(35(13)80)59(93)69-37/h29-41,44-53,80-82,85-87H,16-28H2,1-15H3,(H2,66,83)(H2,67,88)(H,68,94)(H,69,93)(H,70,95)(H,71,91)(H,72,84)(H,73,90)(H,74,96)(H,75,89)(H,76,92)(H,77,97)/t33-,34?,35?,36+,37+,38+,39?,40?,41-,44-,45-,46-,47-,48+,49+,50?,51-,52?,53+/m0/s1",MRTGWORMQOZSMV-BYCMVUIZSA-N,22833265,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0342,Laxaphycin B,,other cyclic peptide,Laxaphycins,C65H114N14O19,1394.838468,CCCCCCC[C@@H]1CC(=O)N[C@H](C(=O)N[C@H](C(=O)NC(C(=O)N[C@@H](C(=O)NC(C(=O)N(C(C(=O)N[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)NC(C(=O)N[C@H](C(=O)N1)C(C)O)CC(C)C)[C@@H](C)O)[C@H](C(=O)N)O)[C@@H](C)CC)C)CCC(=O)N)C(C(C)C)O)C)[C@H](C(C)C)O)C(C)C,"InChI=1S/C65H114N14O19/c1-16-18-19-20-21-23-38-29-43(83)72-44(31(5)6)58(91)76-47(51(84)32(7)8)60(93)68-35(12)55(88)75-48(52(85)33(9)10)61(94)70-39(25-26-42(66)82)64(97)78(15)50(34(11)17-2)63(96)77-49(53(86)54(67)87)62(95)74-46(37(14)81)65(98)79-27-22-24-41(79)57(90)71-40(28-30(3)4)56(89)73-45(36(13)80)59(92)69-38/h30-41,44-53,80-81,84-86H,16-29H2,1-15H3,(H2,66,82)(H2,67,87)(H,68,93)(H,69,92)(H,70,94)(H,71,90)(H,72,83)(H,73,89)(H,74,95)(H,75,88)(H,76,91)(H,77,96)/t34-,35?,36?,37+,38+,39?,40?,41-,44-,45-,46-,47-,48+,49+,50?,51-,52?,53+/m0/s1",URYPPVMQQUERGK-IRBJMCNESA-N,22833263,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0343,Laxaphycin B2,Laxaphycin C ,other cyclic peptide,Laxaphycins,C65H114N14O18,1378.843553,CCCCCCC[C@@H]1CC(=O)N[C@H](C(=O)N[C@@H](C(=O)NC(C(=O)N[C@@H](C(=O)NC(C(=O)N(C(C(=O)N[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)NC(C(=O)N[C@H](C(=O)N1)C(C)O)CC(C)C)[C@@H](C)O)[C@H](C(=O)N)O)[C@@H](C)CC)C)CCC(=O)N)CC(C)C)C)[C@H](C(C)C)O)C(C)C,"InChI=1S/C65H114N14O18/c1-16-18-19-20-21-23-39-30-45(83)73-46(33(7)8)59(91)76-49(52(84)34(9)10)61(93)68-36(12)55(87)71-41(28-31(3)4)56(88)70-40(25-26-44(66)82)64(96)78(15)51(35(11)17-2)63(95)77-50(53(85)54(67)86)62(94)75-48(38(14)81)65(97)79-27-22-24-43(79)58(90)72-42(29-32(5)6)57(89)74-47(37(13)80)60(92)69-39/h31-43,46-53,80-81,84-85H,16-30H2,1-15H3,(H2,66,82)(H2,67,86)(H,68,93)(H,69,92)(H,70,88)(H,71,87)(H,72,90)(H,73,83)(H,74,89)(H,75,94)(H,76,91)(H,77,95)/t35-,36?,37?,38+,39+,40?,41+,42?,43-,46-,47-,48-,49+,50+,51?,52-,53+/m0/s1",ZGEFAENLWOFMKR-YZVLHJFSSA-N,22833264,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0344,Trichormamide C,,other cyclic peptide,,C65H114N14O18,1378.843553,CCCCCCC[C@@H]1CC(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)[C@@H](C)O)CC(C)C)[C@@H](C)O)CC(=O)N)[C@@H](C)CC)C)CCC(=O)N)[C@H](C(C)C)O)C)[C@H](C(C)C)O)C(C)C,"InChI=1S/C65H114N14O18/c1-16-18-19-20-21-23-39-29-46(84)73-47(32(5)6)59(91)77-50(53(85)33(7)8)61(93)68-36(12)55(87)76-51(54(86)34(9)10)62(94)70-40(25-26-44(66)82)64(96)78(15)52(35(11)17-2)63(95)72-42(30-45(67)83)57(89)75-49(38(14)81)65(97)79-27-22-24-43(79)58(90)71-41(28-31(3)4)56(88)74-48(37(13)80)60(92)69-39/h31-43,47-54,80-81,85-86H,16-30H2,1-15H3,(H2,66,82)(H2,67,83)(H,68,93)(H,69,92)(H,70,94)(H,71,90)(H,72,95)(H,73,84)(H,74,88)(H,75,89)(H,76,87)(H,77,91)/t35-,36-,37+,38+,39+,40-,41+,42+,43-,47-,48-,49-,50+,51+,52-,53-,54-/m0/s1",QIMJZYCZFCUBDB-WIOVDTPFSA-N,122183693,yes,Oscillatoria/Planktothrix,,UIC 10045
CyanoMetDB_0345,Coibamide A,,other cyclic peptide,other cyclic depsipeptide,C65H110N10O16,1286.810128,CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N([C@H](C(=O)N1C)COC)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](COC)N(C)C(=O)[C@H](C(C)C)OC(=O)[C@H](C(C)C)N(C)C)C)C)C)CC2=CC=C(C=C2)OC)CC(C)C)C)C,"InChI=1S/C65H110N10O16/c1-26-40(10)52-56(77)66-41(11)57(78)70(17)47(31-36(2)3)55(76)67-46(33-44-27-29-45(89-25)30-28-44)58(79)69(16)42(12)64(85)90-43(13)53(62(83)72(19)50(35-88-24)61(82)74(52)21)75(22)59(80)48(32-37(4)5)71(18)60(81)49(34-87-23)73(20)63(84)54(39(8)9)91-65(86)51(38(6)7)68(14)15/h27-30,36-43,46-54H,26,31-35H2,1-25H3,(H,66,77)(H,67,76)/t40-,41-,42-,43+,46-,47-,48-,49-,50-,51-,52-,53-,54-/m0/s1",LVHKHLZPRPTQJG-BNLDXBMISA-N,24881184,yes,Leptolyngbya,n.a.,n.a.
CyanoMetDB_0346,Phormidolide,,other linear non-peptide,,C59H97BrO12,1076.616341,CCCCCCCCCCCCCCCC(O[C@H](C[C@H](O)[C@@H](C)[C@H](O)C[C@H](O)C(C)(C)[C@H](O)C/C(C)=C/C(O)[C@@]1(C)O[C@@H](C/C(C)=C/C(C[C@H](O)C/C=C/C(C)=C/2)=C)C[C@H]1OC2=O)CC(/C(OC)=C\Br)=C)=O,"InChI=1S/C59H97BrO12/c1-12-13-14-15-16-17-18-19-20-21-22-23-24-28-56(67)70-47(35-44(6)51(39-60)69-11)36-49(62)45(7)50(63)38-53(65)58(8,9)52(64)32-43(5)33-54(66)59(10)55-37-48(72-59)31-42(4)29-41(3)30-46(61)27-25-26-40(2)34-57(68)71-55/h25-26,29,33-34,39,45-50,52-55,61-66H,3,6,12-24,27-28,30-32,35-38H2,1-2,4-5,7-11H3/b26-25+,40-34+,42-29+,43-33+,51-39+/t45-,46-,47+,48+,49+,50-,52-,53+,54+,55-,59-/m1/s1",ZQZINNIFSWTJMU-OPUVCDAMSA-N,11029547,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0347,Hoshinoamide B,,other linear peptide,"Depsipeptide, Lipopeptide",C64H99N9O12,1185.74132,OC1=CC=C(CCCC(NCCCCCCCCC(N(C(CC(C)C)C(NC(C(CC)C)([H])C(N(C)C(C(C)C)C(NC(CCC(N)=O)C(N2CCCC2C(N(C)C(C(N3C(C(OC)=O)CCC3)=O)CC4=CC=CC=C4)=O)=O)=O)=O)=O)C)=O)=O)C=C1,"InChI=1S/C64H99N9O12/c1-11-44(6)56(68-58(78)51(40-42(2)3)69(7)55(77)30-19-14-12-13-15-20-37-66-54(76)29-21-26-45-31-33-47(74)34-32-45)63(83)71(9)57(43(4)5)59(79)67-48(35-36-53(65)75)60(80)72-38-22-27-49(72)61(81)70(8)52(41-46-24-17-16-18-25-46)62(82)73-39-23-28-50(73)64(84)85-10/h16-18,24-25,31-34,42-44,48-52,56-57,74H,11-15,19-23,26-30,35-41H2,1-10H3,(H2,65,75)(H,66,76)(H,67,79)(H,68,78)/t44-,48-,49-,50-,51-,52-,56-,57+/m0/s1",NSVRPKQYFYOKJR-RGEGFSPNSA-N,145991284,yes,Caldora,penicillata,n.a.
CyanoMetDB_0348,Trichormamide D,,other cyclic peptide,,C64H96N12O14,1256.716896,CCCCCCC[C@@H]1CC(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N1)CC(C)C)CC3=CC=CC=C3)C(C)C)CC(C)C)CC4=CC=C(C=C4)O)CO)CCC(=O)N,"InChI=1S/C64H96N12O14/c1-9-11-12-13-17-21-42-34-53(80)68-45(27-28-52(65)79)57(83)69-44(10-2)64(90)76-29-18-22-51(76)62(88)74-50(36-77)61(87)72-48(33-41-23-25-43(78)26-24-41)58(84)71-47(31-38(5)6)60(86)75-55(39(7)8)63(89)73-49(32-40-19-15-14-16-20-40)59(85)70-46(30-37(3)4)56(82)66-35-54(81)67-42/h10,14-16,19-20,23-26,37-39,42,45-51,55,77-78H,9,11-13,17-18,21-22,27-36H2,1-8H3,(H2,65,79)(H,66,82)(H,67,81)(H,68,80)(H,69,83)(H,70,85)(H,71,84)(H,72,87)(H,73,89)(H,74,88)(H,75,86)/b44-10+/t42-,45+,46+,47-,48-,49-,50+,51+,55+/m1/s1",IGQWXWBFBZQMSX-GVHVATKXSA-N,122183694,yes,Oscillatoria/Planktothrix,,UIC 10045
CyanoMetDB_0350,Lobocyclamide C,,other cyclic peptide,Lipopeptide,C63H111N13O20,1369.806833,CN(C1=O)[C@H](C(N[C@@H](C(N[C@H](C(N2[C@@H](C[C@H](C2)O)C(N[C@@H](C(N[C@@H]([C@@H](C)O)C(N[C@H](CCCCC)CC(N[C@H](C(N[C@@H](C(N[C@H](C(N[C@@H](C(N[C@@H]1CCC(N)=O)=O)[C@H](C(C)C)O)=O)C)=O)[C@@H](O)C(C)C)=O)C(C)C)=O)=O)=O)CC(C)C)=O)=O)[C@H](O)C)=O)[C@H](CO)O)=O)C(CC)C,"InChI=1S/C63H111N13O20/c1-16-18-19-20-36-24-43(83)69-44(29(5)6)56(89)74-48(51(84)30(7)8)59(92)65-33(12)53(86)73-49(52(85)31(9)10)60(93)67-38(21-22-42(64)82)62(95)75(15)50(32(11)17-2)61(94)72-47(41(81)27-77)58(91)71-46(35(14)79)63(96)76-26-37(80)25-40(76)55(88)68-39(23-28(3)4)54(87)70-45(34(13)78)57(90)66-36/h28-41,44-52,77-81,84-85H,16-27H2,1-15H3,(H2,64,82)(H,65,92)(H,66,90)(H,67,93)(H,68,88)(H,69,83)(H,70,87)(H,71,91)(H,72,94)(H,73,86)(H,74,89)/t32?,33-,34+,35+,36+,37+,38+,39+,40-,41-,44-,45-,46-,47+,48+,49+,50-,51-,52-/m0/s1",IEELHQHOEPWJSV-XSAXUJGHSA-N,139587936,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0351,Laxaphycin D,,other cyclic peptide,Laxaphycins,C63H110N14O19,1366.807167,O=C(NC(C(C)O)C(NC(C(NC(C(C)C)C(NC(C(NC(C(NC(C(O)C(C)C)C(NC(CCC(N)=O)C(N(C1C(CC)C)C)=O)=O)=O)C)=O)C(O)C(C)C)=O)=O)CCCCCC)=O)C(CC(C)C)NC(C2N(C(C(C(C)O)NC(C(C(O)C(N)=O)NC1=O)=O)=O)CCC2)=O,"InChI=1S/C63H110N14O19/c1-16-18-19-20-22-36-53(86)70-41(29(5)6)56(89)74-44(48(81)30(7)8)58(91)66-33(12)52(85)73-45(49(82)31(9)10)59(92)68-37(24-25-40(64)80)62(95)76(15)47(32(11)17-2)61(94)75-46(50(83)51(65)84)60(93)72-43(35(14)79)63(96)77-26-21-23-39(77)55(88)69-38(27-28(3)4)54(87)71-42(34(13)78)57(90)67-36/h28-39,41-50,78-79,81-83H,16-27H2,1-15H3,(H2,64,80)(H2,65,84)(H,66,91)(H,67,90)(H,68,92)(H,69,88)(H,70,86)(H,71,87)(H,72,93)(H,73,85)(H,74,89)(H,75,94)",YAHAJTYFWXJYRD-UHFFFAOYSA-N,,yes,Anabaena,laxa,n.a.
CyanoMetDB_0352,Lyngbyazothrin A,,other cyclic peptide,Anabaenopeptin,C62H96N12O19,1312.691469,CC[C@H](C)[C@@H]1C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)NC(C(=O)N2CCC[C@H]2C(=O)NC(C(C(=O)N[C@H](C(=O)NCC(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N1)CCC(=O)N)O)CC(CC(C(CC(C)C)O)O)O)CCC5=CC=C(C=C5)OC)[C@@H](C)O)CO,"InChI=1S/C62H96N12O19/c1-8-33(5)50-58(88)69-42(31-75)55(85)65-38(9-2)54(84)71-51(34(6)76)59(89)67-40(21-18-35-16-19-37(93-7)20-17-35)61(91)73-25-10-13-43(73)56(86)68-41(28-36(77)29-47(79)46(78)27-32(3)4)52(82)60(90)66-39(22-23-48(63)80)53(83)64-30-49(81)72-24-12-15-45(72)62(92)74-26-11-14-44(74)57(87)70-50/h9,16-17,19-20,32-34,36,39-47,50-52,75-79,82H,8,10-15,18,21-31H2,1-7H3,(H2,63,80)(H,64,83)(H,65,85)(H,66,90)(H,67,89)(H,68,86)(H,69,88)(H,70,87)(H,71,84)/b38-9+/t33-,34+,36?,39-,40?,41?,42-,43-,44-,45-,46?,47?,50+,51-,52?/m0/s1",ACFCYNJDAMJVRV-NPTOQFMUSA-N,44254417,yes,Lyngbya,n.a.,SAG 36.91
CyanoMetDB_0353,Laxaphycin E,,other cyclic peptide,Laxaphycins,C62H101N11O14,1223.752947,O=C(C(NC(C1N(CC(C1)O)C(C(NC2=O)=CC)=O)=O)CCO)NC(C(NC(C(NC(C(NC(C(CC)C)C(NC(CC(C)C)C(NCC(NC(CC(NC2CCO)=O)CCCCCCC)=O)=O)=O)=O)C(CC)C)=O)CC(C)C)=O)CC3=CC=CC=C3,"InChI=1S/C62H101N11O14/c1-11-15-16-17-21-24-41-32-50(77)65-44(25-27-74)55(80)66-43(14-4)62(87)73-35-42(76)33-49(73)59(84)67-45(26-28-75)56(81)69-48(31-40-22-19-18-20-23-40)57(82)68-47(30-37(7)8)58(83)71-53(39(10)13-3)61(86)72-52(38(9)12-2)60(85)70-46(29-36(5)6)54(79)63-34-51(78)64-41/h14,18-20,22-23,36-39,41-42,44-49,52-53,74-76H,11-13,15-17,21,24-35H2,1-10H3,(H,63,79)(H,64,78)(H,65,77)(H,66,80)(H,67,84)(H,68,82)(H,69,81)(H,70,85)(H,71,83)(H,72,86)",WNBDJWWVEUXKFZ-UHFFFAOYSA-N,,yes,Anabaena,laxa,n.a.
CyanoMetDB_0354,Hoshinoamide A,,other linear peptide,"Depsipeptide, Lipopeptide",C61H95N9O12,1145.71002,OC1=CC=C(CCCC(NCCCCCC(N(C(C(NC(C(CC)C)([H])C(N(C)C(C(C)C)C(NC(C(NC(C(C)C)C(N(C(CC2=CC=CC=C2)C(N3C(C(OC)=O)CCC3)=O)C)=O)=O)CCC(N)=O)=O)=O)=O)CC(C)C)C)=O)=O)C=C1,"InChI=1S/C61H95N9O12/c1-13-41(8)53(66-56(76)47(36-38(2)3)67(9)51(74)27-18-15-19-34-63-50(73)26-20-24-42-28-30-44(71)31-29-42)60(80)69(11)54(40(6)7)57(77)64-45(32-33-49(62)72)55(75)65-52(39(4)5)59(79)68(10)48(37-43-22-16-14-17-23-43)58(78)70-35-21-25-46(70)61(81)82-12/h14,16-17,22-23,28-31,38-41,45-48,52-54,71H,13,15,18-21,24-27,32-37H2,1-12H3,(H2,62,72)(H,63,73)(H,64,77)(H,65,75)(H,66,76)/t41-,45-,46-,47-,48+,52+,53-,54+/m0/s1",MBRGVPJSDHLXNJ-UMAFDXPGSA-N,146683897,yes,Caldora,penicillata,n.a.
CyanoMetDB_0355,Lyngbyazothrin B,Portoamide D,other cyclic peptide,,C61H94N12O18,1282.680904,[H]C1=CC=C(CCC2NC([C@@H](NC(/C(NC([C@@H](NC([C@H](NC([C@@H]3CCCN3C([C@H]4N(C(CNC([C@@H](NC(C(O)C(CC(O[H])CC(O)C(O)CC(C)C)NC([C@@H]5CCCN5C2=O)=O)=O)CCC(N)=O)=O)=O)CCC4)=O)=O)[C@@H](C)CC)=O)CO)=O)=C\C)=O)[C@@H](C)O)=O)C=C1,"InChI=1S/C61H94N12O18/c1-7-33(5)49-57(87)68-41(31-74)54(84)64-37(8-2)53(83)70-50(34(6)75)58(88)66-39(21-20-35-15-10-9-11-16-35)60(90)72-25-12-17-42(72)55(85)67-40(28-36(76)29-46(78)45(77)27-32(3)4)51(81)59(89)65-38(22-23-47(62)79)52(82)63-30-48(80)71-24-14-19-44(71)61(91)73-26-13-18-43(73)56(86)69-49/h8-11,15-16,32-34,36,38-46,49-51,74-78,81H,7,12-14,17-31H2,1-6H3,(H2,62,79)(H,63,82)(H,64,84)(H,65,89)(H,66,88)(H,67,85)(H,68,87)(H,69,86)(H,70,83)/b37-8+/t33-,34+,36?,38-,39?,40?,41-,42-,43-,44-,45?,46?,49+,50-,51?/m0/s1",OCPKVHKLLYWOOG-AZFXQPBMSA-N,44254416,yes,Lyngbya ,n.a.,n.a.
CyanoMetDB_0356,Aeruginazole DA1304,,other cyclic peptide,Aeruginazole,C61H72N14O13S3,1304.456542,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C(=O)N[C@@H](C4=NC(=CS4)C(=O)NCC(=O)NCC(=O)N[C@@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC5=CC=CC=C5)CC6=CC=CC=C6)CO)CC(=O)N)CC7=CC=C(C=C7)O)CC(C)C,"InChI=1S/C61H72N14O13S3/c1-5-33(4)51-61-74-46(31-91-61)58(88)70-41(20-32(2)3)59-73-45(30-90-59)57(87)69-39(23-36-16-18-37(77)19-17-36)55(85)71-42(24-47(62)78)60-72-44(29-89-60)53(83)64-25-48(79)63-26-49(80)67-43(28-76)52(82)65-27-50(81)66-38(21-34-12-8-6-9-13-34)54(84)68-40(56(86)75-51)22-35-14-10-7-11-15-35/h6-19,29-33,38-43,51,76-77H,5,20-28H2,1-4H3,(H2,62,78)(H,63,79)(H,64,83)(H,65,82)(H,66,81)(H,67,80)(H,68,84)(H,69,87)(H,70,88)(H,71,85)(H,75,86)/t33-,38-,39-,40-,41-,42+,43+,51-/m0/s1",SGUAOSQPZLNEKR-YLKOPLLXSA-N,57328240,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_0357,Jahanane,,other linear peptide,Jahanyne,C60H98N8O9,1074.745677,CCCCCCC(C)CC(C)C(N(C)C(C)C(N1CCCC1C(N(C)C(C(C)C)C(N(C)C(C(C)C)C(N(C)C(C(C)C)C(N(C)C(CC2=CC=CC=C2)C(N3C(C(N4C(C(C)=O)CCC4)=O)CCC3)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C60H98N8O9/c1-17-18-19-21-27-41(8)36-42(9)53(70)61(12)43(10)54(71)67-34-25-31-47(67)55(72)63(14)51(39(4)5)59(76)65(16)52(40(6)7)60(77)64(15)50(38(2)3)58(75)62(13)49(37-45-28-22-20-23-29-45)57(74)68-35-26-32-48(68)56(73)66-33-24-30-46(66)44(11)69/h20,22-23,28-29,38-43,46-52H,17-19,21,24-27,30-37H2,1-16H3/t41-,42+,43-,46-,47-,48-,49-,50-,51-,52-/m0/s1",YXLLSDGWDOATCZ-CMRAMGONSA-N,139591454,yes,Okeania,n.a.,n.a.
CyanoMetDB_0358,Laxaphycin A,,other cyclic peptide,Laxaphycins,C60H97N11O14,1195.721647,CCCCCC1CC(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N2C[C@@H](CC2C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N1)CC(C)C)[C@@H](C)CC)[C@@H](C)CC)CC(C)C)CC3=CC=CC=C3)CCO)O)CCO,"InChI=1S/C60H97N11O14/c1-11-15-17-22-39-30-48(75)63-42(23-25-72)53(78)64-41(14-4)60(85)71-33-40(74)31-47(71)57(82)65-43(24-26-73)54(79)67-46(29-38-20-18-16-19-21-38)55(80)66-45(28-35(7)8)56(81)69-51(37(10)13-3)59(84)70-50(36(9)12-2)58(83)68-44(27-34(5)6)52(77)61-32-49(76)62-39/h14,16,18-21,34-37,39-40,42-47,50-51,72-74H,11-13,15,17,22-33H2,1-10H3,(H,61,77)(H,62,76)(H,63,75)(H,64,78)(H,65,82)(H,66,80)(H,67,79)(H,68,83)(H,69,81)(H,70,84)/b41-14+/t36-,37-,39?,40+,42-,43-,44-,45+,46+,47?,50+,51-/m0/s1",AQBJITSSPIIUAM-CCBYSCTGSA-N,22833262,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0359,Hormothamnin A,,other cyclic peptide,,C60H97N11O14,1195.721647,CCCCC[C@@H]1CC(=O)N[C@H](C(=O)N/C(=C\C)/C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N1)CC(C)C)[C@@H](C)CC)[C@@H](C)CC)CC(C)C)CC3=CC=CC=C3)CCO)O)CCO,"InChI=1S/C60H97N11O14/c1-11-15-17-22-39-30-48(75)63-42(23-25-72)53(78)64-41(14-4)60(85)71-33-40(74)31-47(71)57(82)65-43(24-26-73)54(79)67-46(29-38-20-18-16-19-21-38)55(80)66-45(28-35(7)8)56(81)69-51(37(10)13-3)59(84)70-50(36(9)12-2)58(83)68-44(27-34(5)6)52(77)61-32-49(76)62-39/h14,16,18-21,34-37,39-40,42-47,50-51,72-74H,11-13,15,17,22-33H2,1-10H3,(H,61,77)(H,62,76)(H,63,75)(H,64,78)(H,65,82)(H,66,80)(H,67,79)(H,68,83)(H,69,81)(H,70,84)/b41-14-/t36-,37-,39+,40+,42-,43-,44-,45+,46+,47-,50+,51-/m0/s1",AQBJITSSPIIUAM-RSBFCROKSA-N,139587944,yes,Hormothamnion,enteromorphoides,n.a.
CyanoMetDB_0360,Jahanene,,other linear peptide,Jahanyne,C60H96N8O9,1072.730027,C=CCCCCC(C)CC(C)C(N(C)C(C)C(N1CCCC1C(N(C)C(C(C)C)C(N(C)C(C(C)C)C(N(C)C(C(C)C)C(N(C)C(CC2=CC=CC=C2)C(N3C(C(N4C(C(C)=O)CCC4)=O)CCC3)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C60H96N8O9/c1-17-18-19-21-27-41(8)36-42(9)53(70)61(12)43(10)54(71)67-34-25-31-47(67)55(72)63(14)51(39(4)5)59(76)65(16)52(40(6)7)60(77)64(15)50(38(2)3)58(75)62(13)49(37-45-28-22-20-23-29-45)57(74)68-35-26-32-48(68)56(73)66-33-24-30-46(66)44(11)69/h17,20,22-23,28-29,38-43,46-52H,1,18-19,21,24-27,30-37H2,2-16H3/t41-,42+,43-,46-,47-,48-,49-,50-,51-,52-/m0/s1",TUXBGEXEMQTLAI-CMRAMGONSA-N,139591455,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0361,Malevamide E,,other cyclic peptide,other cyclic depsipeptide,C60H94N8O11,1102.704206,C[C@@H]1C(=O)OC(CCCC=CCCC(CC=CC=C(C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N1C)CC(=O)NC)C)C(C)C)C)C(C)C)C)CC3=CC=CC=C3)C)C(C)C)C)OC)C,"InChI=1S/C60H94N8O11/c1-38(2)50-57(74)65(13)47(36-44-30-22-20-23-31-44)56(73)66(14)51(39(3)4)58(75)67(15)52(40(5)6)59(76)68-35-27-34-46(68)54(71)64(12)48(37-49(69)61-10)55(72)63(11)43(9)60(77)79-42(8)29-21-18-17-19-24-32-45(78-16)33-26-25-28-41(7)53(70)62-50/h17,19-20,22-23,25-26,28,30-31,38-40,42-43,45-48,50-52H,18,21,24,27,29,32-37H2,1-16H3,(H,61,69)(H,62,70)/t42?,43-,45?,46+,47+,48+,50-,51+,52+/m1/s1",JCNPRLFFSUMABB-OFOGQRPBSA-N,139583748,yes,Symploca,laete-viridis,n.a.
CyanoMetDB_0362,Oscillatorin,,other cyclic peptide,,C60H85N15O14,1239.640042,CC(C[C@H]1C(N2C(C(N[C@@H](C(C)C)C(N3CCC[C@H]3C(N[C@@H](CC(N)=O)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCNC(N)=N)C(NCC(N[C@@H](CC4=CC=C(O)C=C4)C(NCC(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)CC5(C/C=C(C)\C)C2NC6=CC=CC=C65)=O)C,"InChI=1S/C60H85N15O14/c1-31(2)21-22-60-28-44-55(87)73-49(33(5)6)57(89)74-24-10-14-43(74)54(86)71-41(27-45(61)77)53(85)70-39(19-20-48(80)81)52(84)69-38(13-9-23-64-59(62)63)50(82)65-29-46(78)67-40(26-34-15-17-35(76)18-16-34)51(83)66-30-47(79)68-42(25-32(3)4)56(88)75(44)58(60)72-37-12-8-7-11-36(37)60/h7-8,11-12,15-18,21,32-33,38-44,49,58,72,76H,9-10,13-14,19-20,22-30H2,1-6H3,(H2,61,77)(H,65,82)(H,66,83)(H,67,78)(H,68,79)(H,69,84)(H,70,85)(H,71,86)(H,73,87)(H,80,81)(H4,62,63,64)/t38-,39-,40-,41-,42-,43-,44?,49-,58?,60?/m0/s1",VMYFCWSHTOSIJD-QYABUWCPSA-N,10034342,yes,Oscillatoria/Planktothrix,agardhii,CCAP 1459/22
CyanoMetDB_0363,Largamide G,,Cyanopeptolin,,C60H82BrN9O18,1295.49612,O[C@@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H]1C(N[C@H](C(N[C@@H]2C([N@@]([C@@H](CC2)O)[C@@H](C(N([C@H](C(N[C@H](C(O[C@H]1C)=O)C(C)C)=O)CC(C=C3)=CC(Cl)=C3O)C)=O)[C@@H](C)O)=O)=O)CCC4=CC=C(O)C=C4)=O)=O)C(C)C)=O)C)=O)CCCC(C=C5)=CC=C5O)=O)CO,"InChI=1S/C60H82ClN9O18/c1-29(2)47(66-51(78)31(5)62-52(79)40(63-55(82)45(76)28-71)11-9-10-34-12-18-37(73)19-13-34)56(83)68-49-33(7)88-60(87)48(30(3)4)67-54(81)43(27-36-17-24-44(75)39(61)26-36)69(8)59(86)50(32(6)72)70-46(77)25-23-42(58(70)85)65-53(80)41(64-57(49)84)22-16-35-14-20-38(74)21-15-35/h12-15,17-21,24,26,29-33,40-43,45-50,71-77H,9-11,16,22-23,25,27-28H2,1-8H3,(H,62,79)(H,63,82)(H,64,84)(H,65,80)(H,66,78)(H,67,81)(H,68,83)/t31-,32+,33-,40-,41-,42-,43-,45+,46+,47-,48-,49-,50+/m0/s1",VBWDLPXKVPKLJB-OCEIGMBJSA-N,,yes,Oscillatoria/Planktothrix,,FL31-01
CyanoMetDB_0365,Grassypeptolide F,,other cyclic peptide,other cyclic depsipeptide,C60H79N9O9S2,1133.544218,CC[C@@H]1C2=NC(CS2)C(=O)N([C@@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N3CCC[C@H]3C(=O)N([C@@H](C4=N[C@@H](CS4)C(=O)N1)CC5=CC=CC=C5)C)C(C)C)C)CC6=CC=CC=C6)C)C)C(C)C)CC7=CC=CC=C7)C,"InChI=1S/C60H79N9O9S2/c1-11-42-54-64-44(34-79-54)56(73)66(8)46(30-39-22-15-12-16-23-39)52(71)65-49(35(2)3)53(72)61-38(7)37(6)60(77)78-48(32-41-26-19-14-20-27-41)58(75)68(10)50(36(4)5)59(76)69-29-21-28-45(69)57(74)67(9)47(31-40-24-17-13-18-25-40)55-63-43(33-80-55)51(70)62-42/h12-20,22-27,35-38,42-50H,11,21,28-34H2,1-10H3,(H,61,72)(H,62,70)(H,65,71)/t37-,38-,42-,43+,44?,45+,46-,47-,48+,49+,50+/m1/s1",OMAHHNNQYKBGML-XCCIRJLLSA-N,139583795,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0366,Aeruginazole DA1274,,other cyclic peptide,Aeruginazole,C60H70N14O12S3,1274.445977,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C(=O)N[C@@H](C4=NC(=CS4)C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC5=CC=CC=C5)CC6=CC=CC=C6)CC(=O)N)CC7=CC=C(C=C7)O)CC(C)C,"InChI=1S/C60H70N14O12S3/c1-5-33(4)51-60-73-45(31-89-60)57(86)69-41(20-32(2)3)58-72-44(30-88-58)56(85)68-39(23-36-16-18-37(75)19-17-36)54(83)70-42(24-46(61)76)59-71-43(29-87-59)52(81)65-27-49(79)63-25-47(77)62-26-48(78)64-28-50(80)66-38(21-34-12-8-6-9-13-34)53(82)67-40(55(84)74-51)22-35-14-10-7-11-15-35/h6-19,29-33,38-42,51,75H,5,20-28H2,1-4H3,(H2,61,76)(H,62,77)(H,63,79)(H,64,78)(H,65,81)(H,66,80)(H,67,82)(H,68,85)(H,69,86)(H,70,83)(H,74,84)/t33-,38-,39-,40-,41-,42+,51-/m0/s1",CPDCBBBFMXRHPP-IKUZVGDBSA-N,57328241,yes,Microcystis,aeruginosa ,IL-374
CyanoMetDB_0367,Lobocyclamide A,,other cyclic peptide,Lipopeptide,C59H95N11O15,1197.700911,CCCCC[C@@H]1CC(N[C@@H](CO)C(N/C(C(N2C[C@H](O)C[C@H]2C(N[C@@H](CCO)C(N[C@H](CC3=CC=C(O)C=C3)C(N[C@H](CC(C)C)C(N[C@@H](C(CC)C)C(N[C@@H]([C@@H](CC)C)C(N[C@@H](CC(C)C)C(NCC(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=C/C)=O)=O,"InChI=1S/C59H95N11O15/c1-11-15-16-17-37-27-47(75)62-45(31-72)55(81)63-40(14-4)59(85)70-30-39(74)28-46(70)56(82)64-41(22-23-71)52(78)66-44(26-36-18-20-38(73)21-19-36)53(79)65-43(25-33(7)8)54(80)68-50(35(10)13-3)58(84)69-49(34(9)12-2)57(83)67-42(24-32(5)6)51(77)60-29-48(76)61-37/h14,18-21,32-35,37,39,41-46,49-50,71-74H,11-13,15-17,22-31H2,1-10H3,(H,60,77)(H,61,76)(H,62,75)(H,63,81)(H,64,82)(H,65,79)(H,66,78)(H,67,83)(H,68,80)(H,69,84)/b40-14+/t34-,35?,37-,39-,41+,42+,43-,44-,45+,46+,49+,50+/m1/s1",UCGPFEODLDUNCV-ILYSEUNQSA-N,,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0368,Largamide F,,Cyanopeptolin,,C59H80BrN9O18,1281.48047,O[C@@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H]1C(N[C@H](C(N[C@@H]2C([N@@]([C@@H](CC2)O)[C@@H](C(N([C@H](C(N[C@H](C(O[C@H]1C)=O)C(C)C)=O)CC(C=C3)=CC(Br)=C3O)C)=O)[C@@H](C)O)=O)=O)CC4=CC=C(O)C=C4)=O)=O)C(C)C)=O)C)=O)CCCC(C=C5)=CC=C5O)=O)CO,"InChI=1S/C59H80BrN9O18/c1-28(2)46(65-50(77)30(5)61-51(78)39(62-54(81)44(75)27-70)11-9-10-33-12-17-36(72)18-13-33)55(82)67-48-32(7)87-59(86)47(29(3)4)66-53(80)42(26-35-16-22-43(74)38(60)24-35)68(8)58(85)49(31(6)71)69-45(76)23-21-40(57(69)84)63-52(79)41(64-56(48)83)25-34-14-19-37(73)20-15-34/h12-20,22,24,28-32,39-42,44-49,70-76H,9-11,21,23,25-27H2,1-8H3,(H,61,78)(H,62,81)(H,63,79)(H,64,83)(H,65,77)(H,66,80)(H,67,82)/t30-,31+,32-,39-,40-,41-,42-,44+,45+,46-,47-,48-,49+/m0/s1",MZYZCUCXNWCJKE-LSBISEEZSA-N,,yes,Oscillatoria/Planktothrix,,FL31-01
CyanoMetDB_0369,Grassypeptolide G,,other cyclic peptide,other cyclic depsipeptide,C59H77N9O9S2,1119.528567,C[C@@H]1[C@H](NC(=O)[C@@H](NC(=O)[C@H](N(C(=O)C2CSC(=N2)[C@H](NC(=O)[C@@H]3CSC(=N3)[C@H](N(C(=O)[C@@H]4CCCN4C(=O)[C@@H](N(C(=O)[C@@H](OC1=O)CC5=CC=CC=C5)C)C(C)C)C)CC6=CC=CC=C6)C)C)CC7=CC=CC=C7)C(C)C)C,"InChI=1S/C59H77N9O9S2/c1-34(2)48-52(71)60-37(6)36(5)59(76)77-47(31-41-25-18-13-19-26-41)57(74)67(10)49(35(3)4)58(75)68-28-20-27-44(68)56(73)66(9)46(30-40-23-16-12-17-24-40)54-62-42(32-79-54)50(69)61-38(7)53-63-43(33-78-53)55(72)65(8)45(51(70)64-48)29-39-21-14-11-15-22-39/h11-19,21-26,34-38,42-49H,20,27-33H2,1-10H3,(H,60,71)(H,61,69)(H,64,70)/t36-,37-,38-,42+,43?,44+,45-,46-,47+,48+,49+/m1/s1",ULECEIQKIPOQCI-GENNVTPMSA-N,139585357,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0370,Wewakazole,,other cyclic peptide,Wewakazole,C59H72N12O12,1140.539266,O=C(N1CCC[C@H]1C(N[C@H]2[C@H](CC)C)=O)[C@@H](NC(C3=COC([C@H](CC4=CC=CC=C4)NC(C5=C(C)OC([C@H](C(C)C)NC(CNC([C@@H]6CCCN6C([C@@H]7CCCN7C([C@H](C)NC(C8=COC2=N8)=O)=O)=O)=O)=O)=N5)=O)=N3)=O)CC9=CC=CC=C9 ,"InChI=1S/C59H72N12O12/c1-7-33(4)47-55-65-40(31-82-55)49(73)61-34(5)57(78)71-26-16-23-44(71)59(80)70-25-14-21-42(70)51(75)60-29-45(72)66-46(32(2)3)56-68-48(35(6)83-56)53(77)62-38(27-36-17-10-8-11-18-36)54-64-41(30-81-54)50(74)63-39(28-37-19-12-9-13-20-37)58(79)69-24-15-22-43(69)52(76)67-47/h8-13,17-20,30-34,38-39,42-44,46-47H,7,14-16,21-29H2,1-6H3,(H,60,75)(H,61,73)(H,62,77)(H,63,74)(H,66,72)(H,67,76)/t33-,34-,38-,39-,42-,43-,44-,46-,47-/m0/s1",LRFQMOZAQWOOPZ-IBFZZIGPSA-N,21578002,yes,Lyngbya ,majuscula,n.a.
CyanoMetDB_0371,Puwainaphycin B,,other cyclic peptide,Puwainaphycine,C59H100N12O16,1232.738025,CN([C@@H](CC(N)=O)C(N1[C@H](C(N[C@@H]([C@@H](O)C(N[C@H](C(N/C(C(N[C@H](C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC2=O)=O)=O)C(C)C)=O)[C@@H](O)C)=O)=C/C)=O)C(C)C)=O)[C@H](CCCCCCCCCC(CCCC)=O)C)=O)CCC1)=O)C([C@H]([C@@H](OC)C)N2)=O,"InChI=1S/C59H100N12O16/c1-12-14-24-37(73)25-21-19-17-15-16-18-20-23-34(7)47-50(77)57(84)67-46(33(5)6)54(81)63-38(13-2)52(79)69-48(35(8)72)56(83)66-45(32(3)4)55(82)64-39(27-28-42(60)74)51(78)62-31-44(76)65-49(36(9)87-11)59(86)70(10)41(30-43(61)75)58(85)71-29-22-26-40(71)53(80)68-47/h13,32-36,39-41,45-50,72,77H,12,14-31H2,1-11H3,(H2,60,74)(H2,61,75)(H,62,78)(H,63,81)(H,64,82)(H,65,76)(H,66,83)(H,67,84)(H,68,80)(H,69,79)/b38-13+/t34-,35-,36-,39-,40-,41-,45-,46-,47+,48-,49-,50+/m0/s1",HPIOIUSFXDCSLD-KEVLTHRLSA-N,72193952,yes,Anabaena,sp.,BQ-16-1
CyanoMetDB_0372,Puwainaphycin A,,other cyclic peptide,Puwainaphycine,C58H98N12O17,1234.71729,CN([C@@H](CC(N)=O)C(N1[C@H](C(N[C@@H]([C@@H](O)C(N[C@H](C(N/C(C(N[C@H](C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC2=O)=O)=O)[C@@H](O)C)=O)[C@@H](O)C)=O)=C/C)=O)C(C)C)=O)[C@H](CCCCCCCCCC(CCCC)=O)C)=O)CCC1)=O)C([C@H]([C@@H](OC)C)N2)=O,"InChI=1S/C58H98N12O17/c1-11-13-23-36(73)24-20-18-16-14-15-17-19-22-32(5)45-49(77)56(84)65-44(31(3)4)53(81)62-37(12-2)51(79)67-47(34(7)72)55(83)68-46(33(6)71)54(82)63-38(26-27-41(59)74)50(78)61-30-43(76)64-48(35(8)87-10)58(86)69(9)40(29-42(60)75)57(85)70-28-21-25-39(70)52(80)66-45/h12,31-35,38-40,44-49,71-72,77H,11,13-30H2,1-10H3,(H2,59,74)(H2,60,75)(H,61,78)(H,62,81)(H,63,82)(H,64,76)(H,65,84)(H,66,80)(H,67,79)(H,68,83)/b37-12+/t32-,33-,34-,35-,38-,39-,40-,44-,45+,46-,47-,48-,49+/m0/s1",VBYYGSMHUKZIND-NPNGGBIDSA-N,72193951,yes,Anabaena,sp.,BQ-16-1
CyanoMetDB_0373,Trichormamide A,,other cyclic peptide,,C58H93N11O15,1183.685261,CCCCCCC[C@@H]1CC(N[C@H](CO)C(N[C@H](CO)C(N2CCCC2C(N[C@H](CO)C(N[C@H](CC3=CC=C(O)C=C3)C(N[C@H](CC(C)C)C(N[C@@H]([C@@H](CC)C)C(NC(C(CC)C)C(N4CCC[C@H]4C(NCC(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C58H93N11O15/c1-8-11-12-13-14-17-37-28-46(74)61-41(30-70)52(78)65-43(32-72)57(83)68-24-16-19-45(68)55(81)64-42(31-71)53(79)63-40(27-36-20-22-38(73)23-21-36)50(76)62-39(26-33(4)5)51(77)66-48(34(6)9-2)56(82)67-49(35(7)10-3)58(84)69-25-15-18-44(69)54(80)59-29-47(75)60-37/h20-23,33-35,37,39-45,48-49,70-73H,8-19,24-32H2,1-7H3,(H,59,80)(H,60,75)(H,61,74)(H,62,76)(H,63,79)(H,64,81)(H,65,78)(H,66,77)(H,67,82)/t34-,35?,37-,39-,40-,41-,42-,43-,44+,45?,48+,49?/m1/s1",YNLIJTVZSFUHKP-KTOYLDSTSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0374,Kawaguchipeptin B,,other cyclic peptide,,C58H76N16O18,1284.55235,C[C@@H](O)[C@H]1C(N2CCC[C@H]2C(N[C@@H](CC3=CNC4=CC=CC=C43)C(N[C@@H](CC(C)C)C(N[C@@H](CC(N)=O)C(NCC(N[C@@H](CC(O)=O)C(N[C@@H](CC(N)=O)C(N[C@@H](CC(N)=O)C(N[C@@H](CC5=CNC6=CC=CC=C65)C(N[C@@H](CO)C(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C58H76N16O18/c1-26(2)15-34-50(84)68-37(18-43(59)77)49(83)64-24-46(80)65-40(21-47(81)82)55(89)70-39(20-45(61)79)54(88)69-38(19-44(60)78)53(87)67-35(16-28-22-62-32-11-6-4-9-30(28)32)52(86)72-41(25-75)56(90)73-48(27(3)76)58(92)74-14-8-13-42(74)57(91)71-36(51(85)66-34)17-29-23-63-33-12-7-5-10-31(29)33/h4-7,9-12,22-23,26-27,34-42,48,62-63,75-76H,8,13-21,24-25H2,1-3H3,(H2,59,77)(H2,60,78)(H2,61,79)(H,64,83)(H,65,80)(H,66,85)(H,67,87)(H,68,84)(H,69,88)(H,70,89)(H,71,91)(H,72,86)(H,73,90)(H,81,82)/t27-,34+,35+,36+,37+,38+,39+,40+,41+,42+,48+/m1/s1",AFDPMSAJJZIIQX-DMGAWOCMSA-N,16143430,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0375,Wewakazole B,,other cyclic peptide,,C58H70N12O12,1126.523616,CC[C@H](C)[C@H]1C2=NC(=CO2)C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)NCC(=O)N[C@H](C5=NC(=C(O5)C)C(=O)N[C@H](C6=NC(=C(O6)C)C(=O)N[C@H](C(=O)N7CCC[C@H]7C(=O)N1)CC8=CC=CC=C8)C)CC9=CC=CC=C9)C,"InChI=1S/C58H70N12O12/c1-7-31(2)45-55-64-40(30-80-55)48(72)61-33(4)56(77)70-26-16-23-43(70)58(79)69-25-14-21-41(69)49(73)59-29-44(71)62-38(27-36-17-10-8-11-18-36)54-67-46(35(6)82-54)51(75)60-32(3)53-66-47(34(5)81-53)52(76)63-39(28-37-19-12-9-13-20-37)57(78)68-24-15-22-42(68)50(74)65-45/h8-13,17-20,30-33,38-39,41-43,45H,7,14-16,21-29H2,1-6H3,(H,59,73)(H,60,75)(H,61,72)(H,62,71)(H,63,76)(H,65,74)/t31-,32-,33-,38-,39-,41-,42-,43-,45-/m0/s1",QDAUOBXWEKQKBF-DOWNRXLQSA-N,139589594,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0377,Puwainaphycin D,,other cyclic peptide,Puwainaphycine,C57H97ClN12O15,1224.688488,CN([C@@H](CC(N)=O)C(N1[C@H](C(N[C@@H]([C@@H](O)C(N[C@H](C(N/C(C(N[C@H](C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC2=O)=O)=O)C(C)C)=O)[C@@H](O)C)=O)=C/C)=O)C(C)C)=O)[C@H](CCCCCCCCCC(Cl)CC)C)=O)CCC1)=O)C([C@H]([C@@H](OC)C)N2)=O,"InChI=1S/C57H97ClN12O15/c1-12-35(58)23-20-18-16-14-15-17-19-22-32(7)45-48(75)55(82)66-44(31(5)6)52(79)62-36(13-2)50(77)68-46(33(8)71)54(81)65-43(30(3)4)53(80)63-37(25-26-40(59)72)49(76)61-29-42(74)64-47(34(9)85-11)57(84)69(10)39(28-41(60)73)56(83)70-27-21-24-38(70)51(78)67-45/h13,30-35,37-39,43-48,71,75H,12,14-29H2,1-11H3,(H2,59,72)(H2,60,73)(H,61,76)(H,62,79)(H,63,80)(H,64,74)(H,65,81)(H,66,82)(H,67,78)(H,68,77)/b36-13+/t32-,33-,34-,35?,37-,38-,39-,43-,44-,45+,46-,47-,48+/m0/s1",QEQPUTKQRURHAG-RMKUKBDQSA-N,72193954,yes,Anabaena,sp.,BQ-16-1
CyanoMetDB_0378,Largamide H,,other cyclic peptide,,C57H90N12O16,1198.659775,CCCCCCC[C@@H](C[C@@H]1[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N/C(=C\C)/C(=O)N[C@H](C(=O)N(CC(=O)N[C@H](C(=O)N1)C)C)CCC(=O)N)CC(=O)N)C)[C@@H](C)O)CCCC2=CC=C(C=C2)OC)C(C)C)O)O,"InChI=1S/C57H90N12O16/c1-11-14-15-16-17-20-35(71)28-41-48(75)55(82)62-38(13-3)51(78)66-46(31(4)5)54(81)63-39(21-18-19-34-22-24-36(85-10)25-23-34)52(79)67-47(33(7)70)57(84)69(9)42(29-44(59)73)53(80)61-37(12-2)50(77)64-40(26-27-43(58)72)56(83)68(8)30-45(74)60-32(6)49(76)65-41/h12-13,22-25,31-33,35,39-42,46-48,70-71,75H,11,14-21,26-30H2,1-10H3,(H2,58,72)(H2,59,73)(H,60,74)(H,61,80)(H,62,82)(H,63,81)(H,64,77)(H,65,76)(H,66,78)(H,67,79)/b37-12-,38-13+/t32-,33+,35-,39-,40-,41+,42-,46-,47-,48+/m0/s1",YRCPTMBCIKDNMH-XLNWVFMZSA-N,16083538,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_0379,Loggerpeptin B,,Cyanopeptolin,Depsipeptide,C57H83N9O15,1133.600863,OC1=CC=C(C=C1)C[C@@H](C(N[C@H](C(O[C@@H](C)[C@@H](C(N[C@H](C(N[C@@H]2C(N3[C@@H](CC2)O)=O)=O)CC(C)C)=O)NC([C@H](NC([C@@H](NC(CCC)=O)C)=O)[C@H](OC([C@H](C)NC(CCC)=O)=O)C)=O)=O)C(C)C)=O)N(C)C([C@@H]3CC4=CC=CC=C4)=O,"InChI=1S/C57H83N9O15/c1-12-17-43(68)58-32(7)49(71)63-48(34(9)80-56(78)33(8)59-44(69)18-13-2)53(75)64-47-35(10)81-57(79)46(31(5)6)62-51(73)41(28-37-21-23-38(67)24-22-37)65(11)55(77)42(29-36-19-15-14-16-20-36)66-45(70)26-25-39(54(66)76)60-50(72)40(27-30(3)4)61-52(47)74/h14-16,19-24,30-35,39-42,45-48,67,70H,12-13,17-18,25-29H2,1-11H3,(H,58,68)(H,59,69)(H,60,72)(H,61,74)(H,62,73)(H,63,71)(H,64,75)/t32-,33-,34+,35-,39-,40-,41-,42-,45+,46-,47-,48+/m0/s1",WQBNRZSYFLXKOU-SAVASHKUSA-N,146683894,yes,Leptolyngbya,sp.,DRTO?73
CyanoMetDB_0380,Grassypeptolide E,,other cyclic peptide,other cyclic depsipeptide,C57H81N9O10S2,1115.554782,CC[C@@H]1C2=N[C@@H](CS2)C(=O)N([C@H](C(=O)N[C@H](C(=O)N[C@@H]([C@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N3CCC[C@H]3C(=O)N([C@H](C4=N[C@](CS4)(C(=O)N1)C)CC5=CC=CC=C5)C)C(C)C)C)CC6=CC=CC=C6)C)C)[C@@H](C)O)CC(C)C)C,"InChI=1S/C57H81N9O10S2/c1-13-39-49-59-40(30-77-49)51(70)63(10)42(27-32(2)3)47(68)61-45(36(8)67)48(69)58-35(7)34(6)55(74)76-44(29-38-23-18-15-19-24-38)53(72)65(12)46(33(4)5)54(73)66-26-20-25-41(66)52(71)64(11)43(28-37-21-16-14-17-22-37)50-62-57(9,31-78-50)56(75)60-39/h14-19,21-24,32-36,39-46,67H,13,20,25-31H2,1-12H3,(H,58,69)(H,60,75)(H,61,68)/t34-,35-,36-,39-,40+,41+,42+,43+,44+,45+,46+,57-/m1/s1",FKVLMCJKLNRPEK-SIWPDUPVSA-N,53492934,yes,Leptolyngbya,n.a.,n.a.
CyanoMetDB_0381,Grassypeptolide D,,other cyclic peptide,other cyclic depsipeptide,C57H81N9O10S2,1115.554782,CC[C@@H]1C2=N[C@@H](CS2)C(=O)N([C@@H](C(=O)N[C@@H](C(=O)N[C@@H]([C@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N3CCC[C@H]3C(=O)N([C@H](C4=N[C@](CS4)(C(=O)N1)C)CC5=CC=CC=C5)C)C(C)C)C)CC6=CC=CC=C6)C)C)[C@@H](C)O)CC(C)C)C,"InChI=1S/C57H81N9O10S2/c1-13-39-49-59-40(30-77-49)51(70)63(10)42(27-32(2)3)47(68)61-45(36(8)67)48(69)58-35(7)34(6)55(74)76-44(29-38-23-18-15-19-24-38)53(72)65(12)46(33(4)5)54(73)66-26-20-25-41(66)52(71)64(11)43(28-37-21-16-14-17-22-37)50-62-57(9,31-78-50)56(75)60-39/h14-19,21-24,32-36,39-46,67H,13,20,25-31H2,1-12H3,(H,58,69)(H,60,75)(H,61,68)/t34-,35-,36-,39-,40+,41+,42-,43+,44+,45-,46+,57-/m1/s1",FKVLMCJKLNRPEK-VLPKDPSOSA-N,53492810,yes,Leptolyngbya,n.a.,n.a.
CyanoMetDB_0382,Micropeptin 88D,,Cyanopeptolin,Micropeptin,C57H80N8O15,1116.574314,CCCC(N[C@@H](CC1=CC=C(C=C1)O)C(N[C@@H](CCC(N[C@H]2[C@@H](OC([C@@H](NC([C@@H](N(C([C@@H](N3[C@@H](CC[C@@H](C3=O)NC([C@@H](NC2=O)CC4CCC(C=C4)O)=O)O)C(C)C)=O)C)CC5=CC=CC=C5)=O)[C@@H](C)CC)=O)C)=O)C(O)=O)=O)=O,"InChI=1S/C57H80N8O15/c1-8-13-44(68)58-41(28-35-16-20-37(66)21-17-35)50(71)60-40(56(77)78)24-26-45(69)62-48-33(6)80-57(79)47(32(5)9-2)63-52(73)43(30-34-14-11-10-12-15-34)64(7)55(76)49(31(3)4)65-46(70)27-25-39(54(65)75)59-51(72)42(61-53(48)74)29-36-18-22-38(67)23-19-36/h10-12,14-18,20-22,31-33,36,38-43,46-49,66-67,70H,8-9,13,19,23-30H2,1-7H3,(H,58,68)(H,59,72)(H,60,71)(H,61,74)(H,62,69)(H,63,73)(H,77,78)/t32-,33-,36?,38?,39-,40-,41-,42-,43-,46+,47-,48-,49-/m0/s1",MPVPJTGCOMUXEY-HRJRIKTRSA-N,,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0383,Oscillapeptin B,,Cyanopeptolin,Oscillapeptin,C57H79N7O18S,1181.52023,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](NC([C@@H](OC)COS(=O)(O)=O)=O)CCC2=CC=C(O)C=C2)=O)C(N[C@@H](CCC3=CC(C)=C(O)C=C3)C(N[C@H]4CC[C@@H](O)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC5=CC=C(OC)C=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C57H79N7O18S/c1-10-31(3)47-57(75)82-34(6)48(62-51(69)41(23-16-35-12-19-38(65)20-13-35)58-53(71)45(80-9)30-81-83(76,77)78)54(72)59-40(24-17-36-18-26-44(66)33(5)28-36)50(68)60-42-25-27-46(67)64(55(42)73)49(32(4)11-2)56(74)63(7)43(52(70)61-47)29-37-14-21-39(79-8)22-15-37/h12-15,18-22,26,28,31-32,34,40-43,45-49,65-67H,10-11,16-17,23-25,27,29-30H2,1-9H3,(H,58,71)(H,59,72)(H,60,68)(H,61,70)(H,62,69)(H,76,77,78)/t31-,32+,34-,40-,41+,42-,43-,45-,46+,47-,48-,49+/m0/s1",NLQWQLCUSBPPRU-QSYYJPTJSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0384,Micropeptin 88F,,Cyanopeptolin,"Micropeptin, Oscillapeptin",C58H78N8O15,1112.543014,O=C(CCC)N[C@H](C(N[C@H](C(OC)=O)CCC(N[C@@H]1C(N[C@H](C(N[C@@H](CC[C@H]2O)C(N2[C@@H](C(N([C@H](C(N[C@H](C(O[C@H]1C)=O)[C@H](CC)C)=O)CC3=CC=CC=C3)C)=O)C(C)C)=O)=O)CC4=CC=C(O)C=C4)=O)=O)=O)CC5=CC=C(O)C=C5,"InChI=1S/C58H78N8O15/c1-9-14-45(69)59-42(29-36-17-21-38(67)22-18-36)51(72)61-41(57(78)80-8)25-27-46(70)63-49-34(6)81-58(79)48(33(5)10-2)64-53(74)44(31-35-15-12-11-13-16-35)65(7)56(77)50(32(3)4)66-47(71)28-26-40(55(66)76)60-52(73)43(62-54(49)75)30-37-19-23-39(68)24-20-37/h11-13,15-24,32-34,40-44,47-50,67-68,71H,9-10,14,25-31H2,1-8H3,(H,59,69)(H,60,73)(H,61,72)(H,62,75)(H,63,70)(H,64,74)/t33-,34-,40-,41-,42-,43-,44-,47+,48-,49-,50+/m0/s1",LLRIWFOSYFXMLM-KBALIGIFSA-N,139584514,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0385,Micropeptin 88C,,Cyanopeptolin,Micropeptin,C57H76N8O15,1112.543014,C[C@H](OC([C@H]([C@H](CC)C)NC([C@H](CC1=CC=CC=C1)N(C)C([C@H](C(C)C)N2C([C@H](CC[C@H]2O)NC3=O)=O)=O)=O)=O)[C@H](NC(CC[C@@H](C(O)=O)NC([C@H](CC4=CC=C(C=C4)O)NC(CCC)=O)=O)=O)C(N[C@H]3CC5=CC=C(C=C5)O)=O,"InChI=1S/C57H76N8O15/c1-8-13-44(68)58-41(28-35-16-20-37(66)21-17-35)50(71)60-40(56(77)78)24-26-45(69)62-48-33(6)80-57(79)47(32(5)9-2)63-52(73)43(30-34-14-11-10-12-15-34)64(7)55(76)49(31(3)4)65-46(70)27-25-39(54(65)75)59-51(72)42(61-53(48)74)29-36-18-22-38(67)23-19-36/h10-12,14-23,31-33,39-43,46-49,66-67,70H,8-9,13,24-30H2,1-7H3,(H,58,68)(H,59,72)(H,60,71)(H,61,74)(H,62,69)(H,63,73)(H,77,78)/t32-,33-,39-,40-,41-,42-,43-,46+,47-,48-,49-/m0/s1",QVFJAFKXTMGGJM-HXWNZHHOSA-N,,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0386,Aghardipeptin B,,other cyclic peptide,,C57H69N11O8,1035.533058,O=C(C(C)NC(C(CC1=CNC2=CC=CC=C12)N3)=O)N4C(C(NC(C(NC(C(C)C)C(NC(CC5=CNC6=CC=CC=C56)C(NC(CC(C)C)C(N7C(C3=O)CCC7)=O)=O)=O)=O)CC8=CNC9=CC=CC=C98)=O)CCC4,"InChI=1S/C57H69N11O8/c1-31(2)24-46-57(76)68-23-13-21-48(68)54(73)62-43(25-34-28-58-40-17-9-6-14-37(34)40)50(69)61-33(5)56(75)67-22-12-20-47(67)53(72)63-45(27-36-30-60-42-19-11-8-16-39(36)42)52(71)66-49(32(3)4)55(74)64-44(51(70)65-46)26-35-29-59-41-18-10-7-15-38(35)41/h6-11,14-19,28-33,43-49,58-60H,12-13,20-27H2,1-5H3,(H,61,69)(H,62,73)(H,63,72)(H,64,74)(H,65,70)(H,66,71)",GFHJBYMOXXILNJ-UHFFFAOYSA-N,73798207,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0387,Calophycin,,other cyclic peptide,,C56H96N16O16,1248.719021,O=C([C@H]1N(CCC1)C([C@H](CC(N)=O)N(C([C@H](CCCNC(N)=N)NC(CNC([C@@H](NC([C@H](CC(N)=O)NC2=O)=O)CCC(N)=O)=O)=O)=O)C)=O)N[C@H]([C@@H](C)CCCCCCCCCCCC)[C@H](C(N[C@H](C(N[C@@H](C)C(N[C@@H]2CC(O)=O)=O)=O)C(C)C)=O)O,"InChI=1S/C56H96N16O16/c1-7-8-9-10-11-12-13-14-15-16-19-31(4)45-46(79)53(86)69-44(30(2)3)52(85)64-32(5)47(80)67-36(27-43(77)78)50(83)68-35(26-40(58)74)49(82)66-33(22-23-39(57)73)48(81)63-29-42(76)65-34(20-17-24-62-56(60)61)54(87)71(6)38(28-41(59)75)55(88)72-25-18-21-37(72)51(84)70-45/h30-38,44-46,79H,7-29H2,1-6H3,(H2,57,73)(H2,58,74)(H2,59,75)(H,63,81)(H,64,85)(H,65,76)(H,66,82)(H,67,80)(H,68,83)(H,69,86)(H,70,84)(H,77,78)(H4,60,61,62)/t31-,32-,33-,34-,35-,36+,37-,38-,44-,45+,46+/m0/s1",UAZZFDUYHPLRJY-CUBYLZRLSA-N,,yes,Calothrix,fusca,EU-10-1
CyanoMetDB_0388,Puwainaphycin E,,other cyclic peptide,Puwainaphycine,C56H96N12O16,1192.706725,CN([C@@H](CC(N)=O)C(N1[C@H](C(N[C@@H]([C@@H](O)C(N[C@H](C(N/C(C(N[C@H](C(N[C@H](C(N[C@@H](CCC(N)=O)C(NCC2=O)=O)=O)[C@@H](O)C)=O)[C@@H](O)C)=O)=C/C)=O)C(C)C)=O)[C@H](CCCCCCCCCCCC)C)=O)CCC1)=O)C([C@H]([C@@H](OC)C)N2)=O,"InChI=1S/C56H96N12O16/c1-11-13-14-15-16-17-18-19-20-21-23-31(5)43-47(74)54(81)63-42(30(3)4)51(78)60-35(12-2)49(76)65-45(33(7)70)53(80)66-44(32(6)69)52(79)61-36(25-26-39(57)71)48(75)59-29-41(73)62-46(34(8)84-10)56(83)67(9)38(28-40(58)72)55(82)68-27-22-24-37(68)50(77)64-43/h12,30-34,36-38,42-47,69-70,74H,11,13-29H2,1-10H3,(H2,57,71)(H2,58,72)(H,59,75)(H,60,78)(H,61,79)(H,62,73)(H,63,81)(H,64,77)(H,65,76)(H,66,80)/b35-12+/t31-,32-,33-,34-,36-,37-,38-,42-,43+,44-,45-,46-,47+/m0/s1",DZUUDVQOVMOBOV-IOZAWTNVSA-N,,yes,Anabaena,sp.,BQ-16-1
CyanoMetDB_0389,Puwainaphycin C,,other cyclic peptide,,C56H95ClN12O16,1226.667753,CCC(CCCCCCCCCC(C)C1C(C(=O)NC(C(=O)N/C(=C/C)/C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)NC(C(=O)N(C(C(=O)N2CCCC2C(=O)N1)CC(=O)N)C)C(C)OC)CCC(=O)N)C(C)O)C(C)O)C(C)C)O)Cl,"InChI=1S/C56H95ClN12O16/c1-11-34(57)22-19-17-15-13-14-16-18-21-30(5)43-47(75)54(82)64-42(29(3)4)51(79)61-35(12-2)49(77)66-45(32(7)71)53(81)67-44(31(6)70)52(80)62-36(24-25-39(58)72)48(76)60-28-41(74)63-46(33(8)85-10)56(84)68(9)38(27-40(59)73)55(83)69-26-20-23-37(69)50(78)65-43/h12,29-34,36-38,42-47,70-71,75H,11,13-28H2,1-10H3,(H2,58,72)(H2,59,73)(H,60,76)(H,61,79)(H,62,80)(H,63,74)(H,64,82)(H,65,78)(H,66,77)(H,67,81)/b35-12+",LLZGZWBVBWCMRA-RHQFVSDJSA-N,14769213,yes,Anabaena,n.a.,n.a.
CyanoMetDB_0390,Lyngbyastatin 2,,other cyclic peptide,Lyngbya toxin (depsipeptide),C56H94N6O13,1058.687887,CC[C@@H]1CCC[C@H]([C@H](C(=O)O[C@@H]([C@H](CC=C(C(=CC(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N3CCC[C@H]3C(=O)O1)C(C)C)C)COC)C)C(C)C)C)[C@@H](C)CC)C)OC)C)C)C)C)O,"InChI=1S/C56H94N6O13/c1-18-35(7)49-53(68)60(15)47(33(3)4)52(67)57(12)43(32-72-16)51(66)61-29-21-24-41(61)50(65)59(14)48(34(5)6)54(69)62-30-22-25-42(62)56(71)75-40(19-2)23-20-26-44(63)38(10)55(70)74-39(11)36(8)27-28-37(9)45(73-17)31-46(64)58(49)13/h28,31,33-36,38-44,47-49,63H,18-27,29-30,32H2,1-17H3/t35-,36-,38+,39+,40+,41-,42-,43-,44+,47-,48-,49-/m0/s1",VXNKUFHPWIHJDR-CFYHMXAFSA-N,22610441,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0391,Symplocin A,,other linear peptide,,C56H86N8O14,1094.626349,CC[C@@H](C)[C@H](C(=O)O[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)[C@@H](CC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N(C)[C@H](CC2=CC=CC=C2)C(=O)N3CCC[C@H]3C(=O)OC)O)N(C)C,"InChI=1S/C56H86N8O14/c1-13-35(8)48(62(9)10)56(76)78-49(34(6)7)53(73)59-40(27-37-21-23-38(66)24-22-37)50(70)60-41(31-65)51(71)58-39(26-32(2)3)44(67)29-45(68)61-47(33(4)5)52(72)57-30-46(69)63(11)43(28-36-18-15-14-16-19-36)54(74)64-25-17-20-42(64)55(75)77-12/h14-16,18-19,21-24,32-35,39-44,47-49,65-67H,13,17,20,25-31H2,1-12H3,(H,57,72)(H,58,71)(H,59,73)(H,60,70)(H,61,68)/t35-,39+,40+,41+,42+,43-,44-,47+,48-,49-/m1/s1",NDLHEZRABDBDPY-YQLRASQXSA-N,57379439,yes,Symploca,n.a.,n.a.
CyanoMetDB_0392,Largamide E,,Cyanopeptolin,,C56H82ClN9O17,1187.55172,O[C@@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H]1C(N[C@H](C(N[C@@H]2C([N@@]([C@@H](CC2)O)[C@@H](C(N([C@H](C(N[C@H](C(O[C@H]1C)=O)C(C)C)=O)CC(C=C3)=CC(Cl)=C3O)C)=O)[C@@H](C)O)=O)=O)CC(C)C)=O)=O)C(C)C)=O)C)=O)CCCC(C=C4)=CC=C4O)=O)CO,"InChI=1S/C56H82ClN9O17/c1-26(2)22-38-49(75)60-37-19-21-42(72)66(54(37)80)46(30(8)68)55(81)65(10)39(24-33-16-20-40(70)35(57)23-33)50(76)63-44(28(5)6)56(82)83-31(9)45(53(79)61-38)64-52(78)43(27(3)4)62-47(73)29(7)58-48(74)36(59-51(77)41(71)25-67)13-11-12-32-14-17-34(69)18-15-32/h14-18,20,23,26-31,36-39,41-46,67-72H,11-13,19,21-22,24-25H2,1-10H3,(H,58,74)(H,59,77)(H,60,75)(H,61,79)(H,62,73)(H,63,76)(H,64,78)/t29-,30+,31-,36-,37-,38-,39-,41+,42+,43-,44-,45-,46+/m0/s1",DDRDKAKGHUYAPS-LFQAHCTKSA-N,,yes,Oscillatoria/Planktothrix,,FL31-01
CyanoMetDB_0393,Largamide D,,Cyanopeptolin,,C56H82BrN9O17,1231.501205,O[C@@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@@H]1C(N[C@H](C(N[C@@H]2C([N@@]([C@@H](CC2)O)[C@@H](C(N([C@H](C(N[C@H](C(O[C@H]1C)=O)C(C)C)=O)CC(C=C3)=CC(Br)=C3O)C)=O)[C@@H](C)O)=O)=O)CC(C)C)=O)=O)C(C)C)=O)C)=O)CCCC(C=C4)=CC=C4O)=O)CO,"InChI=1S/C56H82BrN9O17/c1-26(2)22-38-49(75)60-37-19-21-42(72)66(54(37)80)46(30(8)68)55(81)65(10)39(24-33-16-20-40(70)35(57)23-33)50(76)63-44(28(5)6)56(82)83-31(9)45(53(79)61-38)64-52(78)43(27(3)4)62-47(73)29(7)58-48(74)36(59-51(77)41(71)25-67)13-11-12-32-14-17-34(69)18-15-32/h14-18,20,23,26-31,36-39,41-46,67-72H,11-13,19,21-22,24-25H2,1-10H3,(H,58,74)(H,59,77)(H,60,75)(H,61,79)(H,62,73)(H,63,76)(H,64,78)/t29-,30+,31-,36-,37-,38-,39-,41+,42+,43-,44-,45-,46+/m0/s1",VIXXINFROOFGPE-LFQAHCTKSA-N,,yes,Oscillatoria/Planktothrix,,FL31-01
CyanoMetDB_0394,Largamide D oxazolidine,,Cyanopeptolin,,C56H80BrN9O16,1213.490641,C[C@@H]1[C@@H](C(=O)N[C@H](C(=O)N[C@H]2CC[C@@H]3N(C2=O)[C@@H]([C@@H](O3)C)C(=O)N([C@H](C(=O)N[C@H](C(=O)O1)C(C)C)CC4=CC(=C(C=C4)O)Br)C)CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCC5=CC=C(C=C5)O)NC(=O)[C@@H](CO)O,"InChI=1S/C56H80BrN9O16/c1-26(2)22-38-49(73)60-37-19-21-42-66(54(37)78)46(31(9)81-42)55(79)65(10)39(24-33-16-20-40(69)35(57)23-33)50(74)63-44(28(5)6)56(80)82-30(8)45(53(77)61-38)64-52(76)43(27(3)4)62-47(71)29(7)58-48(72)36(59-51(75)41(70)25-67)13-11-12-32-14-17-34(68)18-15-32/h14-18,20,23,26-31,36-39,41-46,67-70H,11-13,19,21-22,24-25H2,1-10H3,(H,58,72)(H,59,75)(H,60,73)(H,61,77)(H,62,71)(H,63,74)(H,64,76)/t29-,30+,31-,36-,37-,38-,39-,41+,42+,43-,44-,45-,46-/m0/s1",ACEYNJYKEXLTFZ-XQVAVGLYSA-N,139586409,yes,n.a.,confervoides,n.a.
CyanoMetDB_0395,Aeruginopeptin 95B,,other cyclic peptide,Aeruginopeptin,C56H79N9O17,1149.559392,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC(C(NC(C(NC(C(O)CC2=CC=C(O)C=C2)=O)C(O)C)=O)CCC(N)=O)=O)C(N[C@@H](CC3CCC(O)C=C3)C(N[C@H]4CC[C@@H](O)N([C@@H]([C@H](O)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C56H79N9O17/c1-7-28(2)44-56(81)82-31(5)46(63-48(73)37(21-23-42(57)71)58-52(77)45(29(3)66)62-51(76)41(70)27-34-15-19-36(69)20-16-34)53(78)60-39(25-33-13-17-35(68)18-14-33)49(74)59-38-22-24-43(72)65(54(38)79)47(30(4)67)55(80)64(6)40(50(75)61-44)26-32-11-9-8-10-12-32/h8-13,15-17,19-20,28-31,33,35,37-41,43-47,66-70,72H,7,14,18,21-27H2,1-6H3,(H2,57,71)(H,58,77)(H,59,74)(H,60,78)(H,61,75)(H,62,76)(H,63,73)/t28-,29?,30+,31-,33?,35?,37?,38-,39-,40-,41?,43+,44-,45?,46-,47-/m0/s1",TUPDMLYCDOSVAR-TWRSYMOESA-N,,yes,Microcystis,aeruginosa,TAC 954; M2285
CyanoMetDB_0396,Grassypeptolide C,,other cyclic peptide,other cyclic depsipeptide,C56H79N9O10S2,1101.539132,CC[C@@H]1C2=N[C@@H](CS2)C(=O)N([C@@H](C(=O)N[C@@H](C(=O)N[C@@H]([C@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N3CCC[C@H]3C(=O)N([C@H](C4=N[C@@H](CS4)C(=O)N1)CC5=CC=CC=C5)C)C(C)C)C)CC6=CC=CC=C6)C)C)[C@@H](C)O)CC(C)C)C,"InChI=1S/C56H79N9O10S2/c1-12-38-50-60-40(30-76-50)52(70)62(9)42(26-31(2)3)48(68)61-45(35(8)66)49(69)57-34(7)33(6)56(74)75-44(28-37-22-17-14-18-23-37)54(72)64(11)46(32(4)5)55(73)65-25-19-24-41(65)53(71)63(10)43(27-36-20-15-13-16-21-36)51-59-39(29-77-51)47(67)58-38/h13-18,20-23,31-35,38-46,66H,12,19,24-30H2,1-11H3,(H,57,69)(H,58,67)(H,61,68)/t33-,34-,35-,38-,39+,40+,41+,42-,43+,44+,45-,46+/m1/s1",KUUZFDUZAFJFSJ-WLXMMAAGSA-N,50907342,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0397,Grassypeptolide A,,other cyclic peptide,other cyclic depsipeptide,C56H79N9O10S2,1101.539132,CC[C@@H]1C2=N[C@@H](CS2)C(=O)N([C@@H](C(=O)N[C@@H](C(=O)N[C@@H]([C@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N3CCC[C@H]3C(=O)N([C@@H](C4=N[C@@H](CS4)C(=O)N1)CC5=CC=CC=C5)C)C(C)C)C)CC6=CC=CC=C6)C)C)[C@@H](C)O)CC(C)C)C,"InChI=1S/C56H79N9O10S2/c1-12-38-50-60-40(30-76-50)52(70)62(9)42(26-31(2)3)48(68)61-45(35(8)66)49(69)57-34(7)33(6)56(74)75-44(28-37-22-17-14-18-23-37)54(72)64(11)46(32(4)5)55(73)65-25-19-24-41(65)53(71)63(10)43(27-36-20-15-13-16-21-36)51-59-39(29-77-51)47(67)58-38/h13-18,20-23,31-35,38-46,66H,12,19,24-30H2,1-11H3,(H,57,69)(H,58,67)(H,61,68)/t33-,34-,35-,38-,39+,40+,41+,42-,43-,44+,45-,46+/m1/s1",KUUZFDUZAFJFSJ-IHTUVIFUSA-N,24809132,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0398,Oscillapeptin A,"Oscillapeptin (Shin, H. J. 1995)",Cyanopeptolin,Oscillapeptin,C56H77N7O18S,1167.50458,CC[C@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@@H](NC(C(OC)COS(=O)(O)=O)=O)CCC2=CC=C(O)C=C2)=O)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N[C@H]4CC[C@@H](O)N([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC5=CC=C(OC)C=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C56H77N7O18S/c1-9-31(3)46-56(74)81-33(5)47(61-50(68)41(26-18-35-13-21-38(65)22-14-35)57-52(70)44(79-8)30-80-82(75,76)77)53(71)58-40(25-17-34-11-19-37(64)20-12-34)49(67)59-42-27-28-45(66)63(54(42)72)48(32(4)10-2)55(73)62(6)43(51(69)60-46)29-36-15-23-39(78-7)24-16-36/h11-16,19-24,31-33,40-48,64-66H,9-10,17-18,25-30H2,1-8H3,(H,57,70)(H,58,71)(H,59,67)(H,60,69)(H,61,68)(H,75,76,77)/t31-,32-,33+,40+,41+,42+,43+,44?,45-,46+,47+,48-/m1/s1",MPCIPLGLKBYIIR-JOROZROBSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0400,Nostocyclin,,other cyclic peptide,other cyclic depsipeptide,C56H76N8O16,1116.537928,CC[C@H](C)[C@@H](C(=O)N[C@@H](CCO)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCO)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C)NC(=O)[C@@H](CC5=CC=C(C=C5)O)O,"InChI=1S/C56H76N8O16/c1-7-31(4)46(61-51(74)43(69)29-35-15-19-37(68)20-16-35)52(75)57-39(24-26-66)49(72)62-47-32(5)80-56(79)45(30(2)3)60-50(73)41(27-34-13-17-36(67)18-14-34)63(6)55(78)42(28-33-11-9-8-10-12-33)64-44(70)22-21-40(54(64)77)59-48(71)38(23-25-65)58-53(47)76/h8-20,30-32,38-47,65-70H,7,21-29H2,1-6H3,(H,57,75)(H,58,76)(H,59,71)(H,60,73)(H,61,74)(H,62,72)/t31-,32+,38-,39-,40-,41-,42-,43+,44+,45-,46-,47-/m0/s1",ZTYJFHZRHBZOQP-ZCCMQKKMSA-N,139585618,yes,Nostoc,n.a.,n.a.
CyanoMetDB_0401,Aeruginopeptin 95A,Aerugininopeptin 95A,Cyanopeptolin,Aeruginopeptin,C56H75N9O17,1145.528092,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC(C(NC(C(NC(C(O)CC2=CC=C(O)C=C2)=O)C(O)C)=O)CCC(N)=O)=O)C(N[C@@H](CC3=CC=C(O)C=C3)C(N[C@H]4CC[C@@H](O)N([C@@H]([C@H](O)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C56H75N9O17/c1-7-28(2)44-56(81)82-31(5)46(63-48(73)37(21-23-42(57)71)58-52(77)45(29(3)66)62-51(76)41(70)27-34-15-19-36(69)20-16-34)53(78)60-39(25-33-13-17-35(68)18-14-33)49(74)59-38-22-24-43(72)65(54(38)79)47(30(4)67)55(80)64(6)40(50(75)61-44)26-32-11-9-8-10-12-32/h8-20,28-31,37-41,43-47,66-70,72H,7,21-27H2,1-6H3,(H2,57,71)(H,58,77)(H,59,74)(H,60,78)(H,61,75)(H,62,76)(H,63,73)/t28-,29?,30+,31-,37?,38-,39-,40-,41?,43+,44-,45?,46-,47-/m0/s1",BIEZHRIRLVWXFT-FGEPEWBASA-N,,yes,Microcystis,aeruginosa,TAC 954; M2285
CyanoMetDB_0402,Norlyngbyastatin 2,,other cyclic peptide,Lyngbya toxin (depsipeptide),C55H92N6O13,1044.672237,CC[C@@H]1CCC[C@@H](O)[C@@H](C)C(O[C@H](C)[C@@H](C)C/C=C(C)/C(CC(N(C)[C@@H]([C@H](CC)C)C(N(C)[C@@H](C(C)C)C(N(C)[C@@H](COC)C(N2CCC[C@H]2C(N(C)[C@@H](C(C)C)C(N3CCC[C@H]3C(O1)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C55H92N6O13/c1-17-34(7)48-52(68)59(15)46(32(3)4)51(67)56(12)42(31-72-16)50(66)60-28-20-23-40(60)49(65)58(14)47(33(5)6)53(69)61-29-21-24-41(61)55(71)74-39(18-2)22-19-25-43(62)37(10)54(70)73-38(11)35(8)26-27-36(9)44(63)30-45(64)57(48)13/h27,32-35,37-43,46-48,62H,17-26,28-31H2,1-16H3/b36-27+/t34-,35-,37+,38+,39+,40-,41-,42-,43+,46-,47-,48-/m0/s1",RLWWDHNEFWYSBR-HFYTXMBXSA-N,10486261,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0403,Minutissamide D,,other cyclic peptide,,C55H91N13O16,1189.670674,CCC(CCCCCCCCC[C@H](C)[C@@H]1[C@H](C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N1)CC(=O)N)C)[C@@H](C)O)C)CC(=O)N)CC(=O)N)C(C)C)O)O,"InChI=1S/C55H91N13O16/c1-10-32(70)22-19-17-15-13-14-16-18-21-29(6)43-45(74)53(82)64-42(28(4)5)52(81)61-34(12-3)48(77)63-36(26-40(57)72)50(79)60-33(11-2)47(76)62-35(25-39(56)71)49(78)59-30(7)46(75)66-44(31(8)69)55(84)67(9)38(27-41(58)73)54(83)68-24-20-23-37(68)51(80)65-43/h11-12,28-32,35-38,42-45,69-70,74H,10,13-27H2,1-9H3,(H2,56,71)(H2,57,72)(H2,58,73)(H,59,78)(H,60,79)(H,61,81)(H,62,76)(H,63,77)(H,64,82)(H,65,80)(H,66,75)/b33-11+,34-12+/t29-,30+,31+,32?,35-,36-,37-,38-,42-,43+,44-,45+/m0/s1",QBOXPOZQNMGPJN-MVNQSCNZSA-N,53467423,yes,Anabaena,minutissima,UTEX 1613
CyanoMetDB_0404,Minutissamide C,,other cyclic peptide,,C55H89N13O16,1187.655024,CCC(=O)CCCCCCCCC[C@H](C)[C@@H]1[C@H](C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N1)CC(=O)N)C)[C@@H](C)O)C)CC(=O)N)CC(=O)N)C(C)C)O,"InChI=1S/C55H89N13O16/c1-10-32(70)22-19-17-15-13-14-16-18-21-29(6)43-45(74)53(82)64-42(28(4)5)52(81)61-34(12-3)48(77)63-36(26-40(57)72)50(79)60-33(11-2)47(76)62-35(25-39(56)71)49(78)59-30(7)46(75)66-44(31(8)69)55(84)67(9)38(27-41(58)73)54(83)68-24-20-23-37(68)51(80)65-43/h11-12,28-31,35-38,42-45,69,74H,10,13-27H2,1-9H3,(H2,56,71)(H2,57,72)(H2,58,73)(H,59,78)(H,60,79)(H,61,81)(H,62,76)(H,63,77)(H,64,82)(H,65,80)(H,66,75)/b33-11+,34-12+/t29-,30+,31+,35-,36-,37-,38-,42-,43+,44-,45+/m0/s1",HZHLPFLQTJCCHS-HFAMINCGSA-N,53467644,yes,Anabaena,minutissima,UTEX 1613
CyanoMetDB_0405,Micropeptin 1120,,Cyanopeptolin,Micropeptin,C55H81N11O14,1119.596446,O=C([C@@H](NC(CC[C@H](NC([C@@H](NC(CCC)=O)CC1=CC=C(C=C1)O)=O)C(OC)=O)=O)[C@H](C)OC2=O)N[C@H](C(N[C@@H]3C(N([C@@H](CC3)O)[C@@H](C(C)C)C(N(C)[C@@H](CC4=CC=CC=C4)C(N[C@H]2[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C55H81N11O14/c1-9-15-41(68)59-39(28-34-19-21-35(67)22-20-34)48(72)62-38(53(77)79-8)23-25-42(69)63-45-32(6)80-54(78)44(31(5)10-2)64-49(73)40(29-33-16-12-11-13-17-33)65(7)52(76)46(30(3)4)66-43(70)26-24-37(51(66)75)61-47(71)36(60-50(45)74)18-14-27-58-55(56)57/h11-13,16-17,19-22,30-32,36-40,43-46,67,70H,9-10,14-15,18,23-29H2,1-8H3,(H,59,68)(H,60,74)(H,61,71)(H,62,72)(H,63,69)(H,64,73)(H4,56,57,58)/t31-,32-,36-,37-,38-,39-,40-,43+,44-,45-,46-/m0/s1",LTYYAEDKIVYNKM-IGCJTOBOSA-N,146683899,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_0406,Oscillapeptin C,,Cyanopeptolin,Oscillapeptin,C55H79N7O14,1061.5685,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](NC([C@@H](OC)CO)=O)CCC2=CC=C(O)C=C2)=O)C(N[C@@H](CC3CC[C@@H](O)C=C3)C(N[C@H]4CC[C@@H](OC)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C55H79N7O14/c1-9-31(3)45-55(73)76-33(5)46(60-48(66)39(56-51(69)43(30-63)74-7)25-20-34-16-21-37(64)22-17-34)52(70)58-41(28-36-18-23-38(65)24-19-36)49(67)57-40-26-27-44(75-8)62(53(40)71)47(32(4)10-2)54(72)61(6)42(50(68)59-45)29-35-14-12-11-13-15-35/h11-18,21-23,31-33,36,38-47,63-65H,9-10,19-20,24-30H2,1-8H3,(H,56,69)(H,57,67)(H,58,70)(H,59,68)(H,60,66)/t31-,32+,33-,36?,38-,39+,40-,41-,42-,43-,44+,45-,46-,47+/m0/s1",JUQKYMGTTRNQNE-YHWXHQGLSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 205
CyanoMetDB_0407,Grassypeptolide B,,other cyclic peptide,other cyclic depsipeptide,C55H77N9O10S2,1087.523482,C[C@@H]1[C@H](NC(=O)[C@H](NC(=O)[C@H](N(C(=O)[C@@H]2CSC(=N2)[C@H](NC(=O)[C@@H]3CSC(=N3)[C@H](N(C(=O)[C@@H]4CCCN4C(=O)[C@@H](N(C(=O)[C@@H](OC1=O)CC5=CC=CC=C5)C)C(C)C)C)CC6=CC=CC=C6)C)C)CC(C)C)[C@@H](C)O)C,"InChI=1S/C55H77N9O10S2/c1-30(2)25-41-47(67)60-44(35(8)65)48(68)56-33(6)32(5)55(73)74-43(27-37-21-16-13-17-22-37)53(71)63(11)45(31(3)4)54(72)64-24-18-23-40(64)52(70)62(10)42(26-36-19-14-12-15-20-36)50-58-38(28-76-50)46(66)57-34(7)49-59-39(29-75-49)51(69)61(41)9/h12-17,19-22,30-35,38-45,65H,18,23-29H2,1-11H3,(H,56,68)(H,57,66)(H,60,67)/t32-,33-,34-,35-,38+,39+,40+,41-,42-,43+,44-,45+/m1/s1",NSQZLRCRDQWFOY-RIFKOKSMSA-N,50907138,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0408,Oscillapeptin E,Cyanopeptolin 1138,Cyanopeptolin,Oscillapeptin,C55H75N7O17S,1137.494015,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](NC([C@@H](OC)COS(=O)(O)=O)=O)CCC2=CC=C(O)C=C2)=O)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N[C@H]4CC[C@@H](O)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C55H75N7O17S/c1-8-31(3)45-55(73)79-33(5)46(60-49(67)40(26-20-35-17-23-38(64)24-18-35)56-51(69)43(77-7)30-78-80(74,75)76)52(70)57-39(25-19-34-15-21-37(63)22-16-34)48(66)58-41-27-28-44(65)62(53(41)71)47(32(4)9-2)54(72)61(6)42(50(68)59-45)29-36-13-11-10-12-14-36/h10-18,21-24,31-33,39-47,63-65H,8-9,19-20,25-30H2,1-7H3,(H,56,69)(H,57,70)(H,58,66)(H,59,68)(H,60,67)(H,74,75,76)/t31-,32+,33-,39-,40+,41-,42-,43-,44+,45-,46-,47+/m0/s1",IPSPUQFSLMOERD-SFCFPJHSSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 205
CyanoMetDB_0410,Pheophytin a,,other cyclic non-peptide,porphyrins,C55H74N4O5,870.5659215,C=CC(C(C)=C(N1)/C=C2[C@H]([C@@H](C3=N/2)CCC(OC/C=C(CCCC(CCCC(CCCC(C)C)C)C)/C)=O)C)=C1/C=C4C(C)=C(C(/C=C(N5)/C(C)=C6C5=C3[C@@H](C(OC)=O)C6=O)=N/4)CC,"InChI=1S/C55H74N4O5/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,51,56,59H,1,14-25,27H2,2-12H3/b34-26-,42-28-,43-29-,44-28-,45-30-,46-29-,47-30-,52-50-/t32?,33?,37-,41-,51+/m0/s1",CQIKWXUXPNUNDV-CANNFCGJSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0411,Micropeptin D,,Cyanopeptolin,Micropeptin,C55H73N7O14,1055.52155,O=C(N[C@H](C(N[C@H]1[C@@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC5=CC=C(O)C=C5)NC1=O)=O)C4=O)=O)=O)=O)=O)CCC(O)=O)CCCCCCC,"InChI=1S/C55H73N7O14/c1-6-7-8-9-13-16-44(65)56-39(26-28-46(67)68)49(69)60-48-33(4)76-55(75)47(32(2)3)59-51(71)42(30-36-19-23-38(64)24-20-36)61(5)54(74)43(31-34-14-11-10-12-15-34)62-45(66)27-25-40(53(62)73)57-50(70)41(58-52(48)72)29-35-17-21-37(63)22-18-35/h10-12,14-15,17-24,32-33,39-43,45,47-48,63-64,66H,6-9,13,16,25-31H2,1-5H3,(H,56,65)(H,57,70)(H,58,72)(H,59,71)(H,60,69)(H,67,68)/t33-,39+,40+,41+,42+,43+,45-,47+,48+/m1/s1",UYWDIVWVEOWICI-YCNLCRJCSA-N,42638300,yes,Microcystis,aeruginosa,NIES 100
CyanoMetDB_0412,Micropeptin 88Y,,Cyanopeptolin,Micropeptin,C55H72N8O15,1084.511714,CC[C@H]([C@@H]1C(O[C@@H](C)[C@H](NC(CC[C@H](NC([C@H](NC(C)=O)CC2=CC=C(O)C=C2)=O)C(O)=O)=O)C(N[C@@H](CC3=CC=C(O)C=C3)C(N[C@H]4CC[C@@H](O)N([C@@H](C(C)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C55H72N8O15/c1-8-30(4)45-55(77)78-31(5)46(60-43(67)24-22-39(54(75)76)58-48(69)40(56-32(6)64)26-34-14-18-36(65)19-15-34)51(72)59-41(27-35-16-20-37(66)21-17-35)49(70)57-38-23-25-44(68)63(52(38)73)47(29(2)3)53(74)62(7)42(50(71)61-45)28-33-12-10-9-11-13-33/h9-21,29-31,38-42,44-47,65-66,68H,8,22-28H2,1-7H3,(H,56,64)(H,57,70)(H,58,69)(H,59,72)(H,60,67)(H,61,71)(H,75,76)/t30-,31+,38+,39+,40-,41+,42+,44-,45-,46+,47+/m1/s1",ROXJSZHCCCSPST-WKZGWEQNSA-N,,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0413,Chlorophyll a,,other cyclic non-peptide,porphyrins,C55H72N4O5Mg,892.5353131,CCC1=C(C2=NC1=CC3=C(C4=C([N-]3)C(=C5[C@H]([C@@H](C(=N5)C=C6C(=C(C(=C2)[N-]6)C=C)C)C)CCC(=O)OC/C=C(\C)/CCC[C@H](C)CCC[C@H](C)CCCC(C)C)[C@H](C4=O)C(=O)OC)C)C.[Mg+2],"InChI=1S/C55H73N4O5.Mg/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42;/h13,26,28-33,37,41,51H,1,14-25,27H2,2-12H3,(H-,56,57,58,59,61);/q-1;+2/p-1/b34-26+;/t32-,33-,37+,41+,51-;/m1./s1",ATNHDLDRLWWWCB-RGRHHCTPSA-M,,no,n.a.,n.a.,n.a.
CyanoMetDB_0414,Micropeptin T1,,Cyanopeptolin,Micropeptin,C55H70N8O13,1050.506234,O=C([C@@H](NC([C@H](NC(CCCCC)=O)CCC(O)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)[C@@H](CC3=CC=CC=C3)C(N(C)[C@@H](CC4=CNC5=C4C=CC=C5)C(N[C@H]1C(C)C)=O)=O)=O)=O)CC6=CC=C(C=C6)O,"InChI=1S/C55H70N8O13/c1-6-7-9-18-44(65)57-39(24-26-46(67)68)49(69)61-48-32(4)76-55(75)47(31(2)3)60-51(71)42(29-35-30-56-38-17-13-12-16-37(35)38)62(5)54(74)43(28-33-14-10-8-11-15-33)63-45(66)25-23-40(53(63)73)58-50(70)41(59-52(48)72)27-34-19-21-36(64)22-20-34/h8,10-17,19-22,30-32,39-43,45,47-48,56,64,66H,6-7,9,18,23-29H2,1-5H3,(H,57,65)(H,58,70)(H,59,72)(H,60,71)(H,61,69)(H,67,68)/t32-,39+,40-,41-,42-,43-,45+,47-,48-/m0/s1",WECHBPBIWSIRMG-HZNZKCKDSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0415,Chlorophyll f,,other cyclic non-peptide,porphyrins,C55H70N4O6Mg,906.5145777,O=C(CC[C@@]1([H])[C@@](C)([H])/C(N=C1C([C@@](C2=O)([H])C(OC)=O)=C(C2=C/3C)[N-]C3=C/C4=N/C(C(C)=C4CC)=C\5)=C/C6=C(C([H])=O)C(C=C)=C5[N-]6)OCC=C(C)CCCC(CCCC(CCCC(C)C)C)C.[Mg+2],"InChI=1S/C55H71N4O6.Mg/c1-12-38-35(8)42-27-46-39(13-2)41(30-60)47(57-46)28-43-36(9)40(52(58-43)50-51(55(63)64-11)54(62)49-37(10)44(59-53(49)50)29-45(38)56-42)23-24-48(61)65-26-25-34(7)22-16-21-33(6)20-15-19-32(5)18-14-17-31(3)4;/h13,25,27-33,36,40,51H,2,12,14-24,26H2,1,3-11H3,(H-,56,57,58,59,60,62);/q-1;+2/p-1/t32?,33?,36-,40-,51+;/m0./s1",FBMIDEWOZNHQKD-UCLIUJATSA-M,,yes,Halomicronema,hongdechloris,n.a.
CyanoMetDB_0416,Wewakpeptin D,,other cyclic peptide,Wewakpeptin,C54H85N7O11,1007.630707,CCCCC[C@@H]1C(C(=O)N[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)O1)C(C)C)CC4=CC=CC=C4)C(C)C)C)C)C)C)C)[C@@H](C)CC)(C)C,"InChI=1S/C54H85N7O11/c1-15-17-19-28-41-54(10,11)53(70)56-43(34(7)16-2)50(67)58(13)35(8)46(63)57(12)36(9)47(64)59(14)44(33(5)6)52(69)71-40(31-37-24-20-18-21-25-37)49(66)61-30-23-27-39(61)48(65)60-29-22-26-38(60)45(62)55-42(32(3)4)51(68)72-41/h18,20-21,24-25,32-36,38-44H,15-17,19,22-23,26-31H2,1-14H3,(H,55,62)(H,56,70)/t34-,35-,36-,38-,39-,40+,41+,42-,43-,44-/m0/s1",UUCAGRLWNLHYHI-WMHQRPKNSA-N,11434643,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0417,Apramide F,,other linear peptide,,C54H84N8O8S,1004.613283,C[C@H](CCCCC=C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N3CCC[C@H]3C4=NC=CS4,"InChI=1S/C54H84N8O8S/c1-16-17-18-19-22-37(8)48(63)56(10)38(9)49(64)58(12)46(36(6)7)54(69)62-31-21-24-42(62)50(65)59(13)45(35(4)5)53(68)60(14)44(34(2)3)52(67)57(11)43(33-39-25-27-40(70-15)28-26-39)51(66)61-30-20-23-41(61)47-55-29-32-71-47/h16,25-29,32,34-38,41-46H,1,17-24,30-31,33H2,2-15H3/t37-,38+,41+,42+,43+,44+,45+,46+/m1/s1",BBXBRYOECNAMNU-GKMPNBHNSA-N,10819827,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0418,Apramide D,,other linear peptide,,C54H82N8O8S,1002.597633,C[C@H](CCCCC#C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N3CCC[C@H]3C4=NC=CS4,"InChI=1S/C54H82N8O8S/c1-16-17-18-19-22-37(8)48(63)56(10)38(9)49(64)58(12)46(36(6)7)54(69)62-31-21-24-42(62)50(65)59(13)45(35(4)5)53(68)60(14)44(34(2)3)52(67)57(11)43(33-39-25-27-40(70-15)28-26-39)51(66)61-30-20-23-41(61)47-55-29-32-71-47/h1,25-29,32,34-38,41-46H,17-24,30-31,33H2,2-15H3/t37-,38+,41+,42+,43+,44+,45+,46+/m1/s1",OXCWFJNLZMQXRO-GKMPNBHNSA-N,10724698,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0419,Wewakpeptin C,,other cyclic peptide,Wewakpeptin,C54H81N7O11,1003.599406,CC[C@H](C)[C@H]1C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)O[C@@H](C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)O[C@@H](C(C(=O)N1)(C)C)CCCC#C)C(C)C)CC4=CC=CC=C4)C(C)C)C)C)C)C)C,"InChI=1S/C54H81N7O11/c1-15-17-19-28-41-54(10,11)53(70)56-43(34(7)16-2)50(67)58(13)35(8)46(63)57(12)36(9)47(64)59(14)44(33(5)6)52(69)71-40(31-37-24-20-18-21-25-37)49(66)61-30-23-27-39(61)48(65)60-29-22-26-38(60)45(62)55-42(32(3)4)51(68)72-41/h1,18,20-21,24-25,32-36,38-44H,16-17,19,22-23,26-31H2,2-14H3,(H,55,62)(H,56,70)/t34-,35-,36-,38-,39-,40+,41+,42-,43-,44-/m0/s1",WKZYHHMUTTZYND-WMHQRPKNSA-N,11343673,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0420,Malevamide A,,other linear peptide,,C54H80N8O10,1000.599741,CCCCC(C)C(=O)N1CCC[C@H]1C(=O)N(C)C(CC2=CC=CC=C2)C(=O)NCC(=O)N(C)[C@H](C(C)C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N(C)C(CC3=CC=CC=C3)C(=O)N4CCC[C@@H]4C(=O)OC,"InChI=1S/C54H80N8O10/c1-11-13-22-37(6)51(68)61-29-20-27-40(61)52(69)59(8)42(31-38-23-16-14-17-24-38)48(65)55-34-45(64)60(9)47(35(3)4)50(67)57-46(36(5)12-2)49(66)56-33-44(63)58(7)43(32-39-25-18-15-19-26-39)53(70)62-30-21-28-41(62)54(71)72-10/h14-19,23-26,35-37,40-43,46-47H,11-13,20-22,27-34H2,1-10H3,(H,55,65)(H,56,66)(H,57,67)/t36-,37?,40-,41+,42?,43?,46-,47+/m0/s1",SBBWNCCDZGYIDQ-ZDQPJKKJSA-N,44583745,yes,Symploca,laete-viridis,n.a.
CyanoMetDB_0421,Planktopeptin BL1125,,Cyanopeptolin,,C54H79N9O17,1125.559392,O[C@H]1N(C([C@H](CC1)NC([C@H](CC(C)C)N2)=O)=O)C([C@H](C)O)C(N(C)[C@@H](CC3=CC=C(C=C3)OC)C(N[C@H](C(O[C@H]([C@@H](C2=O)NC([C@H](CCC(N)=O)NC([C@@H](CCC4=CC=C(C=C4)O)NC([C@@H](O)CO)=O)=O)=O)C)=O)[C@@H](C)CC)=O)=O,"InChI=1S/C54H79N9O17/c1-9-28(4)43-54(78)80-30(6)44(61-47(71)36(20-22-41(55)68)56-46(70)35(57-50(74)40(67)26-64)19-14-31-10-15-33(66)16-11-31)51(75)59-38(24-27(2)3)48(72)58-37-21-23-42(69)63(52(37)76)45(29(5)65)53(77)62(7)39(49(73)60-43)25-32-12-17-34(79-8)18-13-32/h10-13,15-18,27-30,35-40,42-45,64-67,69H,9,14,19-26H2,1-8H3,(H2,55,68)(H,56,70)(H,57,74)(H,58,72)(H,59,75)(H,60,73)(H,61,71)/t28-,29-,30-,35+,36-,37-,38-,39-,40-,42+,43-,44-,45?/m0/s1",WABVJCPIKZSXJF-POZIDFPQSA-N,,yes,Oscillatoria/Planktothrix,rubescens,n.a.
CyanoMetDB_0423,Micropeptin 1106,,Cyanopeptolin,Micropeptin,C54H79N11O14,1105.580796,O=C([C@@H](NC(CC[C@H](NC([C@@H](NC(CCC)=O)CC1=CC=C(C=C1)O)=O)C(O)=O)=O)[C@H](C)OC2=O)N[C@H](C(N[C@@H]3C(N([C@@H](CC3)O)[C@@H](C(C)C)C(N(C)[C@@H](CC4=CC=CC=C4)C(N[C@H]2[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C54H79N11O14/c1-8-14-40(67)58-38(27-33-18-20-34(66)21-19-33)47(71)61-37(52(76)77)22-24-41(68)62-44-31(6)79-53(78)43(30(5)9-2)63-48(72)39(28-32-15-11-10-12-16-32)64(7)51(75)45(29(3)4)65-42(69)25-23-36(50(65)74)60-46(70)35(59-49(44)73)17-13-26-57-54(55)56/h10-12,15-16,18-21,29-31,35-39,42-45,66,69H,8-9,13-14,17,22-28H2,1-7H3,(H,58,67)(H,59,73)(H,60,70)(H,61,71)(H,62,68)(H,63,72)(H,76,77)(H4,55,56,57)/t30-,31-,35-,36-,37-,38-,39-,42+,43-,44-,45-/m0/s1",GQAJCNQASKILOK-SBJGWPQUSA-N,146683900,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_0424,Micropeptin 88N,,Cyanopeptolin,Micropeptin,C54H78N8O14,1062.563749,OC([C@@H](NC([C@H](NC(CCC)=O)CC(C)C)=O)CCC(N[C@@H]1C(N[C@H](C(N[C@@H](CC[C@H]2O)C(N2[C@H](C(N([C@H](C(N[C@H](C(O[C@H]1C)=O)[C@H](C)CC)=O)CC3=CC=CC=C3)C)=O)C(C)C)=O)=O)CC(C=C4)=CC=C4O)=O)=O)=O,"InChI=1S/C54H78N8O14/c1-10-15-41(64)55-38(26-29(3)4)47(67)57-37(53(73)74)22-24-42(65)59-45-32(8)76-54(75)44(31(7)11-2)60-49(69)40(28-33-16-13-12-14-17-33)61(9)52(72)46(30(5)6)62-43(66)25-23-36(51(62)71)56-48(68)39(58-50(45)70)27-34-18-20-35(63)21-19-34/h12-14,16-21,29-32,36-40,43-46,63,66H,10-11,15,22-28H2,1-9H3,(H,55,64)(H,56,68)(H,57,67)(H,58,70)(H,59,65)(H,60,69)(H,73,74)/t31-,32+,36+,37+,38-,39+,40+,43-,44+,45+,46+/m1/s1",PUNPCZIPNYKTCV-TYHNBFPCSA-N,,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0425,Micropeptin 88E,,Cyanopeptolin,Micropeptin,C54H78N8O14,1062.563749,C[C@H](OC([C@H]([C@H](CC)C)NC([C@H](CC1=CC=CC=C1)N(C)C([C@H](C(C)C)N2C([C@H](CC[C@H]2O)NC3=O)=O)=O)=O)=O)[C@H](NC(CC[C@@H](C(O)=O)NC([C@H](CC4=CC=C(C=C4)O)NC(CCC)=O)=O)=O)C(N[C@H]3CC(C)C)=O,"InChI=1S/C54H78N8O14/c1-10-15-41(64)55-39(27-34-18-20-35(63)21-19-34)48(68)57-37(53(73)74)22-24-42(65)59-45-32(8)76-54(75)44(31(7)11-2)60-49(69)40(28-33-16-13-12-14-17-33)61(9)52(72)46(30(5)6)62-43(66)25-23-36(51(62)71)56-47(67)38(26-29(3)4)58-50(45)70/h12-14,16-21,29-32,36-40,43-46,63,66H,10-11,15,22-28H2,1-9H3,(H,55,64)(H,56,67)(H,57,68)(H,58,70)(H,59,65)(H,60,69)(H,73,74)/t31-,32-,36-,37-,38-,39-,40-,43+,44-,45-,46-/m0/s1",HVAAQTDXUSPMLD-IGCJTOBOSA-N,,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0426,Oscillapeptin D,,Cyanopeptolin,,C54H77N7O17S,1127.509665,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](NC([C@@H](OC)COS(=O)(O)=O)=O)CCC2=CC=C(O)C=C2)=O)C(N[C@@H](CC3CC[C@@H](O)C=C3)C(N[C@H]4CC[C@@H](O)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C54H77N7O17S/c1-8-30(3)44-54(72)78-32(5)45(59-47(65)38(24-19-33-15-20-36(62)21-16-33)55-50(68)42(76-7)29-77-79(73,74)75)51(69)57-40(27-35-17-22-37(63)23-18-35)48(66)56-39-25-26-43(64)61(52(39)70)46(31(4)9-2)53(71)60(6)41(49(67)58-44)28-34-13-11-10-12-14-34/h10-17,20-22,30-32,35,37-46,62-64H,8-9,18-19,23-29H2,1-7H3,(H,55,68)(H,56,66)(H,57,69)(H,58,67)(H,59,65)(H,73,74,75)/t30-,31+,32-,35?,37-,38+,39-,40-,41-,42-,43+,44-,45-,46+/m0/s1",DZGWKZQZDPEAAS-NNGYWCRXSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 205
CyanoMetDB_0427,Aeruginopeptin 917SB,Aeruginopeptin 917S-B,other cyclic peptide,Aeruginopeptin,C54H76N8O15,1076.543014,CC[C@@H](C1C(O[C@@H](C)[C@H](NC([C@@H](NC([C@@H](O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@@H](CC3CCC(O)C=C3)C(N[C@H]4CC[C@@H](O)N([C@@H](CC(C)C)C(N(C)[C@@H](CC5=CC=C(O)C=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C54H76N8O15/c1-7-29(4)45-54(76)77-30(5)46(60-47(69)37(20-22-43(55)67)56-50(72)42(66)27-33-12-18-36(65)19-13-33)51(73)58-39(25-31-8-14-34(63)15-9-31)48(70)57-38-21-23-44(68)62(52(38)74)41(24-28(2)3)53(75)61(6)40(49(71)59-45)26-32-10-16-35(64)17-11-32/h8,10-14,16-19,28-31,34,37-42,44-46,63-66,68H,7,9,15,20-27H2,1-6H3,(H2,55,67)(H,56,72)(H,57,70)(H,58,73)(H,59,71)(H,60,69)/t29-,30-,31?,34?,37-,38-,39-,40-,41-,42-,44+,45?,46-/m0/s1",OZABBUPKYTXOSK-QOAXZWKZSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0429,Micropeptin DR1060,,Cyanopeptolin,Micropeptin,C54H76N8O14,1060.548099,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)NC(C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)CC(C)C)O)C[C@@H]4CC[C@H](C=C4)O)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H](CC5=CC=C(C=C5)O)O)C,"InChI=1S/C54H76N8O14/c1-7-30(4)45-54(75)76-31(5)46(60-47(68)37(21-23-43(55)66)56-50(71)42(65)28-34-15-19-36(64)20-16-34)51(72)58-39(26-33-13-17-35(63)18-14-33)48(69)57-38-22-24-44(67)62(52(38)73)41(25-29(2)3)53(74)61(6)40(49(70)59-45)27-32-11-9-8-10-12-32/h8-13,15-17,19-20,29-31,33,35,37-42,44-46,63-65,67H,7,14,18,21-28H2,1-6H3,(H2,55,66)(H,56,71)(H,57,69)(H,58,72)(H,59,70)(H,60,68)/t30-,31+,33-,35-,37-,38-,39?,40-,41-,42+,44+,45-,46-/m0/s1",AMGAAKSPMIBFCU-QFUOYNNWSA-N,102041486,yes,Microcystis,aeruginosa,TAU IL-237 and IL-23
CyanoMetDB_0430,Microcystilide A,Aeruginopeptin 917SA,Cyanopeptolin,Aeruginopeptin,C54H72N8O15,1072.511714,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](NC([C@@H](O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@@H](CC3=CC=C(O)C=C3)C(NC4CCC(O)N([C@@H](CC(C)C)C(N(C)[C@@H](CC5=CC=C(O)C=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C54H72N8O15/c1-7-29(4)45-54(76)77-30(5)46(60-47(69)37(20-22-43(55)67)56-50(72)42(66)27-33-12-18-36(65)19-13-33)51(73)58-39(25-31-8-14-34(63)15-9-31)48(70)57-38-21-23-44(68)62(52(38)74)41(24-28(2)3)53(75)61(6)40(49(71)59-45)26-32-10-16-35(64)17-11-32/h8-19,28-30,37-42,44-46,63-66,68H,7,20-27H2,1-6H3,(H2,55,67)(H,56,72)(H,57,70)(H,58,73)(H,59,71)(H,60,69)/t29-,30-,37+,38?,39+,40+,41+,42+,44?,45+,46+/m1/s1",GZJSMNOPCVUYFU-PBMWJKAYSA-N,,yes,Microcystis,aeruginosa,NO-15-1840
CyanoMetDB_0433,Micropeptin DR1056,,Cyanopeptolin,Micropeptin,C54H72N8O14,1056.516799,CC[C@H]([C@@H]1C(O[C@H](C)[C@@H](NC([C@@H](NC([C@H](O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@H](CC3=CC=C(O)C=C3)C(N[C@@H]4CC[C@H](O)N([C@H](CC(C)C)C(N(C)[C@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C54H72N8O14/c1-7-30(4)45-54(75)76-31(5)46(60-47(68)37(21-23-43(55)66)56-50(71)42(65)28-34-15-19-36(64)20-16-34)51(72)58-39(26-33-13-17-35(63)18-14-33)48(69)57-38-22-24-44(67)62(52(38)73)41(25-29(2)3)53(74)61(6)40(49(70)59-45)27-32-11-9-8-10-12-32/h8-20,29-31,37-42,44-46,63-65,67H,7,21-28H2,1-6H3,(H2,55,66)(H,56,71)(H,57,69)(H,58,72)(H,59,70)(H,60,68)/t30-,31-,37+,38-,39-,40-,41-,42-,44+,45-,46-/m1/s1",ZAZDUJCSUMWDHI-VMTAWSSBSA-N,,yes,Microcystis,aeruginosa,TAU IL-237 and IL-23
CyanoMetDB_0434,Hofmannolin,,Cyanopeptolin,,C54H71N7O16,1073.495729,CC[C@H](C)[C@@H](C(N[C@@H](CCC(O)=O)C(N[C@@H]1[C@H](OC([C@H](NC([C@@H](N(C([C@@H](N2[C@@H](CC[C@@H](C2=O)NC([C@@H](NC1=O)CC3=CC=C(O)C=C3)=O)O)CC4=CC=C(C=C4)OC)=O)C)CC5=CC=C(C=C5)O)=O)C(C)C)=O)C)=O)=O)O,"InChI=1S/C54H71N7O16/c1-8-29(4)46(67)51(72)55-37(22-24-43(65)66)47(68)59-45-30(5)77-54(75)44(28(2)3)58-49(70)40(26-32-11-17-35(63)18-12-32)60(6)53(74)41(27-33-13-19-36(76-7)20-14-33)61-42(64)23-21-38(52(61)73)56-48(69)39(57-50(45)71)25-31-9-15-34(62)16-10-31/h9-20,28-30,37-42,44-46,62-64,67H,8,21-27H2,1-7H3,(H,55,72)(H,56,69)(H,57,71)(H,58,70)(H,59,68)(H,65,66)/t29-,30+,37-,38-,39-,40-,41-,42+,44+,45+,46-/m0/s1",JRWABASHXVMVPY-UKWUABHESA-N,,yes,Scytonema,hofmannii ,PCC 7110
CyanoMetDB_0435,Lyngbyastatin 6,,other cyclic peptide,Lyngbya toxin (depsipeptide),C54H70N8O18S,1150.452879,C/C=C\1/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](CCC3=CC=C(C=C3)O)NC(=O)[C@H](C)NC(=O)[C@@H](COS(=O)(=O)O)O)C)C(C)C)CC4=CC=C(C=C4)O)C)CC5=CC=CC=C5)OC,"InChI=1S/C54H70N8O18S/c1-8-37-47(67)58-39-24-25-43(78-7)62(52(39)72)41(27-33-12-10-9-11-13-33)53(73)61(6)40(26-34-16-21-36(64)22-17-34)49(69)59-44(29(2)3)54(74)80-31(5)45(51(71)56-37)60-48(68)38(23-18-32-14-19-35(63)20-15-32)57-46(66)30(4)55-50(70)42(65)28-79-81(75,76)77/h8-17,19-22,29-31,38-45,63-65H,18,23-28H2,1-7H3,(H,55,70)(H,56,71)(H,57,66)(H,58,67)(H,59,69)(H,60,68)(H,75,76,77)/b37-8-/t30-,31+,38-,39-,40-,41-,42+,43+,44-,45-/m0/s1",MSJHPEKZCVVYTI-VIXCIGPQSA-N,23657138,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0436,Prenylagaramide A,Prenylagaramide,other cyclic peptide,Prenylagaramide,C54H68N10O14,1080.491647,C/C(C)=C\COC1=CC=C(C[C@H](NC([C@H]2N(CCC2)C3=O)=O)C(NCC(N[C@H](C(NCC(N[C@@H](CCC(O)=O)C(N[C@@H](CC4=CC=CC=C4)C(N[C@@H](CC5=CC=CC=C5)C(N[C@H]3CC(N)=O)=O)=O)=O)=O)=O)[C@@H](C)O)=O)=O)C=C1,"InChI=1S/C54H68N10O14/c1-31(2)22-24-78-36-18-16-35(17-19-36)27-38-48(71)56-30-45(68)63-47(32(3)65)53(76)57-29-44(67)58-37(20-21-46(69)70)49(72)59-39(25-33-11-6-4-7-12-33)50(73)60-40(26-34-13-8-5-9-14-34)51(74)62-41(28-43(55)66)54(77)64-23-10-15-42(64)52(75)61-38/h4-9,11-14,16-19,22,32,37-42,47,65H,10,15,20-21,23-30H2,1-3H3,(H2,55,66)(H,56,71)(H,57,76)(H,58,67)(H,59,72)(H,60,73)(H,61,75)(H,62,74)(H,63,68)(H,69,70)/t32-,37+,38+,39+,40+,41+,42+,47+/m1/s1",LXDPLRBOMKUKGF-DEOTVAGQSA-N,10748669,yes,Oscillatoria/Planktothrix,agardhii,NIES 205; NIES 596
CyanoMetDB_0437,Wewakamide A,,other cyclic peptide,other cyclic depsipeptide,C53H86N8O10,994.646691,CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@@H]([C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N([C@H](C(=O)N1C)CC(C)C)C)C)C)C(C)C)CC3=CC=CC=C3)CC(C)C)C)C)C(C)C,"InChI=1S/C53H86N8O10/c1-17-33(10)43-48(65)57-42(31(6)7)47(64)54-35(12)34(11)45(62)55-38(26-29(2)3)46(63)56-39(28-37-22-19-18-20-23-37)53(70)71-44(32(8)9)52(69)61-25-21-24-40(61)50(67)58(14)36(13)49(66)59(15)41(27-30(4)5)51(68)60(43)16/h18-20,22-23,29-36,38-44H,17,21,24-28H2,1-16H3,(H,54,64)(H,55,62)(H,56,63)(H,57,65)/t33-,34+,35+,36-,38-,39-,40-,41-,42-,43-,44-/m0/s1",QGVOFCJSCWSNCO-POWBWRITSA-N,139586107,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0438,Apramide E,,other linear peptide,,C53H80N8O8S,988.5819827,C[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N3CCC[C@H]3C4=NC=CS4)N(C)C(=O)CCCCCC#C,"InChI=1S/C53H80N8O8S/c1-15-16-17-18-19-24-43(62)55(9)37(8)48(63)57(11)46(36(6)7)53(68)61-31-21-23-41(61)49(64)58(12)45(35(4)5)52(67)59(13)44(34(2)3)51(66)56(10)42(33-38-25-27-39(69-14)28-26-38)50(65)60-30-20-22-40(60)47-54-29-32-70-47/h1,25-29,32,34-37,40-42,44-46H,16-24,30-31,33H2,2-14H3/t37-,40-,41-,42-,44-,45-,46-/m0/s1",VYJAWGAQNOLQQQ-LVUAGUMRSA-N,10796039,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0439,Nostopeptolide A1,,other cyclic peptide,other cyclic depsipeptide,C53H80N10O14,1080.585547,CCCC(N[C@H](C(N[C@H]1COC([C@@H]2CCCN2C([C@H](CC3=CC=C(O)C=C3)NC([C@H](CC(N)=O)NC(CNC([C@@H](CC(C)C)NC(CC([C@H](CC(C)C)NC([C@@H]4C[C@H](C)CN4C1=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)[C@@H](CC)C)=O,"InChI=1S/C53H80N10O14/c1-9-12-43(67)61-46(31(8)10-2)50(73)60-38-27-77-53(76)39-13-11-18-62(39)51(74)37(22-32-14-16-33(64)17-15-32)59-48(71)36(23-42(54)66)57-45(69)25-55-47(70)35(20-29(5)6)56-44(68)24-41(65)34(19-28(3)4)58-49(72)40-21-30(7)26-63(40)52(38)75/h14-17,28-31,34-40,46,64H,9-13,18-27H2,1-8H3,(H2,54,66)(H,55,70)(H,56,68)(H,57,69)(H,58,72)(H,59,71)(H,60,73)(H,61,67)/t30-,31-,34-,35-,36-,37-,38-,39-,40-,46-/m0/s1",VJNXGGVCMFEVSM-ZABMOCCYSA-N,10796211,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_0440,Nostopeptolide A3,,other cyclic peptide,other cyclic depsipeptide,C53H80N10O14,1080.585547,CCCC(N[C@H](C(N[C@H]1COC([C@@H]2CCCN2C([C@H](CC3=CC=C(O)C=C3)NC([C@H](CC(N)=O)NC(CNC([C@@H](CC(C)C)NC(CC([C@@H](CC(C)C)NC([C@@H]4C[C@H](C)CN4C1=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)[C@@H](CC)C)=O,"InChI=1S/C53H80N10O14/c1-9-12-43(67)61-46(31(8)10-2)50(73)60-38-27-77-53(76)39-13-11-18-62(39)51(74)37(22-32-14-16-33(64)17-15-32)59-48(71)36(23-42(54)66)57-45(69)25-55-47(70)35(20-29(5)6)56-44(68)24-41(65)34(19-28(3)4)58-49(72)40-21-30(7)26-63(40)52(38)75/h14-17,28-31,34-40,46,64H,9-13,18-27H2,1-8H3,(H2,54,66)(H,55,70)(H,56,68)(H,57,69)(H,58,72)(H,59,71)(H,60,73)(H,61,67)/t30-,31-,34-,35-,36-,37-,38-,39-,40-,46-/m0/s1",VJNXGGVCMFEVSM-ZABMOCCYSA-N,10796211,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_0441,Oscillapeptin F,,Cyanopeptolin,Oscillapeptin,C51H76N8O16S,1088.509999,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](NC([C@H](OC)COS(=O)(O)=O)=O)CCC2=CC=C(O)C=C2)=O)C(N[C@@H](CCCCN)C(N[C@H]3CC[C@@H](O)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC4=CC=CC=C4)C(N1)=O)=O)C3=O)=O)=O)=O)C,"InChI=1S/C51H76N8O16S/c1-8-29(3)41-51(69)75-31(5)42(57-45(63)36(23-20-32-18-21-34(60)22-19-32)53-47(65)39(73-7)28-74-76(70,71)72)48(66)54-35(17-13-14-26-52)44(62)55-37-24-25-40(61)59(49(37)67)43(30(4)9-2)50(68)58(6)38(46(64)56-41)27-33-15-11-10-12-16-33/h10-12,15-16,18-19,21-22,29-31,35-43,60-61H,8-9,13-14,17,20,23-28,52H2,1-7H3,(H,53,65)(H,54,66)(H,55,62)(H,56,64)(H,57,63)(H,70,71,72)/t29-,30+,31-,35-,36+,37-,38-,39+,40+,41-,42-,43+/m0/s1",XIRMQYOQMRLRBE-OXMFHIGUSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 596
CyanoMetDB_0442,Cyanopeptolin 1034,"Cyanopeptolin 1034A, Cyanopeptolin 1034B",Cyanopeptolin,,C53H78N8O13,1034.568835,O=C(NC(CCCCN)C(NC1C(N(C(C(N(C(C(NC2C(CC)C)=O)CC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)C(C(OC2=O)C)NC(C(CCC(O)=O)NC(CCCCCCC)=O)=O,"InChI=1S/C53H78N8O13/c1-6-8-9-10-14-20-42(63)55-38(26-28-44(65)66)48(68)59-46-33(4)74-53(73)45(32(3)7-2)58-49(69)40(30-35-21-23-36(62)24-22-35)60(5)52(72)41(31-34-17-12-11-13-18-34)61-43(64)27-25-39(51(61)71)57-47(67)37(56-50(46)70)19-15-16-29-54/h11-13,17-18,21-24,32-33,37-41,43,45-46,62,64H,6-10,14-16,19-20,25-31,54H2,1-5H3,(H,55,63)(H,56,70)(H,57,67)(H,58,69)(H,59,68)(H,65,66)",VRDHHEHNPQTZLR-UHFFFAOYSA-N,146683912,no,n.a.,n.a.,n.a.
CyanoMetDB_0443,Micropeptin LH1062,,Cyanopeptolin,Micropeptin,C53H78N10O13,1062.574983,CCCCCCCC(N[C@H](C(NC1C(C)OC([C@H](C(C)C)NC([C@@H](CC2=CC=C(O)C=C2)N(C)C([C@@H](CC3=CC=CC=C3)N4[C@@H](O)CC[C@@H](NC([C@@H](CCC/N=C(N)\N)NC1=O)=O)C4=O)=O)=O)=O)=O)CCC(OC)=O)=O,"InChI=1S/C53H78N10O13/c1-7-8-9-10-14-19-41(65)57-37(25-27-43(67)75-6)47(69)61-45-32(4)76-52(74)44(31(2)3)60-48(70)39(29-34-20-22-35(64)23-21-34)62(5)51(73)40(30-33-16-12-11-13-17-33)63-42(66)26-24-38(50(63)72)59-46(68)36(58-49(45)71)18-15-28-56-53(54)55/h11-13,16-17,20-23,31-32,36-40,42,44-45,64,66H,7-10,14-15,18-19,24-30H2,1-6H3,(H,57,65)(H,58,71)(H,59,68)(H,60,70)(H,61,69)(H4,54,55,56)/t32?,36-,37+,38-,39-,40-,42+,44+,45?/m1/s1",GBJLMUFWWICUPN-KVDCAQDBSA-N,,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0444,Oscillapeptin G,,Cyanopeptolin,,C53H77N9O17,1111.543742,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@@H](NC(C(NC([C@@H](O)CO)=O)CCC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@@H](CC(C)C)C(N[C@H]3CC[C@@H](O)N([C@H]([C@@H](O)C)C(N(C)[C@@H](CC4=CC=C(O)C=C4)C(N1)=O)=O)C3=O)=O)=O)=O)C,"InChI=1S/C53H77N9O17/c1-8-27(4)42-53(78)79-29(6)43(60-46(71)35(19-21-40(54)68)55-45(70)34(56-49(74)39(67)25-63)18-13-30-9-14-32(65)15-10-30)50(75)58-37(23-26(2)3)47(72)57-36-20-22-41(69)62(51(36)76)44(28(5)64)52(77)61(7)38(48(73)59-42)24-31-11-16-33(66)17-12-31/h9-12,14-17,26-29,34-39,41-44,63-67,69H,8,13,18-25H2,1-7H3,(H2,54,68)(H,55,70)(H,56,74)(H,57,72)(H,58,75)(H,59,73)(H,60,71)/t27-,28-,29-,34?,35-,36-,37-,38-,39-,41+,42-,43-,44+/m0/s1",QLOMTVNWPCVFDT-OWUVMXICSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 610 = CCAP 1 459/22 = NIVA CYA 18
CyanoMetDB_0445,Cyanopeptolin 1063,,Cyanopeptolin,,C53H77N9O14,1063.558998,O=C(NC(CC1=CC=C(O)C=C1)C(NC2C(N(C(C(N(C(C(NC3C(C)CC)=O)CC4=CC=C(O)C=C4)C)=O)C(C)CC)C(O)CC2)=O)=O)C(C(OC3=O)C)NC(C(CCC(N)=O)NC(C(NC(C)=O)CC(C)C)=O)=O,"InChI=1S/C53H77N9O14/c1-10-28(5)43-53(75)76-30(7)44(60-46(68)36(20-22-41(54)66)56-47(69)38(24-27(3)4)55-31(8)63)50(72)58-39(25-32-12-16-34(64)17-13-32)48(70)57-37-21-23-42(67)62(51(37)73)45(29(6)11-2)52(74)61(9)40(49(71)59-43)26-33-14-18-35(65)19-15-33/h12-19,27-30,36-40,42-45,64-65,67H,10-11,20-26H2,1-9H3,(H2,54,66)(H,55,63)(H,56,69)(H,57,70)(H,58,72)(H,59,71)(H,60,68)",BPRXDBUQWPHHSG-UHFFFAOYSA-N,146683913,no,n.a.,n.a.,n.a.
CyanoMetDB_0446,Cyanopeptolin 1068,Cyanopeptolin 1068 MB,Cyanopeptolin,,C53H77ClN8O13,1068.529862,O=C(NC(CCCCN(C)C)C(NC1C(N(C(C(N(C(C(NC2C(C)CC)=O)CC3=CC(Cl)=C(O)C=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)C(C(OC2=O)C)NC(C(CCC(O)=O)NC(CCCCC)=O)=O,"InChI=1S/C53H77ClN8O13/c1-8-10-12-20-42(64)55-37(23-26-44(66)67)48(69)59-46-32(4)75-53(74)45(31(3)9-2)58-49(70)39(30-34-21-24-41(63)35(54)28-34)61(7)52(73)40(29-33-17-13-11-14-18-33)62-43(65)25-22-38(51(62)72)57-47(68)36(56-50(46)71)19-15-16-27-60(5)6/h11,13-14,17-18,21,24,28,31-32,36-40,43,45-46,63,65H,8-10,12,15-16,19-20,22-23,25-27,29-30H2,1-7H3,(H,55,64)(H,56,71)(H,57,68)(H,58,70)(H,59,69)(H,66,67)",CUDZGXXIBRAWAU-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,n.a.
CyanoMetDB_0447,Oscillapeptilide 97A,Oscillapeptilide 97-A,Cyanopeptolin,Oscillapeptilide,C53H75N9O13,1045.548434,C[C@@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)[C@H](C(N([C@H](C(N[C@@H]([C@@H](CC)C)C1=O)=O)CC(C=C3)=CC=C3OC)C)=O)CC4=CC=CC=C4)=O)=O)CC(C)C)=O)NC([C@H](CCC(N)=O)NC([C@H]5N(CCC5)C(C)=O)=O)=O,"InChI=1S/C53H75N9O13/c1-9-30(4)44-53(73)75-31(5)45(59-46(66)36(21-23-42(54)64)55-48(68)39-16-13-25-61(39)32(6)63)50(70)57-38(26-29(2)3)47(67)56-37-22-24-43(65)62(51(37)71)41(28-33-14-11-10-12-15-33)52(72)60(7)40(49(69)58-44)27-34-17-19-35(74-8)20-18-34/h10-12,14-15,17-20,29-31,36-41,43-45,65H,9,13,16,21-28H2,1-8H3,(H2,54,64)(H,55,68)(H,56,67)(H,57,70)(H,58,69)(H,59,66)/t30-,31-,36+,37+,38+,39+,40+,41+,43-,44+,45+/m1/s1",FQTOZJUPMXZERB-MBRIYKRMSA-N,,yes,Oscillatoria/Planktothrix,agardhii,strain   97
CyanoMetDB_0448,Oscillapeptide 97A,,other cyclic peptide,other cyclic depsipeptide,C53H75N9O13,1045.548434,CC(N1[C@H](C(N[C@@H](CCC(N)=O)C(N[C@@H]2C(N[C@H](C(N[C@@H]3C(N([C@@H](CC4=CC=CC=C4)C(N(C)[C@H](C(N[C@H](C(O[C@@H]2C)=O)[C@H](CC)C)=O)CC5=CC=C(OC)C=C5)=O)[C@H](O)CC3)=O)=O)CC(C)C)=O)=O)=O)CCC1)=O,"InChI=1S/C53H75N9O13/c1-9-30(4)44-53(73)75-31(5)45(59-46(66)36(21-23-42(54)64)55-48(68)39-16-13-25-61(39)32(6)63)50(70)57-38(26-29(2)3)47(67)56-37-22-24-43(65)62(51(37)71)41(28-33-14-11-10-12-15-33)52(72)60(7)40(49(69)58-44)27-34-17-19-35(74-8)20-18-34/h10-12,14-15,17-20,29-31,36-41,43-45,65H,9,13,16,21-28H2,1-8H3,(H2,54,64)(H,55,68)(H,56,67)(H,57,70)(H,58,69)(H,59,66)/t30-,31+,36-,37-,38-,39-,40-,41-,43+,44-,45-/m0/s1",FQTOZJUPMXZERB-HYOFZHFKSA-N,15885028,yes,Oscillatoria/Planktothrix,agardhii,n.a.
CyanoMetDB_0449,Micropeptin 88B,,Cyanopeptolin,Micropeptin,C53H74N8O16,1078.522278,C[C@H](OC([C@H]([C@H](CC)C)NC([C@H](CC1=CC=CC=C1)N(C)C([C@H](C(C)C)N2C([C@H](CC[C@H]2O)NC3=O)=O)=O)=O)=O)[C@H](NC(CC[C@@H](C(O)=O)NC([C@H](CC4=CC=C(C=C4)O)NC(CCC)=O)=O)=O)C(N[C@H]3CCC(O)=O)=O,"InChI=1S/C53H74N8O16/c1-8-13-39(63)54-37(26-32-16-18-33(62)19-17-32)47(69)57-36(52(74)75)20-23-40(64)58-44-30(6)77-53(76)43(29(5)9-2)59-48(70)38(27-31-14-11-10-12-15-31)60(7)51(73)45(28(3)4)61-41(65)24-21-35(50(61)72)56-46(68)34(55-49(44)71)22-25-42(66)67/h10-12,14-19,28-30,34-38,41,43-45,62,65H,8-9,13,20-27H2,1-7H3,(H,54,63)(H,55,71)(H,56,68)(H,57,69)(H,58,64)(H,59,70)(H,66,67)(H,74,75)/t29-,30-,34-,35-,36-,37-,38-,41+,43-,44-,45-/m0/s1",YCVYNQFZZBCUTC-PIUARTGTSA-N,,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0450,Micropeptin KB1046,,Cyanopeptolin,Micropeptin,C53H74N8O14,1046.532449,O=C([C@@H](NC([C@@H](CCC(N)=O)NC(C(O)CC1=CC=C(O)C=C1)=O)=O)[C@H](C)OC2=O)N[C@H](C(N[C@@H]3C([N@]([C@@H](CC3)O)[C@@H](C(C)C)C(N(C)[C@@H](CC4=CC=CC=C4)C(N[C@H]2[C@@H](C)CC)=O)=O)=O)=O)CC5CCC(O)C=C5,"InChI=1S/C53H74N8O14/c1-7-29(4)43-53(74)75-30(5)44(59-46(67)36(21-23-41(54)65)55-49(70)40(64)27-33-15-19-35(63)20-16-33)50(71)57-38(25-32-13-17-34(62)18-14-32)47(68)56-37-22-24-42(66)61(51(37)72)45(28(2)3)52(73)60(6)39(48(69)58-43)26-31-11-9-8-10-12-31/h8-13,15-17,19-20,28-30,32,34,36-40,42-45,62-64,66H,7,14,18,21-27H2,1-6H3,(H2,54,65)(H,55,70)(H,56,68)(H,57,71)(H,58,69)(H,59,67)/t29-,30-,32?,34?,36+,37-,38-,39-,40?,42+,43-,44-,45-/m0/s1",BWJMWVYLIXGGQH-AIALULLUSA-N,146683760,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0451,Micropeptin KR1030,,Cyanopeptolin,Micropeptin,C53H74N8O13,1030.537534,CCCCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC5CCC(O)C=C5)NC1=O)=O)C4=O)=O)=O)=O)=O)CCC(N)=O)=O,"InChI=1S/C53H74N8O13/c1-6-7-9-14-43(65)55-37(23-25-42(54)64)47(67)59-46-31(4)74-53(73)45(30(2)3)58-49(69)40(28-34-17-21-36(63)22-18-34)60(5)52(72)41(29-32-12-10-8-11-13-32)61-44(66)26-24-38(51(61)71)56-48(68)39(57-50(46)70)27-33-15-19-35(62)20-16-33/h8,10-13,15,17-19,21-22,30-31,33,35,37-41,44-46,62-63,66H,6-7,9,14,16,20,23-29H2,1-5H3,(H2,54,64)(H,55,65)(H,56,68)(H,57,70)(H,58,69)(H,59,67)/t31-,33?,35?,37-,38-,39-,40-,41-,44+,45-,46-/m0/s1",DJXQTLGWCRRMJY-GPTLJAKDSA-N,146683624,yes,Microcystis,aeruginosa,TAU IL-40
CyanoMetDB_0452,Kulokekahilide 1,,other cyclic peptide,other cyclic depsipeptide,C53H74N6O10,954.5466426,CCC[C@@H]1[C@H](C)C(O[C@H](CC2=CC=CC=C2)C(N3CCC[C@@H]3C(O[C@H](C(C)C)C(N(C)[C@@H](C(C)C)C(N4CCC[C@@H]4C(N[C@H]([C@H](CC5=CC=CC=C5)C)C(N6CCC[C@@H]6C(N1)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C53H74N6O10/c1-9-19-38-35(7)52(66)68-42(31-37-22-14-11-15-23-37)48(62)59-29-18-26-41(59)53(67)69-45(33(4)5)51(65)56(8)44(32(2)3)50(64)58-28-17-25-40(58)47(61)55-43(34(6)30-36-20-12-10-13-21-36)49(63)57-27-16-24-39(57)46(60)54-38/h10-15,20-23,32-35,38-45H,9,16-19,24-31H2,1-8H3,(H,54,60)(H,55,61)/t34-,35-,38-,39+,40+,41+,42+,43+,44-,45+/m1/s1",HEQFVTIDWBACAH-MGRSABLUSA-N,10486059,yes,n.a.,n.a.,n.a.
CyanoMetDB_0453,Micropeptin TR1058,,Cyanopeptolin,Micropeptin,C53H70N8O15,1058.496064,C[C@H]1[C@H](NC([C@@H](NC([C@H](O)CC2=CC=C(O)C=C2)=O)CC3=CC=C(O)C=C3)=O)C(N[C@@H](CCC(N)=O)C(N[C@H]4CC[C@@H](O)N([C@@H](CC(C)C)C(N(C)[C@@H](CC5=CC=C(O)C=C5)C(N[C@@H](C(C)C)C(O1)=O)=O)=O)C4=O)=O)=O,"InChI=1S/C53H70N8O15/c1-27(2)23-40-52(74)60(6)39(25-31-9-15-34(63)16-10-31)48(70)58-44(28(3)4)53(75)76-29(5)45(50(72)55-36(19-21-42(54)66)46(68)56-37-20-22-43(67)61(40)51(37)73)59-47(69)38(24-30-7-13-33(62)14-8-30)57-49(71)41(65)26-32-11-17-35(64)18-12-32/h7-18,27-29,36-41,43-45,62-65,67H,19-26H2,1-6H3,(H2,54,66)(H,55,72)(H,56,68)(H,57,71)(H,58,70)(H,59,69)/t29-,36-,37-,38-,39-,40-,41+,43+,44-,45-/m0/s1",OYZCQQLGGJQPJU-ACXDUPKJSA-N,139590549,yes,Microcystis,n.a.,TAU  IL-428
CyanoMetDB_0454,Ichthyopeptin A,,Cyanopeptolin,,C53H70N8O14,1042.501149,CC[C@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](NC(C(O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@@H](CC3=CC=C(O)C=C3)C(N[C@H]4CC[C@@H](O)N([C@@H](C(C)C)C(N(C)C(CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C53H70N8O14/c1-7-29(4)43-53(74)75-30(5)44(59-46(67)36(21-23-41(54)65)55-49(70)40(64)27-33-15-19-35(63)20-16-33)50(71)57-38(25-32-13-17-34(62)18-14-32)47(68)56-37-22-24-42(66)61(51(37)72)45(28(2)3)52(73)60(6)39(48(69)58-43)26-31-11-9-8-10-12-31/h8-20,28-30,36-40,42-45,62-64,66H,7,21-27H2,1-6H3,(H2,54,65)(H,55,70)(H,56,68)(H,57,71)(H,58,69)(H,59,67)/t29-,30+,36-,37+,38+,39?,40?,42-,43+,44+,45+/m1/s1",HUXQLCBYRTWEFS-GHUUQZFASA-N,,yes,Microcystis,ichthyoblabe,BM Mi/13
CyanoMetDB_0455,Micropeptin KT1042,,Cyanopeptolin,Micropeptin,C53H70N8O14,1042.501149,CC[C@H]([C@@H]1C(N(C)[C@@H](CC2=CC=CC=C2)C(N[C@@H](C(C)C)C(O[C@@H](C)[C@H](NC([C@H](NC([C@H](O)CC3=CC=C(O)C=C3)=O)CCC(N)=O)=O)C(N[C@@H](CC4=CC=C(O)C=C4)C(N[C@H]5CC[C@@H](O)[N@@]1C5=O)=O)=O)=O)=O)=O)C,"InChI=1S/C53H70N8O14/c1-7-29(4)45-52(73)60(6)39(26-31-11-9-8-10-12-31)48(69)58-43(28(2)3)53(74)75-30(5)44(59-46(67)36(21-23-41(54)65)55-49(70)40(64)27-33-15-19-35(63)20-16-33)50(71)57-38(25-32-13-17-34(62)18-14-32)47(68)56-37-22-24-42(66)61(45)51(37)72/h8-20,28-30,36-40,42-45,62-64,66H,7,21-27H2,1-6H3,(H2,54,65)(H,55,70)(H,56,68)(H,57,71)(H,58,69)(H,59,67)/t29-,30+,36-,37+,38+,39+,40-,42-,43+,44+,45-/m1/s1",JRUSMDKOMMRBPY-AQDMRTBMSA-N,,yes,Microcystis,aeruginosa,TAU IL-347
CyanoMetDB_0456,Micropeptin C,,Cyanopeptolin,Micropeptin,C53H69N7O14,1027.49025,CCCCCC(N[C@H](C(N[C@H]1[C@@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC5=CC=C(O)C=C5)NC1=O)=O)C4=O)=O)=O)=O)=O)CCC(O)=O)=O,"InChI=1S/C53H69N7O14/c1-6-7-9-14-42(63)54-37(24-26-44(65)66)47(67)58-46-31(4)74-53(73)45(30(2)3)57-49(69)40(28-34-17-21-36(62)22-18-34)59(5)52(72)41(29-32-12-10-8-11-13-32)60-43(64)25-23-38(51(60)71)55-48(68)39(56-50(46)70)27-33-15-19-35(61)20-16-33/h8,10-13,15-22,30-31,37-41,43,45-46,61-62,64H,6-7,9,14,23-29H2,1-5H3,(H,54,63)(H,55,68)(H,56,70)(H,57,69)(H,58,67)(H,65,66)/t31-,37+,38+,39+,40+,41+,43-,45+,46+/m1/s1",IXBOOEYQWFLNRB-XZZJZNPNSA-N,42638462,yes,Microcystis,aeruginosa,NIES 100
CyanoMetDB_0457,Cyanopeptolin CP1027,CP 1027,Cyanopeptolin,,C53H69N7O14,1027.49025,O=C(NC(C(NC(C(NC(CC1=CC=C(O)C=C1)C(NC2C(N(C(C(N(C(C(NC3C(C)C)=O)CCC4=CC=C(O)C=C4)C)=O)CC5=CC=CC=C5)C(O)CC2)=O)=O)=O)C(OC3=O)C)=O)CC(O)=O)CCCCC,"InChI=1S/C53H69N7O14/c1-6-7-9-14-42(64)54-39(28-43(65)66)49(69)58-45-31(4)74-52(72)44(30(2)3)57-50(70)40(25-19-32-15-20-35(61)21-16-32)59(5)53(73)60(29-34-12-10-8-11-13-34)46-41(63)26-24-37(47(46)67)55-48(68)38(56-51(45)71)27-33-17-22-36(62)23-18-33/h8,10-13,15-18,20-23,30-31,37-41,44-46,61-63H,6-7,9,14,19,24-29H2,1-5H3,(H,54,64)(H,55,68)(H,56,71)(H,57,70)(H,58,69)(H,65,66)",LJHPKJNLVFAGNP-UHFFFAOYSA-N,,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0458,Lyngbyastatin 4,,other cyclic peptide,Lyngbya toxin (depsipeptide),C53H68N8O18S,1136.437229,C/C=C\1/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](CCC3=CC=C(C=C3)O)NC(=O)[C@H](C)NC(=O)[C@@H](COS(=O)(=O)O)O)C)C(C)C)CC4=CC=C(C=C4)O)C)CC5=CC=CC=C5)O,"InChI=1S/C53H68N8O18S/c1-7-36-46(67)57-38-23-24-42(65)61(51(38)72)40(26-32-11-9-8-10-12-32)52(73)60(6)39(25-33-15-20-35(63)21-16-33)48(69)58-43(28(2)3)53(74)79-30(5)44(50(71)55-36)59-47(68)37(22-17-31-13-18-34(62)19-14-31)56-45(66)29(4)54-49(70)41(64)27-78-80(75,76)77/h7-16,18-21,28-30,37-44,62-65H,17,22-27H2,1-6H3,(H,54,70)(H,55,71)(H,56,66)(H,57,67)(H,58,69)(H,59,68)(H,75,76,77)/b36-7-/t29-,30+,37-,38-,39-,40-,41+,42+,43-,44-/m0/s1",QVBXBGIPSMEBEL-RNXFLSOQSA-N,16104920,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0459,Lyngbyastatin 5,,other cyclic peptide,Lyngbya toxin (depsipeptide),C53H68N8O15,1056.480414,C/C=C\1/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](CCC3=CC=C(C=C3)O)NC(=O)[C@H](C)NC(=O)[C@@H](CO)O)C)C(C)C)CC4=CC=C(C=C4)O)C)CC5=CC=CC=C5)O,"InChI=1S/C53H68N8O15/c1-7-36-46(68)57-38-23-24-42(66)61(51(38)73)40(26-32-11-9-8-10-12-32)52(74)60(6)39(25-33-15-20-35(64)21-16-33)48(70)58-43(28(2)3)53(75)76-30(5)44(50(72)55-36)59-47(69)37(22-17-31-13-18-34(63)19-14-31)56-45(67)29(4)54-49(71)41(65)27-62/h7-16,18-21,28-30,37-44,62-66H,17,22-27H2,1-6H3,(H,54,71)(H,55,72)(H,56,67)(H,57,68)(H,58,70)(H,59,69)/b36-7-/t29-,30+,37-,38-,39-,40-,41+,42+,43-,44-/m0/s1",KKTKZTTVMLKFOE-RNXFLSOQSA-N,23657136,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0460,Wewakpeptin B,,other cyclic peptide,Wewakpeptin,C52H89N7O11,987.6620067,CCCCC[C@@H]1C(C(=O)N[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)O1)C(C)C)C(C)C)C(C)C)C)C(C)C)C)C)C)[C@@H](C)CC)(C)C,"InChI=1S/C52H89N7O11/c1-18-20-21-26-37-52(13,14)51(68)54-39(33(11)19-2)46(63)55(15)34(12)44(61)56(16)40(30(5)6)47(64)57(17)41(31(7)8)50(67)70-42(32(9)10)48(65)59-28-23-25-36(59)45(62)58-27-22-24-35(58)43(60)53-38(29(3)4)49(66)69-37/h29-42H,18-28H2,1-17H3,(H,53,60)(H,54,68)/t33-,34-,35-,36-,37+,38-,39-,40-,41-,42-/m0/s1",BMHUXRHQCDUIBJ-RCNMYSQZSA-N,11423228,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0461,Wewakpeptin A,,other cyclic peptide,Wewakpeptin,C52H85N7O11,983.6307066,CC[C@H](C)[C@H]1C(=O)N([C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)O[C@@H](C(C(=O)N1)(C)C)CCCC#C)C(C)C)C(C)C)C(C)C)C)C(C)C)C)C)C,"InChI=1S/C52H85N7O11/c1-18-20-21-26-37-52(13,14)51(68)54-39(33(11)19-2)46(63)55(15)34(12)44(61)56(16)40(30(5)6)47(64)57(17)41(31(7)8)50(67)70-42(32(9)10)48(65)59-28-23-25-36(59)45(62)58-27-22-24-35(58)43(60)53-38(29(3)4)49(66)69-37/h1,29-42H,19-28H2,2-17H3,(H,53,60)(H,54,68)/t33-,34-,35-,36-,37+,38-,39-,40-,41-,42-/m0/s1",ZADWIGJGAWOIKB-RCNMYSQZSA-N,11205367,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0462,Lyngbyastatin 3,,other cyclic peptide,Lyngbya toxin (depsipeptide),C52H84N8O12,1012.62087,CCC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)NCC(=O)N([C@H](C(=O)NCC(=O)N([C@H](C(=O)N([C@H](C(=O)NC(C(=O)C(C(=O)N([C@H](C(=O)N1)C)C)(C)C)C)CC2=CC=C(C=C2)OC)C)C(C)C)C)CC(C)C)C)[C@@H](C)CC)C,"InChI=1S/C52H84N8O12/c1-18-20-37-32(8)50(69)72-43(31(7)19-2)48(67)54-27-40(61)58(14)38(25-29(3)4)46(65)53-28-41(62)60(16)42(30(5)6)49(68)59(15)39(26-35-21-23-36(71-17)24-22-35)47(66)55-33(9)44(63)52(11,12)51(70)57(13)34(10)45(64)56-37/h21-24,29-34,37-39,42-43H,18-20,25-28H2,1-17H3,(H,53,65)(H,54,67)(H,55,66)(H,56,64)/t31-,32-,33?,34-,37+,38-,39-,42-,43-/m0/s1",BNVLXJXRCARHAN-KJYYPGTOSA-N,44246697,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0463,Apramide C,,other linear peptide,,C52H82N8O8S,978.5976328,C[C@H](CCCCC=C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N(C)CC3=NC=CS3,"InChI=1S/C52H82N8O8S/c1-17-18-19-20-22-36(8)46(61)55(11)37(9)47(62)57(13)45(35(6)7)52(67)60-29-21-23-40(60)49(64)58(14)44(34(4)5)51(66)59(15)43(33(2)3)50(65)56(12)41(31-38-24-26-39(68-16)27-25-38)48(63)54(10)32-42-53-28-30-69-42/h17,24-28,30,33-37,40-41,43-45H,1,18-23,29,31-32H2,2-16H3/t36-,37+,40+,41+,43+,44+,45+/m1/s1",JKGGQCDMVBBAKM-RBFNLMEMSA-N,10843605,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0464,Scyptolin B,,Cyanopeptolin,,C52H80ClN9O16,1121.541155,CCCC(N[C@@H](C(NC(C(N[C@@H]1[C@@H](C)OC([C@@H](C(C)C)NC([C@H](CC2=CC(Cl)=C(O)C=C2)N(C)C([C@H]([C@H](O)C)N3[C@@H](O)CC[C@H](NC([C@H](CC(C)C)NC1=O)=O)C3=O)=O)=O)=O)=O)C(OC([C@@H](NC(CCC)=O)C)=O)C)=O)C)=O,"InChI=1S/C52H80ClN9O16/c1-13-15-37(65)54-26(7)44(68)59-42(29(10)77-51(75)27(8)55-38(66)16-14-2)48(72)60-41-30(11)78-52(76)40(25(5)6)58-46(70)35(23-31-17-19-36(64)32(53)22-31)61(12)50(74)43(28(9)63)62-39(67)20-18-33(49(62)73)56-45(69)34(21-24(3)4)57-47(41)71/h17,19,22,24-30,33-35,39-43,63-64,67H,13-16,18,20-21,23H2,1-12H3,(H,54,65)(H,55,66)(H,56,69)(H,57,71)(H,58,70)(H,59,68)(H,60,72)/t26-,27+,28-,29?,30-,33+,34+,35+,39+,40-,41-,42?,43+/m1/s1",KEOLGCFLKHISHR-NFSIXUBXSA-N,,yes,Scytonema,hofmannii ,PCC 7110
CyanoMetDB_0465,Apramide A,,other linear peptide,,C52H80N8O8S,976.5819827,C[C@H](CCCCC#C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N(C)CC3=NC=CS3,"InChI=1S/C52H80N8O8S/c1-17-18-19-20-22-36(8)46(61)55(11)37(9)47(62)57(13)45(35(6)7)52(67)60-29-21-23-40(60)49(64)58(14)44(34(4)5)51(66)59(15)43(33(2)3)50(65)56(12)41(31-38-24-26-39(68-16)27-25-38)48(63)54(10)32-42-53-28-30-69-42/h1,24-28,30,33-37,40-41,43-45H,18-23,29,31-32H2,2-16H3/t36-,37+,40+,41+,43+,44+,45+/m1/s1",DFHDGRZCTHONRC-RBFNLMEMSA-N,10653516,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0466,Micropeptin LH1048,,Cyanopeptolin,Micropeptin,C52H76N10O13,1048.559333,CCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCN=C(N)N)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C52H76N10O13/c1-6-7-8-9-13-18-40(64)56-36(24-26-42(66)67)46(69)60-44-31(4)75-51(74)43(30(2)3)59-47(70)38(28-33-19-21-34(63)22-20-33)61(5)50(73)39(29-32-15-11-10-12-16-32)62-41(65)25-23-37(49(62)72)58-45(68)35(57-48(44)71)17-14-27-55-52(53)54/h10-12,15-16,19-22,30-31,35-39,41,43-44,63,65H,6-9,13-14,17-18,23-29H2,1-5H3,(H,56,64)(H,57,71)(H,58,68)(H,59,70)(H,60,69)(H,66,67)(H4,53,54,55)/t31-,35+,36+,37+,38+,39+,41-,43+,44+/m1/s1",CUCYHZCOKFGZNB-ZPBSQBHBSA-N,73054342,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0467,Cyanopeptolin CP1048,CP1048,Cyanopeptolin,,C52H76N10O13,1048.559333,O=C(NC(C(NC(C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CCC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)=O)C(OC2=O)C)=O)CC(O)=O)CCCCCCC,"InChI=1S/C52H76N10O13/c1-6-7-8-9-13-18-40(64)56-37(29-42(66)67)46(69)60-44-31(4)75-51(74)43(30(2)3)59-47(70)38(25-21-32-19-22-34(63)23-20-32)61(5)50(73)39(28-33-15-11-10-12-16-33)62-41(65)26-24-36(49(62)72)58-45(68)35(57-48(44)71)17-14-27-55-52(53)54/h10-12,15-16,19-20,22-23,30-31,35-39,41,43-44,63,65H,6-9,13-14,17-18,21,24-29H2,1-5H3,(H,56,64)(H,57,71)(H,58,68)(H,59,70)(H,60,69)(H,66,67)(H4,53,54,55)",VYXPXPDSGOMRCH-UHFFFAOYSA-N,146684844,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0468,Micropeptin F,,Cyanopeptolin,Micropeptin,C52H75N7O14,1021.5372,O=C(N[C@H](C(N[C@H]1[C@@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC(C)C)N3[C@H](O)CC[C@H](NC([C@H](CC4=CC=C(O)C=C4)NC1=O)=O)C3=O)=O)=O)=O)=O)CCC(O)=O)CCCCCCC,"InChI=1S/C52H75N7O14/c1-8-9-10-11-12-13-41(62)53-36(23-25-43(64)65)46(66)57-45-31(6)73-52(72)44(30(4)5)56-48(68)39(28-33-16-20-35(61)21-17-33)58(7)51(71)40(26-29(2)3)59-42(63)24-22-37(50(59)70)54-47(67)38(55-49(45)69)27-32-14-18-34(60)19-15-32/h14-21,29-31,36-40,42,44-45,60-61,63H,8-13,22-28H2,1-7H3,(H,53,62)(H,54,67)(H,55,69)(H,56,68)(H,57,66)(H,64,65)/t31-,36+,37+,38+,39+,40+,42-,44+,45+/m1/s1",LDXXBAHTNLNWIZ-WXCLYRHNSA-N,42638301,yes,Microcystis,aeruginosa,NIES 100
CyanoMetDB_0469,Cyanopeptolin 1054 MB2,Cyanopeptolin 1054B,Cyanopeptolin,,C52H75ClN8O13,1054.514212,OC1N(C(CC2=CC=CC=C2)C(N(C)C(CC3=CC(Cl)=C(O)C=C3)C(NC(C(O4)=O)C(C)CC)=O)=O)C(C(NC(C(CCCCNC)NC(C(NC(C(CCC(O)=O)NC(CCCCC)=O)=O)C4C)=O)=O)CC1)=O,"InChI=1S/C52H75ClN8O13/c1-7-9-11-19-41(63)55-36(22-25-43(65)66)47(68)59-45-31(4)74-52(73)44(30(3)8-2)58-48(69)38(29-33-20-23-40(62)34(53)27-33)60(6)51(72)39(28-32-16-12-10-13-17-32)61-42(64)24-21-37(50(61)71)57-46(67)35(56-49(45)70)18-14-15-26-54-5/h10,12-13,16-17,20,23,27,30-31,35-39,42,44-45,54,62,64H,7-9,11,14-15,18-19,21-22,24-26,28-29H2,1-6H3,(H,55,63)(H,56,70)(H,57,67)(H,58,69)(H,59,68)(H,65,66)",YXVIBMXDJZANBZ-UHFFFAOYSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0470,Symplostatin 2,,other cyclic peptide,other cyclic depsipeptide,C52H74N8O13S,1050.509606,CCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CCS(=O)C)C(=O)NC1C(OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2C(CC[C@@H](C2=O)NC(=O)/C(=C/C)/NC1=O)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C52H74N8O13S/c1-10-16-40(62)56-43(30(6)11-2)48(67)54-36(25-26-74(9)72)46(65)58-44-31(7)73-52(71)42(29(4)5)57-47(66)38(27-33-19-21-34(61)22-20-33)59(8)51(70)39(28-32-17-14-13-15-18-32)60-41(63)24-23-37(50(60)69)55-45(64)35(12-3)53-49(44)68/h12-15,17-22,29-31,36-39,41-44,61,63H,10-11,16,23-28H2,1-9H3,(H,53,68)(H,54,67)(H,55,64)(H,56,62)(H,57,66)(H,58,65)/b35-12-",ZXPCHASEFBWLAG-OHLKXVFMSA-N,,yes,Symploca,hydnoides,n.a.
CyanoMetDB_0471,L-Phe-D-MeAsp(?)-L-Arg-Adda-D-Glu(?)-Mdha-D-Ala-OH,,other linear peptide,,C52H74N10O13,1046.543682,C[C@@H](/C=C(\C)/C=C/[C@H]([C@H](C)C(=O)N[C@H](CCC(=O)O)C(=O)N(C)C(=C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(=O)OC)NC(=O)[C@H](CC1=CC=CC=C1)N)[C@H](CC2=CC=CC=C2)OC,"InChI=1S/C52H74N10O13/c1-30(26-31(2)42(74-7)28-36-18-13-10-14-19-36)21-22-38(32(3)45(66)60-40(23-24-43(63)64)50(71)62(6)34(5)46(67)57-33(4)51(72)73)58-48(69)39(20-15-25-56-52(54)55)59-49(70)41(29-44(65)75-8)61-47(68)37(53)27-35-16-11-9-12-17-35/h9-14,16-19,21-22,26,31-33,37-42H,5,15,20,23-25,27-29,53H2,1-4,6-8H3,(H,57,67)(H,58,69)(H,59,70)(H,60,66)(H,61,68)(H,63,64)(H,72,73)(H4,54,55,56)/b22-21+,30-26+/t31-,32-,33-,37-,38+,39-,40+,41+,42-/m0/s1",XRXBRZUIHOEFDK-VWLIMPBISA-N,139584257,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0472,Oscillapeptilide 97B,Oscillapeptilide 97-B,Cyanopeptolin,,C52H73N9O13,1031.532783,C[C@@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)[C@H](C(N([C@H](C(N[C@@H]([C@@H](CC)C)C1=O)=O)CC(C=C3)=CC=C3O)C)=O)CC4=CC=CC=C4)=O)=O)CC(C)C)=O)NC([C@H](CCC(N)=O)NC([C@H]5N(CCC5)C(C)=O)=O)=O,"InChI=1S/C52H73N9O13/c1-8-29(4)43-52(73)74-30(5)44(58-45(66)35(20-22-41(53)64)54-47(68)38-15-12-24-60(38)31(6)62)49(70)56-37(25-28(2)3)46(67)55-36-21-23-42(65)61(50(36)71)40(27-32-13-10-9-11-14-32)51(72)59(7)39(48(69)57-43)26-33-16-18-34(63)19-17-33/h9-11,13-14,16-19,28-30,35-40,42-44,63,65H,8,12,15,20-27H2,1-7H3,(H2,53,64)(H,54,68)(H,55,67)(H,56,70)(H,57,69)(H,58,66)/t29-,30-,35+,36+,37+,38+,39+,40+,42-,43+,44+/m1/s1",BBZTYFBGJBQEMN-JFONPDHOSA-N,,yes,Oscillatoria/Planktothrix,agardhii,strain   97
CyanoMetDB_0473,Oscillapeptide 97B,,other cyclic peptide,other cyclic depsipeptide,C52H73N9O13,1031.532783,CC(N1[C@H](C(N[C@@H](CCC(N)=O)C(N[C@@H]2C(N[C@H](C(N[C@@H]3C(N([C@@H](CC4=CC=CC=C4)C(N(C)[C@H](C(N[C@H](C(O[C@@H]2C)=O)[C@H](CC)C)=O)CC5=CC=C(O)C=C5)=O)[C@H](O)CC3)=O)=O)CC(C)C)=O)=O)=O)CCC1)=O,"InChI=1S/C52H73N9O13/c1-8-29(4)43-52(73)74-30(5)44(58-45(66)35(20-22-41(53)64)54-47(68)38-15-12-24-60(38)31(6)62)49(70)56-37(25-28(2)3)46(67)55-36-21-23-42(65)61(50(36)71)40(27-32-13-10-9-11-14-32)51(72)59(7)39(48(69)57-43)26-33-16-18-34(63)19-17-33/h9-11,13-14,16-19,28-30,35-40,42-44,63,65H,8,12,15,20-27H2,1-7H3,(H2,53,64)(H,54,68)(H,55,67)(H,56,70)(H,57,69)(H,58,66)/t29-,30+,35-,36-,37-,38-,39-,40-,42+,43-,44-/m0/s1",BBZTYFBGJBQEMN-CTNYBTECSA-N,15885029,yes,Oscillatoria/Planktothrix,agardhii,n.a.
CyanoMetDB_0474,Micropeptin T2,,Cyanopeptolin,Micropeptin,C52H73N9O12,1015.537869,CCCCCC(N[C@@H](CCC(O)=O)C(N[C@H](C(N[C@H](C(N[C@@H]1C(N([C@@H](CC1)O)[C@@H](CC2=CC=CC=C2)C(N3C)=O)=O)=O)CCCCN)=O)[C@@H](OC([C@H](C(C)C)NC([C@@H]3CC4=CNC5=C4C=CC=C5)=O)=O)C)=O)=O,"InChI=1S/C52H73N9O12/c1-6-7-9-21-41(62)55-37(23-25-43(64)65)47(67)59-45-31(4)73-52(72)44(30(2)3)58-48(68)39(28-33-29-54-35-19-13-12-18-34(33)35)60(5)51(71)40(27-32-16-10-8-11-17-32)61-42(63)24-22-38(50(61)70)57-46(66)36(56-49(45)69)20-14-15-26-53/h8,10-13,16-19,29-31,36-40,42,44-45,54,63H,6-7,9,14-15,20-28,53H2,1-5H3,(H,55,62)(H,56,69)(H,57,66)(H,58,68)(H,59,67)(H,64,65)/t31-,36-,37-,38-,39-,40-,42+,44-,45-/m0/s1",DZYIOZFQWKUHBQ-ZNOXHDIESA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0475,Aeruginopeptin 228B,,other cyclic peptide,Aeruginopeptin,C52H72N8O15,1048.511714,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@@H](CC3C=CC(O)CC3)C(N[C@H]4CC[C@@H](O)N([C@@H]([C@H](O)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C52H72N8O15/c1-6-27(2)42-52(74)75-29(4)43(58-45(67)35(20-22-40(53)65)54-48(70)39(64)26-32-14-18-34(63)19-15-32)49(71)56-37(24-31-12-16-33(62)17-13-31)46(68)55-36-21-23-41(66)60(50(36)72)44(28(3)61)51(73)59(5)38(47(69)57-42)25-30-10-8-7-9-11-30/h7-12,14-16,18-19,27-29,31,33,35-39,41-44,61-64,66H,6,13,17,20-26H2,1-5H3,(H2,53,65)(H,54,70)(H,55,68)(H,56,71)(H,57,69)(H,58,67)/t27-,28+,29-,31?,33?,35?,36-,37-,38-,39?,41+,42-,43-,44-/m0/s1",NPFMRWVLZMWWHA-ZEOJLTFGSA-N,,yes,Microcystis,aeruginosa,TAC 954; M2285
CyanoMetDB_0476,Micropeptin 103,,Cyanopeptolin,Micropeptin,C52H72N10O13,1044.528032,C[C@@H]1OC([C@@H](NC([C@@H](N(C([C@@H](N2C([C@H](CC[C@H]2O)NC([C@@H](NC([C@H]1NC([C@@H](NC(CNC(CCCCC)=O)=O)[C@H](O)C)=O)=O)CCC(N)=O)=O)=O)CC3=CC=CC=C3)=O)C)CC4=CNC5=CC=CC=C45)=O)C(C)C)=O,"InChI=1S/C52H72N10O13/c1-7-8-10-19-40(65)55-27-41(66)58-44(29(4)63)48(70)60-45-30(5)75-52(74)43(28(2)3)59-47(69)37(25-32-26-54-34-18-14-13-17-33(32)34)61(6)51(73)38(24-31-15-11-9-12-16-31)62-42(67)23-21-36(50(62)72)57-46(68)35(56-49(45)71)20-22-39(53)64/h9,11-18,26,28-30,35-38,42-45,54,63,67H,7-8,10,19-25,27H2,1-6H3,(H2,53,64)(H,55,65)(H,56,71)(H,57,68)(H,58,66)(H,59,69)(H,60,70)/t29-,30+,35+,36+,37+,38+,42-,43+,44+,45+/m1/s1",VREBHIIBSKFJFH-OAYDWUBUSA-N,,yes,Microcystis,viridis,NIES 103
CyanoMetDB_0477,Aeruginopeptin 228A,,other cyclic peptide,Aeruginopeptin,C52H68N8O15,1044.480414,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@@H](CC3=CC=C(O)C=C3)C(N[C@H]4CC[C@@H](O)N([C@@H]([C@H](O)C)C(N(C)[C@@H](CC5=CC=CC=C5)C(N1)=O)=O)C4=O)=O)=O)=O)C,"InChI=1S/C52H68N8O15/c1-6-27(2)42-52(74)75-29(4)43(58-45(67)35(20-22-40(53)65)54-48(70)39(64)26-32-14-18-34(63)19-15-32)49(71)56-37(24-31-12-16-33(62)17-13-31)46(68)55-36-21-23-41(66)60(50(36)72)44(28(3)61)51(73)59(5)38(47(69)57-42)25-30-10-8-7-9-11-30/h7-19,27-29,35-39,41-44,61-64,66H,6,20-26H2,1-5H3,(H2,53,65)(H,54,70)(H,55,68)(H,56,71)(H,57,69)(H,58,67)/t27-,28+,29-,35?,36-,37-,38-,39?,41+,42-,43-,44-/m0/s1",UXBXSFBQJFREKB-KUQNXYTCSA-N,,yes,Microcystis,aeruginosa,TAC 954; M2285
CyanoMetDB_0478,Micropeptin 996,,Cyanopeptolin,,C52H68N8O12,996.4956697,CCCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCC3=CC=C(C=C3)O)O)CC4=CC=CC=C4)C)CC5=CC=CC=C5)C(C)C)C,"InChI=1S/C52H68N8O12/c1-6-13-42(63)54-36(24-26-41(53)62)47(66)58-45-31(4)72-52(71)44(30(2)3)57-48(67)39(28-33-14-9-7-10-15-33)59(5)51(70)40(29-34-16-11-8-12-17-34)60-43(64)27-25-38(50(60)69)56-46(65)37(55-49(45)68)23-20-32-18-21-35(61)22-19-32/h7-12,14-19,21-22,30-31,36-40,43-45,61,64H,6,13,20,23-29H2,1-5H3,(H2,53,62)(H,54,63)(H,55,68)(H,56,65)(H,57,67)(H,58,66)/t31-,36+,37+,38+,39+,40+,43-,44+,45+/m1/s1",FVNMXCKUDZBKTO-NUOSYCILSA-N,139591234,yes,Microcystis,aeruginosa ,UTEX LB2386
CyanoMetDB_0479,Cyanopeptolin CP1013,CP 1013,Cyanopeptolin,,C52H67N7O14,1013.4746,O=C(NC(C(NC(C(NC(CC1=CC=C(O)C=C1)C(NC2C(N(C(C(N(C(C(NC3C(C)C)=O)CC4=CC=C(O)C=C4)C)=O)CC5=CC=CC=C5)C(O)CC2)=O)=O)=O)C(OC3=O)C)=O)CC(O)=O)CCCCC,"InChI=1S/C52H67N7O14/c1-6-7-9-14-41(63)53-38(27-42(64)65)48(68)57-44-30(4)73-51(71)43(29(2)3)56-49(69)39(26-32-17-21-35(61)22-18-32)58(5)52(72)59(28-33-12-10-8-11-13-33)45-40(62)24-23-36(46(45)66)54-47(67)37(55-50(44)70)25-31-15-19-34(60)20-16-31/h8,10-13,15-22,29-30,36-40,43-45,60-62H,6-7,9,14,23-28H2,1-5H3,(H,53,63)(H,54,67)(H,55,70)(H,56,69)(H,57,68)(H,64,65)",SPSCLYIAFWGDSR-UHFFFAOYSA-N,,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0480,Urumamide,,other cyclic peptide,other cyclic depsipeptide,C51H90N8O10,974.6779911,CC[C@H]1[C@@H](C)C(N[C@@H](CC(C)C)C(N(C)C([C@H](CC)C)C(O[C@@H](C(C)C)C(N(C)[C@@H](C)C(N(C)[C@@H](CC(C)C)C(N(C)[C@@H](C(C)C)C(N2CCC[C@H]2C(N[C@@H](C(C)C)C(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C51H90N8O10/c1-20-32(13)41-51(68)69-42(31(11)12)50(67)55(16)34(15)46(63)56(17)38(26-28(5)6)48(65)57(18)40(30(9)10)49(66)59-24-22-23-37(59)44(61)54-39(29(7)8)45(62)52-35(21-2)33(14)43(60)53-36(25-27(3)4)47(64)58(41)19/h27-42H,20-26H2,1-19H3,(H,52,62)(H,53,60)(H,54,61)/t32-,33-,34-,35+,36-,37-,38-,39-,40-,41-,42+/m0/s1",QSZUTKACGNSKBA-IBIXCCNUSA-N,132526125,yes,Okeania,n.a.,n.a.
CyanoMetDB_0481,Minutissamide A,,other cyclic peptide,,C51H83N13O15,1117.613159,CCCCCCCC[C@H](C)[C@@H]1[C@H](C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N1)CC(=O)N)C)[C@@H](C)O)C)CC(=O)N)CC(=O)N)C(C)C)O,"InChI=1S/C51H83N13O15/c1-10-13-14-15-16-17-19-26(6)39-41(69)49(77)60-38(25(4)5)48(76)57-30(12-3)44(72)59-32(23-36(53)67)46(74)56-29(11-2)43(71)58-31(22-35(52)66)45(73)55-27(7)42(70)62-40(28(8)65)51(79)63(9)34(24-37(54)68)50(78)64-21-18-20-33(64)47(75)61-39/h11-12,25-28,31-34,38-41,65,69H,10,13-24H2,1-9H3,(H2,52,66)(H2,53,67)(H2,54,68)(H,55,73)(H,56,74)(H,57,76)(H,58,71)(H,59,72)(H,60,77)(H,61,75)(H,62,70)/b29-11+,30-12+/t26-,27+,28+,31-,32-,33-,34-,38-,39+,40-,41+/m0/s1",CDKFNTHBTCWURX-GCFIISOESA-N,53467208,yes,Anabaena,minutissima,UTEX 1613
CyanoMetDB_0482,Lyngbyastatin 1,,other cyclic peptide,Lyngbya toxin (depsipeptide),C51H82N8O12,998.6052201,CC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)NCC(=O)N([C@H](C(=O)NCC(=O)N([C@H](C(=O)N([C@H](C(=O)NC(C(=O)C(C(=O)N([C@H](C(=O)N1)C)C)(C)C)C)CC2=CC=C(C=C2)OC)C)C(C)C)C)CC(C)C)C)[C@@H](C)CC)C,"InChI=1S/C51H82N8O12/c1-18-30(7)42-47(66)53-26-39(60)57(14)37(24-28(3)4)45(64)52-27-40(61)59(16)41(29(5)6)48(67)58(15)38(25-34-20-22-35(70-17)23-21-34)46(65)54-32(9)43(62)51(11,12)50(69)56(13)33(10)44(63)55-36(19-2)31(8)49(68)71-42/h20-23,28-33,36-38,41-42H,18-19,24-27H2,1-17H3,(H,52,64)(H,53,66)(H,54,65)(H,55,63)/t30-,31-,32?,33-,36+,37-,38-,41-,42-/m0/s1",MKKWMLGEOYGWEO-ZGLRIMITSA-N,10373774,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0483,Ibu-epidemethoxylyngbyastatin 3,,other cyclic peptide,other cyclic depsipeptide,C51H82N8O11,982.6103055,CCC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)NCC(=O)N([C@H](C(=O)NCC(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)C(C(=O)N([C@H](C(=O)N1)C)C)(C)C)C)CC2=CC=CC=C2)C)C(C)C)C)CC(C)C)C)[C@@H](C)CC)C,"InChI=1S/C51H82N8O11/c1-17-22-36-32(8)49(68)70-42(31(7)18-2)47(66)53-27-39(60)57(14)37(25-29(3)4)45(64)52-28-40(61)59(16)41(30(5)6)48(67)58(15)38(26-35-23-20-19-21-24-35)46(65)54-33(9)43(62)51(11,12)50(69)56(13)34(10)44(63)55-36/h19-21,23-24,29-34,36-38,41-42H,17-18,22,25-28H2,1-16H3,(H,52,64)(H,53,66)(H,54,65)(H,55,63)/t31-,32-,33-,34-,36+,37-,38-,41-,42-/m0/s1",IIRHRPDTNGFOSK-ONMSWCRESA-N,53492935,yes,Leptolyngbya,n.a.,n.a.
CyanoMetDB_0484,Minutissamide B,,other cyclic peptide,,C51H82ClN13O15,1151.574187,C/C=C/1\C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@H](C(=O)N[C@H](C(=O)N/C(=C/C)/C(=O)N[C@H](C(=O)N1)CC(=O)N)C(C)C)O)[C@@H](C)CCCCCCCCCl)CC(=O)N)C)[C@@H](C)O)C)CC(=O)N,"InChI=1S/C51H82ClN13O15/c1-9-29-43(72)59-31(22-35(53)67)45(74)56-27(6)42(71)63-40(28(7)66)51(80)64(8)34(24-37(55)69)50(79)65-21-17-19-33(65)47(76)62-39(26(5)18-15-13-11-12-14-16-20-52)41(70)49(78)61-38(25(3)4)48(77)58-30(10-2)44(73)60-32(23-36(54)68)46(75)57-29/h9-10,25-28,31-34,38-41,66,70H,11-24H2,1-8H3,(H2,53,67)(H2,54,68)(H2,55,69)(H,56,74)(H,57,75)(H,58,77)(H,59,72)(H,60,73)(H,61,78)(H,62,76)(H,63,71)/b29-9+,30-10+/t26-,27+,28+,31-,32-,33-,34-,38-,39+,40-,41+/m0/s1",BVPWTFZHTABZAH-IXKBYUEASA-N,53467209,yes,Anabaena,minutissima,UTEX 1613
CyanoMetDB_0485,Cyanopeptolin 1025,,Cyanopeptolin,,C51H79N9O13,1025.579734,O=C1N2C(O)CCC1NC(C(CC(C)C)NC(C(NC(C(NC(C3N(C(CC)=O)CCC3)=O)CCC(N)=O)=O)C(OC(C(CC(C)C)NC(C(CC4=CC=C(OC)C=C4)N(C)C(C2CC(C)C)=O)=O)=O)C)=O)=O,"InChI=1S/C51H79N9O13/c1-11-41(62)59-22-12-13-37(59)46(66)53-33(18-20-40(52)61)44(64)57-43-30(8)73-51(71)36(24-28(4)5)56-47(67)38(26-31-14-16-32(72-10)17-15-31)58(9)50(70)39(25-29(6)7)60-42(63)21-19-34(49(60)69)54-45(65)35(23-27(2)3)55-48(43)68/h14-17,27-30,33-39,42-43,63H,11-13,18-26H2,1-10H3,(H2,52,61)(H,53,66)(H,54,65)(H,55,68)(H,56,67)(H,57,64)",VCGBQJUGWVTYEK-UHFFFAOYSA-N,146684813,no,n.a.,n.a.,n.a.
CyanoMetDB_0486,Apramide B,,other linear peptide,,C51H78N8O8S,962.5663327,C[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N(C)CC3=NC=CS3)N(C)C(=O)CCCCCC#C,"InChI=1S/C51H78N8O8S/c1-16-17-18-19-20-23-42(60)54(10)36(8)46(61)56(12)45(35(6)7)51(66)59-29-21-22-39(59)48(63)57(13)44(34(4)5)50(65)58(14)43(33(2)3)49(64)55(11)40(31-37-24-26-38(67-15)27-25-37)47(62)53(9)32-41-52-28-30-68-41/h1,24-28,30,33-36,39-40,43-45H,17-23,29,31-32H2,2-15H3/t36-,39-,40-,43-,44-,45-/m0/s1	",BCUVOJDQGDCCLP-ASAKNYMISA-N,10724599,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0487,Nodularin-R-GSH,,Nodularin,,C51H77N11O16S,1131.527047,CC(SC[C@@H](C(NCC(O)=O)=O)NC(CC[C@H](N)C(O)=O)=O)C1([H])C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCC/N=C(N)\N)C(N[C@@H](/C=C/C(C)=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(O)=O)CCC(N1C)=O)=O)=O)=O)=O,"InChI=1S/C51H77N11O16S/c1-26(22-27(2)37(78-7)23-31-12-9-8-10-13-31)15-17-33-28(3)43(67)60-35(49(74)75)18-20-39(64)62(6)42(30(5)79-25-36(45(69)56-24-40(65)66)57-38(63)19-16-32(52)48(72)73)47(71)61-41(50(76)77)29(4)44(68)59-34(46(70)58-33)14-11-21-55-51(53)54/h8-10,12-13,15,17,22,27-30,32-37,41-42H,11,14,16,18-21,23-25,52H2,1-7H3,(H,56,69)(H,57,63)(H,58,70)(H,59,68)(H,60,67)(H,61,71)(H,65,66)(H,72,73)(H,74,75)(H,76,77)(H4,53,54,55)/b17-15+,26-22+/t27-,28-,29-,30?,32-,33-,34-,35+,36-,37-,41+,42?/m0/s1",QBMDYWDETQLVRP-SCXNOQFRSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0488,Aeruginopeptin 917SC,Aeruginopeptin 917S-C,other cyclic peptide,Aeruginopeptin,C51H74N8O14,1022.532449,CC[C@H](C1C(O[C@H](C)[C@@H](NC([C@H](NC(C(O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@H](CC(C)C)C(N[C@@H]3CC[C@H](O)N([C@H](CC(C)C)C(N(C)[C@H](CC4=CC=C(O)C=C4)C(N1)=O)=O)C3=O)=O)=O)=O)C,"InChI=1S/C51H74N8O14/c1-9-28(6)42-51(72)73-29(7)43(57-44(65)34(18-20-40(52)63)53-47(68)39(62)25-31-12-16-33(61)17-13-31)48(69)55-36(22-26(2)3)45(66)54-35-19-21-41(64)59(49(35)70)38(23-27(4)5)50(71)58(8)37(46(67)56-42)24-30-10-14-32(60)15-11-30/h10-17,26-29,34-39,41-43,60-62,64H,9,18-25H2,1-8H3,(H2,52,63)(H,53,68)(H,54,66)(H,55,69)(H,56,67)(H,57,65)/t28-,29-,34-,35-,36-,37-,38-,39?,41+,42?,43-/m1/s1",ZRKGXBXTXWRIOY-VXFBRUNQSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0491,Micropeptin DR1006,,Cyanopeptolin,Micropeptin,C51H74N8O13,1006.537534,CC[C@@H](C1C(O[C@H](C)[C@@H](NC(C(NC([C@H](O)CC2=CC=C(O)C=C2)=O)CCC(N)=O)=O)C(N[C@H](CC(C)C)C(N[C@@H]3CC[C@H](O)N([C@H](CC(C)C)C(N(C)[C@H](CC4=CC=CC=C4)C(N1)=O)=O)C3=O)=O)=O)=O)C,"InChI=1S/C51H74N8O13/c1-9-29(6)42-51(71)72-30(7)43(57-44(64)34(19-21-40(52)62)53-47(67)39(61)26-32-15-17-33(60)18-16-32)48(68)55-36(23-27(2)3)45(65)54-35-20-22-41(63)59(49(35)69)38(24-28(4)5)50(70)58(8)37(46(66)56-42)25-31-13-11-10-12-14-31/h10-18,27-30,34-39,41-43,60-61,63H,9,19-26H2,1-8H3,(H2,52,62)(H,53,67)(H,54,65)(H,55,68)(H,56,66)(H,57,64)/t29-,30+,34?,35+,36+,37+,38+,39+,41-,42?,43+/m0/s1",LWLFZSOQVBERAE-PQGNRCIWSA-N,,yes,Microcystis,aeruginosa,TAU IL-237 and IL-23
CyanoMetDB_0492,Cyanopeptolin 1006D,Cyanopeptolin 1007 MB1,Cyanopeptolin,Micropeptin,C51H74N8O13,1006.537534,OC1=CC=C(CC(N(C(C(N2C(O)CCC(NC(C(CCCCN)NC(C3NC(C(NC(CCCCC)=O)CCC(O)=O)=O)=O)=O)C2=O)CC4=CC=CC=C4)=O)C)C(NC(C(C)CC)C(OC3C)=O)=O)C=C1,"InChI=1S/C51H74N8O13/c1-6-8-10-18-40(61)53-36(24-26-42(63)64)46(66)57-44-31(4)72-51(71)43(30(3)7-2)56-47(67)38(28-33-19-21-34(60)22-20-33)58(5)50(70)39(29-32-15-11-9-12-16-32)59-41(62)25-23-37(49(59)69)55-45(65)35(54-48(44)68)17-13-14-27-52/h9,11-12,15-16,19-22,30-31,35-39,41,43-44,60,62H,6-8,10,13-14,17-18,23-29,52H2,1-5H3,(H,53,61)(H,54,68)(H,55,65)(H,56,67)(H,57,66)(H,63,64)",SHWLRVKGNIYTJW-UHFFFAOYSA-N,146683914,no,n.a.,n.a.,n.a.
CyanoMetDB_0493,Maedamide,,other linear peptide,,C51H74N6O12,962.5364718,CC[C@@H](C)[C@@](C(NCC(N(C)[C@@H](CC1=CC=CC=C1)C(N2CCCC2C(OC)=O)=O)=O)=O)([H])NC(C[C@@H]([C@@H](CC3=CC=CC=C3)NC(C4CCCN4C([C@]([C@@H](C)CC)([H])OC([C@H](C(C)C)O)=O)=O)=O)O)=O,"InChI=1S/C51H74N6O12/c1-9-32(5)43(47(63)52-30-42(60)55(7)39(28-35-21-15-12-16-22-35)48(64)57-26-18-24-38(57)50(66)68-8)54-41(59)29-40(58)36(27-34-19-13-11-14-20-34)53-46(62)37-23-17-25-56(37)49(65)45(33(6)10-2)69-51(67)44(61)31(3)4/h11-16,19-22,31-33,36-40,43-45,58,61H,9-10,17-18,23-30H2,1-8H3,(H,52,63)(H,53,62)(H,54,59)/t32-,33+,36-,37?,38?,39+,40+,43-,44+,45-/m1/s1",YOPVXOUHYSYHKL-JBYGUWGWSA-N,146683631,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0494,Cyanopeptolin CP1018,CP 1018,Cyanopeptolin,,C51H74N10O12,1018.548768,O=C(NC(C(NC(C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)=O)C(OC2=O)C)=O)CC(O)=O)CCCCCCC,"InChI=1S/C51H74N10O12/c1-6-7-8-9-16-23-39(62)55-36(29-41(64)65)45(67)59-43-31(4)73-50(72)42(30(2)3)58-46(68)37(27-32-18-12-10-13-19-32)60(5)49(71)38(28-33-20-14-11-15-21-33)61-40(63)25-24-35(48(61)70)57-44(66)34(56-47(43)69)22-17-26-54-51(52)53/h10-15,18-21,30-31,34-38,40,42-43,63H,6-9,16-17,22-29H2,1-5H3,(H,55,62)(H,56,69)(H,57,66)(H,58,68)(H,59,67)(H,64,65)(H4,52,53,54)",NULOMZZHAMINRL-UHFFFAOYSA-N,,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0495,Cyanopeptolin CP1020,CP 1020,Cyanopeptolin,,C51H73N9O13,1019.532783,CCCCCC(=O)NC(CC(=O)O)C(=O)NC1C(OC(=O)C(NC(=O)C(N(C(=O)N(C2C(CCC(C2=O)NC(=O)C(NC1=O)CCCCC(=N)N)O)CC3=CC=CC=C3)C)CCC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C51H73N9O13/c1-6-7-9-18-40(63)54-36(27-41(64)65)47(68)58-43-30(4)73-50(71)42(29(2)3)57-48(69)37(25-21-31-19-22-33(61)23-20-31)59(5)51(72)60(28-32-14-10-8-11-15-32)44-38(62)26-24-34(45(44)66)55-46(67)35(56-49(43)70)16-12-13-17-39(52)53/h8,10-11,14-15,19-20,22-23,29-30,34-38,42-44,61-62H,6-7,9,12-13,16-18,21,24-28H2,1-5H3,(H3,52,53)(H,54,63)(H,55,67)(H,56,70)(H,57,69)(H,58,68)(H,64,65)",XTZJVZVEOFJSLC-UHFFFAOYSA-N,,yes,Nostoc,edaphicum ,CCNP 1411
CyanoMetDB_0496,Anabaenopeptilide 202A,,Cyanopeptolin,Anabaenopeptilide,C51H71N9O15,1049.506963,O=C(N[C@@H](CC[C@H]1O)C2=O)[C@H](CCC3=CC=C(O)C=C3)NC([C@@H](NC([C@H](CCC(N)=O)NC([C@H]4N(CCC4)C([H])=O)=O)=O)[C@H](OC(C([C@@H](C)CC)NC([C@H](CC5=CC(C)=C(O)C=C5)N(C)C([C@H]([N@]12)[C@H](O)C)=O)=O)=O)C)=O,"InChI=1S/C51H71N9O15/c1-7-26(2)41-51(74)75-29(5)42(57-45(68)34(17-20-39(52)65)53-46(69)36-9-8-22-59(36)25-61)48(71)54-33(16-12-30-10-14-32(63)15-11-30)44(67)55-35-18-21-40(66)60(49(35)72)43(28(4)62)50(73)58(6)37(47(70)56-41)24-31-13-19-38(64)27(3)23-31/h10-11,13-15,19,23,25-26,28-29,33-37,40-43,62-64,66H,7-9,12,16-18,20-22,24H2,1-6H3,(H2,52,65)(H,53,69)(H,54,71)(H,55,67)(H,56,70)(H,57,68)/t26-,28+,29+,33-,34-,35-,36-,37-,40+,41?,42-,43+/m0/s1",MYXLCMGBRMLJOW-ISYVHKLZSA-N,,yes,Anabaena,n.a.,strain 202A2
CyanoMetDB_0497,Pompanopeptin B,,other cyclic peptide,,C51H71N7O11,957.5211561,CC[C@H](C)[C@@H](C(=O)O)NC(=O)N[C@@H]1CCCCNC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)CCC2=CC=C(C=C2)O)C)CCCCC3=CC=C(C=C3)O)CCC4=CC=C(C=C4)O,"InChI=1S/C51H71N7O11/c1-6-32(4)44(50(67)68)57-51(69)55-39-12-9-10-30-52-45(62)40(28-20-34-16-24-37(60)25-17-34)53-47(64)42(13-8-7-11-33-14-22-36(59)23-15-33)58(5)49(66)41(29-21-35-18-26-38(61)27-19-35)54-48(65)43(31(2)3)56-46(39)63/h14-19,22-27,31-32,39-44,59-61H,6-13,20-21,28-30H2,1-5H3,(H,52,62)(H,53,64)(H,54,65)(H,56,63)(H,67,68)(H2,55,57,69)/t32-,39+,40-,41-,42-,43-,44-/m0/s1",CQFDBEAGHPQKOL-IBPDFIATSA-N,24829364,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0498,Micropeptin KR 1002,,Cyanopeptolin,Micropeptin,C51H70N8O13,1002.506234,CCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC5CCC(O)C=C5)NC1=O)=O)C4=O)=O)=O)=O)=O)CCC(N)=O)=O,"InChI=1S/C51H70N8O13/c1-6-10-41(63)53-35(21-23-40(52)62)45(65)57-44-29(4)72-51(71)43(28(2)3)56-47(67)38(26-32-15-19-34(61)20-16-32)58(5)50(70)39(27-30-11-8-7-9-12-30)59-42(64)24-22-36(49(59)69)54-46(66)37(55-48(44)68)25-31-13-17-33(60)18-14-31/h7-9,11-13,15-17,19-20,28-29,31,33,35-39,42-44,60-61,64H,6,10,14,18,21-27H2,1-5H3,(H2,52,62)(H,53,63)(H,54,66)(H,55,68)(H,56,67)(H,57,65)/t29-,31?,33?,35-,36-,37-,38-,39-,42+,43-,44-/m0/s1",UDOWEWNWQMROSG-RTEXHQORSA-N,146683625,yes,Microcystis,aeruginosa,TAU IL-40
CyanoMetDB_0499,Micropeptin SD-1002,,Cyanopeptolin,Micropeptin,C51H70N8O13,1002.506234,CCCCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CNC3=C2C=CC=C3)N(C)C([C@H]([C@H](CC)C)N4[C@H](O)CC[C@H](NC([C@H](CC5=CC=C(O)C=C5)NC1=O)=O)C4=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C51H70N8O13/c1-8-10-11-16-39(61)53-37(25-41(63)64)46(66)57-43-29(6)72-51(71)42(27(3)4)56-47(67)38(24-31-26-52-34-15-13-12-14-33(31)34)58(7)50(70)44(28(5)9-2)59-40(62)22-21-35(49(59)69)54-45(65)36(55-48(43)68)23-30-17-19-32(60)20-18-30/h12-15,17-20,26-29,35-38,40,42-44,52,60,62H,8-11,16,21-25H2,1-7H3,(H,53,61)(H,54,65)(H,55,68)(H,56,67)(H,57,66)(H,63,64)/t28-,29-,35-,36-,37-,38-,40+,42-,43-,44-/m0/s1",AWYLSHUAIRJXQH-IATMBTRSSA-N,,yes,Microcystis,aeruginosa,TAU IL-215
CyanoMetDB_0500,Micropeptin KR998,,Cyanopeptolin,Micropeptin,C51H66N8O13,998.4749342,CCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC5=CC=C(O)C=C5)NC1=O)=O)C4=O)=O)=O)=O)=O)CCC(N)=O)=O,"InChI=1S/C51H66N8O13/c1-6-10-41(63)53-35(21-23-40(52)62)45(65)57-44-29(4)72-51(71)43(28(2)3)56-47(67)38(26-32-15-19-34(61)20-16-32)58(5)50(70)39(27-30-11-8-7-9-12-30)59-42(64)24-22-36(49(59)69)54-46(66)37(55-48(44)68)25-31-13-17-33(60)18-14-31/h7-9,11-20,28-29,35-39,42-44,60-61,64H,6,10,21-27H2,1-5H3,(H2,52,62)(H,53,63)(H,54,66)(H,55,68)(H,56,67)(H,57,65)/t29-,35-,36-,37-,38-,39-,42+,43-,44-/m0/s1",OOPLGLFZVDBGII-IHUTXGNJSA-N,146683626,yes,Microcystis,aeruginosa,TAU IL-40
CyanoMetDB_0501,Cyanopeptolin CP999,CP 999,Cyanopeptolin,,C51H65N7O14,999.4589498,CCCC(=O)NC(CC(=O)O)C(=O)NC1C(OC(=O)C(NC(=O)C(N(C(=O)N(C2C(CCC(C2=O)NC(=O)C(NC1=O)CC3=CC=C(C=C3)O)O)CC4=CC=CC=C4)C)CCC5=CC=C(C=C5)O)C(C)C)C,"InChI=1S/C51H65N7O14/c1-6-10-40(62)52-37(26-41(63)64)47(67)56-43-29(4)72-50(70)42(28(2)3)55-48(68)38(23-17-30-13-18-33(59)19-14-30)57(5)51(71)58(27-32-11-8-7-9-12-32)44-39(61)24-22-35(45(44)65)53-46(66)36(54-49(43)69)25-31-15-20-34(60)21-16-31/h7-9,11-16,18-21,28-29,35-39,42-44,59-61H,6,10,17,22-27H2,1-5H3,(H,52,62)(H,53,66)(H,54,69)(H,55,68)(H,56,67)(H,63,64)",RMHQXWCPSCVYFW-UHFFFAOYSA-N,,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0502,Cyanopeptolin 1000A,,Cyanopeptolin,,C50H80N8O13,1000.584485,O=C(NC(CCCCN)C(NC1C(N(C(C(N(C(C(NC2C(C)CC)=O)CC3=CC=C(O)C=C3)C)=O)CC(C)C)C(O)CC1)=O)=O)C(C(OC2=O)C)NC(C(CCC(O)=O)NC(CCCCCCC)=O)=O,"InChI=1S/C50H80N8O13/c1-8-10-11-12-13-17-39(60)52-35(23-25-41(62)63)45(65)56-43-31(6)71-50(70)42(30(5)9-2)55-46(66)37(28-32-18-20-33(59)21-19-32)57(7)49(69)38(27-29(3)4)58-40(61)24-22-36(48(58)68)54-44(64)34(53-47(43)67)16-14-15-26-51/h18-21,29-31,34-38,40,42-43,59,61H,8-17,22-28,51H2,1-7H3,(H,52,60)(H,53,67)(H,54,64)(H,55,66)(H,56,65)(H,62,63)",DNLVCEDLSFGAHN-UHFFFAOYSA-N,146683915,no,n.a.,n.a.,n.a.
CyanoMetDB_0503,Majusculamide C,,other cyclic peptide,other cyclic depsipeptide,C50H80N8O12,984.58957,CC[C@@H]1[C@H](C)C(O[C@@H]([C@@H](CC)C)C(NCC(N(C)[C@@H]([C@@H](CC)C)C(NCC(N(C)[C@H](C(C)C)C(N(C)[C@@H](CC2=CC=C(OC)C=C2)C(NC(C)C(C(C)(C)C(N[C@@H](C)C(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C50H80N8O12/c1-17-28(6)40-45(64)51-25-37(59)57(14)39(27(4)5)47(66)56(13)36(24-33-20-22-34(69-16)23-21-33)44(63)53-31(9)42(61)50(11,12)49(68)54-32(10)43(62)55-35(19-3)30(8)48(67)70-41(29(7)18-2)46(65)52-26-38(60)58(40)15/h20-23,27-32,35-36,39-41H,17-19,24-26H2,1-16H3,(H,51,64)(H,52,65)(H,53,63)(H,54,68)(H,55,62)",KDZUJZSBNBCYEK-UHFFFAOYSA-N,23424631,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0504,Dolastatin 12,,other cyclic peptide,Oscillapeptin,C50H80N8O11,968.5946554,CC[C@@H]1[C@H](C)C(OC([C@H](CC)C)C(NCC(N(C)[C@H](CC(C)C)C(NCC(N(C)[C@@H](C(C)C)C(N(C)[C@@H](CC2=CC=CC=C2)C(NC(C)C(C(C)(C)C(N(C)[C@H](C)C(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C50H80N8O11/c1-17-30(7)41-46(65)52-26-38(59)56(14)36(24-28(3)4)44(63)51-27-39(60)58(16)40(29(5)6)47(66)57(15)37(25-34-22-20-19-21-23-34)45(64)53-32(9)42(61)50(11,12)49(68)55(13)33(10)43(62)54-35(18-2)31(8)48(67)69-41/h19-23,28-33,35-37,40-41H,17-18,24-27H2,1-16H3,(H,51,63)(H,52,65)(H,53,64)(H,54,62)/t30?,31?,32-,33-,35?,36-,37-,40-,41?/m0/s1",MLDFWFKDAWCBSV-RHXOOYMASA-N,3086602,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0505,Planktopeptin BL1061,,Cyanopeptolin,,C50H79N9O16,1061.564478,O=C([C@@H](NC([C@@H](NC([C@H](NC([C@H](CO)O)=O)CC(C)C)=O)CCC(N)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)C([C@@H](O)C)C(N(C)[C@@H](CC3=CC=C(C=C3)OC)C(N[C@H]1[C@@H](C)CC)=O)=O)=O)=O)CC(C)C,"InChI=1S/C50H79N9O16/c1-11-26(6)39-50(73)75-28(8)40(57-42(65)31(16-18-37(51)63)52-43(66)33(20-24(2)3)54-46(69)36(62)23-60)47(70)55-34(21-25(4)5)44(67)53-32-17-19-38(64)59(48(32)71)41(27(7)61)49(72)58(9)35(45(68)56-39)22-29-12-14-30(74-10)15-13-29/h12-15,24-28,31-36,38-41,60-62,64H,11,16-23H2,1-10H3,(H2,51,63)(H,52,66)(H,53,67)(H,54,69)(H,55,70)(H,56,68)(H,57,65)/t26-,27-,28-,31-,32-,33+,34-,35-,36-,38+,39-,40-,41?/m0/s1",WXRCCWVSRYSFSV-MGBQUNHYSA-N,,yes,Oscillatoria/Planktothrix,rubescens,n.a.
CyanoMetDB_0506,Cyanopeptolin 1011,,Cyanopeptolin,,C50H77N9O13,1011.564084,O=C1N2C(O)CCC1NC(C(CC(C)C)NC(C(NC(C(NC(C3N(C(C)=O)CCC3)=O)CCC(N)=O)=O)C(OC(C(CC(C)C)NC(C(CC4=CC=C(OC)C=C4)N(C)C(C2CC(C)C)=O)=O)=O)C)=O)=O,"InChI=1S/C50H77N9O13/c1-26(2)22-35-44(64)53-34-18-20-41(62)59(48(34)68)39(24-28(5)6)49(69)57(9)38(25-31-13-15-32(71-10)16-14-31)46(66)55-36(23-27(3)4)50(70)72-29(7)42(47(67)54-35)56-43(63)33(17-19-40(51)61)52-45(65)37-12-11-21-58(37)30(8)60/h13-16,26-29,33-39,41-42,62H,11-12,17-25H2,1-10H3,(H2,51,61)(H,52,65)(H,53,64)(H,54,67)(H,55,66)(H,56,63)",BSDLLWKMEPXEAP-UHFFFAOYSA-N,146684814,no,n.a.,n.a.,n.a.
CyanoMetDB_0507,Tasiamide B,,other linear peptide,Carmabin,C50H74N8O12,978.5426199,C[C@@H](C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC)NC(=O)[C@H](CC(C)C)NC(=O)C[C@@H]([C@H](CC3=CC=CC=C3)NC(=O)[C@H](CCC(=O)N)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C)O)O,"InChI=1S/C50H74N8O12/c1-29(2)25-36(45(64)52-31(5)47(66)57(8)39(27-34-19-14-11-15-20-34)48(67)58-24-16-21-38(58)50(69)70-9)53-42(62)28-40(60)35(26-33-17-12-10-13-18-33)54-46(65)37(22-23-41(51)61)56(7)49(68)43(30(3)4)55-44(63)32(6)59/h10-15,17-20,29-32,35-40,43,59-60H,16,21-28H2,1-9H3,(H2,51,61)(H,52,64)(H,53,62)(H,54,65)(H,55,63)/t31-,32-,35-,36-,37-,38-,39-,40-,43-/m0/s1",WFMVRFNXMBGKEW-BGGOGDBVSA-N,10931081,yes,Symploca,n.a.,n.a.
CyanoMetDB_0508,Brintonamide C,,other linear peptide,,C50H73N7O10,931.5418916,CC(C(OC(C(CC1=CC=CC=C1)N(C)C)=O)C(N2C(C(NCC(N(C)C(CC(C)C)C(NC(C)C(N(C)C(CC3=CC=CC=C3)C(N4C(C(OC)=O)CCC4)=O)=O)=O)=O)=O)CCC2)=O)CC,"InChI=1S/C50H73N7O10/c1-11-33(4)43(67-50(65)41(53(6)7)30-36-22-16-13-17-23-36)48(63)56-26-18-24-37(56)44(59)51-31-42(58)54(8)39(28-32(2)3)45(60)52-34(5)46(61)55(9)40(29-35-20-14-12-15-21-35)47(62)57-27-19-25-38(57)49(64)66-10/h12-17,20-23,32-34,37-41,43H,11,18-19,24-31H2,1-10H3,(H,51,59)(H,52,60)/t33-,34-,37-,38-,39-,40+,41-,43+/m0/s1",YUUZXYIURFEAIK-WJUYPRDGSA-N,145958767,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_0509,Micropeptin HH992,,Cyanopeptolin,Micropeptin,C50H72N8O13,992.5218844,O[C@H](C(N[C@@H](C(N[C@@H]1C(N[C@H](C(N2[C@@H](CC[C@H]2C(N[C@H](C(N([C@H](C(N[C@H](C(O[C@H]1C)=O)C(C)C)=O)CC3=CC=CC=C3)C)=O)CC(C)C)=O)OC)=O)CC(C)C)=O)=O)CC(N)=O)=O)CC4=CC=C(C=C4)O,"InChI=1S/C50H72N8O13/c1-26(2)21-34-48(67)57(8)37(23-30-13-11-10-12-14-30)45(64)55-41(28(5)6)50(69)71-29(7)42(47(66)54-35(22-27(3)4)49(68)58-36(44(63)53-34)19-20-40(58)70-9)56-43(62)33(25-39(51)61)52-46(65)38(60)24-31-15-17-32(59)18-16-31/h10-18,26-29,33-38,40-42,59-60H,19-25H2,1-9H3,(H2,51,61)(H,52,65)(H,53,63)(H,54,66)(H,55,64)(H,56,62)/t29-,33+,34-,35-,36-,37-,38-,40+,41-,42-/m0/s1",ZXKMRIUULRZARB-IHDOGMILSA-N,,yes,Microcystis,aeruginosa,TAU IL-347
CyanoMetDB_0510,Micropeptin KB992,,Cyanopeptolin,Micropeptin,C50H72N8O13,992.5218844,O=C([C@@H](NC([C@H](NC(C(O)CC1=CC=C(O)C=C1)=O)CC(N)=O)=O)[C@H](C)OC2=O)N[C@H](C(N[C@@H]3C([N@]([C@@H](CC3)OC)[C@@H]([C@H](CC)C)C(N(C)[C@@H](CC4=CC=CC=C4)C(N[C@H]2C(C)C)=O)=O)=O)=O)CC(C)C,"InChI=1S/C50H72N8O13/c1-10-28(6)42-49(68)57(8)36(23-30-14-12-11-13-15-30)45(64)55-40(27(4)5)50(69)71-29(7)41(47(66)54-34(22-26(2)3)43(62)52-33-20-21-39(70-9)58(42)48(33)67)56-44(63)35(25-38(51)61)53-46(65)37(60)24-31-16-18-32(59)19-17-31/h11-19,26-29,33-37,39-42,59-60H,10,20-25H2,1-9H3,(H2,51,61)(H,52,62)(H,53,65)(H,54,66)(H,55,64)(H,56,63)/t28-,29-,33-,34-,35+,36-,37?,39+,40-,41-,42-/m0/s1",LEMGGXYDKCZIKV-JQIPHXISSA-N,146683761,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0511,Loggerpeptin A,,Cyanopeptolin,Depsipeptide,C50H72N8O13,992.5218844,OC1=CC=C(C=C1)C[C@@H](C(N[C@H](C(O[C@H](C)[C@@H](C(N[C@H](C(N[C@@H]2C(N3[C@@H](CC2)O)=O)=O)CC(C)C)=O)NC([C@@H](NC([C@@H](NC(CCC)=O)C)=O)[C@@H](O)C)=O)=O)C(C)C)=O)N(C)C([C@@H]3CC4=CC=CC=C4)=O,"InChI=1S/C50H72N8O13/c1-10-14-38(61)51-28(6)43(63)55-41(29(7)59)46(66)56-42-30(8)71-50(70)40(27(4)5)54-45(65)36(24-32-17-19-33(60)20-18-32)57(9)49(69)37(25-31-15-12-11-13-16-31)58-39(62)22-21-34(48(58)68)52-44(64)35(23-26(2)3)53-47(42)67/h11-13,15-20,26-30,34-37,39-42,59-60,62H,10,14,21-25H2,1-9H3,(H,51,61)(H,52,64)(H,53,67)(H,54,65)(H,55,63)(H,56,66)/t28-,29-,30-,34-,35-,36-,37-,39+,40-,41-,42-/m1/s1",UAVAEWGJORGZNS-QALITSKGSA-N,,yes,Leptolyngbya,sp.,DRTO?73
CyanoMetDB_0512,Cyanopeptolin 1020,,Cyanopeptolin,,C50H72N10O13,1020.528032,C[C@H]1OC([C@@H](NC([C@@H](N(C([C@@H](N2C([C@H](CC[C@H]2O)NC([C@@H](NC([C@H]1NC([C@@H](NC(CCCCC)=O)CCC(O)=O)=O)=O)CCC/N=C(N)/N)=O)=O)CC3=CC=CC=C3)=O)C)CC(C=C4)=CC=C4O)=O)C(C)C)=O,"InChI=1S/C50H72N10O13/c1-6-7-9-16-38(62)54-34(22-24-40(64)65)44(67)58-42-29(4)73-49(72)41(28(2)3)57-45(68)36(26-31-17-19-32(61)20-18-31)59(5)48(71)37(27-30-13-10-8-11-14-30)60-39(63)23-21-35(47(60)70)56-43(66)33(55-46(42)69)15-12-25-53-50(51)52/h8,10-11,13-14,17-20,28-29,33-37,39,41-42,61,63H,6-7,9,12,15-16,21-27H2,1-5H3,(H,54,62)(H,55,69)(H,56,66)(H,57,68)(H,58,67)(H,64,65)(H4,51,52,53)/t29-,33+,34+,35+,36+,37+,39-,41+,42+/m1/s1",NYXUAFLMUQAJPS-AYGLBTBXSA-N,46830813,yes,Microcystis,aeruginosa,UV006
CyanoMetDB_0513,Micropeptin LH1021,,Cyanopeptolin,Micropeptin,C50H71N9O14,1021.512048,CCCCCC(=O)NCC(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCC(=O)N)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C50H71N9O14/c1-7-8-10-15-38(63)52-26-39(64)55-42(28(4)60)46(68)57-43-29(5)73-50(72)41(27(2)3)56-45(67)35(24-31-16-18-32(61)19-17-31)58(6)49(71)36(25-30-13-11-9-12-14-30)59-40(65)23-21-34(48(59)70)54-44(66)33(53-47(43)69)20-22-37(51)62/h9,11-14,16-19,27-29,33-36,40-43,60-61,65H,7-8,10,15,20-26H2,1-6H3,(H2,51,62)(H,52,63)(H,53,69)(H,54,66)(H,55,64)(H,56,67)(H,57,68)/t28-,29-,33+,34+,35+,36+,40-,41+,42+,43+/m1/s1",OXGRZUBFKHYZLM-BLEAEYKXSA-N,73054069,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0515,Micropeptin E,Cyanopeptolin 993,Cyanopeptolin,Micropeptin,C50H71N7O14,993.5059,CCCCCC(N[C@H](C(N[C@H]1[C@@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC(C)C)N3[C@H](O)CC[C@H](NC([C@H](CC4=CC=C(O)C=C4)NC1=O)=O)C3=O)=O)=O)=O)=O)CCC(O)=O)=O,"InChI=1S/C50H71N7O14/c1-8-9-10-11-39(60)51-34(21-23-41(62)63)44(64)55-43-29(6)71-50(70)42(28(4)5)54-46(66)37(26-31-14-18-33(59)19-15-31)56(7)49(69)38(24-27(2)3)57-40(61)22-20-35(48(57)68)52-45(65)36(53-47(43)67)25-30-12-16-32(58)17-13-30/h12-19,27-29,34-38,40,42-43,58-59,61H,8-11,20-26H2,1-7H3,(H,51,60)(H,52,65)(H,53,67)(H,54,66)(H,55,64)(H,62,63)/t29-,34+,35+,36+,37+,38+,40-,42+,43+/m1/s1",ACMHKGWLZHYQFH-YEZRCUTOSA-N,42638463,yes,Microcystis,aeruginosa,NIES 100
CyanoMetDB_0516,Cyanopeptolin 1054 MB1,Cyanopeptolin 1054A,Cyanopeptolin,,C50H71ClN10O13,1054.48906,O=C1C(NC(C(CCCNC(N)=N)NC(C(NC(C(CC(O)=O)NC(CCCCC)=O)=O)C2C)=O)=O)CCC(OC)N1C(CC3=CC=CC=C3)C(N(C)C(CC4=CC(Cl)=C(O)C=C4)C(NC(C(O2)=O)C(C)C)=O)=O,"InChI=1S/C50H71ClN10O13/c1-7-8-10-17-38(63)55-34(26-40(64)65)44(67)59-42-28(4)74-49(72)41(27(2)3)58-45(68)35(25-30-18-20-37(62)31(51)23-30)60(5)48(71)36(24-29-14-11-9-12-15-29)61-39(73-6)21-19-33(47(61)70)57-43(66)32(56-46(42)69)16-13-22-54-50(52)53/h9,11-12,14-15,18,20,23,27-28,32-36,39,41-42,62H,7-8,10,13,16-17,19,21-22,24-26H2,1-6H3,(H,55,63)(H,56,69)(H,57,66)(H,58,68)(H,59,67)(H,64,65)(H4,52,53,54)",LWZKHJVQPHBPNS-UHFFFAOYSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0517,Samoamide A,,other cyclic peptide,,C50H70N8O8,910.5316612,CC[C@H](C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N1)CC5=CC=CC=C5)CC(C)C)C(C)C)CC6=CC=CC=C6,"InChI=1S/C50H70N8O8/c1-7-32(6)42-50(66)57-25-15-22-39(57)46(62)51-35(28-33-17-10-8-11-18-33)43(59)54-41(31(4)5)47(63)53-37(27-30(2)3)48(64)58-26-16-23-40(58)49(65)56-24-14-21-38(56)45(61)52-36(44(60)55-42)29-34-19-12-9-13-20-34/h8-13,17-20,30-32,35-42H,7,14-16,21-29H2,1-6H3,(H,51,62)(H,52,61)(H,53,63)(H,54,59)(H,55,60)/t32-,35-,36-,37-,38-,39-,40-,41-,42-/m0/s1",HXZHQSBZXQKEMC-HBGYEDQKSA-N,132497583,yes,Symploca,sp.,n.a.
CyanoMetDB_0518,Kempopeptin A,,Cyanopeptolin,,C50H70N8O13,990.5062343,CC(N1[C@@H](C(N[C@H](C(N[C@@H]2C(N[C@H](C(N[C@@H]3C(N([C@@H](CC3)O)[C@H](C(N([C@H](C(N[C@H](C(O[C@H]2C)=O)C(C)C)=O)CC(C=C4)=CC=C4O)C)=O)CC5=CC=CC=C5)=O)=O)CC(C)C)=O)=O)[C@@H](C)O)=O)CCC1)=O,"InChI=1S/C50H70N8O13/c1-26(2)23-35-43(63)51-34-20-21-39(62)58(48(34)68)38(25-31-13-10-9-11-14-31)49(69)56(8)37(24-32-16-18-33(61)19-17-32)45(65)53-40(27(3)4)50(70)71-29(6)42(47(67)52-35)55-46(66)41(28(5)59)54-44(64)36-15-12-22-57(36)30(7)60/h9-11,13-14,16-19,26-29,34-42,59,61-62H,12,15,20-25H2,1-8H3,(H,51,63)(H,52,67)(H,53,65)(H,54,64)(H,55,66)/t28-,29+,34+,35+,36-,37+,38+,39-,40+,41+,42+/m1/s1",NGRWMTIDCSTQOO-DOXMJLHASA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0519,Loggerpeptin C,,Cyanopeptolin,Depsipeptide,C50H70N8O12,974.5113197,OC1=CC=C(C[C@H](N(C([C@@H]2CC3=CC=CC=C3)=O)C)C(N[C@@H](C(C)C)C(O[C@@H]([C@H](NC(/C(NC([C@H](C)NC(CCC)=O)=O)=C/C)=O)C(N[C@@H](CC(C)C)C(N[C@@H]4C(N2[C@H](O)CC4)=O)=O)=O)C)=O)=O)C=C1,"InChI=1S/C50H70N8O12/c1-10-15-39(60)51-29(7)43(62)52-34(11-2)44(63)56-42-30(8)70-50(69)41(28(5)6)55-46(65)37(25-32-18-20-33(59)21-19-32)57(9)49(68)38(26-31-16-13-12-14-17-31)58-40(61)23-22-35(48(58)67)53-45(64)36(24-27(3)4)54-47(42)66/h11-14,16-21,27-30,35-38,40-42,59,61H,10,15,22-26H2,1-9H3,(H,51,60)(H,52,62)(H,53,64)(H,54,66)(H,55,65)(H,56,63)/b34-11-/t29-,30-,35-,36-,37-,38-,40+,41-,42-/m1/s1",ROIGLVLBYBHXSI-PJBIHNBPSA-N,,yes,Leptolyngbya,sp.,DRTO?73
CyanoMetDB_0521,Norbisebromoamide,,other linear peptide,,C50H70BrN7O8S,1007.418996,CCC(=O)[C@@H]1CCCN1C(=O)[C@H](CC2=CC=CC=C2)N(C)C(=O)[C@@H](CC(C)C)NC(=O)[C@@H]3CSC(=N3)[C@@H]4C[C@@H](CN4C(=O)[C@@H](CC5=CC(=C(C=C5)O)Br)N(C)C(=O)[C@H](C)NC(=O)C(C)(C)C)C,"InChI=1S/C50H70BrN7O8S/c1-11-41(59)37-18-15-21-57(37)47(64)39(25-32-16-13-12-14-17-32)56(10)46(63)35(22-29(2)3)53-43(61)36-28-67-44(54-36)38-23-30(4)27-58(38)48(65)40(26-33-19-20-42(60)34(51)24-33)55(9)45(62)31(5)52-49(66)50(6,7)8/h12-14,16-17,19-20,24,29-31,35-40,60H,11,15,18,21-23,25-28H2,1-10H3,(H,52,66)(H,53,61)/t30-,31-,35+,36-,37-,38-,39-,40+/m0/s1",ADHYVMBQQIBLSN-FXYFJLBQSA-N,52912657,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0522,Anabaenopeptilide 202B,,Cyanopeptolin,Anabaenopeptilide,C50H68ClN9O15,1069.45234,O=C(N[C@@H](CC[C@H]1O)C2=O)[C@H](CCC3=CC=C(O)C=C3)NC([C@@H](NC([C@H](CCC(N)=O)NC([C@H]4N(CCC4)C([H])=O)=O)=O)[C@H](OC(C([C@@H](C)CC)NC([C@H](CC5=CC(Cl)=C(O)C=C5)N(C)C([C@H]([N@]12)[C@H](O)C)=O)=O)=O)C)=O,"InChI=1S/C50H68ClN9O15/c1-6-25(2)40-50(74)75-27(4)41(57-44(68)33(16-19-38(52)65)53-45(69)35-8-7-21-59(35)24-61)47(71)54-32(15-11-28-9-13-30(63)14-10-28)43(67)55-34-17-20-39(66)60(48(34)72)42(26(3)62)49(73)58(5)36(46(70)56-40)23-29-12-18-37(64)31(51)22-29/h9-10,12-14,18,22,24-27,32-36,39-42,62-64,66H,6-8,11,15-17,19-21,23H2,1-5H3,(H2,52,65)(H,53,69)(H,54,71)(H,55,67)(H,56,70)(H,57,68)/t25-,26+,27+,32-,33-,34-,35-,36-,39+,40?,41-,42+/m0/s1",BHWMXGSIUOZDBI-IWHQFTEDSA-N,,yes,Anabaena,n.a.,strain 202A2
CyanoMetDB_0523,Cyanopeptolin CP985,CP 985,Cyanopeptolin,,C50H63N7O14,985.4432997,CCCC(NC(C(NC(C(NC(CC1=CC=C(O)C=C1)C(NC2C(N(C(C(N(C(C(NC3C(C)C)=O)CC4=CC=C(O)C=C4)C)=O)CC5=CC=CC=C5)C(O)CC2)=O)=O)=O)C(OC3=O)C)=O)CC(O)=O)=O,"InChI=1S/C50H63N7O14/c1-6-10-39(60)51-36(26-41(62)63)45(65)55-43-28(4)71-50(70)42(27(2)3)54-46(66)37(24-31-15-19-33(59)20-16-31)56(5)49(69)38(25-29-11-8-7-9-12-29)57-40(61)22-21-34(48(57)68)52-44(64)35(53-47(43)67)23-30-13-17-32(58)18-14-30/h7-9,11-20,27-28,34-38,40,42-43,58-59,61H,6,10,21-26H2,1-5H3,(H,51,60)(H,52,64)(H,53,67)(H,54,66)(H,55,65)(H,62,63)",DYRQEOZVTZDRBA-UHFFFAOYSA-N,139590673,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0524,Cyanopeptolin CP969,CP 969,Cyanopeptolin,,C50H63N7O13,969.4483851,CCCC(NC(C(NC(C(NC(CC1=CC=C(O)C=C1)C(NC2C(N(C(C(N(C(C(NC3C(C)C)=O)CC4=CC=CC=C4)C)=O)CC5=CC=CC=C5)C(O)CC2)=O)=O)=O)C(OC3=O)C)=O)CC(O)=O)=O,"InChI=1S/C50H63N7O13/c1-6-13-39(59)51-36(27-41(61)62)45(64)55-43-29(4)70-50(69)42(28(2)3)54-46(65)37(25-30-14-9-7-10-15-30)56(5)49(68)38(26-31-16-11-8-12-17-31)57-40(60)23-22-34(48(57)67)52-44(63)35(53-47(43)66)24-32-18-20-33(58)21-19-32/h7-12,14-21,28-29,34-38,40,42-43,58,60H,6,13,22-27H2,1-5H3,(H,51,59)(H,52,63)(H,53,66)(H,54,65)(H,55,64)(H,61,62)",IVRIBUXARUEDTR-UHFFFAOYSA-N,146682051,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0525,Nostotrebin 6,,other linear non-peptide,,C50H38O10,798.2464974,C1=CC(=CC=C1CC2=C(C(=O)C(C2=O)(C3=CC=C(C=C3)O)C4(C(=O)C(=C(C4=O)CC5=CC=C(C=C5)O)CC6=CC=C(C=C6)O)C7=CC=C(C=C7)O)CC8=CC=C(C=C8)O)O,"InChI=1S/C50H38O10/c51-35-13-1-29(2-14-35)25-41-42(26-30-3-15-36(52)16-4-30)46(58)49(45(41)57,33-9-21-39(55)22-10-33)50(34-11-23-40(56)24-12-34)47(59)43(27-31-5-17-37(53)18-6-31)44(48(50)60)28-32-7-19-38(54)20-8-32/h1-24,51-56H,25-28H2",BIRIZXULSMAMOU-UHFFFAOYSA-N,46240160,yes,Nostoc,n.a.,str.  Lukešová  27/97
CyanoMetDB_0526,?-N-methylamino-L-alanine,L-BMAA,other linear non-peptide,BMAA,C4H10N2O2,118.0742276,CNC[C@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,105089,no,Nostoc,n.a.,n.a.
CyanoMetDB_0527,"(S)-2,4-diaminobutyric acid",DAB,other linear non-peptide,BMAA,C4H10N2O2,118.0742276,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,134490,no,Calothrix,n.a.,n.a.
CyanoMetDB_0528,N-(2-aminoethyl)-glycine,AEG,other linear non-peptide,BMAA,C4H10N2O2,118.0742276,OC(CNCCN)=O,"InChI=1S/C4H10N2O2/c5-1-2-6-3-4(7)8/h6H,1-3,5H2,(H,7,8)",PIINGYXNCHTJTF-UHFFFAOYSA-N,428913,no,Synechocystis; Chroococcidiopsis; Oscillatoria; Lyngbya; Nostoc; Nodularia; Anabaena; Fischerella,[Synechocystis]sp.; [Chroococcidiopsis]sp.; [Oscillatoria]sp.; [Lyngbya]sp.; [Nostoc]sp.; [Nodularia]sp.; [Anabaena]sp.; [Fischerella]sp.,[Synechocystis sp.]CC6803; [Chroococcidiopsis sp.]PCC6712; [Oscillatoria sp.]PCC6506; [Lyngbya sp.]PCC8106; [Nostoc sp.]PCC7120; [Nodularia sp.]PCC73104; [Anabaena sp.]PCC73105; [Fischerella sp.]PCC7521
CyanoMetDB_0529,Micropeptin A,,Cyanopeptolin,Micropeptin,C49H78N8O13,986.5688346,C[C@@H]1OC([C@@H](NC(C(N(C([C@@H](N2C([C@H](CC[C@H]2O)NC([C@@H](NC([C@H]1NC([C@H](NC(CCCCCCC)=O)CCC(O)=O)=O)=O)CCCCN)=O)=O)CC(C)C)=O)C)CC(C=C3)=CC=C3O)=O)C(C)C)=O,"InChI=1S/C49H78N8O13/c1-8-9-10-11-12-16-38(59)51-34(22-24-40(61)62)44(64)55-42-30(6)70-49(69)41(29(4)5)54-45(65)36(27-31-17-19-32(58)20-18-31)56(7)48(68)37(26-28(2)3)57-39(60)23-21-35(47(57)67)53-43(63)33(52-46(42)66)15-13-14-25-50/h17-20,28-30,33-37,39,41-42,58,60H,8-16,21-27,50H2,1-7H3,(H,51,59)(H,52,66)(H,53,63)(H,54,65)(H,55,64)(H,61,62)/t30-,33-,34+,35-,36?,37-,39+,41-,42-/m0/s1",NIHAVBBFFMHNQH-ZSQDWTPRSA-N,,yes,Microcystis,aeruginosa,NIES 100
CyanoMetDB_0530,57-Normajusculamide C,,other cyclic peptide,other cyclic depsipeptide,C49H78N8O12,970.57392,CC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)NCC(=O)N([C@H](C(=O)NCC(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)C(C(=O)N[C@H](C(=O)N1)C)(C)C)C)CC2=CC=C(C=C2)OC)C)C(C)C)C)C(C)CC)C)C(C)C)C,"InChI=1S/C49H78N8O12/c1-17-28(7)39-44(63)50-24-36(58)56(14)38(26(3)4)46(65)55(13)35(23-32-19-21-33(68-16)22-20-32)43(62)52-30(9)41(60)49(11,12)48(67)53-31(10)42(61)54-34(18-2)29(8)47(66)69-40(27(5)6)45(64)51-25-37(59)57(39)15/h19-22,26-31,34-35,38-40H,17-18,23-25H2,1-16H3,(H,50,63)(H,51,64)(H,52,62)(H,53,67)(H,54,61)/t28?,29-,30-,31-,34+,35-,38-,39-,40-/m0/s1",NDFBQYCGCBEBOD-ZDKALMRWSA-N,139586364,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0531,Desmethoxymajusculamide C,,other cyclic peptide,other cyclic depsipeptide,C49H78N8O11,954.5790054,CC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)NCC(=O)N([C@H](C(=O)NCC(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)C(C(=O)N[C@H](C(=O)N1)C)(C)C)C)CC2=CC=CC=C2)C)C(C)C)C)[C@@H](C)CC)C)[C@@H](C)CC)C,"InChI=1S/C49H78N8O11/c1-16-28(6)39-44(63)50-25-36(58)56(14)38(27(4)5)46(65)55(13)35(24-33-22-20-19-21-23-33)43(62)52-31(9)41(60)49(11,12)48(67)53-32(10)42(61)54-34(18-3)30(8)47(66)68-40(29(7)17-2)45(64)51-26-37(59)57(39)15/h19-23,27-32,34-35,38-40H,16-18,24-26H2,1-15H3,(H,50,63)(H,51,64)(H,52,62)(H,53,67)(H,54,61)/t28-,29-,30-,31-,32-,34+,35-,38-,39-,40-/m0/s1",FBFVXSBCWUNIQI-XPQZGKFDSA-N,44179712,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0532,Cyanopeptolin 1014,,Cyanopeptolin,,C49H78N10O13,1014.574983,O=C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC(C)C)C(O)CC1)=O)=O)C(C(OC2=O)C)NC(C(CCC(O)=O)NC(CCCCCCC)=O)=O,"InChI=1S/C49H78N10O13/c1-8-9-10-11-12-15-37(61)53-33(21-23-39(63)64)43(66)57-41-29(6)72-48(71)40(28(4)5)56-44(67)35(26-30-16-18-31(60)19-17-30)58(7)47(70)36(25-27(2)3)59-38(62)22-20-34(46(59)69)55-42(65)32(54-45(41)68)14-13-24-52-49(50)51/h16-19,27-29,32-36,38,40-41,60,62H,8-15,20-26H2,1-7H3,(H,53,61)(H,54,68)(H,55,65)(H,56,67)(H,57,66)(H,63,64)(H4,50,51,52)",XROOLCIJEAHFKQ-UHFFFAOYSA-N,146684708,no,n.a.,n.a.,n.a.
CyanoMetDB_0533,Micropeptin KB1048,,Cyanopeptolin,Micropeptin,C49H77ClN10O13,1048.53601,O=C([C@@H](NC([C@H](NC(CCCCC)=O)CC(OC)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)OC)[C@@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC=C(O)C(Cl)=C3)C(N[C@H]1[C@H](C)CC)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C49H77ClN10O13/c1-10-13-14-17-36(62)54-33(25-38(63)72-9)43(65)58-40-28(6)73-48(70)39(26(4)11-2)57-44(66)34(24-29-18-20-35(61)30(50)23-29)59(7)47(69)41(27(5)12-3)60-37(71-8)21-19-32(46(60)68)56-42(64)31(55-45(40)67)16-15-22-53-49(51)52/h18,20,23,26-28,31-34,37,39-41,61H,10-17,19,21-22,24-25H2,1-9H3,(H,54,62)(H,55,67)(H,56,64)(H,57,66)(H,58,65)(H4,51,52,53)/t26-,27+,28+,31+,32+,33-,34+,37-,39+,40+,41+/m1/s1",ZBTUUKPQIAJGEH-OXWULJHXSA-N,146683762,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0536,Adda-D-Glu(?)-Mdha-D-Ala-L-Leu-D-MeAsp(?)-L-Arg-OH,,other linear peptide,,C49H76N10O13,1012.559333,C[C@@H](/C=C(\C)/C=C/[C@@H]([C@H](C)C(=O)N[C@H](CCC(=O)O)C(=O)N(C)C(=C)C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H]([C@H](C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)C(=O)O)N)[C@H](CC1=CC=CC=C1)OC,"InChI=1S/C49H76N10O13/c1-26(2)23-37(45(66)58-40(48(70)71)30(6)42(63)56-36(47(68)69)17-14-22-53-49(51)52)57-43(64)31(7)54-44(65)32(8)59(9)46(67)35(20-21-39(60)61)55-41(62)29(5)34(50)19-18-27(3)24-28(4)38(72-10)25-33-15-12-11-13-16-33/h11-13,15-16,18-19,24,26,28-31,34-38,40H,8,14,17,20-23,25,50H2,1-7,9-10H3,(H,54,65)(H,55,62)(H,56,63)(H,57,64)(H,58,66)(H,60,61)(H,68,69)(H,70,71)(H4,51,52,53)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35+,36-,37-,38-,40+/m0/s1",MDLRMBQBQKNBKL-FDEKQDHZSA-N,139583655,No,Microcystis,n.a.,n.a.
CyanoMetDB_0537,L-Leu-D-MeAsp(?)-L-Arg-Adda-D-Glu(?)-Mdha-D-Ala-OH,,other cyclic peptide,other cyclic depsipeptide,C49H76N10O13,1012.559333,C[C@@H](/C=C(\C)/C=C/[C@H]([C@H](C)C(=O)N[C@H](CCC(=O)O)C(=O)N(C)C(=C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CC(=O)OC)NC(=O)[C@H](CC(C)C)N)[C@H](CC1=CC=CC=C1)OC,"InChI=1S/C49H76N10O13/c1-27(2)23-34(50)44(65)58-38(26-41(62)72-10)46(67)56-36(17-14-22-53-49(51)52)45(66)55-35(19-18-28(3)24-29(4)39(71-9)25-33-15-12-11-13-16-33)30(5)42(63)57-37(20-21-40(60)61)47(68)59(8)32(7)43(64)54-31(6)48(69)70/h11-13,15-16,18-19,24,27,29-31,34-39H,7,14,17,20-23,25-26,50H2,1-6,8-10H3,(H,54,64)(H,55,66)(H,56,67)(H,57,63)(H,58,65)(H,60,61)(H,69,70)(H4,51,52,53)/b19-18+,28-24+/t29-,30-,31-,34-,35+,36-,37+,38+,39-/m0/s1",VCIRRSHFOUSDPE-HOBRTJIKSA-N,139585302,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0538,Cyanopeptolin 997 A,,Cyanopeptolin,,C49H75N9O13,997.5484335,O=C1N2C(O)CCC1NC(C(CC(C)C)NC(C(NC(C(NC(C3N(C(C)=O)CCC3)=O)CCC(N)=O)=O)C(OC(C(CC(C)C)NC(C(CC4=CC=C(O)C=C4)N(C)C(C2CC(C)C)=O)=O)=O)C)=O)=O,"InChI=1S/C49H75N9O13/c1-25(2)21-34-43(64)52-33-17-19-40(62)58(47(33)68)38(23-27(5)6)48(69)56(9)37(24-30-12-14-31(60)15-13-30)45(66)54-35(22-26(3)4)49(70)71-28(7)41(46(67)53-34)55-42(63)32(16-18-39(50)61)51-44(65)36-11-10-20-57(36)29(8)59/h12-15,25-28,32-38,40-41,60,62H,10-11,16-24H2,1-9H3,(H2,50,61)(H,51,65)(H,52,64)(H,53,67)(H,54,66)(H,55,63)",ISFDOCSKWOKPKT-UHFFFAOYSA-N,146684815,no,n.a.,n.a.,n.a.
CyanoMetDB_0539,Cyanopeptolin 997 B,,Cyanopeptolin,,C49H75N9O13,997.5484335,O=C1N2C(CCC1NC(C(NC(C(C(C)OC(C(NC(C(N(C(C2C(C)C)=O)C)CC3=CC=C(C=C3)OC)=O)CC(C)C)=O)NC(C(CCC(N)=O)NC(C4N(CCC4)C(C)=O)=O)=O)=O)CC(C)C)=O)O,"InChI=1S/C49H75N9O13/c1-25(2)22-34-43(63)52-33-18-20-39(61)58(47(33)67)41(27(5)6)48(68)56(9)37(24-30-13-15-31(70-10)16-14-30)45(65)54-35(23-26(3)4)49(69)71-28(7)40(46(66)53-34)55-42(62)32(17-19-38(50)60)51-44(64)36-12-11-21-57(36)29(8)59/h13-16,25-28,32-37,39-41,61H,11-12,17-24H2,1-10H3,(H2,50,60)(H,51,64)(H,52,63)(H,53,66)(H,54,65)(H,55,62)",SXHHUANHHDDXLK-UHFFFAOYSA-N,146684816,no,n.a.,n.a.,n.a.
CyanoMetDB_0540,Cyanopeptolin 997 C,,Cyanopeptolin,,C49H75N9O13,997.5484335,O=C1N2C(O)CCC1NC(C(CC(C)C)NC(C(NC(C(NC(C3N(C(C)=O)CCC3)=O)CCC(N)=O)=O)C(OC(C(C(C)C)NC(C(CC4=CC=C(OC)C=C4)N(C)C(C2CC(C)C)=O)=O)=O)C)=O)=O,"InChI=1S/C49H75N9O13/c1-25(2)22-34-43(63)52-33-18-20-39(61)58(47(33)67)37(23-26(3)4)48(68)56(9)36(24-30-13-15-31(70-10)16-14-30)45(65)54-40(27(5)6)49(69)71-28(7)41(46(66)53-34)55-42(62)32(17-19-38(50)60)51-44(64)35-12-11-21-57(35)29(8)59/h13-16,25-28,32-37,39-41,61H,11-12,17-24H2,1-10H3,(H2,50,60)(H,51,64)(H,52,63)(H,53,66)(H,54,65)(H,55,62)",VSSCJBFQSLJQLW-UHFFFAOYSA-N,146684817,no,n.a.,n.a.,n.a.
CyanoMetDB_0542,Micromide,,other linear peptide,Carmabin,C49H73N7O7S,903.5292189,CCC[C@H](CC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N(C)[C@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N(C)CC3=NC=CS3)OC,"InChI=1S/C49H73N7O7S/c1-13-21-37(63-12)30-40(57)51-38(28-35-22-17-15-18-23-35)46(59)55(10)43(33(5)6)45(58)52-42(32(3)4)48(61)56(11)44(34(7)14-2)49(62)54(9)39(29-36-24-19-16-20-25-36)47(60)53(8)31-41-50-26-27-64-41/h15-20,22-27,32-34,37-39,42-44H,13-14,21,28-31H2,1-12H3,(H,51,57)(H,52,58)/t34-,37+,38-,39-,42-,43+,44-/m0/s1",ZPBVMFSLPZDOHZ-GNUBDBAHSA-N,21602045,yes,Symploca,n.a.,VP727
CyanoMetDB_0543,Pitiprolamide,,other cyclic peptide,other cyclic depsipeptide,C49H72N6O10,904.5309925,CCC[C@@H]1C(C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)O[C@H](C(=O)N3CCC[C@H]3C(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N5CCC[C@H]5C(=O)O1)[C@H](C)CC6=CC=CC=C6)C(C)C)C(C)C)(C)C,"InChI=1S/C49H72N6O10/c1-9-17-37-49(7,8)48(63)51-38(29(2)3)43(58)54-26-16-23-36(54)47(62)65-40(30(4)5)45(60)53-25-14-21-34(53)42(57)52-24-13-20-33(52)41(56)50-39(31(6)28-32-18-11-10-12-19-32)44(59)55-27-15-22-35(55)46(61)64-37/h10-12,18-19,29-31,33-40H,9,13-17,20-28H2,1-8H3,(H,50,56)(H,51,63)/t31-,33+,34+,35+,36+,37-,38+,39+,40+/m1/s1",GDQDVTDPOBTBOA-AVSCPADHSA-N,50993830,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0545,Micropeptin HH978,,Cyanopeptolin,Micropeptin,C49H70N8O13,978.5062343,O[C@@H](C(N[C@H](C(N[C@H]1C(N[C@@H](C(N[C@H]2C([N@]([C@H](CC2)O)[C@H](C(N([C@@H](C(N[C@H](C(O[C@@H]1C)=O)C(C)C)=O)CC3=CC=CC=C3)C)=O)CC(C)C)=O)=O)CC(C)C)=O)=O)CC(N)=O)=O)CC(C=C4)=CC=C4O,"InChI=1S/C49H70N8O13/c1-25(2)20-33-42(62)51-32-18-19-39(61)57(47(32)67)36(21-26(3)4)48(68)56(8)35(22-29-12-10-9-11-13-29)44(64)54-40(27(5)6)49(69)70-28(7)41(46(66)53-33)55-43(63)34(24-38(50)60)52-45(65)37(59)23-30-14-16-31(58)17-15-30/h9-17,25-28,32-37,39-41,58-59,61H,18-24H2,1-8H3,(H2,50,60)(H,51,62)(H,52,65)(H,53,66)(H,54,64)(H,55,63)/t28-,32-,33-,34+,35-,36+,37-,39+,40+,41-/m1/s1",IRVJVPYNSVRRCE-VPPHHLPSSA-N,,yes,Microcystis,aeruginosa,TAU IL-347
CyanoMetDB_0546,Micropeptin MM978,,Cyanopeptolin,Micropeptin,C49H70N8O13,978.5062343,CCCCCC(N[C@@H](C(N[C@H]1[C@@H](C)OC([C@H]([C@@H](CC)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CCC(N)=O)NC1=O)=O)C4=O)=O)=O)=O)=O)[C@@H](O)C)=O,"InChI=1S/C49H70N8O13/c1-7-9-11-16-38(61)53-41(28(4)58)45(65)55-42-29(5)70-49(69)40(27(3)8-2)54-44(64)35(25-31-17-19-32(59)20-18-31)56(6)48(68)36(26-30-14-12-10-13-15-30)57-39(62)24-22-34(47(57)67)52-43(63)33(51-46(42)66)21-23-37(50)60/h10,12-15,17-20,27-29,33-36,39-42,58-59,62H,7-9,11,16,21-26H2,1-6H3,(H2,50,60)(H,51,66)(H,52,63)(H,53,61)(H,54,64)(H,55,65)/t27-,28+,29-,33+,34+,35+,36+,39-,40+,41-,42+/m1/s1",UUCARZDTWSMEHB-IEZMLONRSA-N,,yes,Microcystis,n.a.,TAU IL-36
CyanoMetDB_0547,Micropeptin HM978,Ichthyopeptin B,Cyanopeptolin,Micropeptin,C49H70N8O13,978.5062343,CC[C@@H]([C@H]1C(N(C)[C@@H](CC2=CC=CC=C2)C(N[C@@H](C(C)C)C(O[C@@H](C)[C@H](NC([C@H](NC([C@H](O)CC3=CC=C(O)C=C3)=O)CC(N)=O)=O)C(N[C@@H](CC(C)C)C(N[C@H]4CC[C@@H](O)N1C4=O)=O)=O)=O)=O)=O)C,"InChI=1S/C49H70N8O13/c1-9-27(6)41-48(68)56(8)35(22-29-13-11-10-12-14-29)44(64)54-39(26(4)5)49(69)70-28(7)40(46(66)53-33(21-25(2)3)42(62)51-32-19-20-38(61)57(41)47(32)67)55-43(63)34(24-37(50)60)52-45(65)36(59)23-30-15-17-31(58)18-16-30/h10-18,25-28,32-36,38-41,58-59,61H,9,19-24H2,1-8H3,(H2,50,60)(H,51,62)(H,52,65)(H,53,66)(H,54,64)(H,55,63)/t27-,28-,32-,33-,34+,35-,36+,38+,39-,40-,41-/m0/s1",ISXVVVPYLBADKW-CUVRCYEHSA-N,,yes,Microcystis,n.a.,TAU IL-33
CyanoMetDB_0550,Cyanopeptolin 1007,"CYP 1007, Cyanopeptolin 1006, CP1006",Cyanopeptolin,,C49H70N10O13,1006.512382,CCCCCC(NC(CC(O)=O)C(N[C@@H]([C@@H](OC([C@@H](NC([C@H](CC1=CC=C(C=C1)O)N2C)=O)C(C)C)=O)C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H]3C(N([C@@H](CC3)O)[C@@H](CC4=CC=CC=C4)C2=O)=O)=O)=O)=O)=O,"InChI=1S/C49H70N10O13/c1-6-7-9-16-37(61)53-34(26-39(63)64)43(66)57-41-28(4)72-48(71)40(27(2)3)56-44(67)35(24-30-17-19-31(60)20-18-30)58(5)47(70)36(25-29-13-10-8-11-14-29)59-38(62)22-21-33(46(59)69)55-42(65)32(54-45(41)68)15-12-23-52-49(50)51/h8,10-11,13-14,17-20,27-28,32-36,38,40-41,60,62H,6-7,9,12,15-16,21-26H2,1-5H3,(H,53,61)(H,54,68)(H,55,65)(H,56,67)(H,57,66)(H,63,64)(H4,50,51,52)/t28-,32-,33-,34?,35-,36-,38+,40-,41-/m0/s1",NXYIQBUCMJLPLM-YSSHBZHUSA-N,146684849,no,n.a.,n.a.,n.a.
CyanoMetDB_0551,Cyanopeptolin CP990,CP 990,Cyanopeptolin,,C49H70N10O12,990.5174677,O=C(NC(C(NC(C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)=O)C(OC2=O)C)=O)CC(O)=O)CCCCC,"InChI=1S/C49H70N10O12/c1-6-7-10-21-37(60)53-34(27-39(62)63)43(65)57-41-29(4)71-48(70)40(28(2)3)56-44(66)35(25-30-16-11-8-12-17-30)58(5)47(69)36(26-31-18-13-9-14-19-31)59-38(61)23-22-33(46(59)68)55-42(64)32(54-45(41)67)20-15-24-52-49(50)51/h8-9,11-14,16-19,28-29,32-36,38,40-41,61H,6-7,10,15,20-27H2,1-5H3,(H,53,60)(H,54,67)(H,55,64)(H,56,66)(H,57,65)(H,62,63)(H4,50,51,52)",HFRWIDDUABJXBW-UHFFFAOYSA-N,146682046,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0552,Cyanopeptolin CP992,CP 992,Cyanopeptolin,,C49H69N9O13,991.5014833,CCCC(=O)NC(CC(=O)O)C(=O)NC1C(OC(=O)C(NC(=O)C(N(C(=O)N(C2C(CCC(C2=O)NC(=O)C(NC1=O)CCCCC(=N)N)O)CC3=CC=CC=C3)C)CCC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C49H69N9O13/c1-6-12-38(61)52-34(25-39(62)63)45(66)56-41-28(4)71-48(69)40(27(2)3)55-46(67)35(23-19-29-17-20-31(59)21-18-29)57(5)49(70)58(26-30-13-8-7-9-14-30)42-36(60)24-22-32(43(42)64)53-44(65)33(54-47(41)68)15-10-11-16-37(50)51/h7-9,13-14,17-18,20-21,27-28,32-36,40-42,59-60H,6,10-12,15-16,19,22-26H2,1-5H3,(H3,50,51)(H,52,61)(H,53,65)(H,54,68)(H,55,67)(H,56,66)(H,62,63)",POSNRXYPBRQMLK-UHFFFAOYSA-N,,yes,Nostoc,edaphicum ,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0553,Micropeptin GH979,,Cyanopeptolin,Micropeptin,C49H69N7O14,979.4902499,CC[C@@H]([C@H]1C(N(C)[C@@H](CC2=CC=CC=C2)C(N[C@@H](C(C)C)C(O[C@@H](C)[C@H](NC([C@H](NC([C@H](O)CC3=CC=C(O)C=C3)=O)CC(O)=O)=O)C(N[C@@H](CC(C)C)C(N[C@H]4CC[C@@H](O)N1C4=O)=O)=O)=O)=O)=O)C,"InChI=1S/C49H69N7O14/c1-9-27(6)41-48(68)55(8)35(22-29-13-11-10-12-14-29)44(64)53-39(26(4)5)49(69)70-28(7)40(46(66)52-33(21-25(2)3)42(62)50-32-19-20-37(59)56(41)47(32)67)54-43(63)34(24-38(60)61)51-45(65)36(58)23-30-15-17-31(57)18-16-30/h10-18,25-28,32-37,39-41,57-59H,9,19-24H2,1-8H3,(H,50,62)(H,51,65)(H,52,66)(H,53,64)(H,54,63)(H,60,61)/t27-,28-,32-,33-,34+,35-,36+,37+,39-,40-,41-/m0/s1",JRKQMCKTFHKZAH-QYZPXVODSA-N,,yes,Microcystis,n.a.,TAU IL-33
CyanoMetDB_0554,Micropeptin SD979,,Cyanopeptolin,Micropeptin,C49H69N7O14,979.4902499,CCCCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H]([C@H](CC)C)N3[C@H](O)CC[C@H](NC([C@H](CC4=CC=C(O)C=C4)NC1=O)=O)C3=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C49H69N7O14/c1-8-10-11-12-37(59)50-35(25-39(61)62)44(64)54-41-28(6)70-49(69)40(26(3)4)53-45(65)36(24-30-15-19-32(58)20-16-30)55(7)48(68)42(27(5)9-2)56-38(60)22-21-33(47(56)67)51-43(63)34(52-46(41)66)23-29-13-17-31(57)18-14-29/h13-20,26-28,33-36,38,40-42,57-58,60H,8-12,21-25H2,1-7H3,(H,50,59)(H,51,63)(H,52,66)(H,53,65)(H,54,64)(H,61,62)/t27-,28-,33-,34-,35-,36-,38+,40-,41-,42-/m0/s1",GHKMHLKAFWFBIP-NXEMVWDVSA-N,,yes,Microcystis,aeruginosa,TAU IL-215
CyanoMetDB_0555,Cyanopeptolin 963A,,Cyanopeptolin,,C49H69N7O13,963.4953353,CCCCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=CC=C2)N(C)C([C@H](CC(C)C)N3[C@H](O)CC[C@H](NC([C@H](CC4=CC=C(O)C=C4)NC1=O)=O)C3=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C49H69N7O13/c1-8-9-11-16-38(58)50-35(26-40(60)61)44(63)54-42-29(6)69-49(68)41(28(4)5)53-45(64)36(25-30-14-12-10-13-15-30)55(7)48(67)37(23-27(2)3)56-39(59)22-21-33(47(56)66)51-43(62)34(52-46(42)65)24-31-17-19-32(57)20-18-31/h10,12-15,17-20,27-29,33-37,39,41-42,57,59H,8-9,11,16,21-26H2,1-7H3,(H,50,58)(H,51,62)(H,52,65)(H,53,64)(H,54,63)(H,60,61)/t29-,33-,34-,35-,36-,37-,39+,41-,42-/m0/s1",NGPDQWFWZNXVLZ-FJOPZUAJSA-N,,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_0556,Cyanopeptolin 1041,Cyanopeptolin 1040; Cyanopeptolin 1040 MB,Cyanopeptolin,,C49H69ClN10O13,1040.47341,CCCCCC(N[C@@H](CC(O)=O)C(N[C@@H]([C@@H](OC([C@@H](NC([C@H](CC1=CC(Cl)=C(C=C1)O)N2C)=O)C(C)C)=O)C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H]3C(N([C@@H](CC3)O)[C@@H](CC4=CC=CC=C4)C2=O)=O)=O)=O)=O)=O,"InChI=1S/C49H69ClN10O13/c1-6-7-9-16-37(62)54-33(25-39(64)65)43(67)58-41-27(4)73-48(72)40(26(2)3)57-44(68)34(24-29-17-19-36(61)30(50)22-29)59(5)47(71)35(23-28-13-10-8-11-14-28)60-38(63)20-18-32(46(60)70)56-42(66)31(55-45(41)69)15-12-21-53-49(51)52/h8,10-11,13-14,17,19,22,26-27,31-35,38,40-41,61,63H,6-7,9,12,15-16,18,20-21,23-25H2,1-5H3,(H,54,62)(H,55,69)(H,56,66)(H,57,68)(H,58,67)(H,64,65)(H4,51,52,53)/t27-,31-,32-,33-,34-,35-,38+,40-,41-/m0/s1",VJWGOZOKWZDACX-HDRHQAAESA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0557,Bouillomide A,,Cyanopeptolin,,C49H68N8O12,960.4956697,C[C@@H]1OC([C@@H](NC([C@@H](N(C([C@@H](N2C([C@H](CC[C@H]2O)NC(/C(NC([C@H]1NC([C@@H](NC([C@@H](NC(CCC)=O)C)=O)C(C)C)=O)=O)=C/C)=O)=O)CC3=CC=CC=C3)=O)C)CC(C=C4)=CC=C4O)=O)C(C)C)=O,"InChI=1S/C49H68N8O12/c1-10-15-37(59)50-28(7)42(61)53-39(26(3)4)45(64)55-41-29(8)69-49(68)40(27(5)6)54-44(63)35(24-31-18-20-32(58)21-19-31)56(9)48(67)36(25-30-16-13-12-14-17-30)57-38(60)23-22-34(47(57)66)52-43(62)33(11-2)51-46(41)65/h11-14,16-21,26-29,34-36,38-41,58,60H,10,15,22-25H2,1-9H3,(H,50,59)(H,51,65)(H,52,62)(H,53,61)(H,54,63)(H,55,64)/b33-11-/t28-,29-,34-,35-,36-,38+,39-,40-,41-/m0/s1",KROYJVUBAIMQLZ-TWKCUDIBSA-N,,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_0558,Micropeptin HH960,,Cyanopeptolin,Micropeptin,C49H68N8O12,960.4956697,O[C@@H](C(N[C@H](C(N[C@H]1C(N[C@@H](C(N[C@H]2C(N(C=CC2)[C@@H](C(N([C@@H](C(N[C@@H](C(O[C@@H]1C)=O)C(C)C)=O)CC3=CC=CC=C3)C)=O)CC(C)C)=O)=O)CC(C)C)=O)=O)CC(N)=O)=O)CC(C=C4)=CC=C4O,"InChI=1S/C49H68N8O12/c1-26(2)21-34-42(61)51-33-15-12-20-57(47(33)66)37(22-27(3)4)48(67)56(8)36(23-30-13-10-9-11-14-30)44(63)54-40(28(5)6)49(68)69-29(7)41(46(65)53-34)55-43(62)35(25-39(50)60)52-45(64)38(59)24-31-16-18-32(58)19-17-31/h9-14,16-20,26-29,33-38,40-41,58-59H,15,21-25H2,1-8H3,(H2,50,60)(H,51,61)(H,52,64)(H,53,65)(H,54,63)(H,55,62)/t29-,33-,34-,35+,36-,37-,38-,40-,41-/m1/s1",DFOCHYXOOMGICE-BBJLODPZSA-N,,yes,Microcystis,aeruginosa,TAU IL-347
CyanoMetDB_0559,Lyngbyastatin 9,,other cyclic peptide,Lyngbya toxin,C49H68N8O12,960.4956697,C/C=C1C(N[C@@H]2CC[C@@H](N(C2=O)[C@@H](C(N([C@@H](C(N[C@@H](C(O[C@@H]([C@H](C(N/1)=O)NC([C@@H](C(C)C)NC([C@@H](C)NC(CCC)=O)=O)=O)C)=O)C(C)C)=O)CC3=CC=C(C=C3)O)C)=O)CC4=CC=CC=C4)O)=O,"InChI=1S/C49H68N8O12/c1-10-15-37(59)50-28(7)42(61)53-39(26(3)4)45(64)55-41-29(8)69-49(68)40(27(5)6)54-44(63)35(24-31-18-20-32(58)21-19-31)56(9)48(67)36(25-30-16-13-12-14-17-30)57-38(60)23-22-34(47(57)66)52-43(62)33(11-2)51-46(41)65/h11-14,16-21,26-29,34-36,38-41,58,60H,10,15,22-25H2,1-9H3,(H,50,59)(H,51,65)(H,52,62)(H,53,61)(H,54,63)(H,55,64)/b33-11-/t28-,29?,34?,35?,36?,38?,39?,40?,41?/m0/s1",KROYJVUBAIMQLZ-LPGVZCDSSA-N,,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0560,Prenylagaramide B,,other cyclic peptide,Prenylagaramide,C49H68N8O10,928.5058404,CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N1)CC4=CC=C(C=C4)O)CC(C)C)CC5=CC=C(C=C5)OCC=C(C)C)CC(=O)N,"InChI=1S/C49H68N8O10/c1-7-30(6)42-47(64)54-38(27-41(50)59)49(66)56-21-8-10-39(56)45(62)52-36(25-32-14-18-34(19-15-32)67-23-20-28(2)3)44(61)51-35(24-29(4)5)43(60)53-37(26-31-12-16-33(58)17-13-31)48(65)57-22-9-11-40(57)46(63)55-42/h12-20,29-30,35-40,42,58H,7-11,21-27H2,1-6H3,(H2,50,59)(H,51,61)(H,52,62)(H,53,60)(H,54,64)(H,55,63)/t30-,35-,36-,37-,38-,39-,40-,42-/m0/s1",FLMLQOUFYRJGJD-XANOLGTJSA-N,10748669,yes,Oscillatoria/Planktothrix,agardhii,NIES 205; NIES 596
CyanoMetDB_0562,Oscillamide C,,Anabaenopeptin,Oscillapeptilide,C49H68N10O10,956.5119884,CC[C@@H]([C@H]1C(N[C@@H](CCC2=CC=C(O)C=C2)C(N(C)[C@@H](CCC3=CC=C(O)C=C3)C(N[C@@H](CC4=CC=CC=C4)C(NCCCC[C@@H](NC(N[C@@H](C(O)=O)CCC/N=C(N)\N)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C49H68N10O10/c1-4-30(2)41-45(65)54-37(25-19-31-15-21-34(60)22-16-31)46(66)59(3)40(26-20-32-17-23-35(61)24-18-32)44(64)55-39(29-33-11-6-5-7-12-33)42(62)52-27-9-8-13-36(43(63)58-41)56-49(69)57-38(47(67)68)14-10-28-53-48(50)51/h5-7,11-12,15-18,21-24,30,36-41,60-61H,4,8-10,13-14,19-20,25-29H2,1-3H3,(H,52,62)(H,54,65)(H,55,64)(H,58,63)(H,67,68)(H4,50,51,53)(H2,56,57,69)/t30-,36+,37-,38+,39-,40-,41-/m0/s1",TTWROJJNRKDVPJ-WZOZYBMTSA-N,,yes,Oscillatoria/Planktothrix,agardhii,CCAP 1459/11A
CyanoMetDB_0563,Dinghupeptin B,,other cyclic peptide,other cyclic depsipeptide,C49H67N9O14,1005.480748,O=C1N([C@@H]2CC3=CC=CC=C3)[C@@H](OC)CCC1NC([C@H](NC([C@H](NC([C@@H](NC(/C(C)=C/C)=O)CCC(N)=O)=O)[C@@H](C)OC([C@H](C)NC([C@@H](CC4=CC=C(O)C=C4)N(C2=O)C)=O)=O)=O)CCC(NCCO)=O)=O,"InChI=1S/C49H67N9O14/c1-7-27(2)42(63)53-33(17-20-38(50)61)44(65)56-41-29(4)72-49(70)28(3)52-45(66)36(25-31-13-15-32(60)16-14-31)57(5)48(69)37(26-30-11-9-8-10-12-30)58-40(71-6)22-19-35(47(58)68)55-43(64)34(54-46(41)67)18-21-39(62)51-23-24-59/h7-16,28-29,33-37,40-41,59-60H,17-26H2,1-6H3,(H2,50,61)(H,51,62)(H,52,66)(H,53,63)(H,54,67)(H,55,64)(H,56,65)/b27-7+",NFCQEJKKOQOJJM-OAHLVZFQSA-N,,yes,Streptomyces,n.a.,SC0581
CyanoMetDB_0564,Dinghupeptin D,,other cyclic peptide,other cyclic depsipeptide,C49H67N9O14,1005.480748,O=C([C@](N1C([C@@H](NC([C@@H](NC([C@H](NC(/C(C)=C/C)=O)CCC(N)=O)=O)[C@H](C)OC([C@@H](C)NC([C@H](CC2=CC=C(O)C=C2)N(C3=O)C)=O)=O)=O)CCC(NCCO)=O)=O)([H])CC[C@H]1OC)N[C@H]3CC4=CC=CC=C4,"InChI=1S/C49H67N9O14/c1-7-27(2)42(63)53-33(17-20-38(50)61)43(64)56-41-29(4)72-49(70)28(3)52-45(66)37(26-31-13-15-32(60)16-14-31)57(5)47(68)35(25-30-11-9-8-10-12-30)55-44(65)36-19-22-40(71-6)58(36)48(69)34(54-46(41)67)18-21-39(62)51-23-24-59/h7-16,28-29,33-37,40-41,59-60H,17-26H2,1-6H3,(H2,50,61)(H,51,62)(H,52,66)(H,53,63)(H,54,67)(H,55,65)(H,56,64)/b27-7+",HCNWTASKWLYYJZ-OAHLVZFQSA-N,,yes,Streptomyces,n.a.,SC0581
CyanoMetDB_0565,Bouillomide B,,Cyanopeptolin,,C49H67BrN8O12,1038.406183,CCCC(N[C@H](C(N[C@@H](C(N[C@H]1[C@H](C)OC([C@@H](C(C)C)NC([C@H](CC2=CC=C(O)C(Br)=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC(/C(NC1=O)=C/C)=O)C4=O)=O)=O)=O)=O)C(C)C)=O)C)=O,"InChI=1S/C49H67BrN8O12/c1-10-15-37(60)51-27(7)42(62)54-39(25(3)4)45(65)56-41-28(8)70-49(69)40(26(5)6)55-44(64)34(24-30-18-20-36(59)31(50)22-30)57(9)48(68)35(23-29-16-13-12-14-17-29)58-38(61)21-19-33(47(58)67)53-43(63)32(11-2)52-46(41)66/h11-14,16-18,20,22,25-28,33-35,38-41,59,61H,10,15,19,21,23-24H2,1-9H3,(H,51,60)(H,52,66)(H,53,63)(H,54,62)(H,55,64)(H,56,65)/b32-11-/t27-,28-,33-,34-,35-,38+,39+,40+,41-/m0/s1",QGIQHZHVLBXUBA-HLZAKHHZSA-N,,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_0566,Lyngbyastatin 10,,other cyclic peptide,Lyngbya toxin (depsipeptide),C49H67BrN8O12,1038.406183,C/C=C1C(N[C@@H]2CC[C@@H](N(C2=O)[C@@H](C(N([C@@H](C(N[C@@H](C(O[C@@H]([C@H](C(N/1)=O)NC([C@@H](C(C)C)NC([C@@H](C)NC(CCC)=O)=O)=O)C)=O)C(C)C)=O)CC3=CC=C(C(Br)=C3)O)C)=O)CC4=CC=CC=C4)O)=O,"InChI=1S/C49H67BrN8O12/c1-10-15-37(60)51-27(7)42(62)54-39(25(3)4)45(65)56-41-28(8)70-49(69)40(26(5)6)55-44(64)34(24-30-18-20-36(59)31(50)22-30)57(9)48(68)35(23-29-16-13-12-14-17-29)58-38(61)21-19-33(47(58)67)53-43(63)32(11-2)52-46(41)66/h11-14,16-18,20,22,25-28,33-35,38-41,59,61H,10,15,19,21,23-24H2,1-9H3,(H,51,60)(H,52,66)(H,53,63)(H,54,62)(H,55,64)(H,56,65)/b32-11-/t27-,28?,33?,34?,35?,38?,39?,40?,41?/m0/s1",QGIQHZHVLBXUBA-JLZHWBFNSA-N,,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0567,Anabaenopeptin G-Itou,Anabaenopeptin G,Anabaenopeptin,,C49H67N7O11,929.489856,OC1=CC=C(C=C1)CC[C@H](NC([C@H]([C@H](CC)C)N2)=O)C(N(C)[C@@H](CCC3=CC=C(C=C3)O)C(N[C@H](C(NCCCC[C@H](C2=O)NC(N[C@@H](C(O)=O)CC4=CC=C(C=C4)O)=O)=O)[C@H](CC)C)=O)=O,"InChI=1S/C49H67N7O11/c1-6-29(3)41-45(62)50-27-9-8-10-37(52-49(67)53-39(48(65)66)28-33-15-23-36(59)24-16-33)43(60)54-42(30(4)7-2)46(63)51-38(25-17-31-11-19-34(57)20-12-31)47(64)56(5)40(44(61)55-41)26-18-32-13-21-35(58)22-14-32/h11-16,19-24,29-30,37-42,57-59H,6-10,17-18,25-28H2,1-5H3,(H,50,62)(H,51,63)(H,54,60)(H,55,61)(H,65,66)(H2,52,53,67)/t29-,30-,37+,38-,39+,40-,41-,42-/m0/s1",HXYYQLNMRLHXGK-AKVVBRFBSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 595
CyanoMetDB_0568,Anabaenopeptin MM913,,Anabaenopeptin,,C49H67N7O10,913.4949414,CC[C@@H]([C@H]1C(N[C@@H](CCC2=CC=CC=C2)C(N(C)[C@@H](CCC3=CC=C(O)C=C3)C(N[C@@H]([C@H](CC)C)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=C(O)C=C4)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C49H67N7O10/c1-6-30(3)41-45(61)50-28-12-11-15-37(52-49(66)53-39(48(64)65)29-34-18-24-36(58)25-19-34)43(59)54-42(31(4)7-2)46(62)51-38(26-20-32-13-9-8-10-14-32)47(63)56(5)40(44(60)55-41)27-21-33-16-22-35(57)23-17-33/h8-10,13-14,16-19,22-25,30-31,37-42,57-58H,6-7,11-12,15,20-21,26-29H2,1-5H3,(H,50,61)(H,51,62)(H,54,59)(H,55,60)(H,64,65)(H2,52,53,66)/t30-,31-,37+,38-,39-,40-,41-,42-/m0/s1",NJBYXGADSAVGAJ-CSFANIJXSA-N,50924070,yes,n.a.,n.a.,n.a.
CyanoMetDB_0569,Microphycin KB921,,other cyclic peptide,Microphycin,C49H63N9O9,921.4748746,O=C(N[C@H](C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](C)C(N[C@H](C(N[C@H](C(N2[C@H]3CCC2)=O)C)=O)CCC(N)=O)=O)=O)=O)CC4=CC=CC=C4)[C@@H](NC([C@@H](NC3=O)CC(C)C)=O)CC5=CC=CC=C5 ,"InChI=1S/C49H63N9O9/c1-29(2)25-36-45(63)55-38(27-33-17-10-6-11-18-33)47(65)56-39(28-34-19-12-7-13-20-34)46(64)54-37(26-32-15-8-5-9-16-32)44(62)51-30(3)42(60)53-35(22-23-41(50)59)43(61)52-31(4)49(67)58-24-14-21-40(58)48(66)57-36/h5-13,15-20,29-31,35-40H,14,21-28H2,1-4H3,(H2,50,59)(H,51,62)(H,52,61)(H,53,60)(H,54,64)(H,55,63)(H,56,65)(H,57,66)/t30-,31-,35-,36-,37-,38-,39-,40-/m0/s1",LPFPRCWRCQGJHJ-FDLSECELSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0570,Jizanpeptin D,,Cyanopeptolin,Micropeptin,C48H77BrN8O16S,1132.436163,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@H](C(N([C@H](C(N[C@@H]([C@H](CC)C)C1=O)=O)CC(C=C3Br)=CC=C3OC)C)=O)[C@@H](CC)C)=O)=O)CCCCN)=O)NC(C([C@H](CC)C)NC([C@@H](COS(O)(=O)=O)OC)=O)=O,"InChI=1S/C48H77BrN8O16S/c1-11-25(4)37(53-43(61)35(71-10)24-72-74(67,68)69)44(62)55-39-28(7)73-48(66)38(26(5)12-2)54-42(60)33(23-29-17-19-34(70-9)30(49)22-29)56(8)47(65)40(27(6)13-3)57-36(58)20-18-32(46(57)64)52-41(59)31(51-45(39)63)16-14-15-21-50/h17,19,22,25-28,31-33,35-40,58H,11-16,18,20-21,23-24,50H2,1-10H3,(H,51,63)(H,52,59)(H,53,61)(H,54,60)(H,55,62)(H,67,68,69)/t25-,26-,27+,28-,31-,32-,33-,35+,36+,37?,38-,39-,40-/m0/s1",PKBSRAAKQRNSBG-LBZLCFKRSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0571,Cyanopeptolin D,,Cyanopeptolin,,C48H76N8O12,956.5582699,CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCCN(C)C)O)CC(C)C)C)CC3=CC=CC=C3)C(C)C)C,"InChI=1S/C48H76N8O12/c1-10-11-13-21-37(57)49-34(27-39(59)60)43(62)53-41-30(6)68-48(67)40(29(4)5)52-44(63)35(26-31-18-14-12-15-19-31)55(9)47(66)36(25-28(2)3)56-38(58)23-22-33(46(56)65)51-42(61)32(50-45(41)64)20-16-17-24-54(7)8/h12,14-15,18-19,28-30,32-36,38,40-41,58H,10-11,13,16-17,20-27H2,1-9H3,(H,49,57)(H,50,64)(H,51,61)(H,52,63)(H,53,62)(H,59,60)/t30-,32+,33?,34?,35+,36+,38?,40+,41+/m1/s1",DXELFTOXIMDPAT-LDAYMODSSA-N,101656814,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_0572,Nostofungicidine,,other linear peptide,,C48H76N10O18,1080.533906,CCCCCCCCCCCCC(CCC1CC(=O)NCC(=O)NC(C(=O)N2CC(CC2C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)N1)C(C(=O)N)O)C(C(=O)N)O)C(C3=CC=C(C=C3)O)O)CO)O)CO)O,"InChI=1S/C48H76N10O18/c1-2-3-4-5-6-7-8-9-10-11-12-27(61)18-15-26-19-33(64)51-21-34(65)53-31(24-60)48(76)58-22-29(63)20-32(58)44(72)54-30(23-59)43(71)55-35(38(66)25-13-16-28(62)17-14-25)46(74)57-37(40(68)42(50)70)47(75)56-36(45(73)52-26)39(67)41(49)69/h13-14,16-17,26-27,29-32,35-40,59-63,66-68H,2-12,15,18-24H2,1H3,(H2,49,69)(H2,50,70)(H,51,64)(H,52,73)(H,53,65)(H,54,72)(H,55,71)(H,56,75)(H,57,74)",IDDRLYONDGIWOT-UHFFFAOYSA-N,10796210,yes,Nostoc,commune,n.a.
CyanoMetDB_0573,Micropeptin KB984,,Cyanopeptolin,Micropeptin,C48H76N10O12,984.5644179,O=C([C@@H](NC([C@H](NC(CCCCC)=O)CC(OC)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)OC)[C@@H](C(C)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N[C@H]1[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C48H76N10O12/c1-10-12-14-21-35(59)52-33(26-37(60)69-9)42(62)56-39-29(6)70-47(67)38(28(5)11-2)55-43(63)34(25-30-18-15-13-16-19-30)57(7)46(66)40(27(3)4)58-36(68-8)23-22-32(45(58)65)54-41(61)31(53-44(39)64)20-17-24-51-48(49)50/h13,15-16,18-19,27-29,31-34,36,38-40H,10-12,14,17,20-26H2,1-9H3,(H,52,59)(H,53,64)(H,54,61)(H,55,63)(H,56,62)(H4,49,50,51)/t28-,29-,31-,32-,33+,34-,36+,38-,39-,40-/m0/s1",XDAMLEAPLXFLAC-CSAXWXJNSA-N,146683764,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0574,Apratoxin D,,other cyclic peptide,Lyngbya toxin (depsipeptide),C48H75N5O8S,881.5336356,CC[C@@H]([C@H]1C(N2CCC[C@H]2C(O[C@H]([C@H](CC(C)(C)C)C)C[C@@H](C)C[C@H](O)[C@H](C)C3=N[C@@H](/C=C(C)/C(N[C@@H](CC4=CC=C(OC)C=C4)C(N(C)[C@@H](C)C(N1C)=O)=O)=O)CS3)=O)=O)C,"InChI=1S/C48H75N5O8S/c1-14-29(3)41-46(58)53-21-15-16-38(53)47(59)61-40(31(5)26-48(8,9)10)23-28(2)22-39(54)32(6)43-49-35(27-62-43)24-30(4)42(55)50-37(25-34-17-19-36(60-13)20-18-34)45(57)51(11)33(7)44(56)52(41)12/h17-20,24,28-29,31-33,35,37-41,54H,14-16,21-23,25-27H2,1-13H3,(H,50,55)/t28-,29-,31-,32-,33-,35-,37-,38-,39-,40-,41-/m0/s1",OFUDGDJEKOUEKG-HSPKUFASSA-N,139583653,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0576,Cyanopeptolin 1007 MB2,,Cyanopeptolin,,C48H75ClN8O13,1006.514212,O=C(CCCCC)NC(C(NC1C(C)OC(C(C(CC)C)NC(C(N(C(C(N2C(O)CCC(NC(C(NC1=O)CCCCN)=O)C2=O)CC(C)C)=O)C)CC3=CC(Cl)=C(O)C=C3)=O)=O)=O)CCC(O)=O,"InChI=1S/C48H75ClN8O13/c1-8-10-11-15-37(59)51-32(18-21-39(61)62)43(64)55-41-28(6)70-48(69)40(27(5)9-2)54-44(65)34(25-29-16-19-36(58)30(49)24-29)56(7)47(68)35(23-26(3)4)57-38(60)20-17-33(46(57)67)53-42(63)31(52-45(41)66)14-12-13-22-50/h16,19,24,26-28,31-35,38,40-41,58,60H,8-15,17-18,20-23,25,50H2,1-7H3,(H,51,59)(H,52,66)(H,53,63)(H,54,65)(H,55,64)(H,61,62)",PBKYHIZGPQSYNM-UHFFFAOYSA-N,,no,Microcystis,n.a.,n.a.
CyanoMetDB_0577,Cyanopeptolin CB071,,Cyanopeptolin,,C48H75ClN10O13,1034.52036,CCCCCC(N[C@@H](C(N[C@@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC(Cl)=C(OC)C=C2)N(C)C([C@@H]([C@H](CC)C)N3[C@H](O)CC[C@H](NC([C@H](CCC/N=C(N)\N)NC1=O)=O)C3=O)=O)=O)=O)=O)CCC(O)=O)=O,"InChI=1S/C48H75ClN10O13/c1-9-11-12-15-35(60)53-31(18-21-37(62)63)42(65)57-39-27(6)72-47(70)38(25(3)4)56-43(66)33(24-28-16-19-34(71-8)29(49)23-28)58(7)46(69)40(26(5)10-2)59-36(61)20-17-32(45(59)68)55-41(64)30(54-44(39)67)14-13-22-52-48(50)51/h16,19,23,25-27,30-33,36,38-40,61H,9-15,17-18,20-22,24H2,1-8H3,(H,53,60)(H,54,67)(H,55,64)(H,56,66)(H,57,65)(H,62,63)(H4,50,51,52)/t26-,27-,30-,31+,32-,33-,36+,38-,39+,40+/m0/s1",NCIYGUIDUVAJPC-AYJNPUFISA-N,,yes,Aphanocapsa,n.a.,1001
CyanoMetDB_0578,Nostopeptin A,,Cyanopeptolin,,C48H74N8O12,954.5426199,C[C@@H](CC)[C@H]1C(OC2C(C(NC(C(NC3CCC([N@](C3=O)[C@@H](C(N([C@H](C(N1)=O)CC4=CC=C(C=C4)O)C)=O)[C@H](CC)C)O)=O)CC(C)C)=O)N(C([C@H](CCC(N)=O)NC(CCC)=O)=O)CC2C)=O,"InChI=1S/C48H74N8O12/c1-10-13-36(59)50-31(18-20-35(49)58)45(64)55-24-28(8)41-40(55)44(63)52-33(22-25(4)5)42(61)51-32-19-21-37(60)56(46(32)65)39(27(7)12-3)47(66)54(9)34(23-29-14-16-30(57)17-15-29)43(62)53-38(26(6)11-2)48(67)68-41/h14-17,25-28,31-34,37-41,57,60H,10-13,18-24H2,1-9H3,(H2,49,58)(H,50,59)(H,51,61)(H,52,63)(H,53,62)/t26-,27-,28?,31-,32?,33?,34-,37?,38-,39+,40?,41?/m0/s1",KKMAWFNZQASNQS-QZQHOODISA-N,,yes,Nostoc,minutum,NIES 26
CyanoMetDB_0579,Cyanopeptolin 983,,Cyanopeptolin,,C48H73N9O13,983.5327834,O=C1N2C(CCC1NC(C(NC(C(C(C)OC(C(NC(C(N(C(C2C(C)C)=O)C)CC3=CC=C(C=C3)OC)=O)C(C)C)=O)NC(C(CCC(N)=O)NC(C4N(CCC4)C(C)=O)=O)=O)=O)CC(C)C)=O)O,"InChI=1S/C48H73N9O13/c1-24(2)22-33-42(62)51-32-18-20-37(60)57(46(32)66)40(26(5)6)47(67)55(9)35(23-29-13-15-30(69-10)16-14-29)44(64)53-38(25(3)4)48(68)70-27(7)39(45(65)52-33)54-41(61)31(17-19-36(49)59)50-43(63)34-12-11-21-56(34)28(8)58/h13-16,24-27,31-35,37-40,60H,11-12,17-23H2,1-10H3,(H2,49,59)(H,50,63)(H,51,62)(H,52,65)(H,53,64)(H,54,61)",KJTDXXKIDVOXOH-UHFFFAOYSA-N,146684818,no,n.a.,n.a.,n.a.
CyanoMetDB_0580,Micropeptin SF995,,Cyanopeptolin,Micropeptin,C48H73N11O12,995.5440168,CCCCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CNC3=CC=CC=C32)N(C)C([C@@H]([C@@H](CC)C)N4[C@H](O)CC[C@H](NC([C@H](CCC/N=C(N)\N)NC1=O)=O)C4=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C48H73N11O12/c1-8-10-11-18-35(60)53-33(23-37(62)63)42(65)57-39-27(6)71-47(70)38(25(3)4)56-43(66)34(22-28-24-52-30-16-13-12-15-29(28)30)58(7)46(69)40(26(5)9-2)59-36(61)20-19-32(45(59)68)55-41(64)31(54-44(39)67)17-14-21-51-48(49)50/h12-13,15-16,24-27,31-34,36,38-40,52,61H,8-11,14,17-23H2,1-7H3,(H,53,60)(H,54,67)(H,55,64)(H,56,66)(H,57,65)(H,62,63)(H4,49,50,51)/t26-,27+,31+,32+,33+,34+,36-,38+,39+,40-/m1/s1",TWXCIJLXMTYXKC-YDTVVUIVSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0581,Cyanopeptolin 1001,,Cyanopeptolin,,C48H72ClN9O12,1001.498897,O=C1N2C(O)CCC1NC(C(CC(C)C)NC(C(NC(C(NC(C3N(C)CC=C3)=O)CCC(N)=O)=O)C(OC(C(CC(C)C)NC(C(CC4=CC=C(OCl)C=C4)N(C)C(C2CC(C)C)=O)=O)=O)C)=O)=O,"InChI=1S/C48H72ClN9O12/c1-25(2)21-33-42(62)52-32-17-19-39(60)58(46(32)66)37(23-27(5)6)47(67)57(9)36(24-29-12-14-30(70-49)15-13-29)44(64)54-34(22-26(3)4)48(68)69-28(7)40(45(65)53-33)55-41(61)31(16-18-38(50)59)51-43(63)35-11-10-20-56(35)8/h10-15,25-28,31-37,39-40,60H,16-24H2,1-9H3,(H2,50,59)(H,51,63)(H,52,62)(H,53,65)(H,54,64)(H,55,61)",QIUOCBAUBXIBMI-UHFFFAOYSA-N,146684819,no,n.a.,n.a.,n.a.
CyanoMetDB_0583,Cyanopeptolin 1017,,Cyanopeptolin,,C48H72ClN9O13,1017.493811,O=C1N2C(CCC1NC(C(NC(C(C(C)OC(C(NC(C(N(C(C2C(C)C)=O)C)CC3=CC=C(C=C3)OCl)=O)CC(C)C)=O)NC(C(CCC(N)=O)NC(C4N(CCC4)C(C)=O)=O)=O)=O)CC(C)C)=O)O,"InChI=1S/C48H72ClN9O13/c1-24(2)21-33-42(63)52-32-17-19-38(61)58(46(32)67)40(26(5)6)47(68)56(9)36(23-29-12-14-30(71-49)15-13-29)44(65)54-34(22-25(3)4)48(69)70-27(7)39(45(66)53-33)55-41(62)31(16-18-37(50)60)51-43(64)35-11-10-20-57(35)28(8)59/h12-15,24-27,31-36,38-40,61H,10-11,16-23H2,1-9H3,(H2,50,60)(H,51,64)(H,52,63)(H,53,66)(H,54,65)(H,55,62)",YXGJKFTTZSRCPT-UHFFFAOYSA-N,146684820,no,n.a.,n.a.,n.a.
CyanoMetDB_0584,Cyanopeptolin 992,"Micropeptin EI992, CP 992",Cyanopeptolin,,C48H68N10O13,992.4967323,CCCC(N[C@@H](C(N[C@H]1[C@H](C)OC([C@H]([C@H](CC)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CCC/N=C(N)\N)NC1=O)=O)C4=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C48H68N10O13/c1-6-12-36(60)52-33(25-38(62)63)42(65)56-40-27(4)71-47(70)39(26(3)7-2)55-43(66)34(23-29-16-18-30(59)19-17-29)57(5)46(69)35(24-28-13-9-8-10-14-28)58-37(61)21-20-32(45(58)68)54-41(64)31(53-44(40)67)15-11-22-51-48(49)50/h8-10,13-14,16-19,26-27,31-35,37,39-40,59,61H,6-7,11-12,15,20-25H2,1-5H3,(H,52,60)(H,53,67)(H,54,64)(H,55,66)(H,56,65)(H,62,63)(H4,49,50,51)/t26-,27-,31-,32-,33+,34-,35-,37+,39-,40-/m0/s1",YISRXUQQIVQAHS-ZCJMFZFASA-N,,yes,Nostoc,edaphicum,TAU  IL-217; TAU  IL-231
CyanoMetDB_0585,Cyanopeptolin CP978,CP 978,Cyanopeptolin,,C48H67N9O13,977.4858333,CCCC(=O)NC(CC(=O)O)C(=O)NC1C(OC(=O)C(NC(=O)C(N(C(=O)N(C2C(CCC(C2=O)NC(=O)C(NC1=O)CCCCC(=N)N)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C48H67N9O13/c1-6-12-37(60)51-33(24-38(61)62)44(65)55-40-27(4)70-47(68)39(26(2)3)54-45(66)34(23-28-17-19-30(58)20-18-28)56(5)48(69)57(25-29-13-8-7-9-14-29)41-35(59)22-21-31(42(41)63)52-43(64)32(53-46(40)67)15-10-11-16-36(49)50/h7-9,13-14,17-20,26-27,31-35,39-41,58-59H,6,10-12,15-16,21-25H2,1-5H3,(H3,49,50)(H,51,60)(H,52,64)(H,53,67)(H,54,66)(H,55,65)(H,61,62)",RXTQFABPPDUDPE-UHFFFAOYSA-N,,yes,Nostoc,edaphicum ,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0586,Somamide A,,Cyanopeptolin,Oscillapeptin,C48H67N7O12S,965.4568418,C[C@@H]1OC([C@@H](NC([C@@H](N(C([C@@H](N2C([C@H](CC[C@H]2O)NC(/C(NC([C@H]1NC(C(NC(CCCCC)=O)CCS(C)=O)=O)=O)=C/C)=O)=O)CC3=CC=CC=C3)=O)C)CC(C=C4)=CC=C4O)=O)C(C)C)=O,"InChI=1S/C48H67N7O12S/c1-8-10-12-17-38(57)49-34(24-25-68(7)66)43(60)53-41-29(5)67-48(65)40(28(3)4)52-44(61)36(26-31-18-20-32(56)21-19-31)54(6)47(64)37(27-30-15-13-11-14-16-30)55-39(58)23-22-35(46(55)63)51-42(59)33(9-2)50-45(41)62/h9,11,13-16,18-21,28-29,34-37,39-41,56,58H,8,10,12,17,22-27H2,1-7H3,(H,49,57)(H,50,62)(H,51,59)(H,52,61)(H,53,60)/b33-9-/t29-,34?,35-,36-,37-,39+,40-,41-,68?/m0/s1",YJIIXVAOLGKWSK-GOPLROGVSA-N,146684848,yes,n.a.,n.a.,n.a.
CyanoMetDB_0587,Lyngbyastatin 7,,other cyclic peptide,Lyngbya toxin (depsipeptide),C48H66N8O12,946.4800196,CCCCCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)/C(=C/C)/NC1=O)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C48H66N8O12/c1-7-9-11-16-38(59)50-33(21-23-37(49)58)43(62)54-41-28(5)68-48(67)40(27(3)4)53-44(63)35(25-30-17-19-31(57)20-18-30)55(6)47(66)36(26-29-14-12-10-13-15-29)56-39(60)24-22-34(46(56)65)52-42(61)32(8-2)51-45(41)64/h8,10,12-15,17-20,27-28,33-36,39-41,57,60H,7,9,11,16,21-26H2,1-6H3,(H2,49,58)(H,50,59)(H,51,64)(H,52,61)(H,53,63)(H,54,62)/b32-8-/t28-,33+,34+,35+,36+,39-,40+,41+/m1/s1",DZIGKKCSWPSVIO-SWEGFNRNSA-N,23657291,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0588,Brintonamide D,,other linear peptide,,C48H66N6O10,886.4840423,CC(C(OC(/C=C/C1=CC=CC=C1)=O)C(N2C(C(NCC(N(C)C(CC(C)C)C(NC(C)C(N(C)C(CC3=CC=CC=C3)C(N4C(C(OC)=O)CCC4)=O)=O)=O)=O)=O)CCC2)=O)CC,"InChI=1S/C48H66N6O10/c1-9-32(4)42(64-41(56)25-24-34-18-12-10-13-19-34)47(61)53-26-16-22-36(53)43(57)49-30-40(55)51(6)38(28-31(2)3)44(58)50-33(5)45(59)52(7)39(29-35-20-14-11-15-21-35)46(60)54-27-17-23-37(54)48(62)63-8/h10-15,18-21,24-25,31-33,36-39,42H,9,16-17,22-23,26-30H2,1-8H3,(H,49,57)(H,50,58)/b25-24+/t32-,33-,36-,37-,38-,39+,42+/m0/s1",BLBGDRJUWRFEDQ-VSERBBSRSA-N,145953024,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_0589,Brintonamide E,,other linear peptide,,C48H66N6O10,886.4840423,CC(C(OC(/C=C\C1=CC=CC=C1)=O)C(N2C(C(NCC(N(C)C(CC(C)C)C(NC(C)C(N(C)C(CC3=CC=CC=C3)C(N4C(C(OC)=O)CCC4)=O)=O)=O)=O)=O)CCC2)=O)CC,"InChI=1S/C48H66N6O10/c1-9-32(4)42(64-41(56)25-24-34-18-12-10-13-19-34)47(61)53-26-16-22-36(53)43(57)49-30-40(55)51(6)38(28-31(2)3)44(58)50-33(5)45(59)52(7)39(29-35-20-14-11-15-21-35)46(60)54-27-17-23-37(54)48(62)63-8/h10-15,18-21,24-25,31-33,36-39,42H,9,16-17,22-23,26-30H2,1-8H3,(H,49,57)(H,50,58)/b25-24-/t32-,33-,36-,37-,38-,39+,42+/m0/s1",BLBGDRJUWRFEDQ-QPAOXQKGSA-N,145957924,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_0590,Dinghupeptin A,,other cyclic peptide,other cyclic depsipeptide,C48H65N9O14,991.4650978,O[C@H](N1[C@@H]2CC3=CC=CC=C3)CC[C@@H](NC([C@H](NC([C@H](NC([C@@H](NC(/C(C)=C/C)=O)CCC(N)=O)=O)[C@@H](C)OC([C@H](C)NC([C@@H](CC4=CC=C(O)C=C4)N(C2=O)C)=O)=O)=O)CCC(NCCO)=O)=O)C1=O,"InChI=1S/C48H65N9O14/c1-6-26(2)41(63)52-32(16-19-37(49)60)43(65)55-40-28(4)71-48(70)27(3)51-44(66)35(24-30-12-14-31(59)15-13-30)56(5)47(69)36(25-29-10-8-7-9-11-29)57-39(62)21-18-34(46(57)68)54-42(64)33(53-45(40)67)17-20-38(61)50-22-23-58/h6-15,27-28,32-36,39-40,58-59,62H,16-25H2,1-5H3,(H2,49,60)(H,50,61)(H,51,66)(H,52,63)(H,53,67)(H,54,64)(H,55,65)/b26-6+",QWIPLKRRZPLLFU-GOTRBWPWSA-N,,yes,Streptomyces,n.a.,SC0581
CyanoMetDB_0591,Dinghupeptin C,,other cyclic peptide,Samholide,C48H65N9O13,975.4701832,O=C([C@]1([H])CCCN1C([C@@H](NC([C@@H](NC([C@H](NC(/C(C)=C/C)=O)CCC(N)=O)=O)[C@H](C)OC([C@@H](C)NC([C@H](CC2=CC=C(O)C=C2)N(C3=O)C)=O)=O)=O)CCC(NCCO)=O)=O)N[C@H]3CC4=CC=CC=C4,"InChI=1S/C48H65N9O13/c1-6-27(2)41(62)52-33(18-20-38(49)60)42(63)55-40-29(4)70-48(69)28(3)51-44(65)37(26-31-14-16-32(59)17-15-31)56(5)46(67)35(25-30-11-8-7-9-12-30)54-43(64)36-13-10-23-57(36)47(68)34(53-45(40)66)19-21-39(61)50-22-24-58/h6-9,11-12,14-17,28-29,33-37,40,58-59H,10,13,18-26H2,1-5H3,(H2,49,60)(H,50,61)(H,51,65)(H,52,62)(H,53,66)(H,54,64)(H,55,63)/b27-6+",UQTUSZDBRXRPQR-ASFRMHBNSA-N,,yes,Streptomyces,n.a.,SC0581
CyanoMetDB_0592,Anabaenopeptin 915,,Anabaenopeptin,,C48H65N7O11,915.4742059,CC[C@H](C)[C@H]1C(=O)NCCCC[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N1)CCC2=CC=C(C=C2)O)C)CCC3=CC=C(C=C3)O)C(C)C)NC(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)O,"InChI=1S/C48H65N7O11/c1-6-29(4)41-44(61)49-26-8-7-9-36(51-48(66)52-38(47(64)65)27-32-14-22-35(58)23-15-32)42(59)53-40(28(2)3)45(62)50-37(24-16-30-10-18-33(56)19-11-30)46(63)55(5)39(43(60)54-41)25-17-31-12-20-34(57)21-13-31/h10-15,18-23,28-29,36-41,56-58H,6-9,16-17,24-27H2,1-5H3,(H,49,61)(H,50,62)(H,53,59)(H,54,60)(H,64,65)(H2,51,52,66)/t29-,36+,37-,38-,39-,40-,41-/m0/s1",KWDLKNNQGMAHJR-HBWVXJRASA-N,25209871,yes,Oscillatoria/Planktothrix,agardhii ,CYA 126/8
CyanoMetDB_0593,Anabaenopeptin KB899,Anabaenopeptin KB-899,Anabaenopeptin,,C48H65N7O10,899.4792913,O=C([C@H](CCC1=CC=CC=C1)NC([C@@H](NC([C@H](NC(N[C@@H](C(O)=O)CC2=CC=C(C=C2)O)=O)CCCCN3)=O)C(C)C)=O)N(C)[C@H](C(N[C@H](C3=O)[C@@H](C)CC)=O)CCC4=CC=C(C=C4)O,"InChI=1S/C48H65N7O10/c1-6-30(4)41-44(60)49-27-11-10-14-36(51-48(65)52-38(47(63)64)28-33-17-23-35(57)24-18-33)42(58)53-40(29(2)3)45(61)50-37(25-19-31-12-8-7-9-13-31)46(62)55(5)39(43(59)54-41)26-20-32-15-21-34(56)22-16-32/h7-9,12-13,15-18,21-24,29-30,36-41,56-57H,6,10-11,14,19-20,25-28H2,1-5H3,(H,49,60)(H,50,61)(H,53,58)(H,54,59)(H,63,64)(H2,51,52,65)/t30-,36+,37-,38+,39-,40-,41-/m0/s1",PJUZKPOOVJIMHQ-WZOZYBMTSA-N,146683765,yes,n.a.,n.a.,n.a.
CyanoMetDB_0594,Anabaenopeptin 897,,Anabaenopeptin,,C48H64N8O9,896.4796257,O=C(NC(C(NC(C(N(CC)C(C(N(C)C(C(NC1CC2=CC=CC=C2)=O)CC(N)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CC4=CC=CC=C4,"InChI=1S/C48H64N8O9/c1-5-31(3)41-46(62)56(6-2)38(26-25-32-18-10-7-11-19-32)45(61)55(4)39(30-40(49)57)44(60)51-36(28-33-20-12-8-13-21-33)42(58)50-27-17-16-24-35(43(59)54-41)52-48(65)53-37(47(63)64)29-34-22-14-9-15-23-34/h7-15,18-23,31,35-39,41H,5-6,16-17,24-30H2,1-4H3,(H2,49,57)(H,50,58)(H,51,60)(H,54,59)(H,63,64)(H2,52,53,65)",IZGWGAQDCIDRBV-UHFFFAOYSA-N,146684802,no,Nostoc,n.a.,CENA358
CyanoMetDB_0595,Stigonemapeptin,,other cyclic peptide,other cyclic depsipeptide,C48H63N9O13,973.4545331,C/C=C/1\C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@@H]3CCCN3C=O)C)C(C)C)CC4=CC=C(C=C4)O)C)CC5=CC=CC=C5)O,"InChI=1S/C48H63N9O13/c1-6-31-41(62)52-33-19-21-38(61)57(46(33)67)36(24-28-11-8-7-9-12-28)47(68)55(5)35(23-29-14-16-30(59)17-15-29)44(65)53-39(26(2)3)48(69)70-27(4)40(45(66)50-31)54-42(63)32(18-20-37(49)60)51-43(64)34-13-10-22-56(34)25-58/h6-9,11-12,14-17,25-27,32-36,38-40,59,61H,10,13,18-24H2,1-5H3,(H2,49,60)(H,50,66)(H,51,64)(H,52,62)(H,53,65)(H,54,63)/b31-6+/t27-,32+,33+,34+,35+,36+,38-,39+,40+/m1/s1",AYAWUVIENREIOR-JPANMKSKSA-N,57409770,yes,Stigonema,sp.,n.a.
CyanoMetDB_0596,Nodularin-R-phenylglyoxal (IIa),,Nodularin,,C48H62N8O11,926.4538048,C[C@H](C(N[C@@H](C(O)=O)CCC(N/C1=C/C)=O)=O)[C@@H](NC([C@H](CCC/N=C2NC(O)C(C3=CC=CC=C3)=N/2)NC([C@@H](C)[C@H](C(O)=O)NC1=O)=O)=O)/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC4=CC=CC=C4,"InChI=1S/C48H62N8O11/c1-7-33-43(60)54-39(47(65)66)30(5)42(59)52-35(19-14-24-49-48-55-40(45(62)56-48)32-17-12-9-13-18-32)44(61)51-34(29(4)41(58)53-36(46(63)64)22-23-38(57)50-33)21-20-27(2)25-28(3)37(67-6)26-31-15-10-8-11-16-31/h7-13,15-18,20-21,25,28-30,34-37,39,45,62H,14,19,22-24,26H2,1-6H3,(H,49,56)(H,50,57)(H,51,61)(H,52,59)(H,53,58)(H,54,60)(H,63,64)(H,65,66)/b21-20+,27-25+,33-7+/t28-,29-,30-,34-,35-,36+,37-,39+,45?/m0/s1",PSNDWFQXQZYIJN-IJYLDFDNSA-N,135908695,no,n.a.,n.a.,n.a.
CyanoMetDB_0597,Nodularin-R-phenylglyoxal (IIb),,Nodularin,,C48H62N8O11,926.4538048,C[C@H](C(N[C@@H](C(O)=O)CCC(N/C1=C/C)=O)=O)[C@@H](NC([C@H](CCCN2C(O)C(C3=CC=CC=C3)=NC2=N)NC([C@@H](C)[C@H](C(O)=O)NC1=O)=O)=O)/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC4=CC=CC=C4,"InChI=1S/C48H62N8O11/c1-7-33-43(60)54-39(47(65)66)30(5)42(59)52-35(19-14-24-56-45(62)40(55-48(56)49)32-17-12-9-13-18-32)44(61)51-34(29(4)41(58)53-36(46(63)64)22-23-38(57)50-33)21-20-27(2)25-28(3)37(67-6)26-31-15-10-8-11-16-31/h7-13,15-18,20-21,25,28-30,34-37,39,45,49,62H,14,19,22-24,26H2,1-6H3,(H,50,57)(H,51,61)(H,52,59)(H,53,58)(H,54,60)(H,63,64)(H,65,66)/b21-20+,27-25+,33-7+,49-48?/t28-,29-,30-,34-,35-,36+,37-,39+,45?/m0/s1",XVQZJVBJHLUHMX-KOOZNGLYSA-N,44254509,no,n.a.,n.a.,n.a.
CyanoMetDB_0598,Nodularin-R-phenylglyoxal (IIc),,Nodularin,,C48H60N8O10,908.4432402,C[C@H](C(N[C@@H](C(O)=O)CCC(N/C1=C/C)=O)=O)[C@@H](NC([C@H](CCC/N=C2N=CC(C3=CC=CC=C3)=N/2)NC([C@@H](C)[C@H](C(O)=O)NC1=O)=O)=O)/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC4=CC=CC=C4,"InChI=1S/C48H60N8O10/c1-7-34-44(60)56-41(47(64)65)31(5)43(59)53-36(19-14-24-49-48-50-27-38(55-48)33-17-12-9-13-18-33)45(61)52-35(30(4)42(58)54-37(46(62)63)22-23-40(57)51-34)21-20-28(2)25-29(3)39(66-6)26-32-15-10-8-11-16-32/h7-13,15-18,20-21,25,27,29-31,35-37,39,41H,14,19,22-24,26H2,1-6H3,(H,51,57)(H,52,61)(H,53,59)(H,54,58)(H,56,60)(H,62,63)(H,64,65)/b21-20+,28-25+,34-7+,49-48-/t29-,30-,31-,35-,36-,37+,39-,41+/m0/s1",QIHDZMXXIBXDNG-BFLIOBFDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0599,Jizanpeptin B,,Cyanopeptolin,Micropeptin,C47H75BrN8O16S,1118.420513,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@H](C(N([C@H](C(N[C@@H]([C@H](CC)C)C1=O)=O)CC(C=C3Br)=CC=C3OC)C)=O)[C@@H](CC)C)=O)=O)CCCCN)=O)NC([C@@H](C(C)C)NC([C@@H](COS(O)(=O)=O)OC)=O)=O,"InChI=1S/C47H75BrN8O16S/c1-11-25(5)37-47(65)72-27(7)38(54-43(61)36(24(3)4)52-42(60)34(70-10)23-71-73(66,67)68)44(62)50-30(15-13-14-20-49)40(58)51-31-17-19-35(57)56(45(31)63)39(26(6)12-2)46(64)55(8)32(41(59)53-37)22-28-16-18-33(69-9)29(48)21-28/h16,18,21,24-27,30-32,34-39,57H,11-15,17,19-20,22-23,49H2,1-10H3,(H,50,62)(H,51,58)(H,52,60)(H,53,59)(H,54,61)(H,66,67,68)/t25-,26+,27-,30-,31-,32-,34+,35+,36+,37-,38-,39-/m0/s1",FHDQVQWUFGNFOJ-GCNQYWQMSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0600,Jizanpeptin C,,Cyanopeptolin,Micropeptin,C47H75BrN8O16S,1118.420513,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@H](C(N([C@H](C(N[C@@H]([C@H](CC)C)C1=O)=O)CC(C=C3Br)=CC=C3OC)C)=O)[C@@H](CC)C)=O)=O)CCCCN)=O)NC([C@H](C(C)C)NC([C@@H](COS(O)(=O)=O)OC)=O)=O,"InChI=1S/C47H75BrN8O16S/c1-11-25(5)37-47(65)72-27(7)38(54-43(61)36(24(3)4)52-42(60)34(70-10)23-71-73(66,67)68)44(62)50-30(15-13-14-20-49)40(58)51-31-17-19-35(57)56(45(31)63)39(26(6)12-2)46(64)55(8)32(41(59)53-37)22-28-16-18-33(69-9)29(48)21-28/h16,18,21,24-27,30-32,34-39,57H,11-15,17,19-20,22-23,49H2,1-10H3,(H,50,62)(H,51,58)(H,52,60)(H,53,59)(H,54,61)(H,66,67,68)/t25-,26+,27-,30-,31-,32-,34+,35+,36-,37-,38-,39-/m0/s1",FHDQVQWUFGNFOJ-ZYWZWTHWSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0601,Jizanpeptin E,,Cyanopeptolin,Micropeptin,C47H75BrN10O16S,1146.426661,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C([N@@]([C@@H](CC2)O)[C@@H](C(N([C@H](C(N[C@@H]([C@H](CC)C)C1=O)=O)CC(C=C3Br)=CC=C3OC)C)=O)[C@@H](CC)C)=O)=O)CCC/N=C(N)/N)=O)NC([C@@H](C(C)C)NC([C@@H](COS(O)(=O)=O)OC)=O)=O,"InChI=1S/C47H75BrN10O16S/c1-11-24(5)36-46(67)74-26(7)37(56-42(63)35(23(3)4)54-41(62)33(72-10)22-73-75(68,69)70)43(64)52-29(14-13-19-51-47(49)50)39(60)53-30-16-18-34(59)58(44(30)65)38(25(6)12-2)45(66)57(8)31(40(61)55-36)21-27-15-17-32(71-9)28(48)20-27/h15,17,20,23-26,29-31,33-38,59H,11-14,16,18-19,21-22H2,1-10H3,(H,52,64)(H,53,60)(H,54,62)(H,55,61)(H,56,63)(H4,49,50,51)(H,68,69,70)/t24-,25+,26-,29-,30-,31-,33+,34+,35+,36-,37-,38+/m0/s1",CWXCKTGLJSCRKB-AVZGSPDQSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0602,Micropeptin B,,Cyanopeptolin,"Anabaenopeptilide,  Micropeptin",C47H74N8O13,958.5375345,CCCCCC(N[C@H](C(N[C@H]([C@H](C)OC([C@@H](NC(C1CC2=CC=C(O)C=C2)=O)C(C)C)=O)C(N[C@@H](CCCCN)C(NC3C(N([C@H](C(N1C)=O)CC(C)C)C(O)CC3)=O)=O)=O)=O)CCC(O)=O)=O,"InChI=1S/C47H74N8O13/c1-8-9-10-14-36(57)49-32(20-22-38(59)60)42(62)53-40-28(6)68-47(67)39(27(4)5)52-43(63)34(25-29-15-17-30(56)18-16-29)54(7)46(66)35(24-26(2)3)55-37(58)21-19-33(45(55)65)51-41(61)31(50-44(40)64)13-11-12-23-48/h15-18,26-28,31-35,37,39-40,56,58H,8-14,19-25,48H2,1-7H3,(H,49,57)(H,50,64)(H,51,61)(H,52,63)(H,53,62)(H,59,60)/t28-,31-,32-,33?,34?,35-,37?,39-,40+/m0/s1",JKIBLHXBEWIREM-KBKLCHGISA-N,,yes,Microcystis,aeruginosa,NIES 100
CyanoMetDB_0603,Cyanopeptolin C,,Cyanopeptolin,,C47H74N8O12,942.5426199,CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCCNC)O)CC(C)C)C)CC3=CC=CC=C3)C(C)C)C,"InChI=1S/C47H74N8O12/c1-9-10-12-20-36(56)49-33(26-38(58)59)42(61)53-40-29(6)67-47(66)39(28(4)5)52-43(62)34(25-30-17-13-11-14-18-30)54(8)46(65)35(24-27(2)3)55-37(57)22-21-32(45(55)64)51-41(60)31(50-44(40)63)19-15-16-23-48-7/h11,13-14,17-18,27-29,31-35,37,39-40,48,57H,9-10,12,15-16,19-26H2,1-8H3,(H,49,56)(H,50,63)(H,51,60)(H,52,62)(H,53,61)(H,58,59)/t29-,31+,32?,33?,34+,35+,37?,39+,40+/m1/s1",QOZZMIMTOTZWNP-SXJCRJPTSA-N,101656813,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_0604,Cyanopeptolin 986,,Cyanopeptolin,,C47H74N10O13,986.5436825,O=C(NC(C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC(C)C)C(O)CC1)=O)=O)=O)C(OC2=O)C)C(CCC(O)=O)NC(CCCCC)=O,"InChI=1S/C47H74N10O13/c1-8-9-10-13-35(59)51-31(19-21-37(61)62)41(64)55-39-27(6)70-46(69)38(26(4)5)54-42(65)33(24-28-14-16-29(58)17-15-28)56(7)45(68)34(23-25(2)3)57-36(60)20-18-32(44(57)67)53-40(63)30(52-43(39)66)12-11-22-50-47(48)49/h14-17,25-27,30-34,36,38-39,58,60H,8-13,18-24H2,1-7H3,(H,51,59)(H,52,66)(H,53,63)(H,54,65)(H,55,64)(H,61,62)(H4,48,49,50)",IJAPBAZLQXFSLT-UHFFFAOYSA-N,146684709,no,n.a.,n.a.,n.a.
CyanoMetDB_0605,Micropeptin K139,,Cyanopeptolin,Micropeptin,C47H74N10O13,986.5436825,O=C([C@@H](NC([C@H](NC(CCCCC)=O)CC(O)=O)=O)[C@@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@@]([C@@H](CC2)O)[C@H]([C@H](C)CC)C(N(C)[C@@H](CC3=CC=C(C=C3)O)C(N[C@H]1[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C47H74N10O13/c1-8-11-12-15-34(59)51-32(24-36(61)62)41(64)55-38-27(6)70-46(69)37(25(4)9-2)54-42(65)33(23-28-16-18-29(58)19-17-28)56(7)45(68)39(26(5)10-3)57-35(60)21-20-31(44(57)67)53-40(63)30(52-43(38)66)14-13-22-50-47(48)49/h16-19,25-27,30-33,35,37-39,58,60H,8-15,20-24H2,1-7H3,(H,51,59)(H,52,66)(H,53,63)(H,54,65)(H,55,64)(H,61,62)(H4,48,49,50)/t25-,26+,27+,30-,31-,32+,33-,35+,37-,38-,39+/m0/s1",ROTFFYYCARWRHQ-WNRHWPMLSA-N,,no,Radiocystis,feernandoi,n.a.
CyanoMetDB_0606,Micropeptin KB970A,,Cyanopeptolin,Micropeptin,C47H74N10O12,970.5487679,O=C([C@@H](NC([C@H](NC(CCCCC)=O)CC(OC)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@@H](C(C)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N[C@H]1[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C47H74N10O12/c1-9-11-13-20-34(58)51-32(25-36(60)68-8)41(62)55-38-28(6)69-46(67)37(27(5)10-2)54-42(63)33(24-29-17-14-12-15-18-29)56(7)45(66)39(26(3)4)57-35(59)22-21-31(44(57)65)53-40(61)30(52-43(38)64)19-16-23-50-47(48)49/h12,14-15,17-18,26-28,30-33,35,37-39,59H,9-11,13,16,19-25H2,1-8H3,(H,51,58)(H,52,64)(H,53,61)(H,54,63)(H,55,62)(H4,48,49,50)/t27-,28-,30-,31-,32+,33-,35+,37-,38-,39-/m0/s1",DWZLBIMMIYHXSP-ISLSKMCZSA-N,146683766,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0607,Micropeptin KB970B,,Cyanopeptolin,Micropeptin,C47H74N10O12,970.5487679,O=C([C@@H](NC([C@H](NC(CCCCC)=O)CC(O)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)OC)[C@@H](C(C)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N[C@H]1[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C47H74N10O12/c1-9-11-13-20-34(58)51-32(25-36(59)60)41(62)55-38-28(6)69-46(67)37(27(5)10-2)54-42(63)33(24-29-17-14-12-15-18-29)56(7)45(66)39(26(3)4)57-35(68-8)22-21-31(44(57)65)53-40(61)30(52-43(38)64)19-16-23-50-47(48)49/h12,14-15,17-18,26-28,30-33,35,37-39H,9-11,13,16,19-25H2,1-8H3,(H,51,58)(H,52,64)(H,53,61)(H,54,63)(H,55,62)(H,59,60)(H4,48,49,50)/t27-,28-,30-,31-,32+,33-,35+,37-,38-,39-/m0/s1",SEXRIOQKYUTUPP-ISLSKMCZSA-N,146683767,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0608,Micropeptin KB970C,,Cyanopeptolin,Micropeptin,C47H74N10O12,970.5487679,O=C([C@@H](NC([C@H](NC(CCCCC)=O)CC(OC)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)OC)[C@@H](C(C)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N[C@H]1C(C)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C47H74N10O12/c1-10-11-13-20-34(58)51-32(25-36(59)68-9)41(61)55-38-28(6)69-46(66)37(26(2)3)54-42(62)33(24-29-17-14-12-15-18-29)56(7)45(65)39(27(4)5)57-35(67-8)22-21-31(44(57)64)53-40(60)30(52-43(38)63)19-16-23-50-47(48)49/h12,14-15,17-18,26-28,30-33,35,37-39H,10-11,13,16,19-25H2,1-9H3,(H,51,58)(H,52,63)(H,53,60)(H,54,62)(H,55,61)(H4,48,49,50)/t28-,30-,31-,32+,33-,35+,37-,38-,39-/m0/s1",CDRWZRYLRIEYIE-TZWUAHKLSA-N,146683768,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0609,Micropeptin SD999,,Cyanopeptolin,Micropeptin,C47H73N11O13,999.5389315,CCCCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC(C2=CC=CC=C2N)=O)N(C)C([C@H]([C@H](CC)C)N3[C@H](O)CC[C@H](NC([C@H](CCC/N=C(N)\N)NC1=O)=O)C3=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C47H73N11O13/c1-8-10-11-18-34(60)52-31(22-36(62)63)41(65)56-38-26(6)71-46(70)37(24(3)4)55-42(66)32(23-33(59)27-15-12-13-16-28(27)48)57(7)45(69)39(25(5)9-2)58-35(61)20-19-30(44(58)68)54-40(64)29(53-43(38)67)17-14-21-51-47(49)50/h12-13,15-16,24-26,29-32,35,37-39,61H,8-11,14,17-23,48H2,1-7H3,(H,52,60)(H,53,67)(H,54,64)(H,55,66)(H,56,65)(H,62,63)(H4,49,50,51)/t25-,26-,29-,30-,31-,32-,35+,37-,38-,39-/m0/s1",FJCOMPPQROKFQZ-QZJRKFCKSA-N,,yes,Microcystis,aeruginosa,TAU IL-215
CyanoMetDB_0610,Dolastatin 16,,other cyclic peptide,other cyclic depsipeptide,C47H70N6O10,878.5153425,C[C@H]1C(=O)N2CCC[C@H]2C(=O)O[C@@H](C(=O)N([C@@H](C(=O)N3CCC[C@H]3C(=O)NC(C(=O)N4CCC[C@H]4C(=O)NC(C(C(=O)O1)C)C(C)C)C(C)CC5=CC=CC=C5)C(C)C)C)C(C)C,"InChI=1S/C47H70N6O10/c1-26(2)36-30(8)46(60)62-31(9)42(56)53-24-16-21-35(53)47(61)63-39(28(5)6)45(59)50(10)38(27(3)4)44(58)52-23-15-20-34(52)41(55)49-37(29(7)25-32-17-12-11-13-18-32)43(57)51-22-14-19-33(51)40(54)48-36/h11-13,17-18,26-31,33-39H,14-16,19-25H2,1-10H3,(H,48,54)(H,49,55)/t29?,30?,31-,33-,34-,35-,36?,37?,38+,39+/m0/s1",JXOFEBNJOOEXJY-NLKHYCKVSA-N,177386,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0611,Cyanopeptolin 1003,,Cyanopeptolin,,C47H70ClN9O13,1003.478161,O=C1N2C(CCC1NC(C(NC(C(C(C)OC(C(NC(C(N(C(C2C(C)C)=O)C)CC3=CC=C(C=C3)OCl)=O)C(C)C)=O)NC(C(CCC(N)=O)NC(C4N(CCC4)C(C)=O)=O)=O)=O)CC(C)C)=O)O,"InChI=1S/C47H70ClN9O13/c1-23(2)21-32-41(62)51-31-17-19-36(60)57(45(31)66)39(25(5)6)46(67)55(9)34(22-28-12-14-29(70-48)15-13-28)43(64)53-37(24(3)4)47(68)69-26(7)38(44(65)52-32)54-40(61)30(16-18-35(49)59)50-42(63)33-11-10-20-56(33)27(8)58/h12-15,23-26,30-34,36-39,60H,10-11,16-22H2,1-9H3,(H2,49,59)(H,50,63)(H,51,62)(H,52,65)(H,53,64)(H,54,61)",HWAWOAULBRCOMM-UHFFFAOYSA-N,146684821,no,n.a.,n.a.,n.a.
CyanoMetDB_0612,Cyanopeptolin 920,,Cyanopeptolin,,C47H68N8O11,920.500755,O=C(NC(CCCCN)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)C(C(OC2=O)C)NC(C(NC(C)=O)CC(C)C)=O,"InChI=1S/C47H68N8O11/c1-26(2)23-35(49-29(6)56)42(60)53-40-28(5)66-47(65)39(27(3)4)52-43(61)36(24-31-16-18-32(57)19-17-31)54(7)46(64)37(25-30-13-9-8-10-14-30)55-38(58)21-20-34(45(55)63)51-41(59)33(50-44(40)62)15-11-12-22-48/h8-10,13-14,16-19,26-28,33-40,57-58H,11-12,15,20-25,48H2,1-7H3,(H,49,56)(H,50,62)(H,51,59)(H,52,61)(H,53,60)",STNXNBABUAJYEA-UHFFFAOYSA-N,146683916,no,n.a.,n.a.,n.a.
CyanoMetDB_0613,Oscillapeptin J,,Cyanopeptolin,Oscillapeptin,C47H68N10O18S,1092.443377,CC[C@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@@H](NC([C@H](O)COS(=O)(O)=O)=O)CC2=CC=C(O)C=C2)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]3CC[C@@H](O)N(C([C@H](O)C)C(N(C)[C@@H](CC4=CC=C(O)C=C4)C(N1)=O)=O)C3=O)=O)=O)=O)C,"InChI=1S/C47H68N10O18S/c1-6-23(2)36-46(70)75-25(4)37(55-40(64)32(20-26-9-13-28(59)14-10-26)53-42(66)34(61)22-74-76(71,72)73)43(67)51-30(8-7-19-50-47(48)49)39(63)52-31-17-18-35(62)57(44(31)68)38(24(3)58)45(69)56(5)33(41(65)54-36)21-27-11-15-29(60)16-12-27/h9-16,23-25,30-38,58-62H,6-8,17-22H2,1-5H3,(H,51,67)(H,52,63)(H,53,66)(H,54,65)(H,55,64)(H4,48,49,50)(H,71,72,73)/t23-,24-,25+,30+,31+,32+,33+,34-,35-,36+,37+,38?/m1/s1",TYSLVBJOPFOBFU-WRXHAISRSA-N,,yes,Oscillatoria/Planktothrix,rubescens,"axenic culture from Lake Zuerih, Switzerland"
CyanoMetDB_0614,Oscillacyclin,,other cyclic peptide,,C47H66N10O14,994.4759968,CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CO)[C@@H](C)O)[C@@H](C)O)CC3=CC=CC=C3)CC(=O)N)CC4=CC=C(C=C4)O)C,"InChI=1S/C47H66N10O14/c1-6-23(2)36-44(68)49-24(3)39(63)50-30(20-28-14-16-29(61)17-15-28)40(64)52-32(21-35(48)62)47(71)57-18-10-13-34(57)43(67)51-31(19-27-11-8-7-9-12-27)41(65)55-38(26(5)60)46(70)56-37(25(4)59)45(69)53-33(22-58)42(66)54-36/h7-9,11-12,14-17,23-26,30-34,36-38,58-61H,6,10,13,18-22H2,1-5H3,(H2,48,62)(H,49,68)(H,50,63)(H,51,67)(H,52,64)(H,53,69)(H,54,66)(H,55,65)(H,56,70)/t23-,24-,25+,26+,30-,31-,32-,33-,34-,36-,37-,38-/m0/s1",BQQARIDWNCTETM-WVNVVFAISA-N,15885031,yes,Oscillatoria/Planktothrix,agardhii,n.a.
CyanoMetDB_0616,Cyanopeptolin CP962,CP 962,Cyanopeptolin,,C47H66N10O12,962.4861676,CCCC(NC(C(NC(C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)=O)C(OC2=O)C)=O)CC(O)=O)=O,"InChI=1S/C47H66N10O12/c1-6-14-35(58)51-32(25-37(60)61)41(63)55-39-27(4)69-46(68)38(26(2)3)54-42(64)33(23-28-15-9-7-10-16-28)56(5)45(67)34(24-29-17-11-8-12-18-29)57-36(59)21-20-31(44(57)66)53-40(62)30(52-43(39)65)19-13-22-50-47(48)49/h7-12,15-18,26-27,30-34,36,38-39,59H,6,13-14,19-25H2,1-5H3,(H,51,58)(H,52,65)(H,53,62)(H,54,64)(H,55,63)(H,60,61)(H4,48,49,50)",GKSSZFHZBNEQFN-UHFFFAOYSA-N,,yes,Nostoc,edaphicum,CCNP 1411 (GenBank accession number KJ161445)
CyanoMetDB_0617,Cl-Cyanopeptolin W,,Cyanopeptolin,,C47H65ClN10O13,1012.44211,O=C(N[C@H]1[C@@H](OC(C(NC([C@@H](N(C([C@@H](N2[C@H](O)CC[C@H](NC([C@@H](NC1=O)CCCNC(N)=N)=O)C2=O)CC3=CC=CC=C3)=O)C)CC4=CC(Cl)=C(O)C=C4)=O)C(C)CC)=O)C)C(CCC(O)=O)NC(C)=O,"InChI=1S/C47H65ClN10O13/c1-6-24(2)38-46(70)71-25(3)39(56-41(65)31(52-26(4)59)16-19-37(62)63)43(67)53-30(13-10-20-51-47(49)50)40(64)54-32-15-18-36(61)58(44(32)68)34(22-27-11-8-7-9-12-27)45(69)57(5)33(42(66)55-38)23-28-14-17-35(60)29(48)21-28/h7-9,11-12,14,17,21,24-25,30-34,36,38-39,60-61H,6,10,13,15-16,18-20,22-23H2,1-5H3,(H,52,59)(H,53,67)(H,54,64)(H,55,66)(H,56,65)(H,62,63)(H4,49,50,51)/t24?,25-,30-,31?,32-,33-,34-,36+,38?,39-/m0/s1",QEIMRSYKGCXPIU-PHZUTIMTSA-N,146684850,no,n.a.,n.a.,n.a.
CyanoMetDB_0618,Lyngbyastatin 8,,other cyclic peptide,Lyngbya toxin (depsipeptide),C47H64N8O12,932.4643695,C/C=C\1/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C)NC(=O)C)C)C(C)C)CC3=CC=C(C=C3)O)C)CC4=CC=CC=C4)O,"InChI=1S/C47H64N8O12/c1-10-32-41(60)50-33-20-21-36(58)55(45(33)64)35(23-29-14-12-11-13-15-29)46(65)54(9)34(22-30-16-18-31(57)19-17-30)42(61)52-38(25(4)5)47(66)67-27(7)39(44(63)49-32)53-43(62)37(24(2)3)51-40(59)26(6)48-28(8)56/h10-19,24-27,33-39,57-58H,20-23H2,1-9H3,(H,48,56)(H,49,63)(H,50,60)(H,51,59)(H,52,61)(H,53,62)/b32-10-/t26-,27+,33-,34-,35-,36+,37-,38-,39-/m0/s1",YTNMIYTUTITMBX-JUZMHORNSA-N,71718338,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_0619,Nodulopeptin 901,NP 901,Anabaenopeptin,,C47H63N7O9S,901.4407978,CC([C@H]1C(N[C@@H](CCC2=CC=CC=C2)C(N(C)[C@@H](CCC3=CC=C(O)C=C3)C(N[C@@H](CCSC)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=CC=C4)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C47H63N7O9S/c1-30(2)40-44(59)50-37(24-20-31-13-7-5-8-14-31)45(60)54(3)39(25-21-32-18-22-34(55)23-19-32)43(58)49-36(26-28-64-4)41(56)48-27-12-11-17-35(42(57)53-40)51-47(63)52-38(46(61)62)29-33-15-9-6-10-16-33/h5-10,13-16,18-19,22-23,30,35-40,55H,11-12,17,20-21,24-29H2,1-4H3,(H,48,56)(H,49,58)(H,50,59)(H,53,57)(H,61,62)(H2,51,52,63)/t35-,36+,37+,38+,39+,40+/m1/s1",JJPVZVOERCOVBN-YZPZITCLSA-N,57328459,yes,Nodularia,spumigena,KAC 66
CyanoMetDB_0620,Nodulapeptin 885,NP 885,Anabaenopeptin,,C47H63N7O8S,885.4458832,O=C(N(C(CCC1=CC=CC=C1)C(NC(CCSC)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(CC3=CC=CC=C3)C(O)=O)=O)=O)=O)CCC4=CC=CC=C4,"InChI=1S/C47H63N7O8S/c1-31(2)40-44(58)50-37(25-23-32-16-8-5-9-17-32)45(59)54(3)39(26-24-33-18-10-6-11-19-33)43(57)49-36(27-29-63-4)41(55)48-28-15-14-22-35(42(56)53-40)51-47(62)52-38(46(60)61)30-34-20-12-7-13-21-34/h5-13,16-21,31,35-40H,14-15,22-30H2,1-4H3,(H,48,55)(H,49,57)(H,50,58)(H,53,56)(H,60,61)(H2,51,52,62)",VACYSUXYVYRUHZ-UHFFFAOYSA-N,146683776,no,Nodularia,spumigena,CCNP 1431 ; CCNP 1440 ; KAC 64 ; KAC 66 ; KAC 68
CyanoMetDB_0621,Largamide C,,other cyclic peptide,other cyclic depsipeptide,C47H63N7O13,933.4483851,C/C=C\1/C(=O)N[C@@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C(C)C)NC(=O)C=C(C)C)C)CCCCC3=CC=C(C=C3)O)CCC(=O)O,"InChI=1S/C47H63N7O13/c1-8-33-42(61)50-34(21-22-38(58)59)43(62)51-35(12-10-9-11-29-13-17-31(55)18-14-29)47(66)67-28(7)40(46(65)48-27(6)41(60)49-33)54-44(63)36(24-30-15-19-32(56)20-16-30)52-45(64)39(26(4)5)53-37(57)23-25(2)3/h8,13-20,23,26-28,34-36,39-40,55-56H,9-12,21-22,24H2,1-7H3,(H,48,65)(H,49,60)(H,50,61)(H,51,62)(H,52,64)(H,53,57)(H,54,63)(H,58,59)/b33-8-/t27-,28+,34+,35-,36-,39-,40-/m0/s1",ROTNPXNPAMNTOL-VCEFGQNISA-N,16083540,yes,Oscillatoria/Planktothrix,,FL31-01
CyanoMetDB_0622,Anabaenopeptin 933,Nodulapeptin 933 ;; NP 933,Anabaenopeptin,,C47H63N7O11S,933.4306271,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CCS(C)=O)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(CC3=CC=CC=C3)C(O)=O)=O)=O)=O)CCC4=CC=C(O)C=C4,"InChI=1S/C47H63N7O11S/c1-29(2)40-44(60)50-37(23-17-30-13-19-33(55)20-14-30)45(61)54(3)39(24-18-31-15-21-34(56)22-16-31)43(59)49-36(25-27-66(4)65)41(57)48-26-9-8-12-35(42(58)53-40)51-47(64)52-38(46(62)63)28-32-10-6-5-7-11-32/h5-7,10-11,13-16,19-22,29,35-40,55-56H,8-9,12,17-18,23-28H2,1-4H3,(H,48,57)(H,49,59)(H,50,60)(H,53,58)(H,62,63)(H2,51,52,64)",DRUCHRUYJBMRNS-UHFFFAOYSA-N,146684891,no,Nodularia,spumigena,n.a.
CyanoMetDB_0623,Nodulopeptin 917,NP 917,Anabaenopeptin,,C47H63N7O10S,917.4357124,CC([C@H]1C(N[C@@H](CCC2=CC=CC=C2)C(N(C)[C@@H](CCC3=CC=C(O)C=C3)C(N[C@@H](CCS(C)=O)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=CC=C4)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C47H63N7O10S/c1-30(2)40-44(59)50-37(24-20-31-13-7-5-8-14-31)45(60)54(3)39(25-21-32-18-22-34(55)23-19-32)43(58)49-36(26-28-65(4)64)41(56)48-27-12-11-17-35(42(57)53-40)51-47(63)52-38(46(61)62)29-33-15-9-6-10-16-33/h5-10,13-16,18-19,22-23,30,35-40,55H,11-12,17,20-21,24-29H2,1-4H3,(H,48,56)(H,49,58)(H,50,59)(H,53,57)(H,61,62)(H2,51,52,63)/t35-,36+,37+,38+,39+,40+,65?/m1/s1",ULVLGVQLKGBBDN-HMKXOZJYSA-N,57328460,yes,Nodularia,spumigena,KAC 66
CyanoMetDB_0624,Anabaenopeptin 882,Anabaenopeptin 883b,Anabaenopeptin,Depsipeptide,C47H62N8O9,882.464,O=C(NC(C(NC(C(N(C)C(C(NC(C(NC1CC2=CC=CC=C2)=O)CC(NC)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CC4=CC=CC=C4,"InChI=1S/C47H62N8O9/c1-5-30(2)40-45(61)55(4)38(25-24-31-17-9-6-10-18-31)44(60)51-36(29-39(56)48-3)43(59)50-35(27-32-19-11-7-12-20-32)41(57)49-26-16-15-23-34(42(58)54-40)52-47(64)53-37(46(62)63)28-33-21-13-8-14-22-33/h6-14,17-22,30,34-38,40H,5,15-16,23-29H2,1-4H3,(H,48,56)(H,49,57)(H,50,59)(H,51,60)(H,54,58)(H,62,63)(H2,52,53,64)",JVTHGOZICQCMEX-UHFFFAOYSA-N,146684899,no,Nostoc,n.a.,CENA358
CyanoMetDB_0625,Nodulapeptin 915b,NP 915b,Anabaenopeptin,,C47H61N7O12,915.4378204,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(CC3=CC=CC=C3)C(O)=O)=O)=O)=O)CCC4=CC=C(O)C=C4,"InChI=1S/C47H61N7O12/c1-28(2)40-44(61)49-36(23-17-30-13-19-33(56)20-14-30)45(62)54(4)39(24-18-31-15-21-34(57)22-16-31)43(60)50-38(27-66-29(3)55)41(58)48-25-9-8-12-35(42(59)53-40)51-47(65)52-37(46(63)64)26-32-10-6-5-7-11-32/h5-7,10-11,13-16,19-22,28,35-40,56-57H,8-9,12,17-18,23-27H2,1-4H3,(H,48,58)(H,49,61)(H,50,60)(H,53,59)(H,63,64)(H2,51,52,65)",AEXNDRMQVGNACP-UHFFFAOYSA-N,146684901,no,Nodularia,spumigena,"CCNP 1423 ;  CCNP 1424 ; CCNP 1425 ; CCNP 1428 ;
CCNP1431 ; CCNP1440 ; KAC64 ; KAC66"
CyanoMetDB_0626,Nodulopeptin 899,NP 899,Anabaenopeptin,,C47H61N7O11,899.4429058,CC([C@H]1C(N[C@@H](CCC2=CC=CC=C2)C(N(C)[C@@H](CCC3=CC=C(O)C=C3)C(N[C@@H](COC(C)=O)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=CC=C4)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C47H61N7O11/c1-29(2)40-44(60)49-36(24-20-31-13-7-5-8-14-31)45(61)54(4)39(25-21-32-18-22-34(56)23-19-32)43(59)50-38(28-65-30(3)55)41(57)48-26-12-11-17-35(42(58)53-40)51-47(64)52-37(46(62)63)27-33-15-9-6-10-16-33/h5-10,13-16,18-19,22-23,29,35-40,56H,11-12,17,20-21,24-28H2,1-4H3,(H,48,57)(H,49,60)(H,50,59)(H,53,58)(H,62,63)(H2,51,52,64)/t35-,36+,37+,38+,39+,40+/m1/s1",GGPBHVWOLIWSOQ-YZPZITCLSA-N,57328461,yes,Nodularia,spumigena,KAC 66
CyanoMetDB_0627,Nodulapeptin 883b,NP 883b; Anabaenopeptin 883b,Anabaenopeptin,,C47H61N7O10,883.4479912,O=C(N(C(CCC1=CC=CC=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(CC3=CC=CC=C3)C(O)=O)=O)=O)=O)CCC4=CC=CC=C4,"InChI=1S/C47H61N7O10/c1-30(2)40-44(59)49-36(25-23-32-16-8-5-9-17-32)45(60)54(4)39(26-24-33-18-10-6-11-19-33)43(58)50-38(29-64-31(3)55)41(56)48-27-15-14-22-35(42(57)53-40)51-47(63)52-37(46(61)62)28-34-20-12-7-13-21-34/h5-13,16-21,30,35-40H,14-15,22-29H2,1-4H3,(H,48,56)(H,49,59)(H,50,58)(H,53,57)(H,61,62)(H2,51,52,63)",BTMJOARYLYFBPG-UHFFFAOYSA-N,146684892,no,Nodularia,spumigena,"CCNP 1440 ; CCNP 1431 ; CCNP 1428 ; CCNP 1423 ;
CCNP1424 ; CCNP1425 ; KAC64 ; KAC66 ; KAC68"
CyanoMetDB_0628,Ferintoic acid B,,Anabaenopeptin,,C47H60N8O9,880.4483255,CCC([C@H]1C(N[C@@H](CCC2=CC=C(O)C=C2)C(N(C)[C@@H](C)C(N[C@@H](CC3=CC=CC=C3)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CNC5=CC=CC=C54)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C47H60N8O9/c1-5-28(2)40-44(60)50-37(23-20-30-18-21-33(56)22-19-30)45(61)55(4)29(3)41(57)51-38(25-31-13-7-6-8-14-31)42(58)48-24-12-11-17-36(43(59)54-40)52-47(64)53-39(46(62)63)26-32-27-49-35-16-10-9-15-34(32)35/h6-10,13-16,18-19,21-22,27-29,36-40,49,56H,5,11-12,17,20,23-26H2,1-4H3,(H,48,58)(H,50,60)(H,51,57)(H,54,59)(H,62,63)(H2,52,53,64)/t28?,29-,36+,37-,38-,39-,40-/m0/s1",RZGOIGKRVXBOMH-SJZUUZHTSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0629,Pembamide,,other linear peptide,,C46H86N8O9,894.6517764,CCC(C(NC(C(N(C(C(N)C)=O)C)C(C)C)=O)C(N(C(C(N(C(C(N(C(C(N(C(C(NC(C(O)=O)C(C)C)=O)C(C)C)C)=O)C(CC)C)C)=O)C(CC)C)C)=O)C(C)C)C)=O)C,"InChI=1S/C46H86N8O9/c1-21-28(12)33(49-40(56)34(25(6)7)50(16)41(57)31(15)47)42(58)52(18)36(27(10)11)43(59)53(19)38(30(14)23-3)45(61)54(20)37(29(13)22-2)44(60)51(17)35(26(8)9)39(55)48-32(24(4)5)46(62)63/h24-38H,21-23,47H2,1-20H3,(H,48,55)(H,49,56)(H,62,63)/t28-,29-,30-,31-,32-,33-,34-,35-,36-,37-,38-/m0/s1",ZKZOWKZRKLXMAA-HTRMHDHBSA-N,132941526,yes,n.a.,n.a.,n.a.
CyanoMetDB_0630,Viridamide A,,other linear peptide,Carmabin,C46H79N5O10,861.5826938,CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)O[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)OC)N(C)C(=O)CCCC(CCCC#C)OC,"InChI=1S/C46H79N5O10/c1-16-19-20-23-33(59-14)24-21-26-35(52)49(12)39(31(10)17-2)42(54)47-36(28(4)5)41(53)48-37(29(6)7)43(55)50(13)38(30(8)9)46(58)61-40(32(11)18-3)44(56)51-27-22-25-34(51)45(57)60-15/h1,28-34,36-40H,17-27H2,2-15H3,(H,47,54)(H,48,53)/t31-,32-,33?,34-,36-,37-,38-,39-,40-/m0/s1",XKUKFJXRMIGFKU-QHUKCZFVSA-N,25111596,yes,Oscillatoria/Planktothrix,nigro-viridis ,n.a.
CyanoMetDB_0631,Jizanpeptin A,,Cyanopeptolin,Micropeptin,C46H73BrN8O16S,1104.404862,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@H](C(N([C@H](C(N[C@@H]([C@H](CC)C)C1=O)=O)CC(C=C3Br)=CC=C3OC)C)=O)[C@@H](CC)C)=O)=O)CCCCN)=O)NC([C@@H](C(C)C)NC([C@@H](COS(O)(=O)=O)O)=O)=O,"InChI=1S/C46H73BrN8O16S/c1-10-24(5)36-46(65)71-26(7)37(53-42(61)35(23(3)4)51-41(60)32(56)22-70-72(66,67)68)43(62)49-29(14-12-13-19-48)39(58)50-30-16-18-34(57)55(44(30)63)38(25(6)11-2)45(64)54(8)31(40(59)52-36)21-27-15-17-33(69-9)28(47)20-27/h15,17,20,23-26,29-32,34-38,56-57H,10-14,16,18-19,21-22,48H2,1-9H3,(H,49,62)(H,50,58)(H,51,60)(H,52,59)(H,53,61)(H,66,67,68)/t24-,25+,26-,29-,30-,31-,32+,34+,35+,36-,37-,38-/m0/s1",TYBGMNWFFZOLIN-VKMBJKMZSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0632,Kempopeptin C,,Cyanopeptolin,,C46H73ClN8O11,948.5087329,CCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC(Cl)=C(OC)C=C2)N(C)C(C([C@@H](CC)C)N3[C@H](O)CC[C@H](NC([C@H](CCCCN)NC1=O)=O)C3=O)=O)=O)=O)=O)C(C)C)=O,"InChI=1S/C46H73ClN8O11/c1-11-15-34(56)51-36(24(3)4)42(60)53-38-27(8)66-46(64)37(25(5)6)52-41(59)32(23-28-17-19-33(65-10)29(47)22-28)54(9)45(63)39(26(7)12-2)55-35(57)20-18-31(44(55)62)50-40(58)30(49-43(38)61)16-13-14-21-48/h17,19,22,24-27,30-32,35-39,57H,11-16,18,20-21,23,48H2,1-10H3,(H,49,61)(H,50,58)(H,51,56)(H,52,59)(H,53,60)/t26-,27+,30+,31+,32+,35-,36+,37+,38+,39?/m1/s1",VRMHAVSWTJTFLL-VAXVIAPHSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0633,Kempopeptin B,,Cyanopeptolin,,C46H73BrN8O11,992.458218,CCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC(Br)=C(OC)C=C2)N(C)C([C@@H]([C@@H](CC)C)[N@@]3[C@H](O)CC[C@H](NC([C@H](CCCCN)NC1=O)=O)C3=O)=O)=O)=O)=O)C(C)C)=O,"InChI=1S/C46H73BrN8O11/c1-11-15-34(56)51-36(24(3)4)42(60)53-38-27(8)66-46(64)37(25(5)6)52-41(59)32(23-28-17-19-33(65-10)29(47)22-28)54(9)45(63)39(26(7)12-2)55-35(57)20-18-31(44(55)62)50-40(58)30(49-43(38)61)16-13-14-21-48/h17,19,22,24-27,30-32,35-39,57H,11-16,18,20-21,23,48H2,1-10H3,(H,49,61)(H,50,58)(H,51,56)(H,52,59)(H,53,60)/t26-,27+,30+,31+,32+,35-,36+,37+,38+,39-/m1/s1",BESCRSMOIPNLKZ-VXFXWBCWSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0634,Lagunamide C,,other cyclic peptide,other cyclic depsipeptide,C46H73N5O10,855.5357436,CC[C@H](C)[C@H]1C[C@H]([C@H](C/C=C(/C(=O)O[C@@H](C(=O)N[C@H](C(=O)N([C@@H](C(=O)N(CC(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C)C)[C@H](C)CC)C)CC2=CC=CC=C2)C)C)[C@@H](C)CC)\C)O)C,"InChI=1S/C46H73N5O10/c1-14-27(4)37-24-31(8)36(52)23-22-30(7)45(58)61-40(29(6)16-3)41(54)47-32(9)42(55)51(13)35(25-34-20-18-17-19-21-34)43(56)49(11)26-38(53)48-39(28(5)15-2)44(57)50(12)33(10)46(59)60-37/h17-22,27-29,31-33,35-37,39-40,52H,14-16,23-26H2,1-13H3,(H,47,54)(H,48,53)/b30-22+",PMFRUEJPDMDGMJ-JBASAIQMSA-N,153274454,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0635,Pompanopeptin A,,other cyclic peptide,Depsipeptide,C46H73BrN10O12S,1068.431352,CCCC(=O)N[C@@H](CCS(=O)C)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCN=C(N)N)O)[C@@H](C)CC)C)CC3=CC(=C(C=C3)OC)Br)C(C)C)C,"InChI=1S/C46H73BrN10O12S/c1-10-13-34(58)51-30(19-21-70(9)67)40(61)55-37-26(6)69-45(66)36(24(3)4)54-41(62)32(23-27-15-17-33(68-8)28(47)22-27)56(7)44(65)38(25(5)11-2)57-35(59)18-16-31(43(57)64)53-39(60)29(52-42(37)63)14-12-20-50-46(48)49/h15,17,22,24-26,29-32,35-38,59H,10-14,16,18-21,23H2,1-9H3,(H,51,58)(H,52,63)(H,53,60)(H,54,62)(H,55,61)(H4,48,49,50)/t25-,26+,29-,30-,31-,32-,35+,36-,37-,38-,70?/m0/s1",KHHPHRPDQUMGBB-LLNFQSNNSA-N,24862182,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0636,Ribocyclophane A,,other cyclic non-peptide,Cyclophane,C46H72O14,848.492207,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O[C@H]4[C@@H]([C@@H]([C@@H](CO4)O)O)O)C)CCCC)C(=C2)O)O)O[C@H]5[C@@H]([C@@H]([C@@H](CO5)O)O)O)C,"InChI=1S/C46H72O14/c1-5-7-15-27-17-11-9-13-25(3)44(60-46-42(56)40(54)36(52)24-58-46)30-21-33(49)38(34(50)22-30)28(16-8-6-2)18-12-10-14-26(4)43(29-19-31(47)37(27)32(48)20-29)59-45-41(55)39(53)35(51)23-57-45/h19-22,25-28,35-36,39-56H,5-18,23-24H2,1-4H3/t25-,26-,27-,28-,35+,36+,39+,40+,41+,42+,43+,44+,45-,46-/m0/s1",JKEVYZYKIRFEPT-IYGPRKNSSA-N,139588676,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0637,Micropeptin SD944,,Cyanopeptolin,Micropeptin,C46H72N8O13,944.5218844,CCCCCC(N[C@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@@H]([C@@H](CC)C)N3[C@H](O)CC[C@H](NC([C@H](CCCCN)NC1=O)=O)C3=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C46H72N8O13/c1-8-10-11-15-34(56)48-32(24-36(58)59)41(61)52-38-27(6)67-46(66)37(25(3)4)51-42(62)33(23-28-16-18-29(55)19-17-28)53(7)45(65)39(26(5)9-2)54-35(57)21-20-31(44(54)64)50-40(60)30(49-43(38)63)14-12-13-22-47/h16-19,25-27,30-33,35,37-39,55,57H,8-15,20-24,47H2,1-7H3,(H,48,56)(H,49,63)(H,50,60)(H,51,62)(H,52,61)(H,58,59)/t26-,27+,30+,31+,32+,33+,35-,37+,38+,39-/m1/s1",UWSQTXKVROPVDK-FSKBKGSBSA-N,,yes,Microcystis,aeruginosa,TAU IL-215
CyanoMetDB_0638,Cyanopeptolin 972,,Cyanopeptolin,Oscillapeptin,C46H72N10O13,972.5280324,CCCCCC(N[C@@H](C(N[C@H]1[C@H](C)OC([C@H](C(C)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC(C)C)N3[C@H](O)CC[C@H](NC([C@H](CCC/N=C(N)\N)NC1=O)=O)C3=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C46H72N10O13/c1-8-9-10-13-34(58)50-31(23-36(60)61)40(63)54-38-26(6)69-45(68)37(25(4)5)53-41(64)32(22-27-14-16-28(57)17-15-27)55(7)44(67)33(21-24(2)3)56-35(59)19-18-30(43(56)66)52-39(62)29(51-42(38)65)12-11-20-49-46(47)48/h14-17,24-26,29-33,35,37-38,57,59H,8-13,18-23H2,1-7H3,(H,50,58)(H,51,65)(H,52,62)(H,53,64)(H,54,63)(H,60,61)(H4,47,48,49)/t26-,29-,30-,31+,32-,33-,35+,37-,38-/m0/s1",NKYQWHNOQNOLGP-XSMGRFOPSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0639,Micropeptin 973,,Cyanopeptolin,Micropeptin,C46H72N10O13,972.5280324,O=C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=C(O)C=C3)C)=O)CC(C)C)C(O)CC1)=O)=O)C(C(OC2=O)C)NC(C(CCC(O)=O)NC(CCCC)=O)=O,"InChI=1S/C46H72N10O13/c1-8-9-12-34(58)50-30(18-20-36(60)61)40(63)54-38-26(6)69-45(68)37(25(4)5)53-41(64)32(23-27-13-15-28(57)16-14-27)55(7)44(67)33(22-24(2)3)56-35(59)19-17-31(43(56)66)52-39(62)29(51-42(38)65)11-10-21-49-46(47)48/h13-16,24-26,29-33,35,37-38,57,59H,8-12,17-23H2,1-7H3,(H,50,58)(H,51,65)(H,52,62)(H,53,64)(H,54,63)(H,60,61)(H4,47,48,49)",OHHAWMYRUPJTKQ-UHFFFAOYSA-N,,no,Microcystis ,panniformis,MIRS-04
CyanoMetDB_0640,Cyanopeptolin A,,Cyanopeptolin,,C46H72N10O12,956.5331178,CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCN=C(N)N)O)CC(C)C)C)CC3=CC=CC=C3)C(C)C)C,"InChI=1S/C46H72N10O12/c1-8-9-11-18-34(57)50-31(24-36(59)60)40(62)54-38-27(6)68-45(67)37(26(4)5)53-41(63)32(23-28-15-12-10-13-16-28)55(7)44(66)33(22-25(2)3)56-35(58)20-19-30(43(56)65)52-39(61)29(51-42(38)64)17-14-21-49-46(47)48/h10,12-13,15-16,25-27,29-33,35,37-38,58H,8-9,11,14,17-24H2,1-7H3,(H,50,57)(H,51,64)(H,52,61)(H,53,63)(H,54,62)(H,59,60)(H4,47,48,49)",XKZZUWLVOGBTLH-UHFFFAOYSA-N,23724557,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_0641,Micropeptin KB956,,Cyanopeptolin,Micropeptin,C46H72N10O12,956.5331178,O=C([C@@H](NC([C@H](NC(CCC)=O)CC(OC)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)OC)[C@@H](C(C)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N[C@H]1[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C46H72N10O12/c1-10-16-33(57)50-31(24-35(58)67-9)40(60)54-37-27(6)68-45(65)36(26(5)11-2)53-41(61)32(23-28-17-13-12-14-18-28)55(7)44(64)38(25(3)4)56-34(66-8)21-20-30(43(56)63)52-39(59)29(51-42(37)62)19-15-22-49-46(47)48/h12-14,17-18,25-27,29-32,34,36-38H,10-11,15-16,19-24H2,1-9H3,(H,50,57)(H,51,62)(H,52,59)(H,53,61)(H,54,60)(H4,47,48,49)/t26-,27-,29-,30-,31+,32-,34+,36-,37-,38-/m0/s1",ARGQMCNKKANSBS-BQKCPCLZSA-N,146683769,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0642,Cyanopeptolin B,,Cyanopeptolin,,C46H72N8O12,928.5269698,CCCCCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCCN)O)CC(C)C)C)CC3=CC=CC=C3)C(C)C)C,"InChI=1S/C46H72N8O12/c1-8-9-11-19-35(55)48-32(25-37(57)58)41(60)52-39-28(6)66-46(65)38(27(4)5)51-42(61)33(24-29-16-12-10-13-17-29)53(7)45(64)34(23-26(2)3)54-36(56)21-20-31(44(54)63)50-40(59)30(49-43(39)62)18-14-15-22-47/h10,12-13,16-17,26-28,30-34,36,38-39,56H,8-9,11,14-15,18-25,47H2,1-7H3,(H,48,55)(H,49,62)(H,50,59)(H,51,61)(H,52,60)(H,57,58)/t28-,30+,31?,32?,33+,34+,36?,38+,39+/m1/s1",KSVGOBQTQGOLQM-PLGRJYAQSA-N,,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_0643,Apratoxin H,,other cyclic peptide,Lyngbya toxin (alkaloid),C46H71N5O8S,853.5023354,COC1=CC=C(C=C1)C[C@@H](C(N(C)[C@@H](C)C(N(C)[C@@H]([C@@H](CC)C)C(N2CCCC[C@H]2C(O[C@H](C[C@H](C[C@@H]([C@H]3C)O)C)C(C)(C)C)=O)=O)=O)=O)NC(/C(C)=C/[C@@H]4N=C3SC4)=O,"InChI=1S/C46H71N5O8S/c1-13-28(3)39-44(56)51-21-15-14-16-36(51)45(57)59-38(46(7,8)9)23-27(2)22-37(52)30(5)41-47-33(26-60-41)24-29(4)40(53)48-35(25-32-17-19-34(58-12)20-18-32)43(55)49(10)31(6)42(54)50(39)11/h17-20,24,27-28,30-31,33,35-39,52H,13-16,21-23,25-26H2,1-12H3,(H,48,53)/b29-24+/t27-,28+,30+,31-,33-,35-,36-,37-,38+,39-/m0/s1",VCMQMWKGIHWSPX-UZKHAANKSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0644,Symplocamide A,,Cyanopeptolin,,C46H71BrN10O13,1050.438545,CCCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCCNC(=O)N)O)[C@H](C)CC)C)CC3=CC(=C(C=C3)OC)Br)C(C)C)C,"InChI=1S/C46H71BrN10O13/c1-9-12-34(59)51-29(15-18-33(48)58)40(62)55-37-25(6)70-45(67)36(23(3)4)54-41(63)31(22-26-14-17-32(69-8)27(47)21-26)56(7)44(66)38(24(5)10-2)57-35(60)19-16-30(43(57)65)53-39(61)28(52-42(37)64)13-11-20-50-46(49)68/h14,17,21,23-25,28-31,35-38,60H,9-13,15-16,18-20,22H2,1-8H3,(H2,48,58)(H,51,59)(H,52,64)(H,53,61)(H,54,63)(H,55,62)(H3,49,50,68)/t24-,25+,28-,29-,30-,31-,35+,36-,37-,38-/m0/s1",XFQCUAOQRAZAJB-APLIVAFESA-N,44448139,yes,Symploca,n.a.,PNG-12/15/03-5
CyanoMetDB_0645,Nostopeptin B,,Cyanopeptolin,,C46H70N8O12,926.5113197,C[C@@H](CC)[C@H]1C(OC2C(C(NC(C(NC3CCC([N@](C3=O)[C@@H](C(N([C@H](C(N1)=O)CC4=CC=C(C=C4)O)C)=O)[C@H](CC)C)O)=O)CC(C)C)=O)N(C([C@H](CCC(N)=O)NC(C)=O)=O)CC2C)=O,"InChI=1S/C46H70N8O12/c1-10-24(5)36-46(65)66-39-26(7)22-53(43(62)30(48-27(8)55)16-18-34(47)57)38(39)42(61)50-32(20-23(3)4)40(59)49-31-17-19-35(58)54(44(31)63)37(25(6)11-2)45(64)52(9)33(41(60)51-36)21-28-12-14-29(56)15-13-28/h12-15,23-26,30-33,35-39,56,58H,10-11,16-22H2,1-9H3,(H2,47,57)(H,48,55)(H,49,59)(H,50,61)(H,51,60)/t24-,25-,26?,30-,31?,32?,33-,35?,36-,37+,38?,39?/m0/s1",QMXYZAMGCKYKHQ-FTVIHGQDSA-N,,yes,Nostoc,minutum,NIES 26
CyanoMetDB_0646,Anabaenopeptin KB906,Anabaenopeptin KB-906,Anabaenopeptin,,C46H70N10O9,906.5327239,O=C([C@H](CCC1=CC=CC=C1)NC([C@@H](NC([C@H](NC(N[C@H](C(O)=O)CCCNC(N)=N)=O)CCCCN2)=O)[C@H](CC)C)=O)N(C)[C@H](C(N[C@H](C2=O)[C@@H](C)CC)=O)CCC3=CC=C(C=C3)O,"InChI=1S/C46H70N10O9/c1-6-28(3)37-41(60)49-26-12-11-16-33(52-46(65)53-35(44(63)64)17-13-27-50-45(47)48)39(58)54-38(29(4)7-2)42(61)51-34(24-20-30-14-9-8-10-15-30)43(62)56(5)36(40(59)55-37)25-21-31-18-22-32(57)23-19-31/h8-10,14-15,18-19,22-23,28-29,33-38,57H,6-7,11-13,16-17,20-21,24-27H2,1-5H3,(H,49,60)(H,51,61)(H,54,58)(H,55,59)(H,63,64)(H4,47,48,50)(H2,52,53,65)/t28-,29-,33+,34-,35-,36-,37-,38-/m0/s1",YWBNLYSXTQFQDO-HPTCSELHSA-N,146683770,yes,n.a.,n.a.,n.a.
CyanoMetDB_0647,Anabaenopeptin 906,,Anabaenopeptin,,C46H70N10O9,906.5327239,O=C(N(C(CC(C)C)C(NC(CC1=CC=CC=C1)C2=O)=O)C)C(N(C)C(C(C(C)CC)NC(C(CCCCN2)NC(NC(CCCNC(N)=N)C(O)=O)=O)=O)=O)CCC3=CC=C(O)C=C3,"InChI=1S/C46H70N10O9/c1-7-29(4)38-43(62)55(5)36(23-20-30-18-21-32(57)22-19-30)42(61)56(6)37(26-28(2)3)41(60)51-35(27-31-14-9-8-10-15-31)39(58)49-24-12-11-16-33(40(59)54-38)52-46(65)53-34(44(63)64)17-13-25-50-45(47)48/h8-10,14-15,18-19,21-22,28-29,33-38,57H,7,11-13,16-17,20,23-27H2,1-6H3,(H,49,58)(H,51,60)(H,54,59)(H,63,64)(H4,47,48,50)(H2,52,53,65)",AIKBKNIERXNNFX-UHFFFAOYSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0648,Anabaenopeptin H-Itou,Anabaenopeptin H,Anabaenopeptin,,C46H70N10O10,922.5276385,OC1=CC=C(C=C1)CC[C@H](NC([C@H]([C@H](CC)C)N2)=O)C(N(C)[C@@H](CCC3=CC=C(C=C3)O)C(N[C@H](C(NCCCC[C@H](C2=O)NC(N[C@H](C(O)=O)CCCNC(N)=N)=O)=O)[C@H](CC)C)=O)=O,"InChI=1S/C46H70N10O10/c1-6-27(3)37-41(61)49-25-9-8-11-33(52-46(66)53-35(44(64)65)12-10-26-50-45(47)48)39(59)54-38(28(4)7-2)42(62)51-34(23-17-29-13-19-31(57)20-14-29)43(63)56(5)36(40(60)55-37)24-18-30-15-21-32(58)22-16-30/h13-16,19-22,27-28,33-38,57-58H,6-12,17-18,23-26H2,1-5H3,(H,49,61)(H,51,62)(H,54,59)(H,55,60)(H,64,65)(H4,47,48,50)(H2,52,53,66)/t27-,28-,33+,34-,35-,36-,37-,38-/m0/s1",FUQPCSMHHDRTPK-KUIUNYDASA-N,21575383,yes,Oscillatoria/Planktothrix,agardhii,NIES595
CyanoMetDB_0649,Georgamide,,other cyclic peptide,other cyclic depsipeptide,C46H69N5O10,851.5044434,CC[C@@H]([C@H]1C(N(C)[C@@H](C(C)C)C(N[C@H](C(C)C)C(OC(CCCC#C)C(C)(C)C(N[C@@H]([C@H](O)C)C(N(C)[C@@H](CC2=CC=CC=C2)C(N3CCC[C@H]3C(O1)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C46H69N5O10/c1-13-15-17-24-34-46(9,10)45(59)48-36(30(8)52)41(55)49(11)33(26-31-21-18-16-19-22-31)40(54)51-25-20-23-32(51)43(57)61-38(29(7)14-2)42(56)50(12)37(28(5)6)39(53)47-35(27(3)4)44(58)60-34/h1,16,18-19,21-22,27-30,32-38,52H,14-15,17,20,23-26H2,2-12H3,(H,47,53)(H,48,59)/t29-,30-,32+,33+,34?,35+,36+,37+,38+/m1/s1",PQGOCRXEFILOCI-GHHDHJOVSA-N,10677020,yes,n.a.,n.a.,n.a.
CyanoMetDB_0650,"(3R,2'S)-myxol 2'-fucoside",,other linear non-peptide,,C46H68O7,732.4965045,C[C@H]1[C@H]([C@H]([C@@H](C(O1)O[C@@H](CC/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[C@H](CC2(C)C)O)C)/C)/C)/C)C(C)(C)O)O)O)O ,"InChI=1S/C46H68O7/c1-31(17-12-13-18-32(2)20-15-23-34(4)25-27-39-36(6)29-38(47)30-45(39,8)9)19-14-21-33(3)22-16-24-35(5)26-28-40(46(10,11)51)53-44-43(50)42(49)41(48)37(7)52-44/h12-25,27,37-38,40-44,47-51H,26,28-30H2,1-11H3/b13-12+,19-14+,20-15+,22-16+,27-25+,31-17+,32-18+,33-21+,34-23+,35-24+/t37-,38+,40-,41+,42+,43-,44?/m0/s1",JWQCETJJOVMVED-QFDQEAMISA-N,139585140,yes,Anabaena,n.a.,PCC 7120
CyanoMetDB_0651,Carriebowmide,,other cyclic peptide,Lyngbya toxin (alkaloid),C46H68N6O9S,880.476849,CCC[C@@H]1[C@H](C(=O)O[C@@H](C(=O)N([C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)N1)C)CC(C)C)C)CC2=CC=CC=C2)CCS(=O)C)CC3=CC=CC=C3)C)C(C)C)C,"InChI=1S/C46H68N6O9S/c1-11-18-34-30(6)46(59)61-39(29(4)5)45(58)52(9)38(27-33-21-16-13-17-22-33)43(56)49-35(23-24-62(10)60)41(54)50-36(26-32-19-14-12-15-20-32)44(57)51(8)37(25-28(2)3)42(55)47-31(7)40(53)48-34/h12-17,19-22,28-31,34-39H,11,18,23-27H2,1-10H3,(H,47,55)(H,48,53)(H,49,56)(H,50,54)/t30-,31+,34-,35+,36+,37+,38-,39-,62?/m1/s1",BWWQJPMOEXIEGF-AIOXIWPNSA-N,25180706,yes,Lyngbya,polychroa,n.a.
CyanoMetDB_0652,"(3S,2?S)-4-ketomyxol 2?-fucoside",,other linear non-peptide,,C46H66O8,746.4757691,C[C@H]1[C@H]([C@H]([C@@H](C(O1)O[C@@H](CC/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)/C)C(C)(C)O)O)O)O,"InChI=1S/C46H66O8/c1-30(17-12-13-18-31(2)20-15-23-33(4)25-27-37-35(6)40(48)38(47)29-45(37,8)9)19-14-21-32(3)22-16-24-34(5)26-28-39(46(10,11)52)54-44-43(51)42(50)41(49)36(7)53-44/h12-25,27,36,38-39,41-44,47,49-52H,26,28-29H2,1-11H3/b13-12+,19-14+,20-15+,22-16+,27-25+,30-17+,31-18+,32-21+,33-23+,34-24+/t36-,38-,39-,41+,42+,43-,44?/m0/s1",FYKICBMSBYHBDI-CZUCUDRGSA-N,139588107,yes,Anabaena,n.a.,PCC 7120
CyanoMetDB_0653,Brunsvicamide B,,Anabaenopeptin,,C46H66N8O8,858.5003611,CC[C@H]([C@H](C(O)=O)NC(N[C@@H]1C(N[C@H](C(N[C@H](C(N([C@H](C(N[C@H](C(NCCCC1)=O)CC2=CC=CC=C2)=O)CC3=CNC4=CC=CC=C43)C)=O)CC(C)C)=O)[C@H](CC)C)=O)=O)C,"InChI=1S/C46H66N8O8/c1-8-28(5)38-43(58)50-36(23-27(3)4)44(59)54(7)37(25-31-26-48-33-20-14-13-19-32(31)33)42(57)49-35(24-30-17-11-10-12-18-30)40(55)47-22-16-15-21-34(41(56)52-38)51-46(62)53-39(45(60)61)29(6)9-2/h10-14,17-20,26-29,34-39,48H,8-9,15-16,21-25H2,1-7H3,(H,47,55)(H,49,57)(H,50,58)(H,52,56)(H,60,61)(H2,51,53,62)/t28-,29+,34-,35-,36-,37-,38-,39+/m0/s1",CLAPAZQQSRVIAI-IRIVFKDGSA-N,146682040,yes,Phormidium,n.a.,CCAP 1462/13
CyanoMetDB_0654,(-)Psymbamide A,,anabaenopeptin,,C46H65BrN8O8,936.410874,O=C(N(C(CC1=CNC2=CC=C(Br)C=C21)C(NC(CC3=CC=CC=C3)C4=O)=O)C)C(NC(C(CC(C)C)NC(C(CCCCN4)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CC(C)C,"InChI=1S/C46H65BrN8O8/c1-8-28(6)39(45(61)62)54-46(63)53-34-16-12-13-19-48-40(56)36(22-29-14-10-9-11-15-29)51-43(59)38(23-30-25-49-33-18-17-31(47)24-32(30)33)55(7)44(60)37(21-27(4)5)52-42(58)35(20-26(2)3)50-41(34)57/h9-11,14-15,17-18,24-28,34-39,49H,8,12-13,16,19-23H2,1-7H3,(H,48,56)(H,50,57)(H,51,59)(H,52,58)(H,61,62)(H2,53,54,63)",VFNUKKNFMAPZIA-UHFFFAOYSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0655,Anabaenopeptilide 90A,,Cyanopeptolin,Anabaenopeptilide,C46H64N8O14,952.4541988,O=C(N[C@@H](CC[C@H]1O)C2=O)[C@H](CCC3=CC=C(O)C=C3)NC([C@@H](NC([C@H](CCC(N)=O)NC=O)=O)[C@H](OC(C([C@@H](C)CC)NC([C@H](CC4=CC=C(OC)C=C4)N(C)C([C@H]([N@]12)[C@H](O)C)=O)=O)=O)C)=O,"InChI=1S/C46H64N8O14/c1-7-24(2)37-46(66)68-26(4)38(52-40(60)31(48-23-55)18-20-35(47)58)43(63)49-32(17-12-27-8-13-29(57)14-9-27)41(61)50-33-19-21-36(59)54(44(33)64)39(25(3)56)45(65)53(5)34(42(62)51-37)22-28-10-15-30(67-6)16-11-28/h8-11,13-16,23-26,31-34,36-39,56-57,59H,7,12,17-22H2,1-6H3,(H2,47,58)(H,48,55)(H,49,63)(H,50,61)(H,51,62)(H,52,60)/t24-,25+,26+,31-,32-,33-,34-,36+,37?,38-,39+/m0/s1",OWICVIMBSMKDHR-FSUOFWIBSA-N,,yes,Anabaena,n.a.,strain 90
CyanoMetDB_0656,Micropeptin LH920,,Cyanopeptolin,Micropeptin,C46H64N8O12,920.4643695,CCCCCC(=O)NCC(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)[C@@H](NC1=O)CCC(=O)N)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C46H64N8O12/c1-6-7-9-14-36(57)48-25-37(58)51-40-27(4)66-46(65)39(26(2)3)52-42(61)33(23-29-15-17-30(55)18-16-29)53(5)45(64)34(24-28-12-10-8-11-13-28)54-38(59)22-20-32(44(54)63)50-41(60)31(49-43(40)62)19-21-35(47)56/h8,10-13,15-18,26-27,31-34,38-40,55,59H,6-7,9,14,19-25H2,1-5H3,(H2,47,56)(H,48,57)(H,49,62)(H,50,60)(H,51,58)(H,52,61)/t27-,31+,32+,33+,34+,38-,39+,40+/m1/s1",FYGDKMFIZJPROV-XLZNFROESA-N,73054068,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0657,Nostopeptin BN920,,Cyanopeptolin,,C46H64N8O12,920.4643695,O=C([C@H]([C@@H](OC1=O)C)NC([C@H](NC(C)=O)CCC(N)=O)=O)N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)[C@@H](CC3=CC=CC=C3)C(N(C)[C@@H](CC4=CC=C(C=C4)O)C(N[C@H]1C(C)C)=O)=O)=O)=O)CC(C)C,"InChI=1S/C46H64N8O12/c1-24(2)21-33-41(60)49-32-18-20-37(58)54(44(32)63)35(23-28-11-9-8-10-12-28)45(64)53(7)34(22-29-13-15-30(56)16-14-29)42(61)51-38(25(3)4)46(65)66-26(5)39(43(62)50-33)52-40(59)31(48-27(6)55)17-19-36(47)57/h8-16,24-26,31-35,37-39,56,58H,17-23H2,1-7H3,(H2,47,57)(H,48,55)(H,49,60)(H,50,62)(H,51,61)(H,52,59)/t26-,31+,32-,33-,34-,35-,37+,38-,39-/m0/s1",GSMBUVTZXAPMMN-ZQPYCDFRSA-N,,yes,Nostoc,n.a.,TAU  IL-235
CyanoMetDB_0658,Nostophycin,Nostophycin A,other cyclic peptide,Nostophycin,C46H64N8O10,888.4745403,O=C([C@H](NC([C@H]([C@@H](C[C@@H](CCCC1=CC=CC=C1)O)NC([C@@H]2CCCN2C([C@H](NC3=O)[C@H](C)CC)=O)=O)O)=O)CCC(N)=O)NCC(N4CCC[C@H]4C(N[C@H]3CC5=CC=CC=C5)=O)=O,"InChI=1S/C46H64N8O10/c1-3-28(2)39-46(64)54-24-12-20-36(54)44(62)50-33(26-31(55)18-10-17-29-13-6-4-7-14-29)40(58)45(63)49-32(21-22-37(47)56)41(59)48-27-38(57)53-23-11-19-35(53)43(61)51-34(42(60)52-39)25-30-15-8-5-9-16-30/h4-9,13-16,28,31-36,39-40,55,58H,3,10-12,17-27H2,1-2H3,(H2,47,56)(H,48,59)(H,49,63)(H,50,62)(H,51,61)(H,52,60)/t28-,31-,32-,33-,34+,35+,36+,39-,40+/m1/s1",UQSINWJOXDSXPH-XHECVERBSA-N,10724374,yes,Nostoc,n.a.,152
CyanoMetDB_0659,Micropeptin EI964,,Cyanopeptolin,Micropeptin,C46H64N10O13,964.4654322,CC(N[C@@H](C(N[C@H]1[C@H](C)OC([C@H]([C@H](CC)C)NC([C@H](CC2=CC=C(O)C=C2)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CCC/N=C(N)\N)NC1=O)=O)C4=O)=O)=O)=O)=O)CC(O)=O)=O,"InChI=1S/C46H64N10O13/c1-6-24(2)37-45(68)69-25(3)38(54-40(63)32(23-36(60)61)50-26(4)57)42(65)51-30(13-10-20-49-46(47)48)39(62)52-31-18-19-35(59)56(43(31)66)34(22-27-11-8-7-9-12-27)44(67)55(5)33(41(64)53-37)21-28-14-16-29(58)17-15-28/h7-9,11-12,14-17,24-25,30-35,37-38,58-59H,6,10,13,18-23H2,1-5H3,(H,50,57)(H,51,65)(H,52,62)(H,53,64)(H,54,63)(H,60,61)(H4,47,48,49)/t24-,25-,30-,31-,32+,33-,34-,35+,37-,38-/m0/s1",WCCRMFNYIYCRFM-FSXHJALXSA-N,,yes,Microcystis,n.a.,TAU  IL-217; TAU  IL-231
CyanoMetDB_0660,Cyanopeptolin 954,,Cyanopeptolin,,C46H63ClN8O12,954.4253972,C[C@H]1[C@@H](C(N[C@H](C(N[C@H]2CC[C@H](N(C2=O)[C@H](C(N([C@H](C(N[C@H](C(O1)=O)C(C)C)=O)CC3=CC(Cl)=C(C=C3)O)C)=O)CC4=CC=CC=C4)O)=O)CC(C)C)=O)NC([C@H](CCC(N)=O)NC(C)=O)=O,"InChI=1S/C46H63ClN8O12/c1-23(2)19-32-41(61)50-31-15-18-37(59)55(44(31)64)34(21-27-11-9-8-10-12-27)45(65)54(7)33(22-28-13-16-35(57)29(47)20-28)42(62)52-38(24(3)4)46(66)67-25(5)39(43(63)51-32)53-40(60)30(49-26(6)56)14-17-36(48)58/h8-13,16,20,23-25,30-34,37-39,57,59H,14-15,17-19,21-22H2,1-7H3,(H2,48,58)(H,49,56)(H,50,61)(H,51,63)(H,52,62)(H,53,60)/t25-,30-,31-,32-,33-,34-,37+,38-,39-/m0/s1",JECPFNPTJNKMMN-LDQAUNMKSA-N,11700800,yes,Microcystis,aeruginosa,NIVA Cya 43
CyanoMetDB_0661,Dolastatin 13,,Cyanopeptolin,,C46H63N7O12,905.4534705,O=C(NC(C(N/C(C(NC1C(N(C(C(N(C(C(NC2C(C)C)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)=C/C)=O)C(OC2=O)C)C(C(C)C)NC(C(OC)CO)=O,"InChI=1S/C46H63N7O12/c1-9-30-39(56)48-31-20-21-35(55)53(44(31)61)33(23-29-18-14-11-15-19-29)45(62)52(7)32(22-28-16-12-10-13-17-28)40(57)50-37(26(4)5)46(63)65-27(6)38(43(60)47-30)51-42(59)36(25(2)3)49-41(58)34(24-54)64-8/h9-19,25-27,31-38,54-55H,20-24H2,1-8H3,(H,47,60)(H,48,56)(H,49,58)(H,50,57)(H,51,59)/b30-9-",BIMGQOUOXLLEMX-LZWSGYTISA-N,21670597,yes,Dolabella,auricularia,n.a.
CyanoMetDB_0662,Somamide B,,Cyanopeptolin,,C46H62N8O12,918.4487195,CCCC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2[C@@H](CC[C@@H](C2=O)NC(=O)/C(=C/C)/NC1=O)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C46H62N8O12/c1-7-12-36(57)48-31(19-21-35(47)56)41(60)52-39-26(5)66-46(65)38(25(3)4)51-42(61)33(23-28-15-17-29(55)18-16-28)53(6)45(64)34(24-27-13-10-9-11-14-27)54-37(58)22-20-32(44(54)63)50-40(59)30(8-2)49-43(39)62/h8-11,13-18,25-26,31-34,37-39,55,58H,7,12,19-24H2,1-6H3,(H2,47,56)(H,48,57)(H,49,62)(H,50,59)(H,51,61)(H,52,60)/b30-8-/t26-,31+,32+,33+,34+,37-,38+,39+/m1/s1",QNGONASSDVVIFN-UAMDCIPZSA-N,23657292,yes,n.a.,n.a.,n.a.
CyanoMetDB_0663,Cyanopeptolin 984,,Cyanopeptolin,,C46H62ClN9O13,983.4155608,CCC(C1C(NC2CCC(O)N(C(CC3=CC=CC=C3)C(N(C)C(CC4=CC(Cl)=C(O)C=C4)C(NC(CCC(N)=O)C(OC(C)C(NC(C(NC(C)=O)CCC(N)=O)=O)C(N1)=O)=O)=O)=O)C2=O)=O)C,"InChI=1S/C46H62ClN9O13/c1-6-23(2)38-42(64)51-30-15-19-37(61)56(44(30)66)33(21-26-10-8-7-9-11-26)45(67)55(5)32(22-27-12-16-34(58)28(47)20-27)41(63)52-31(14-18-36(49)60)46(68)69-24(3)39(43(65)53-38)54-40(62)29(50-25(4)57)13-17-35(48)59/h7-12,16,20,23-24,29-33,37-39,58,61H,6,13-15,17-19,21-22H2,1-5H3,(H2,48,59)(H2,49,60)(H,50,57)(H,51,64)(H,52,63)(H,53,65)(H,54,62)",MIEZZLJEMSUAQB-UHFFFAOYSA-N,,no,Microcystis,wesenbergii ,NIVA-CYA 172/5
CyanoMetDB_0664,Micropeptin HA983,,Cyanopeptolin,Micropeptin,C46H62ClN9O13,983.4155608,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@@H](NC(C)=O)CCC(N)=O)=O)C(N[C@@H](CCC(N)=O)C(N[C@H]2CC[C@@H](O)N([C@@H](CC3=CC=CC=C3)C(N(C)[C@@H](CC4=CC(Cl)=C(O)C=C4)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C46H62ClN9O13/c1-6-23(2)38-46(68)69-24(3)39(54-41(63)29(50-25(4)57)13-17-35(48)59)43(65)51-30(14-18-36(49)60)40(62)52-31-15-19-37(61)56(44(31)66)33(21-26-10-8-7-9-11-26)45(67)55(5)32(42(64)53-38)22-27-12-16-34(58)28(47)20-27/h7-12,16,20,23-24,29-33,37-39,58,61H,6,13-15,17-19,21-22H2,1-5H3,(H2,48,59)(H2,49,60)(H,50,57)(H,51,65)(H,52,62)(H,53,64)(H,54,63)/t23-,24-,29-,30-,31-,32-,33-,37+,38-,39-/m0/s1",CTRNIFCHKNRZTD-UIXWAHEDSA-N,,yes,Microcystis,n.a.,TAU IL-33
CyanoMetDB_0667,Largamide B,,other cyclic peptide,other cyclic depsipeptide,C46H61N7O13,919.4327351,C/C=C\1/C(=O)N[C@@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C(C)C)NC(=O)C=C(C)C)C)CCCC3=CC=C(C=C3)O)CCC(=O)O,"InChI=1S/C46H61N7O13/c1-8-32-41(60)49-33(20-21-37(57)58)42(61)50-34(11-9-10-28-12-16-30(54)17-13-28)46(65)66-27(7)39(45(64)47-26(6)40(59)48-32)53-43(62)35(23-29-14-18-31(55)19-15-29)51-44(63)38(25(4)5)52-36(56)22-24(2)3/h8,12-19,22,25-27,33-35,38-39,54-55H,9-11,20-21,23H2,1-7H3,(H,47,64)(H,48,59)(H,49,60)(H,50,61)(H,51,63)(H,52,56)(H,53,62)(H,57,58)/b32-8-/t26-,27+,33+,34-,35-,38-,39-/m0/s1",DEWDCJOBKUWRLJ-XZRXEPBESA-N,16083535,yes,Oscillatoria/Planktothrix,,FL31-01
CyanoMetDB_0668,Anabaenopeptin 871,Anabaenopeptin 872,Anabaenopeptin,,C46H61N7O10,871.4479912,O=C(NC(CC1=CC=CC=C1)C(O)=O)NC(CCCCNC(C(CCC2=CC=C(O)C=C2)NC3=O)=O)C(NC(C(CC)C)C(NC(CCC4=CC=C(O)C=C4)C(N(C)C3C)=O)=O)=O,"InChI=1S/C46H61N7O10/c1-5-28(2)39-43(59)49-37(25-19-31-16-22-34(55)23-17-31)44(60)53(4)29(3)40(56)48-36(24-18-30-14-20-33(54)21-15-30)41(57)47-26-10-9-13-35(42(58)52-39)50-46(63)51-38(45(61)62)27-32-11-7-6-8-12-32/h6-8,11-12,14-17,20-23,28-29,35-39,54-55H,5,9-10,13,18-19,24-27H2,1-4H3,(H,47,57)(H,48,56)(H,49,59)(H,52,58)(H,61,62)(H2,50,51,63)",PQROCLKHWNWBTI-UHFFFAOYSA-N,146684803,no,Nostoc,n.a.,CENA352
CyanoMetDB_0669,Micropeptin T20-PO3,,Cyanopeptolin,"Oscillapeptin, Micropeptin",C46H59N6O15P,966.3776022,O=C([C@@H](NC([C@H](COP(O)(O)=O)O)=O)[C@H](C)OC1=O)NC(C(N[C@@H]2C(N([C@@H](CC2)O)[C@@H](CC3=CC=CC=C3)C(N(C)[C@@H](CC4=CC=C(C=C4)O)C(N[C@@H]1[C@H](CC)C)=O)=O)=O)=O)CC5=CC=CC=C5,"InChI=1S/C46H59N6O15P/c1-5-26(2)38-46(62)67-27(3)39(50-42(58)36(54)25-66-68(63,64)65)43(59)48-33(22-28-12-8-6-9-13-28)40(56)47-32-20-21-37(55)52(44(32)60)35(24-29-14-10-7-11-15-29)45(61)51(4)34(41(57)49-38)23-30-16-18-31(53)19-17-30/h6-19,26-27,32-39,53-55H,5,20-25H2,1-4H3,(H,47,56)(H,48,59)(H,49,57)(H,50,58)(H2,63,64,65)/t26-,27-,32-,33?,34-,35-,36-,37+,38+,39-/m0/s1",VKNCABOVUGTPKC-TYJGFLGVSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0670,Ferintoic acid A,,Anabaenopeptin,,C46H58N8O9,866.4326755,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC3=CNC4=CC=CC=C43)=O)C(N[C@@H](C(C)C)C(N[C@@H](CCC5=CC=C(O)C=C5)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C46H58N8O9/c1-27(2)39-43(59)49-36(22-19-29-17-20-32(55)21-18-29)44(60)54(4)28(3)40(56)50-37(24-30-12-6-5-7-13-30)41(57)47-23-11-10-16-35(42(58)53-39)51-46(63)52-38(45(61)62)25-31-26-48-34-15-9-8-14-33(31)34/h5-9,12-15,17-18,20-21,26-28,35-39,48,55H,10-11,16,19,22-25H2,1-4H3,(H,47,57)(H,49,59)(H,50,56)(H,53,58)(H,61,62)(H2,51,52,63)/t28-,35+,36-,37-,38-,39-/m0/s1",ZATXZWLJJMKQDB-ZEMKBXOSSA-N,10509830,yes,n.a.,n.a.,n.a.
CyanoMetDB_0671,Micropeptin T20,,Cyanopeptolin,"Oscillapeptin, Micropeptin",C46H58N6O12,886.4112714,O=C([C@@H](NC([C@H](CO)O)=O)[C@H](C)OC1=O)NC(C(N[C@@H]2C(N([C@@H](CC2)O)[C@@H](CC3=CC=CC=C3)C(N(C)[C@@H](CC4=CC=C(C=C4)O)C(N[C@@H]1[C@H](CC)C)=O)=O)=O)=O)CC5=CC=CC=C5,"InChI=1S/C46H58N6O12/c1-5-26(2)38-46(63)64-27(3)39(50-42(59)36(55)25-53)43(60)48-33(22-28-12-8-6-9-13-28)40(57)47-32-20-21-37(56)52(44(32)61)35(24-29-14-10-7-11-15-29)45(62)51(4)34(41(58)49-38)23-30-16-18-31(54)19-17-30/h6-19,26-27,32-39,53-56H,5,20-25H2,1-4H3,(H,47,57)(H,48,60)(H,49,58)(H,50,59)/t26-,27-,32-,33?,34-,35-,36-,37+,38+,39-/m0/s1",RSZLUPQFTSUYKP-TYJGFLGVSA-N,146683648,yes,n.a.,n.a.,n.a.
CyanoMetDB_0672,Viridamide B,,other linear peptide,Carmabin,C45H77N5O10,847.5670437,CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)O[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)OC)N(C)C(=O)CCCC(CCCC#C)OC,"InChI=1S/C45H77N5O10/c1-16-18-19-22-32(58-14)23-20-25-34(51)48(12)38(31(11)17-2)41(53)46-35(27(3)4)40(52)47-36(28(5)6)42(54)49(13)37(29(7)8)45(57)60-39(30(9)10)43(55)50-26-21-24-33(50)44(56)59-15/h1,27-33,35-39H,17-26H2,2-15H3,(H,46,53)(H,47,52)/t31-,32?,33-,35-,36-,37-,38-,39-/m0/s1",NMOVUNPLGLJIRX-ZCPVWPFNSA-N,102411412,yes,Oscillatoria/Planktothrix,nigro-viridis ,n.a.
CyanoMetDB_0673,Sulfoquinovosyldiacylglycerol,,other linear non-peptide,,C45H76O12S,840.5057491,CCCCCCCCCCCCCCCC(=O)OC(COC1C(C(C(C(O1)CS(=O)(=O)O)O)O)O)COC(=O)CCCC=CCC=CCC=CCC=CCC=CCC,"InChI=1S/C45H76O12S/c1-3-5-7-9-11-13-15-17-18-19-20-22-23-25-27-29-31-33-40(46)54-35-38(36-55-45-44(50)43(49)42(48)39(57-45)37-58(51,52)53)56-41(47)34-32-30-28-26-24-21-16-14-12-10-8-6-4-2/h5,7,11,13,17-18,20,22,25,27,38-39,42-45,48-50H,3-4,6,8-10,12,14-16,19,21,23-24,26,28-37H2,1-2H3,(H,51,52,53)/b7-5+,13-11+,18-17+,22-20+,27-25+/t38?,39-,42-,43+,44-,45+/m1/s1",IIDPUWZBYVLQEU-GMJMQRIKSA-N,56842030,yes,n.a.,n.a.,n.a.
CyanoMetDB_0674,Suomilide,,other linear peptide,linear depsipeptide,C45H73N7O19S,1047.468194,CCCCCC(=O)OCC1C(C(C(C(O1)OC2CC3C(C4(C2)C(C(N3C(=O)C(C(C)CC)NC(=O)C(COS(=O)(=O)O)OC)C(=O)NCCC5=CCN(C5)C(=N)N)NC(=O)O4)O)OC(=O)CCCCC)O)O,"InChI=1S/C45H73N7O19S/c1-6-9-11-13-30(53)66-22-28-34(55)35(56)36(70-31(54)14-12-10-7-2)42(69-28)68-26-19-27-38(57)45(20-26)37(50-44(61)71-45)33(40(59)48-17-15-25-16-18-51(21-25)43(46)47)52(27)41(60)32(24(4)8-3)49-39(58)29(65-5)23-67-72(62,63)64/h16,24,26-29,32-38,42,55-57H,6-15,17-23H2,1-5H3,(H3,46,47)(H,48,59)(H,49,58)(H,50,61)(H,62,63,64)/t24-,26?,27?,28+,29?,32+,33?,34+,35-,36+,37?,38?,42-,45?/m0/s1",KAKUZTRQMKJXIH-XQKBIKNYSA-N,102505416,yes,Nodularia,spumigena,HKVV
CyanoMetDB_0675,Hoiamide B,,Cyclamide,,C45H73N5O10S3,939.4519571,CCC[C@@H](C)[C@@H]([C@H](C)[C@@H]1[C@H]([C@H](CC2=NC(=CS2)C3=N[C@](CS3)(C4=N[C@](CS4)(C(=O)N[C@H]([C@H]([C@H](C(=O)OC(C(=O)N[C@H](C(=O)O1)[C@@H](C)O)[C@@H](C)CC)C)O)[C@@H](C)CC)C)C)OC)C)O,"InChI=1S/C45H73N5O10S3/c1-14-17-24(6)34(52)26(8)37-25(7)30(58-13)18-31-46-29(19-61-31)39-49-45(12,21-62-39)43-50-44(11,20-63-43)42(57)48-32(22(4)15-2)35(53)27(9)40(55)59-36(23(5)16-3)38(54)47-33(28(10)51)41(56)60-37/h19,22-28,30,32-37,51-53H,14-18,20-21H2,1-13H3,(H,47,54)(H,48,57)/t22-,23-,24+,25-,26-,27+,28+,30-,32-,33-,34-,35-,36?,37-,44+,45+/m0/s1",KNGPFNUOXXLKCN-KKCRFZLHSA-N,139291928,yes,Symploca,n.a.,n.a.
CyanoMetDB_0676,A90720A,,Cyanopeptolin,,C45H72N10O16S,1040.484847,CC1C(C(=O)NC(C(=O)NC2CCC(N(C2=O)C(C(=O)N(C(C(=O)NC(C(=O)O1)C(C)C)CC3=CC=C(C=C3)O)C)CC(C)C)O)CCCN=C(N)N)NC(=O)C(CC(C)C)NC(=O)C(COS(=O)(=O)O)O,"InChI=1S/C45H72N10O16S/c1-22(2)18-30(51-40(62)33(57)21-70-72(67,68)69)38(60)53-36-25(7)71-44(66)35(24(5)6)52-39(61)31(20-26-11-13-27(56)14-12-26)54(8)43(65)32(19-23(3)4)55-34(58)16-15-29(42(55)64)50-37(59)28(49-41(36)63)10-9-17-48-45(46)47/h11-14,22-25,28-36,56-58H,9-10,15-21H2,1-8H3,(H,49,63)(H,50,59)(H,51,62)(H,52,61)(H,53,60)(H4,46,47,48)(H,67,68,69)/t25-,28+,29+,30-,31+,32+,33-,34-,35+,36+/m1/s1",VVBXXVAFSPEIJQ-CNCNYOROSA-N,448770,yes,Microchaete, loktakensis, IC-39-2
CyanoMetDB_0677,Tasipeptin A,,Cyanopeptolin,,C45H71N7O10,869.5262415,O=C([C@@H](NC([C@@H](NC(CCC)=O)C(C)C)=O)[C@@H](C)OC1=O)N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)[C@@H](CC(C)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N[C@H]1C(C)C)=O)=O)=O)=O)CC(C)C,"InChI=1S/C45H71N7O10/c1-12-16-34(53)48-36(26(6)7)41(57)50-38-28(10)62-45(61)37(27(8)9)49-40(56)32(23-29-17-14-13-15-18-29)51(11)44(60)33(22-25(4)5)52-35(54)20-19-30(43(52)59)46-39(55)31(21-24(2)3)47-42(38)58/h13-15,17-18,24-28,30-33,35-38,54H,12,16,19-23H2,1-11H3,(H,46,55)(H,47,58)(H,48,53)(H,49,56)(H,50,57)/t28-,30+,31+,32+,33+,35-,36+,37+,38+/m1/s1",RUCVBGWUPBXPNT-LHBJIRMKSA-N,10440686,yes,Symploca,n.a.,NIH 304
CyanoMetDB_0678,Apratoxin S8,,other cyclic peptide,Lyngbya toxin (peptide),C45H71N5O8S,841.5023354,CC[C@@H]([C@@H]1C(N2CCC[C@@H]2C(O[C@@H](C(C)(C)C)C[C@H](C)C[C@H](O)C(C)(C)C3=N[C@@H](CS3)CCC(N[C@H](CC4=CC=C(OC)C=C4)C(N(C)[C@H](C)C(N1C)=O)=O)=O)=O)=O)C,"InChI=1S/C45H71N5O8S/c1-13-28(3)38-41(55)50-22-14-15-34(50)42(56)58-36(44(5,6)7)24-27(2)23-35(51)45(8,9)43-46-31(26-59-43)18-21-37(52)47-33(25-30-16-19-32(57-12)20-17-30)40(54)48(10)29(4)39(53)49(38)11/h16-17,19-20,27-29,31,33-36,38,51H,13-15,18,21-26H2,1-12H3,(H,47,52)/t27-,28-,29-,31-,33-,34+,35-,36-,38-/m0/s1",HTKROCJPURXVPK-CFCJEBIRSA-N,102358116,yes,n.a.,n.a.,n.a.
CyanoMetDB_0679,Lagunamide A,,other cyclic peptide,other cyclic depsipeptide,C45H71N5O10,841.5200935,CC[C@H](C)[C@H]1[C@H]([C@H](C/C=C(C(O[C@@H](C(N[C@H](C(N([C@@H](C(N(CC(N[C@H](C(N([C@H](C(O1)=O)C)C)=O)[C@H](C)CC)=O)C)=O)CC2=CC=CC=C2)C)=O)C)=O)[C@@H](C)CC)=O)\C)O)C,"InChI=1S/C45H71N5O10/c1-14-26(4)37-43(56)49(12)32(10)45(58)59-38(27(5)15-2)30(8)35(51)23-22-29(7)44(57)60-39(28(6)16-3)40(53)46-31(9)41(54)50(13)34(24-33-20-18-17-19-21-33)42(55)48(11)25-36(52)47-37/h17-22,26-28,30-32,34-35,37-39,51H,14-16,23-25H2,1-13H3,(H,46,53)(H,47,52)/b29-22+",VOJKUGWTQYFABB-QUPMIFSKSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0680,1050-Da MAA,,other linear non-peptide,Mycosporine?like amino acids,C45H70N4O24,1050.437999,OCC(O)(C1)CC(NC(CCCNC2=CC(O)(CC(C2OC)=NCCCC(NC3=C(C(CC(CO)(C3)O)=O)OC)C(O)=O)CO[C@@H]4O[C@@H]([C@@H]([C@@H]([C@H]4O[C@@H]5OC[C@H]([C@@H]([C@H]5O)O)O)O)O)CO)C(O)=O)=C(OC)C1=O,"InChI=1S/C45H70N4O24/c1-67-35-23(46-8-4-6-21(39(60)61)48-25-12-43(64,18-51)14-27(53)36(25)68-2)10-45(66,20-71-42-38(33(58)32(57)30(16-50)72-42)73-41-34(59)31(56)29(55)17-70-41)11-24(35)47-9-5-7-22(40(62)63)49-26-13-44(65,19-52)15-28(54)37(26)69-3/h10,21-22,29-35,38,41-42,46,48-52,55-59,64-66H,4-9,11-20H2,1-3H3,(H,60,61)(H,62,63)/t21?,22?,29-,30-,31+,32+,33+,34-,35?,38-,41+,42-,43?,44?,45?/m1/s1",LXAQAGJUMPYUSR-USTKHRNSSA-N,,yes,Nostoc,commune,KU006
CyanoMetDB_0681,Apratoxin A sulfoxide,,other cyclic peptide,Lyngbya toxin (alkaloid),C45H69N5O9S,855.4816,CC[C@@H]([C@@H]1C(N2CCC[C@@H]2C(O[C@@H](C(C)(C)C)C[C@@H](C)C[C@H](O)[C@@H](C)C3=N[C@H](/C=C(C)/C(N[C@H](CC4=CC=C(OC)C=C4)C(N(C)[C@H](C)C(N1C)=O)=O)=O)CS3=O)=O)=O)C,"InChI=1S/C45H69N5O9S/c1-13-27(3)38-43(55)50-20-14-15-35(50)44(56)59-37(45(7,8)9)22-26(2)21-36(51)29(5)40-46-32(25-60(40)57)23-28(4)39(52)47-34(24-31-16-18-33(58-12)19-17-31)42(54)48(10)30(6)41(53)49(38)11/h16-19,23,26-27,29-30,32,34-38,51H,13-15,20-22,24-25H2,1-12H3,(H,47,52)/b28-23+/t26-,27-,29-,30-,32-,34-,35-,36-,37-,38-,60?/m0/s1",XQTNLJKLCLNKBG-BJAMGVOOSA-N,73353722,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0682,Apratoxin A,,other cyclic peptide,Lyngbya toxin,C45H69N5O8S,839.4866854,CC[C@@H]([C@@H]1C(N2CCC[C@@H]2C(O[C@@H](C(C)(C)C)C[C@@H](C)C[C@H](O)[C@@H](C)C3=N[C@H](/C=C(C)/C(N[C@H](CC4=CC=C(OC)C=C4)C(N(C)[C@H](C)C(N1C)=O)=O)=O)CS3)=O)=O)C,"InChI=1S/C45H69N5O8S/c1-13-27(3)38-43(55)50-20-14-15-35(50)44(56)58-37(45(7,8)9)22-26(2)21-36(51)29(5)40-46-32(25-59-40)23-28(4)39(52)47-34(24-31-16-18-33(57-12)19-17-31)42(54)48(10)30(6)41(53)49(38)11/h16-19,23,26-27,29-30,32,34-38,51H,13-15,20-22,24-25H2,1-12H3,(H,47,52)/b28-23+/t26-,27-,29-,30-,32-,34-,35-,36-,37-,38+/m0/s1",KXUJXPZXILTXDA-JHMIWIOGSA-N,139291939,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0683,Lagunamide B,,other cyclic peptide,other cyclic depsipeptide,C45H69N5O10,839.5044434,CC[C@@H](C)[C@H]1C(N([C@H](C(O[C@H]([C@H]([C@H](C/C=C(C(O[C@@H](C(N[C@H](C(N([C@@H](C(N(CC(N1)=O)C)=O)CC2=CC=CC=C2)C)=O)C)=O)[C@@H](C)CC)=O)\C)O)C)/C(C)=C/C)=O)C)C)=O,"InChI=1S/C45H69N5O10/c1-14-26(4)37-43(56)49(12)32(10)45(58)59-38(27(5)15-2)30(8)35(51)23-22-29(7)44(57)60-39(28(6)16-3)40(53)46-31(9)41(54)50(13)34(24-33-20-18-17-19-21-33)42(55)48(11)25-36(52)47-37/h15,17-22,26,28,30-32,34-35,37-39,51H,14,16,23-25H2,1-13H3,(H,46,53)(H,47,52)/b27-15+,29-22+",AEOXIHQSVQNFCU-HBFICKBQSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0684,Scyptolin A,,Cyanopeptolin,,C45H69ClN8O14,980.4621766,C[C@H]1OC([C@H](NC([C@@H](N(C([C@H](N2C([C@H](CC[C@@H]2O)NC([C@@H](NC([C@@H]1NC([C@H](NC([C@H](NC(CCC)=O)C)=O)[C@@H](C)O)=O)=O)CC(C)C)=O)=O)[C@@H](C)O)=O)C)CC(C=C3)=CC(Cl)=C3O)=O)C(C)C)=O,"InChI=1S/C45H69ClN8O14/c1-11-12-32(58)47-22(6)38(60)51-35(23(7)55)41(63)52-36-25(9)68-45(67)34(21(4)5)50-40(62)30(19-26-13-15-31(57)27(46)18-26)53(10)44(66)37(24(8)56)54-33(59)16-14-28(43(54)65)48-39(61)29(17-20(2)3)49-42(36)64/h13,15,18,20-25,28-30,33-37,55-57,59H,11-12,14,16-17,19H2,1-10H3,(H,47,58)(H,48,61)(H,49,64)(H,50,62)(H,51,60)(H,52,63)/t22-,23-,24-,25-,28+,29+,30+,33+,34-,35-,36-,37-/m1/s1",IZUSQHCHSMJXLV-DEGMBRQQSA-N,,yes,Scytonema,hofmannii,PCC 7110
CyanoMetDB_0685,Dolastatin 15,,other linear peptide,Oscillapeptin,C45H68N6O9,836.5047778,CC(C)[C@@](C(N1[C@@](CCC1)([H])C(N2C(CCC2)C(O[C@@](C(N3C(C=C([C@@]3([H])CC4=CC=CC=C4)OC)=O)=O)([H])C(C)C)=O)=O)=O)([H])N(C)C([C@@](C(C)C)([H])NC([C@](C(C)C)([H])N(C)C)=O)=O,"InChI=1S/C45H68N6O9/c1-26(2)36(46-40(53)37(27(3)4)47(9)10)42(55)48(11)38(28(5)6)43(56)49-22-16-20-31(49)41(54)50-23-17-21-32(50)45(58)60-39(29(7)8)44(57)51-33(34(59-12)25-35(51)52)24-30-18-14-13-15-19-30/h13-15,18-19,25-29,31-33,36-39H,16-17,20-24H2,1-12H3,(H,46,53)/t31-,32?,33-,36+,37-,38-,39+/m1/s1",LQKSHSFQQRCAFW-SPHVGREFSA-N,,yes,Dolabella,auricularia,n.a.
CyanoMetDB_0687,Anabaenopeptin HU892,,Anabaenopeptin,,C45H68N10O9,892.5170738,CC[C@H](C)[C@H]1C(=O)NCCCC[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N1)CCC2=CC=C(C=C2)O)C)CCC3=CC=CC=C3)C(C)C)NC(=O)N[C@@H](CCCN=C(N)N)C(=O)O,"InChI=1S/C45H68N10O9/c1-6-28(4)37-40(59)48-25-11-10-15-32(51-45(64)52-34(43(62)63)16-12-26-49-44(46)47)38(57)53-36(27(2)3)41(60)50-33(23-19-29-13-8-7-9-14-29)42(61)55(5)35(39(58)54-37)24-20-30-17-21-31(56)22-18-30/h7-9,13-14,17-18,21-22,27-28,32-37,56H,6,10-12,15-16,19-20,23-26H2,1-5H3,(H,48,59)(H,50,60)(H,53,57)(H,54,58)(H,62,63)(H4,46,47,49)(H2,51,52,64)/t28-,32+,33-,34-,35-,36-,37-/m0/s1",ZAPKLLKIVMKJFJ-RCYTZTELSA-N,102483843,yes,Microcystis,aeruginosa,TAU IL-342
CyanoMetDB_0688,Anabaenopeptin 908,,Anabaenopeptin,,C45H68N10O10,908.5119884,CC[C@H](C)C1C(=O)NCCCC[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N(C(C(=O)N1)CCC2=CC=C(C=C2)O)C)CCC3=CC=C(C=C3)O)C(C)C)NC(=O)N[C@@H](CCCN=C(N)N)C(=O)O,"InChI=1S/C45H68N10O10/c1-6-27(4)37-40(60)48-24-8-7-10-32(51-45(65)52-34(43(63)64)11-9-25-49-44(46)47)38(58)53-36(26(2)3)41(61)50-33(22-16-28-12-18-30(56)19-13-28)42(62)55(5)35(39(59)54-37)23-17-29-14-20-31(57)21-15-29/h12-15,18-21,26-27,32-37,56-57H,6-11,16-17,22-25H2,1-5H3,(H,48,60)(H,50,61)(H,53,58)(H,54,59)(H,63,64)(H4,46,47,49)(H2,51,52,65)/t27-,32+,33-,34-,35-,36-,37-/m0/s1",FPSCSFRHCCJLDN-ORCWKVIUSA-N,25210015,yes,Oscillatoria/Planktothrix,agardhii ,CYA 126/8
CyanoMetDB_0689,Anabaenopeptin G-Erhard,Anabaenopeptin G,Anabaenopeptin,,C45H68N10O10,908.5119884,OC1=CC=C(CCC(C(N(C(CC(C)C)C(NC(CC2=CC=C(O)C=C2)C(NCCCCC(NC(NC(C(O)=O)CCCNC(N)=N)=O)C3=O)=O)=O)C)=O)NC(C(N3)C(C)CC)=O)C=C1,"InChI=1S/C45H68N10O10/c1-6-27(4)37-41(61)50-33(21-16-28-12-17-30(56)18-13-28)42(62)55(5)36(24-26(2)3)40(60)51-35(25-29-14-19-31(57)20-15-29)38(58)48-22-8-7-10-32(39(59)54-37)52-45(65)53-34(43(63)64)11-9-23-49-44(46)47/h12-15,17-20,26-27,32-37,56-57H,6-11,16,21-25H2,1-5H3,(H,48,58)(H,50,61)(H,51,60)(H,54,59)(H,63,64)(H4,46,47,49)(H2,52,53,65)",QWXYNYACLYWMMJ-UHFFFAOYSA-N,,no,Oscillatoria/Planktothrix,agardhii,HUB011
CyanoMetDB_0690,Anabaenopeptin 877b,Anabaenopeptin 878 Lys in P1,Anabaenopeptin,,C45H67N9O9,877.5061748,O=C(NC(CCCCN)C(O)=O)NC(CCCCNC1=O)C(NC(C(C)CC)C(NC(CCC2=CC=CC=C2)C(NC(CC(NC)=O)C(N(CC)C1CC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C45H67N9O9/c1-5-29(3)38-42(59)49-33(24-23-30-17-9-7-10-18-30)39(56)50-35(28-37(55)47-4)43(60)54(6-2)36(27-31-19-11-8-12-20-31)41(58)48-26-16-14-21-32(40(57)53-38)51-45(63)52-34(44(61)62)22-13-15-25-46/h7-12,17-20,29,32-36,38H,5-6,13-16,21-28,46H2,1-4H3,(H,47,55)(H,48,58)(H,49,59)(H,50,56)(H,53,57)(H,61,62)(H2,51,52,63)",LIKRYFQXLJBHLY-UHFFFAOYSA-N,146684804,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0691,Nodulapeptin 881b,NP 881b ;; Anabaenopeptin 881b,Anabaenopeptin,,C45H67N7O9S,881.4720979,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CCSC)C2=O)=O)C)C(NC(C(C(CC)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C45H67N7O9S/c1-7-28(3)37-42(57)48-35(23-19-30-14-10-9-11-15-30)43(58)52(5)36(24-20-31-17-21-32(53)22-18-31)41(56)47-34(25-27-62-6)39(54)46-26-13-12-16-33(40(55)50-37)49-45(61)51-38(44(59)60)29(4)8-2/h9-11,14-15,17-18,21-22,28-29,33-38,53H,7-8,12-13,16,19-20,23-27H2,1-6H3,(H,46,54)(H,47,56)(H,48,57)(H,50,55)(H,59,60)(H2,49,51,61)",YNLGZOMVPIVMEJ-UHFFFAOYSA-N,146684893,no,Nodularia,spumigena,"CCNP 1402 ; BY 1 ; CCY 9414 ; AV 1 ; CCNP 1427 ; 
CCNP1436 ; KAC7 ; KAC71"
CyanoMetDB_0692,Anabaenopeptin T,,Anabaenopeptin,,C45H67N7O10,865.4949414,CC[C@H](C)[C@H]1C(=O)NCCCC[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N1)CCC2=CC=C(C=C2)O)C)CCC3=CC=C(C=C3)O)C(C)C)NC(=O)N[C@@H]([C@@H](C)CC)C(=O)O,"InChI=1S/C45H67N7O10/c1-8-27(5)37-41(57)46-25-11-10-12-33(48-45(62)51-38(44(60)61)28(6)9-2)39(55)49-36(26(3)4)42(58)47-34(23-17-29-13-19-31(53)20-14-29)43(59)52(7)35(40(56)50-37)24-18-30-15-21-32(54)22-16-30/h13-16,19-22,26-28,33-38,53-54H,8-12,17-18,23-25H2,1-7H3,(H,46,57)(H,47,58)(H,49,55)(H,50,56)(H,60,61)(H2,48,51,62)/t27-,28-,33+,34-,35-,36-,37-,38-/m0/s1",VYPFYBBXIZBMND-KUIUNYDASA-N,44558923,yes,n.a.,n.a.,n.a.
CyanoMetDB_0693,(E)-Dehydroapratoxin A,,other cyclic peptide,other cyclic depsipeptide,C45H67N5O7S,821.4761207,CCC([C@@H]1C(N2CCC[C@@H]2C(O[C@@H](C(C)(C)C)C[C@@H](C)C/C=C(C)/C3=N[C@H](/C=C(C)/C(N[C@H](CC4=CC=C(OC)C=C4)C(N(C)[C@H](C)C(N1C)=O)=O)=O)CS3)=O)=O)C,"InChI=1S/C45H67N5O7S/c1-13-28(3)38-43(54)50-22-14-15-36(50)44(55)57-37(45(7,8)9)23-27(2)16-17-29(4)40-46-33(26-58-40)24-30(5)39(51)47-35(25-32-18-20-34(56-12)21-19-32)42(53)48(10)31(6)41(52)49(38)11/h17-21,24,27-28,31,33,35-38H,13-16,22-23,25-26H2,1-12H3,(H,47,51)/b29-17-,30-24+",RDTKVQUPKFRZEV-IBYWBQMSSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0695,Anabaenopeptin 905,,Anabaenopeptin,,C45H67N11O9,905.5123228,O=C(N(C(CC(N)=O)C(NC(CC1=CC=CC=C1)C2=O)=O)C)C(N(CC)C(C(C(C)CC)NC(C(CCCCN2)NC(NC(CCCNC(N)=N)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C45H67N11O9/c1-5-28(3)37-42(62)56(6-2)34(23-22-29-16-9-7-10-17-29)41(61)55(4)35(27-36(46)57)40(60)51-33(26-30-18-11-8-12-19-30)38(58)49-24-14-13-20-31(39(59)54-37)52-45(65)53-32(43(63)64)21-15-25-50-44(47)48/h7-12,16-19,28,31-35,37H,5-6,13-15,20-27H2,1-4H3,(H2,46,57)(H,49,58)(H,51,60)(H,54,59)(H,63,64)(H4,47,48,50)(H2,52,53,65)",VHBIGUIDSRLROD-UHFFFAOYSA-N,146684805,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0697,Anabaenopeptin 863a,Anabaenopeptin 864,Anabaenopeptin,,C45H66N8O9,862.4952757,O=C(NC(C(NC(C(N(CC)C(C(N(C)C(C(NC1CC2=CC=CC=C2)=O)CC(N)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CC(C)C,"InChI=1S/C45H66N8O9/c1-7-29(5)38-43(59)53(8-2)35(23-22-30-17-11-9-12-18-30)42(58)52(6)36(27-37(46)54)41(57)48-33(26-31-19-13-10-14-20-31)39(55)47-24-16-15-21-32(40(56)51-38)49-45(62)50-34(44(60)61)25-28(3)4/h9-14,17-20,28-29,32-36,38H,7-8,15-16,21-27H2,1-6H3,(H2,46,54)(H,47,55)(H,48,57)(H,51,56)(H,60,61)(H2,49,50,62)",IKFBCVDNSQTTTF-UHFFFAOYSA-N,146684900,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0699,Nodulapeptin 879,NP 879,Anabaenopeptin,,C45H65N7O11,879.4742059,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(C(CC)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C45H65N7O11/c1-7-27(3)37-42(58)47-34(23-19-30-14-10-9-11-15-30)43(59)52(6)36(24-20-31-17-21-32(54)22-18-31)41(57)48-35(26-63-29(5)53)39(55)46-25-13-12-16-33(40(56)50-37)49-45(62)51-38(44(60)61)28(4)8-2/h9-11,14-15,17-18,21-22,27-28,33-38,54H,7-8,12-13,16,19-20,23-26H2,1-6H3,(H,46,55)(H,47,58)(H,48,57)(H,50,56)(H,60,61)(H2,49,51,62)",LTVNLDSXISIYIL-UHFFFAOYSA-N,146684894,no,Nodularia,spumigena,"CCNP 1402 ; BY 1 ; CCY 9414 ; AV 1 ; CCNP 1427 ; 
CCNP1436 ; KAC7 ; KAC71"
CyanoMetDB_0700,Nodulapeptin 863,NP 863,Anabaenopeptin,,C45H65N7O10,863.4792913,O=C(N(C(CCC1=CC=CC=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(C(CC)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C45H65N7O10/c1-7-28(3)37-42(57)47-34(24-22-31-17-11-9-12-18-31)43(58)52(6)36(25-23-32-19-13-10-14-20-32)41(56)48-35(27-62-30(5)53)39(54)46-26-16-15-21-33(40(55)50-37)49-45(61)51-38(44(59)60)29(4)8-2/h9-14,17-20,28-29,33-38H,7-8,15-16,21-27H2,1-6H3,(H,46,54)(H,47,57)(H,48,56)(H,50,55)(H,59,60)(H2,49,51,61)",JWTLSWXNBWLNPD-UHFFFAOYSA-N,146683777,no,Nodularia,spumigena,AV1
CyanoMetDB_0701,Brunsvicamide A,,Anabaenopeptin,,C45H64N8O8,844.4847111,CC[C@H]([C@H](C(O)=O)NC(N[C@@H]1C(N[C@H](C(N[C@H](C(N([C@H](C(N[C@H](C(NCCCC1)=O)CC2=CC=CC=C2)=O)CC3=CNC4=CC=CC=C43)C)=O)CC(C)C)=O)C(C)C)=O)=O)C,"InChI=1S/C45H64N8O8/c1-8-28(6)38(44(59)60)52-45(61)50-33-20-14-15-21-46-39(54)34(23-29-16-10-9-11-17-29)48-41(56)36(24-30-25-47-32-19-13-12-18-31(30)32)53(7)43(58)35(22-26(2)3)49-42(57)37(27(4)5)51-40(33)55/h9-13,16-19,25-28,33-38,47H,8,14-15,20-24H2,1-7H3,(H,46,54)(H,48,56)(H,49,57)(H,51,55)(H,59,60)(H2,50,52,61)/t28-,33+,34+,35+,36+,37+,38-/m1/s1",QOCMZEOVWQAOFT-YDCNANBYSA-N,,yes,Phormidium,n.a.,CCAP 1462/13
CyanoMetDB_0702,Brunsvicamide C,,Anabaenopeptin,,C45H64N8O10,876.4745403,CC[C@H]([C@H](C(O)=O)NC(N[C@@H]1C(N[C@H](C(N[C@H](C(N([C@@H](C(N[C@H](C(NCCCC1)=O)CC2=CC=CC=C2)=O)CC(C3=C(NC([H])=O)C=CC=C3)=O)C)=O)CC(C)C)=O)C(C)C)=O)=O)C,"InChI=1S/C45H64N8O10/c1-8-28(6)38(44(61)62)52-45(63)50-32-20-14-15-21-46-39(56)33(23-29-16-10-9-11-17-29)48-41(58)35(24-36(55)30-18-12-13-19-31(30)47-25-54)53(7)43(60)34(22-26(2)3)49-42(59)37(27(4)5)51-40(32)57/h9-13,16-19,25-28,32-35,37-38H,8,14-15,20-24H2,1-7H3,(H,46,56)(H,47,54)(H,48,58)(H,49,59)(H,51,57)(H,61,62)(H2,50,52,63)/t28-,32+,33+,34+,35-,37+,38-/m1/s1",HQMATMGVGJKSPD-MMHNDARSSA-N,146682035,yes,Phormidium,n.a.,CCAP 1462/13
CyanoMetDB_0703,Cyanopeptolin 960,,Cyanopeptolin,,C45H64N6O15S,960.4150366,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@H](C(N([C@@H](C(N[C@@H]([C@@H](CC)C)C1=O)=O)CC3=CC=CC=C3)C)=O)[C@H](C)CC)=O)=O)CCC(C=C4)=CC=C4O)=O)NC([C@@H](COS(O)(=O)=O)OC)=O,"InChI=1S/C45H64N6O15S/c1-8-25(3)36-45(60)66-27(5)37(49-41(56)34(64-7)24-65-67(61,62)63)42(57)46-31(20-17-28-15-18-30(52)19-16-28)39(54)47-32-21-22-35(53)51(43(32)58)38(26(4)9-2)44(59)50(6)33(40(55)48-36)23-29-13-11-10-12-14-29/h10-16,18-19,25-27,31-38,52-53H,8-9,17,20-24H2,1-7H3,(H,46,57)(H,47,54)(H,48,55)(H,49,56)(H,61,62,63)/t25-,26-,27+,31+,32+,33-,34-,35-,36+,37+,38+/m1/s1",UGFHKRCKPZSIIX-HKDLZGAVSA-N,,yes,Oscillatoria/Planktothrix,agardhii ,CYA 126/8
CyanoMetDB_0704,Cyanopeptolin 880,,Cyanopeptolin,Micropeptin,C45H64N6O12,880.4582215,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@H](C(N([C@@H](C(N[C@@H]([C@@H](CC)C)C1=O)=O)CC3=CC=CC=C3)C)=O)[C@H](C)CC)=O)=O)CCC(C=C4)=CC=C4O)=O)NC([C@@H](CO)OC)=O,"InChI=1S/C45H64N6O12/c1-8-25(3)36-45(61)63-27(5)37(49-41(57)34(24-52)62-7)42(58)46-31(20-17-28-15-18-30(53)19-16-28)39(55)47-32-21-22-35(54)51(43(32)59)38(26(4)9-2)44(60)50(6)33(40(56)48-36)23-29-13-11-10-12-14-29/h10-16,18-19,25-27,31-38,52-54H,8-9,17,20-24H2,1-7H3,(H,46,58)(H,47,55)(H,48,56)(H,49,57)/t25-,26-,27+,31+,32+,33-,34-,35-,36+,37+,38+/m1/s1",AQKSWWARSJIVMX-HKDLZGAVSA-N,,yes,Oscillatoria/Planktothrix,agardhii ,CYA 126/8
CyanoMetDB_0705,Kororamide,,Cyclamide,,C45H64N10O10S2,968.4248306,CC(C[C@H]1C(N[C@H](C2=NC(C(N[C@H](C(N3[C@H](C(N[C@@H](CO)C(NC(CC(C)C)C4=NC(C(N[C@H]([C@H](CC)C)C(N1)=O)=O)CS4)=O)=O)CCC3)=O)CC(N)=O)=O)=CS2)CC5=CC=C(O)C=C5)=O)C,"InChI=1S/C45H64N10O10S2/c1-7-24(6)36-42(64)47-27(15-22(2)3)37(59)49-29(17-25-10-12-26(57)13-11-25)44-52-32(20-67-44)39(61)50-30(18-35(46)58)45(65)55-14-8-9-34(55)41(63)51-31(19-56)38(60)48-28(16-23(4)5)43-53-33(21-66-43)40(62)54-36/h10-13,20,22-24,27-31,33-34,36,56-57H,7-9,14-19,21H2,1-6H3,(H2,46,58)(H,47,64)(H,48,60)(H,49,59)(H,50,61)(H,51,63)(H,54,62)/t24-,27-,28?,29-,30-,31-,33?,34-,36+/m0/s1",GDDNCLFCDXEDQH-GCAKBHEESA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0706,Micropeptin SF909,,Cyanopeptolin,Micropeptin,C45H63N7O13,909.4483851,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=C(C=C3)O)C)CC(C)C)O)CCC(=O)N)NC(=O)[C@H](CC4=CC=C(C=C4)O)O)C,"InChI=1S/C45H63N7O13/c1-7-24(4)37-45(64)65-25(5)38(50-41(60)34(55)22-27-10-14-29(54)15-11-27)42(61)47-30(16-18-35(46)56)39(58)48-31-17-19-36(57)52(43(31)62)33(20-23(2)3)44(63)51(6)32(40(59)49-37)21-26-8-12-28(53)13-9-26/h8-15,23-25,30-34,36-38,53-55,57H,7,16-22H2,1-6H3,(H2,46,56)(H,47,61)(H,48,58)(H,49,59)(H,50,60)/t24?,25-,30+,31+,32+,33+,34+,36-,37+,38+/m1/s1",GONSYIOELLNJMK-LZBSBXODSA-N,10033722,yes,n.a.,n.a.,n.a.
CyanoMetDB_0707,Anabaenopeptilide 90B,,Cyanopeptolin,Anabaenopeptilide,C45H61ClN8O14,972.3995764,O=C(N[C@@H](CC[C@H]1O)C2=O)[C@H](CCC3=CC=C(O)C=C3)NC([C@@H](NC([C@H](CCC(N)=O)NC=O)=O)[C@H](OC(C([C@@H](C)CC)NC([C@H](CC4=CC(Cl)=C(O)C=C4)N(C)C([C@H]([N@]12)[C@H](O)C)=O)=O)=O)C)=O,"InChI=1S/C45H61ClN8O14/c1-6-22(2)36-45(67)68-24(4)37(52-39(61)29(48-21-55)14-17-34(47)59)42(64)49-30(13-9-25-7-11-27(57)12-8-25)40(62)50-31-15-18-35(60)54(43(31)65)38(23(3)56)44(66)53(5)32(41(63)51-36)20-26-10-16-33(58)28(46)19-26/h7-8,10-12,16,19,21-24,29-32,35-38,56-58,60H,6,9,13-15,17-18,20H2,1-5H3,(H2,47,59)(H,48,55)(H,49,64)(H,50,62)(H,51,63)(H,52,61)",HVJQTJPQRUVUKC-TYKAZTJCSA-N,,yes,Anabaena,n.a.,strain 90
CyanoMetDB_0709,Anabaenopeptin NZ841,Nostamide A ;; AP 841,Anabaenopeptin,,C45H59N7O9,841.4374265,CC[C@H]([C@H]1C(N[C@@H](CCC2=CC=C(O)C=C2)C(N(C)CC(N[C@@H](CCC3=CC=CC=C3)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=CC=C4)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C45H59N7O9/c1-4-29(2)39-42(57)48-36(25-21-31-18-22-33(53)23-19-31)43(58)52(3)28-38(54)47-35(24-20-30-13-7-5-8-14-30)40(55)46-26-12-11-17-34(41(56)51-39)49-45(61)50-37(44(59)60)27-32-15-9-6-10-16-32/h5-10,13-16,18-19,22-23,29,34-37,39,53H,4,11-12,17,20-21,24-28H2,1-3H3,(H,46,55)(H,47,54)(H,48,57)(H,51,56)(H,59,60)(H2,49,50,61)/t29-,34-,35+,36+,37+,39+/m1/s1",SYWACJBJVZMIAB-FVGXMBITSA-N,25136362,yes,Anabaena,n.a.,TAU NZ-3-1
CyanoMetDB_0710,Nostamide A,,Anabaenopeptin,,C45H59N7O9,841.4374265,O=C(N(CC(NC(CCC1=CC=C(O)C=C1)C2=O)=O)C)C(NC(C(C(C)CC)NC(C(CCCCN2)NC(NC(CC3=CC=CC=C3)C(O)=O)=O)=O)=O)CCC4=CC=CC=C4,"InChI=1S/C45H59N7O9/c1-4-29(2)39-42(57)48-36(25-21-30-13-7-5-8-14-30)43(58)52(3)28-38(54)47-35(24-20-31-18-22-33(53)23-19-31)40(55)46-26-12-11-17-34(41(56)51-39)49-45(61)50-37(44(59)60)27-32-15-9-6-10-16-32/h5-10,13-16,18-19,22-23,29,34-37,39,53H,4,11-12,17,20-21,24-28H2,1-3H3,(H,46,55)(H,47,54)(H,48,57)(H,51,56)(H,59,60)(H2,49,50,61)",CTLZWDJBHPYFAL-UHFFFAOYSA-N,146683876,no,Nostoc ,punctiforme,PCC7 310
CyanoMetDB_0711,Anabaenopeptin NZ825,,Anabaenopeptin,,C45H59N7O8,825.4425119,CC[C@H]([C@H]1C(N[C@@H](CCC2=CC=CC=C2)C(N(C)CC(N[C@@H](CCC3=CC=CC=C3)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=CC=C4)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C45H59N7O8/c1-4-30(2)39-42(56)48-36(26-24-32-18-10-6-11-19-32)43(57)52(3)29-38(53)47-35(25-23-31-16-8-5-9-17-31)40(54)46-27-15-14-22-34(41(55)51-39)49-45(60)50-37(44(58)59)28-33-20-12-7-13-21-33/h5-13,16-21,30,34-37,39H,4,14-15,22-29H2,1-3H3,(H,46,54)(H,47,53)(H,48,56)(H,51,55)(H,58,59)(H2,49,50,60)/t30-,34-,35+,36+,37+,39+/m1/s1",ZGGULPKYNHMDEV-YSWQSDMFSA-N,102477994,yes,Anabaena,n.a.,TAU NZ-3-1
CyanoMetDB_0712,Tiglicamide A,,other cyclic peptide,other cyclic depsipeptide,C45H59N7O13,905.417085,C/C=C\1/C(=O)N[C@@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C(C)C)NC(=O)/C(=C/C)/C)C)CCC3=CC=C(C=C3)O)CCC(=O)O,"InChI=1S/C45H59N7O13/c1-8-24(5)38(57)51-36(23(3)4)43(62)50-34(22-28-12-17-30(54)18-13-28)42(61)52-37-26(7)65-45(64)33(19-14-27-10-15-29(53)16-11-27)49-41(60)32(20-21-35(55)56)48-40(59)31(9-2)47-39(58)25(6)46-44(37)63/h8-13,15-18,23,25-26,32-34,36-37,53-54H,14,19-22H2,1-7H3,(H,46,63)(H,47,58)(H,48,59)(H,49,60)(H,50,62)(H,51,57)(H,52,61)(H,55,56)/b24-8+,31-9-/t25-,26+,32+,33-,34+,36-,37-/m0/s1",QBFLXQREXRVZCV-IAOICVMWSA-N,44606522,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0713,Oscillamide Y,,Anabaenopeptin,,C45H59N7O10,857.4323411,C[C@@H]([C@H]1C(NC(CCC2=CC=C(O)C=C2)C(N(C)C(C)C(N[C@@H](CC3=CC=CC=C3)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=C(O)C=C4)=O)C(N1)=O)=O)=O)=O)=O)CC,"InChI=1S/C45H59N7O10/c1-5-27(2)38-42(58)47-35(23-18-29-14-19-32(53)20-15-29)43(59)52(4)28(3)39(55)48-36(25-30-11-7-6-8-12-30)40(56)46-24-10-9-13-34(41(57)51-38)49-45(62)50-37(44(60)61)26-31-16-21-33(54)22-17-31/h6-8,11-12,14-17,19-22,27-28,34-38,53-54H,5,9-10,13,18,23-26H2,1-4H3,(H,46,56)(H,47,58)(H,48,55)(H,51,57)(H,60,61)(H2,49,50,62)/t27-,28?,34-,35?,36+,37+,38+/m1/s1",KCAKUFQSCADGHZ-UHFFFAOYSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 610 = CCAP 1 459/22 = NIVA CYA 18
CyanoMetDB_0714,Anabaenopeptin 857,,Anabaenopeptin,,C45H59N7O10,857.4323411,O=C(NC(CC1=CC=CC=C1)C(O)=O)NC(CCCCNC(C(CCC2=CC=C(O)C=C2)NC3=O)=O)C(NC(C(C)C)C(NC(CCC4=CC=C(O)C=C4)C(N(C)C3C)=O)=O)=O,"InChI=1S/C45H59N7O10/c1-27(2)38-42(58)48-36(24-18-30-15-21-33(54)22-16-30)43(59)52(4)28(3)39(55)47-35(23-17-29-13-19-32(53)20-14-29)40(56)46-25-9-8-12-34(41(57)51-38)49-45(62)50-37(44(60)61)26-31-10-6-5-7-11-31/h5-7,10-11,13-16,19-22,27-28,34-38,53-54H,8-9,12,17-18,23-26H2,1-4H3,(H,46,56)(H,47,55)(H,48,58)(H,51,57)(H,60,61)(H2,49,50,62)",PQJHPAGXPOIKTA-UHFFFAOYSA-N,146684806,no,Nostoc,n.a.,CENA352
CyanoMetDB_0715,Anabaenopeptin NZ857,,Anabaenopeptin,,C45H59N7O10,857.4323411,CC[C@H]([C@H]1C(N[C@@H](CCC2=CC=C(O)C=C2)C(N(C)CC(N[C@@H](CCC3=CC=C(O)C=C3)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC4=CC=CC=C4)=O)C(N1)=O)=O)=O)=O)=O)C,"InChI=1S/C45H59N7O10/c1-4-28(2)39-42(58)48-36(24-18-30-15-21-33(54)22-16-30)43(59)52(3)27-38(55)47-35(23-17-29-13-19-32(53)20-14-29)40(56)46-25-9-8-12-34(41(57)51-39)49-45(62)50-37(44(60)61)26-31-10-6-5-7-11-31/h5-7,10-11,13-16,19-22,28,34-37,39,53-54H,4,8-9,12,17-18,23-27H2,1-3H3,(H,46,56)(H,47,55)(H,48,58)(H,51,57)(H,60,61)(H2,49,50,62)/t28-,34-,35+,36+,37+,39+/m1/s1",HRGWILAIPXJBIB-WDOAQSLDSA-N,25136485,yes,Anabaena,n.a.,TAU NZ-3-1
CyanoMetDB_0716,Aurilide B,,other cyclic peptide,other cyclic depsipeptide,C44H75N5O10,833.5513936,CC/C=C(\C)/[C@@H]1[C@H]([C@H](C/C=C(/C(=O)O[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N(CC(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C)C)C(C)C)C)[C@H](C)CC)C)C(C)C)[C@@H](C)CC)\C)O)C,"InChI=1S/C44H75N5O10/c1-17-20-28(10)37-30(12)32(50)22-21-29(11)43(56)59-38(27(9)19-3)39(52)46-35(25(6)7)41(54)49(16)36(26(8)18-2)42(55)47(14)23-33(51)45-34(24(4)5)40(53)48(15)31(13)44(57)58-37/h20-21,24-27,30-32,34-38,50H,17-19,22-23H2,1-16H3,(H,45,51)(H,46,52)/b28-20+,29-21+/t26-,27+,30+,31+,32+,34+,35+,36+,37-,38-/m1/s1",LRWWIPZJXHBJSP-JRVPDWMCSA-N,11721984,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0717,Aurilide A,Aurilide ,other cyclic peptide,other cyclic depsipeptide,C44H75N5O10,833.5513936,CC/C=C(\C)/[C@@H]1[C@H]([C@H](C/C=C(\C(=O)O[C@@H](C(=O)N[C@H](C(=O)N([C@@H](C(=O)N(CC(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C)C)C(C)C)C)CC(C)C)C)C(C)C)[C@@H](C)CC)/C)O)C,"InChI=1S/C44H75N5O10/c1-17-19-28(10)37-30(12)33(50)21-20-29(11)43(56)59-38(27(9)18-2)39(52)46-36(26(7)8)42(55)49(16)32(22-24(3)4)40(53)47(14)23-34(51)45-35(25(5)6)41(54)48(15)31(13)44(57)58-37/h19-20,24-27,30-33,35-38,50H,17-18,21-23H2,1-16H3,(H,45,51)(H,46,52)/b28-19+,29-20+/t27-,30-,31-,32+,33-,35-,36-,37+,38+/m0/s1",XCPGQUJQUPDEFX-PVMXHTSVSA-N,11115520,yes,n.a.,n.a.,n.a.
CyanoMetDB_0718,Apramide G,,other linear peptide,,C44H73N7O6S,827.5343043,C[C@H](CCCCC#C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C2=NC=CS2,"InChI=1S/C44H73N7O6S/c1-17-18-19-20-22-31(10)39(52)46(12)32(11)40(53)47(13)34(27(2)3)41(54)48(14)35(28(4)5)42(55)49(15)36(29(6)7)43(56)50(16)37(30(8)9)44(57)51-25-21-23-33(51)38-45-24-26-58-38/h1,24,26-37H,18-23,25H2,2-16H3/t31-,32+,33+,34+,35+,36+,37+/m1/s1",HAXFUPMEEWESKW-DGELVMTCSA-N,10843163,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0719,Izenamide B,,other linear peptide,linear depsipeptide,C44H71N5O11,845.5150081,O[C@H](C(O[C@@](C(N[C@@H]([C@@H](CC(NC(C(N[C@@H](C(N([C@@H](C(N1CCC[C@H]1C(OC)=O)=O)CC2=CC=CC=C2)C)=O)C)=O)[C@@H](CC)C)=O)O)CC(C)C)=O)([H])[C@H](CC)C)=O)C(C)C,"InChI=1S/C44H71N5O11/c1-12-27(7)36(47-35(51)24-34(50)31(22-25(3)4)46-40(54)38(28(8)13-2)60-44(58)37(52)26(5)6)39(53)45-29(9)41(55)48(10)33(23-30-18-15-14-16-19-30)42(56)49-21-17-20-32(49)43(57)59-11/h14-16,18-19,25-29,31-34,36-38,50,52H,12-13,17,20-24H2,1-11H3,(H,45,53)(H,46,54)(H,47,51)/t27-,28+,29-,31-,32+,33-,34-,36?,37+,38+/m1/s1",XLJBQXZXIWSYHO-JUXXTOFYSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0720,Hoiamide A,,Cyclamide,linear depsipeptide,C44H71N5O10S3,925.436307,CCC[C@@H](C)[C@@H]([C@H](C)[C@@H]1[C@H]([C@H](CC2=NC(=CS2)C3=N[C@](CS3)(C4=N[C@](CS4)(C(=O)N[C@H]([C@H]([C@H](C(=O)O[C@H](C(=O)N[C@H](C(=O)O1)[C@@H](C)O)C(C)C)C)O)[C@@H](C)CC)C)C)OC)C)O,"InChI=1S/C44H71N5O10S3/c1-14-16-23(6)33(51)25(8)36-24(7)29(57-13)17-30-45-28(18-60-30)38-48-44(12,20-61-38)42-49-43(11,19-62-42)41(56)47-31(22(5)15-2)34(52)26(9)39(54)58-35(21(3)4)37(53)46-32(27(10)50)40(55)59-36/h18,21-27,29,31-36,50-52H,14-17,19-20H2,1-13H3,(H,46,53)(H,47,56)/t22-,23+,24-,25-,26+,27+,29-,31-,32-,33-,34-,35-,36-,43+,44+/m0/s1",AJORQYDPWJZVAU-KCIYAEAGSA-N,49864267,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0721,Pitipeptolide C,,other cyclic peptide,linear depsipeptide,C44H69N5O9,811.5095288,CCCCC[C@H]1C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)NCC(=O)O1)[C@@H](C)CC)[C@@H](C)CC)CC3=CC=CC=C3)C)C(C)C)(C)C,"InChI=1S/C44H69N5O9/c1-11-14-16-23-33-44(8,9)43(56)47-35(27(4)5)40(53)48(10)32(25-30-20-17-15-18-21-30)42(55)58-37(29(7)13-3)41(54)49-24-19-22-31(49)38(51)46-36(28(6)12-2)39(52)45-26-34(50)57-33/h15,17-18,20-21,27-29,31-33,35-37H,11-14,16,19,22-26H2,1-10H3,(H,45,52)(H,46,51)(H,47,56)/t28-,29-,31-,32-,33-,35-,36-,37-/m0/s1",GYGCRMRQSIJOON-XXMTWPQQSA-N,15479259,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0722,Apratoxin S4,,other cyclic peptide,Lyngbya toxin (peptide),C44H69N5O8S,827.4866854,CC[C@@H]([C@@H]1C(N2CCC[C@@H]2C(O[C@H](C(C)(C)C)C[C@H](C)C[C@H](O)[C@@H](C)C3=N[C@@H](CS3)CCC(N[C@H](CC4=CC=C(OC)C=C4)C(N(C)[C@H](C)C(N1C)=O)=O)=O)=O)=O)C,"InChI=1S/C44H69N5O8S/c1-12-27(3)38-42(54)49-21-13-14-34(49)43(55)57-36(44(6,7)8)23-26(2)22-35(50)28(4)39-45-31(25-58-39)17-20-37(51)46-33(24-30-15-18-32(56-11)19-16-30)41(53)47(9)29(5)40(52)48(38)10/h15-16,18-19,26-29,31,33-36,38,50H,12-14,17,20-25H2,1-11H3,(H,46,51)/t26-,27-,28-,29-,31-,33-,34-,35-,36-,38-/m0/s1",SHSVXUUTGUMFAP-UOZKOTSUSA-N,70681359,yes,n.a.,n.a.,n.a.
CyanoMetDB_0723,Apratoxin F,,other cyclic peptide,Lyngbya toxin,C44H69N5O8S,827.4866854,CC[C@@H]([C@H]1C(N(C)[C@@H](C)C(O[C@H](C(C)(C)C)C[C@@H](C)C[C@H](O)[C@H](C)C2=NC(/C=C(C)\C(N[C@@H](CC3=CC=C(OC)C=C3)C(N(C)[C@@H](C)C(N1C)=O)=O)=O)CS2)=O)=O)C,"InChI=1S/C44H69N5O8S/c1-15-26(3)37-42(54)48(12)30(7)43(55)57-36(44(8,9)10)21-25(2)20-35(50)28(5)39-45-32(24-58-39)22-27(4)38(51)46-34(23-31-16-18-33(56-14)19-17-31)41(53)47(11)29(6)40(52)49(37)13/h16-19,22,25-26,28-30,32,34-37,50H,15,20-21,23-24H2,1-14H3,(H,46,51)/b27-22-/t25-,26-,28-,29-,30-,32?,34-,35-,36-,37-/m0/s1",BAYCKSGCVUIVNR-MJEAVDSUSA-N,139291790,yes,Lyngbya,bouillonii ,PAL08–16
CyanoMetDB_0724,Apratoxin S9,,other cyclic peptide,Lyngbya toxin (peptide),C44H69N5O8S,827.4866854,CC[C@@H]([C@@H]1C(N2CCC[C@@H]2C(O[C@H](C(C)(C)C)C[C@H](C)C[C@H](O)[C@@H](C)C3=N[C@H](CS3)CCC(N[C@H](CC4=CC=C(OC)C=C4)C(N(C)[C@H](C)C(N1C)=O)=O)=O)=O)=O)C,"InChI=1S/C44H69N5O8S/c1-12-27(3)38-42(54)49-21-13-14-34(49)43(55)57-36(44(6,7)8)23-26(2)22-35(50)28(4)39-45-31(25-58-39)17-20-37(51)46-33(24-30-15-18-32(56-11)19-16-30)41(53)47(9)29(5)40(52)48(38)10/h15-16,18-19,26-29,31,33-36,38,50H,12-14,17,20-25H2,1-11H3,(H,46,51)/t26-,27-,28-,29-,31+,33-,34+,35-,36-,38-/m0/s1",SHSVXUUTGUMFAP-JLSQJOTHSA-N,102358117,yes,n.a.,n.a.,n.a.
CyanoMetDB_0725,Micropeptin KB928,,Cyanopeptolin,Micropeptin,C44H68N10O12,928.5018177,O=C([C@@H](NC([C@H](NC(CCC)=O)CC(O)=O)=O)[C@H](C)OC1=O)N[C@H](C(N[C@@H]2C([N@]([C@@H](CC2)O)[C@@H](C(C)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N[C@H]1[C@H](CC)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C44H68N10O12/c1-8-14-31(55)48-29(22-33(57)58)38(60)52-35-25(6)66-43(65)34(24(5)9-2)51-39(61)30(21-26-15-11-10-12-16-26)53(7)42(64)36(23(3)4)54-32(56)19-18-28(41(54)63)50-37(59)27(49-40(35)62)17-13-20-47-44(45)46/h10-12,15-16,23-25,27-30,32,34-36,56H,8-9,13-14,17-22H2,1-7H3,(H,48,55)(H,49,62)(H,50,59)(H,51,61)(H,52,60)(H,57,58)(H4,45,46,47)/t24-,25-,27-,28-,29+,30-,32+,34-,35-,36-/m0/s1",YYQCWAXCSOHTOZ-NXYUEQNXSA-N,146683771,yes,Microcystis,n.a.,TAU IL-381
CyanoMetDB_0726,Borophycin,,other cyclic non-peptide,,C44H68O14B,831.4702124,[B-]123O[C@]45O[C@H](C(C(=O)C[C@H](CC/C=C\C[C@@H](OC(=O)C(O1)[C@]6(O2)O[C@H](C(C(=O)C[C@H](CC/C=C\C[C@@H](OC(=O)C4O3)CC)O)(C)C)CC[C@H]6C)CC)O)(C)C)CC[C@H]5C,"InChI=1S/C44H68BO14/c1-9-31-19-15-11-13-17-29(46)25-33(48)42(7,8)36-24-22-28(4)44(55-36)38-40(51)53-32(10-2)20-16-12-14-18-30(47)26-34(49)41(5,6)35-23-21-27(3)43(54-35)37(39(50)52-31)56-45(57-38,58-43)59-44/h11-12,15-16,27-32,35-38,46-47H,9-10,13-14,17-26H2,1-8H3/q-1/b15-11-,16-12-/t27-,28-,29+,30+,31+,32+,35+,36+,37?,38?,43+,44+,45?/m1/s1",BGRNGNLBUCICNR-RJJDCBJOSA-N,139586827,yes,Nostoc,linckia,n.a.
CyanoMetDB_0727,Nodularin-R-Cys,,Nodularin,,C44H67N9O12S,945.4629898,OC([C@@H](N)CSC(C1([H])C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCC/N=C(N)\N)C(N[C@@H](/C=C/C(C)=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(O)=O)CCC(N1C)=O)=O)=O)=O)=O)C)=O,"InChI=1S/C44H67N9O12S/c1-23(20-24(2)33(65-7)21-28-12-9-8-10-13-28)15-16-30-25(3)37(55)51-32(42(61)62)17-18-34(54)53(6)36(27(5)66-22-29(45)41(59)60)40(58)52-35(43(63)64)26(4)38(56)50-31(39(57)49-30)14-11-19-48-44(46)47/h8-10,12-13,15-16,20,24-27,29-33,35-36H,11,14,17-19,21-22,45H2,1-7H3,(H,49,57)(H,50,56)(H,51,55)(H,52,58)(H,59,60)(H,61,62)(H,63,64)(H4,46,47,48)/b16-15+,23-20+/t24-,25-,26-,27?,29-,30-,31-,32+,33-,35+,36?/m0/s1",CGPOBYMVGINFLN-WZEZKXEESA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0728,Pitipeptolide B,,other cyclic peptide,other cyclic depsipeptide,C44H67N5O9,809.4938788,CC[C@H](C)[C@H]1C(=O)NCC(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1)[C@@H](C)CC)CC3=CC=CC=C3)C)C(C)C)(C)C)CCCC=C,"InChI=1S/C44H67N5O9/c1-11-14-16-23-33-44(8,9)43(56)47-35(27(4)5)40(53)48(10)32(25-30-20-17-15-18-21-30)42(55)58-37(29(7)13-3)41(54)49-24-19-22-31(49)38(51)46-36(28(6)12-2)39(52)45-26-34(50)57-33/h11,15,17-18,20-21,27-29,31-33,35-37H,1,12-14,16,19,22-26H2,2-10H3,(H,45,52)(H,46,51)(H,47,56)/t28-,29-,31-,32-,33-,35-,36-,37-/m0/s1",WXTNWSNJAHRKRT-XXMTWPQQSA-N,10819182,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0729,Apratoxin B,,other cyclic peptide,other cyclic depsipeptide,C44H67N5O8S,825.4710353,CC[C@@H]([C@H]1C(N2CCCC2C(O[C@H](C(C)(C)C)C[C@@H](C)C[C@H](O)[C@H](C)C3=N[C@@H](/C=C(C)\C(N[C@@H](CC4=CC=C(OC)C=C4)C(N(C)[C@@H](C)C(N1)=O)=O)=O)CS3)=O)=O)C,"InChI=1S/C44H67N5O8S/c1-12-26(3)37-42(54)49-19-13-14-34(49)43(55)57-36(44(7,8)9)21-25(2)20-35(50)28(5)40-45-31(24-58-40)22-27(4)38(51)46-33(23-30-15-17-32(56-11)18-16-30)41(53)48(10)29(6)39(52)47-37/h15-18,22,25-26,28-29,31,33-37,50H,12-14,19-21,23-24H2,1-11H3,(H,46,51)(H,47,52)/b27-22-/t25-,26-,28-,29-,31-,33-,34?,35-,36-,37-/m0/s1",ZSYPDXOLYNZQGO-CSWQYCJFSA-N,139585825,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0730,Apratoxin C,,other cyclic peptide,Lyngbya toxin (depsipeptide),C44H67N5O8S,825.4710353,CC[C@@H]([C@H]1C(N2CCCC2C(O[C@H](C(C)C)C[C@@H](C)C[C@H](O)[C@H](C)C3=N[C@@H](/C=C(C)\C(N[C@@H](CC4=CC=C(OC)C=C4)C(N(C)[C@@H](C)C(N1C)=O)=O)=O)CS3)=O)=O)C,"InChI=1S/C44H67N5O8S/c1-12-27(5)38-43(54)49-19-13-14-35(49)44(55)57-37(25(2)3)21-26(4)20-36(50)29(7)40-45-32(24-58-40)22-28(6)39(51)46-34(23-31-15-17-33(56-11)18-16-31)42(53)47(9)30(8)41(52)48(38)10/h15-18,22,25-27,29-30,32,34-38,50H,12-14,19-21,23-24H2,1-11H3,(H,46,51)/b28-22-/t26-,27-,29-,30-,32-,34-,35?,36-,37-,38-/m0/s1",OIRVOJCFIYCVDL-PRNZABJESA-N,139586185,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0731,Kulokekahilide 2,,other cyclic peptide,other cyclic depsipeptide,C44H67N5O10,825.4887934,CC[C@@H]([C@H]1C(N[C@@H](C)C(O[C@H](/C(C)=C/C)[C@@H](C)[C@@H](O)C/C=C(C)/C(O[C@H](CC(C)C)C(N[C@@H](C)C(N(C)[C@@H](CC2=CC=CC=C2)C(N(C)CC(N1)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C44H67N5O10/c1-13-26(5)37-40(53)46-31(10)44(57)59-38(27(6)14-2)29(8)34(50)21-20-28(7)43(56)58-35(22-25(3)4)39(52)45-30(9)41(54)49(12)33(23-32-18-16-15-17-19-32)42(55)48(11)24-36(51)47-37/h14-20,25-26,29-31,33-35,37-38,50H,13,21-24H2,1-12H3,(H,45,52)(H,46,53)(H,47,51)/b27-14+,28-20+/t26-,29-,30+,31-,33-,34-,35+,37-,38+/m0/s1",JUJXAYASADIXIM-LVOCQXHXSA-N,11491350,yes,n.a.,n.a.,n.a.
CyanoMetDB_0732,Anabaenopeptin 864,,Anabaenopeptin,,C44H65N9O9,863.4905247,O=C(NC(C(NC(C(N(C)C(C(N(C)C(C(NC1CC2=CC=CC=C2)=O)CC(N)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CCCCN,"InChI=1S/C44H65N9O9/c1-5-28(2)37-42(59)52(3)34(23-22-29-16-8-6-9-17-29)41(58)53(4)35(27-36(46)54)40(57)48-33(26-30-18-10-7-11-19-30)38(55)47-25-15-13-20-31(39(56)51-37)49-44(62)50-32(43(60)61)21-12-14-24-45/h6-11,16-19,28,31-35,37H,5,12-15,20-27,45H2,1-4H3,(H2,46,54)(H,47,55)(H,48,57)(H,51,56)(H,60,61)(H2,49,50,62)",HQAMTRISFFPBIM-UHFFFAOYSA-N,146684807,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0733,[Met6] Nodulapeptin C,[Met6] NP C; Nodulapeptin C [Met6] ,Anabaenopeptin,,C44H65N7O9S2,899.428519,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CCSC)C2=O)=O)C)C(NC(C(CCSC)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H65N7O9S2/c1-6-28(2)37(43(58)59)50-44(60)49-32-14-10-11-25-45-38(53)33(23-26-61-4)47-41(56)36(22-18-30-15-19-31(52)20-16-30)51(3)42(57)35(21-17-29-12-8-7-9-13-29)48-40(55)34(24-27-62-5)46-39(32)54/h7-9,12-13,15-16,19-20,28,32-37,52H,6,10-11,14,17-18,21-27H2,1-5H3,(H,45,53)(H,46,54)(H,47,56)(H,48,55)(H,58,59)(H2,49,50,60)",UVYPXLQJIYVPPA-UHFFFAOYSA-N,146684826,no,Nodularia,spumigena,CCY9414
CyanoMetDB_0734,Nodulapeptin 867,NP 867,Anabaenopeptin,,C44H65N7O9S,867.4564479,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CCSC)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H65N7O9S/c1-7-28(4)37(43(58)59)50-44(60)48-32-15-11-12-25-45-38(53)33(24-26-61-6)46-40(55)35(23-19-30-16-20-31(52)21-17-30)51(5)42(57)34(22-18-29-13-9-8-10-14-29)47-41(56)36(27(2)3)49-39(32)54/h8-10,13-14,16-17,20-21,27-28,32-37,52H,7,11-12,15,18-19,22-26H2,1-6H3,(H,45,53)(H,46,55)(H,47,56)(H,49,54)(H,58,59)(H2,48,50,60)",WCRCHLPWAKAILY-UHFFFAOYSA-N,146684827,no,n.a.,n.a.,n.a.
CyanoMetDB_0735,Nodulapeptin 883a,NP 883a; Anabaenopeptin 883b,Anabaenopeptin,,C44H65N7O8S2,883.4336044,O=C(N(C(CCC1=CC=CC=C1)C(NC(CCSC)C2=O)=O)C)C(NC(C(CCSC)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H65N7O8S2/c1-6-29(2)37(43(57)58)50-44(59)49-32-19-13-14-26-45-38(52)33(24-27-60-4)47-41(55)36(23-21-31-17-11-8-12-18-31)51(3)42(56)35(22-20-30-15-9-7-10-16-30)48-40(54)34(25-28-61-5)46-39(32)53/h7-12,15-18,29,32-37H,6,13-14,19-28H2,1-5H3,(H,45,52)(H,46,53)(H,47,55)(H,48,54)(H,57,58)(H2,49,50,59)",XVMDQBMZIUJUKI-UHFFFAOYSA-N,146684895,no,Nodularia,spumigena,"CCNP 1402 ; BY 1 ; CCY 9414 ; AV 1 ; CCNP 1427 ; 
CCNP1436 ; KAC7 ; KAC71"
CyanoMetDB_0736,Nodulapeptin 851,NP 851,Anabaenopeptin,,C44H65N7O8S,851.4615333,O=C(N(C(CCC1=CC=CC=C1)C(NC(CCSC)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H65N7O8S/c1-7-29(4)37(43(57)58)50-44(59)48-32-20-14-15-26-45-38(52)33(25-27-60-6)46-40(54)35(24-22-31-18-12-9-13-19-31)51(5)42(56)34(23-21-30-16-10-8-11-17-30)47-41(55)36(28(2)3)49-39(32)53/h8-13,16-19,28-29,32-37H,7,14-15,20-27H2,1-6H3,(H,45,52)(H,46,54)(H,47,55)(H,49,53)(H,57,58)(H2,48,50,59)",HZXYJCCVMAKAEX-UHFFFAOYSA-N,146683782,no,Nodularia,spumigena,KAC70 ; KAC87
CyanoMetDB_0737,Micropeptin 88A,,Cyanopeptolin,Micropeptin,C44H65N7O12,883.4691206,CC[C@@H](C1C(O[C@@H](C)[C@H](NC(CCC(N)C(O)=O)=O)C(N[C@@H](CC2CCC(O)C=C2)C(N[C@H]3CC[C@@H](O)N([C@@H](C(C)C)C(N(C)[C@@H](CC4=CC=CC=C4)C(N1)=O)=O)C3=O)=O)=O)=O)C,"InChI=1S/C44H65N7O12/c1-7-24(4)35-44(62)63-25(5)36(48-33(53)19-17-29(45)43(60)61)40(57)47-31(21-27-13-15-28(52)16-14-27)38(55)46-30-18-20-34(54)51(41(30)58)37(23(2)3)42(59)50(6)32(39(56)49-35)22-26-11-9-8-10-12-26/h8-13,15,23-25,27-32,34-37,52,54H,7,14,16-22,45H2,1-6H3,(H,46,55)(H,47,57)(H,48,53)(H,49,56)(H,60,61)/t24-,25-,27?,28?,29?,30-,31-,32-,34+,35?,36-,37-/m0/s1",JTGYNJHWOAUNEK-HZZFPCBNSA-N,,yes,Microcystis,aeruginosa,NIES 88
CyanoMetDB_0738,Anabaenopeptin 931,Nodulapeptin 931; NP 931,Anabaenopeptin,,C44H65N7O11S2,931.4183483,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CCS(C)=O)C2=O)=O)C)C(NC(C(CCS(C)=O)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H65N7O11S2/c1-6-28(2)37(43(58)59)50-44(60)49-32-14-10-11-25-45-38(53)33(23-26-63(4)61)47-41(56)36(22-18-30-15-19-31(52)20-16-30)51(3)42(57)35(21-17-29-12-8-7-9-13-29)48-40(55)34(46-39(32)54)24-27-64(5)62/h7-9,12-13,15-16,19-20,28,32-37,52H,6,10-11,14,17-18,21-27H2,1-5H3,(H,45,53)(H,46,54)(H,47,56)(H,48,55)(H,58,59)(H2,49,50,60)",KYTSBJZZBMUXDA-UHFFFAOYSA-N,146684828,no,Nodularia,spumigena,CCNP 1402 ; BY 1
CyanoMetDB_0739,Nodulapeptin 915a,NP 915a,Anabaenopeptin,,C44H65N7O10S2,915.4234337,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CCSC)C2=O)=O)C)C(NC(C(CCS(C)=O)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H65N7O10S2/c1-6-28(2)37(43(58)59)50-44(60)49-32-14-10-11-25-45-38(53)33(23-26-62-4)47-41(56)36(22-18-30-15-19-31(52)20-16-30)51(3)42(57)35(21-17-29-12-8-7-9-13-29)48-40(55)34(46-39(32)54)24-27-63(5)61/h7-9,12-13,15-16,19-20,28,32-37,52H,6,10-11,14,17-18,21-27H2,1-5H3,(H,45,53)(H,46,54)(H,47,56)(H,48,55)(H,58,59)(H2,49,50,60)",RWDXZSMHFBIDLH-UHFFFAOYSA-N,146684747,no,Nodularia,spumigena,n.a.
CyanoMetDB_0740,Nodulapeptin 883c,NP 883c; Anabaenopeptin 883c,Anabaenopeptin,,C44H65N7O10S,883.4513625,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CCS(C)=O)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H65N7O10S/c1-7-28(4)37(43(58)59)50-44(60)48-32-15-11-12-25-45-38(53)33(24-26-62(6)61)46-40(55)35(23-19-30-16-20-31(52)21-17-30)51(5)42(57)34(22-18-29-13-9-8-10-14-29)47-41(56)36(27(2)3)49-39(32)54/h8-10,13-14,16-17,20-21,27-28,32-37,52H,7,11-12,15,18-19,22-26H2,1-6H3,(H,45,53)(H,46,55)(H,47,56)(H,49,54)(H,58,59)(H2,48,50,60)",FBPFAZSIWHALOO-UHFFFAOYSA-N,146684823,no,n.a.,n.a.,n.a.
CyanoMetDB_0741,Pitipeptolide A,,other cyclic peptide,other cyclic depsipeptide,C44H65N5O9,807.4782287,CC[C@H](C)[C@H]1C(=O)NCC(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1)[C@@H](C)CC)CC3=CC=CC=C3)C)C(C)C)(C)C)CCCC#C,"InChI=1S/C44H65N5O9/c1-11-14-16-23-33-44(8,9)43(56)47-35(27(4)5)40(53)48(10)32(25-30-20-17-15-18-21-30)42(55)58-37(29(7)13-3)41(54)49-24-19-22-31(49)38(51)46-36(28(6)12-2)39(52)45-26-34(50)57-33/h1,15,17-18,20-21,27-29,31-33,35-37H,12-14,16,19,22-26H2,2-10H3,(H,45,52)(H,46,51)(H,47,56)/t28-,29-,31-,32-,33-,35-,36-,37-/m0/s1",MGUMDFGKOQUYTD-XXMTWPQQSA-N,11803484,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0742,Viequeamide B,,other cyclic peptide,other cyclic depsipeptide,C44H65N5O9,807.4782287,C[C@H]1C(=O)NC(C(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1C)CC3=CC=CC=C3)C(C)C)C)C(C)C)(C)C)CCCC#C)C(C)C,"InChI=1S/C44H65N5O9/c1-13-14-16-23-33-44(9,10)43(56)46-34(26(2)3)40(53)48(12)36(28(6)7)42(55)57-32(25-30-20-17-15-18-21-30)39(52)49-24-19-22-31(49)38(51)47(11)29(8)37(50)45-35(27(4)5)41(54)58-33/h1,15,17-18,20-21,26-29,31-36H,14,16,19,22-25H2,2-12H3,(H,45,50)(H,46,56)/t29-,31-,32-,33-,34-,35?,36-/m0/s1",OUTOCBREWFCORV-MSWWGIQISA-N,139585173,yes,Rivularia,n.a.,n.a.
CyanoMetDB_0743,Dudawalamide D,,other cyclic peptide,other cyclic depsipeptide,C44H65N5O9,807.4782287,CC[C@H](C1C(N2CCC[C@@H]2C(N(C)[C@H](CC3=CC=CC=C3)C(NCC(O[C@@H](CCCC#C)C(C)(C)C(N[C@H](C(C)C)C(N(C)[C@H](C(C)C)C(O1)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C44H65N5O9/c1-12-14-16-23-33-44(8,9)43(56)46-35(27(3)4)40(53)48(11)36(28(5)6)42(55)58-37(29(7)13-2)41(54)49-24-19-22-31(49)39(52)47(10)32(25-30-20-17-15-18-21-30)38(51)45-26-34(50)57-33/h1,15,17-18,20-21,27-29,31-33,35-37H,13-14,16,19,22-26H2,2-11H3,(H,45,51)(H,46,56)/t29-,31-,32-,33-,35-,36-,37+/m0/s1",YHMPIYZQVBVDCW-UKQDKWHSSA-N,132487930,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0744,Anabaenopeptin 891,Anabaenopeptin 892,Anabaenopeptin,,C44H65N11O9,891.4966727,O=C(NC(C(NC(C(N(C)C(C(N(C)C(C(NC1CC2=CC=CC=C2)=O)CC(N)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CCCNC(N)=N,"InChI=1S/C44H65N11O9/c1-5-27(2)36-41(61)54(3)33(22-21-28-15-8-6-9-16-28)40(60)55(4)34(26-35(45)56)39(59)50-32(25-29-17-10-7-11-18-29)37(57)48-23-13-12-19-30(38(58)53-36)51-44(64)52-31(42(62)63)20-14-24-49-43(46)47/h6-11,15-18,27,30-34,36H,5,12-14,19-26H2,1-4H3,(H2,45,56)(H,48,57)(H,50,59)(H,53,58)(H,62,63)(H4,46,47,49)(H2,51,52,64)",VAXBONMUZWUDCJ-UHFFFAOYSA-N,146684808,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0745,Anabaenopeptin 848,Anabaenopeptin 849,Anabaenopeptin,,C44H64N8O9,848.4796257,O=C(NC(C(NC(C(N(C)C(C(N(C)C(C(NC1CC2=CC=CC=C2)=O)CC(N)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CC(C)C,"InChI=1S/C44H64N8O9/c1-7-28(4)37-42(58)51(5)34(22-21-29-16-10-8-11-17-29)41(57)52(6)35(26-36(45)53)40(56)47-32(25-30-18-12-9-13-19-30)38(54)46-23-15-14-20-31(39(55)50-37)48-44(61)49-33(43(59)60)24-27(2)3/h8-13,16-19,27-28,31-35,37H,7,14-15,20-26H2,1-6H3,(H2,45,53)(H,46,54)(H,47,56)(H,50,55)(H,59,60)(H2,48,49,61)",CJKWSQVHLFUWJD-UHFFFAOYSA-N,146684809,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0746,Anabaenopeptin 850,Anabaenopeptin 850 ; Anabaenopeptin SA7,Anabaenopeptin,,C43H63N9O9,849.487451,O=C(NC(C(NC(C(NC(C(N(C)C(C(NC1CC2=CC=CC=C2)=O)CC(N)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CCCCN,"InChI=1S/C43H63N9O9/c1-4-27(2)36-40(57)47-31(22-21-28-15-7-5-8-16-28)41(58)52(3)34(26-35(45)53)39(56)48-33(25-29-17-9-6-10-18-29)37(54)46-24-14-12-19-30(38(55)51-36)49-43(61)50-32(42(59)60)20-11-13-23-44/h5-10,15-18,27,30-34,36H,4,11-14,19-26,44H2,1-3H3,(H2,45,53)(H,46,54)(H,47,57)(H,48,56)(H,51,55)(H,59,60)(H2,49,50,61)",PKSSHNFKYXYKNH-UHFFFAOYSA-N,146684810,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0747,Nodulapeptin A,NP A,Anabaenopeptin,,C44H63N7O13S,929.4204563,CC[C@H]([C@@H](NC(N[C@@H]1CCCCNC([C@H](COC(C)=O)NC([C@H](CCC2=CC=C(O)C=C2)N(C)C([C@H](CCC3=CC=CC=C3)NC([C@H](CCS(=O)(C)=O)NC1=O)=O)=O)=O)=O)=O)C(O)=O)C,"InChI=1S/C44H63N7O13S/c1-6-27(2)37(43(59)60)50-44(61)49-32-14-10-11-24-45-38(54)35(26-64-28(3)52)48-41(57)36(22-18-30-15-19-31(53)20-16-30)51(4)42(58)34(21-17-29-12-8-7-9-13-29)47-40(56)33(46-39(32)55)23-25-65(5,62)63/h7-9,12-13,15-16,19-20,27,32-37,53H,6,10-11,14,17-18,21-26H2,1-5H3,(H,45,54)(H,46,55)(H,47,56)(H,48,57)(H,59,60)(H2,49,50,61)/t27-,32-,33+,34+,35+,36+,37-/m1/s1",HNJXEUPVUNYUNF-VPKYDJPASA-N,,yes,Nodularia,spumigena,AV1
CyanoMetDB_0748,Nodulapeptin B,,Anabaenopeptin,,C44H63N7O12S,913.4255417,CC[C@H]([C@@H](NC(N[C@@H]1CCCCNC([C@H](COC(C)=O)NC([C@H](CCC2=CC=C(O)C=C2)N(C)C([C@H](CCC3=CC=CC=C3)NC([C@H](CCS(C)=O)NC1=O)=O)=O)=O)=O)=O)C(O)=O)C,"InChI=1S/C44H63N7O12S/c1-6-27(2)37(43(59)60)50-44(61)49-32-14-10-11-24-45-38(54)35(26-63-28(3)52)48-41(57)36(22-18-30-15-19-31(53)20-16-30)51(4)42(58)34(21-17-29-12-8-7-9-13-29)47-40(56)33(46-39(32)55)23-25-64(5)62/h7-9,12-13,15-16,19-20,27,32-37,53H,6,10-11,14,17-18,21-26H2,1-5H3,(H,45,54)(H,46,55)(H,47,56)(H,48,57)(H,59,60)(H2,49,50,61)/t27-,32-,33+,34+,35+,36+,37-,64?/m1/s1",ZTBSRBSUQIFLBN-MTFODHARSA-N,,yes,Nodularia,n.a.,AV1
CyanoMetDB_0749,[MeHph5] Nodulapeptin B,[MeHph5] NP B; Nodulapeptin B [MeHph5] ,Anabaenopeptin,,C44H63N7O11S,897.4306271,O=C(N(C(CCC1=CC=CC=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(CCS(C)=O)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H63N7O11S/c1-6-28(2)37(43(58)59)50-44(60)49-32-19-13-14-25-45-38(53)35(27-62-29(3)52)48-41(56)36(23-21-31-17-11-8-12-18-31)51(4)42(57)34(22-20-30-15-9-7-10-16-30)47-40(55)33(46-39(32)54)24-26-63(5)61/h7-12,15-18,28,32-37H,6,13-14,19-27H2,1-5H3,(H,45,53)(H,46,54)(H,47,55)(H,48,56)(H,58,59)(H2,49,50,60)",OJSBBUXEMSSZOX-UHFFFAOYSA-N,146684824,no,Nodularia,spumigena,CCY9414
CyanoMetDB_0750,Nodulapeptin C,NP C,Anabaenopeptin,,C44H63N7O11S,897.4306271,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(CCSC)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H63N7O11S/c1-6-27(2)37(43(59)60)50-44(61)49-32-14-10-11-24-45-38(54)35(26-62-28(3)52)48-41(57)36(22-18-30-15-19-31(53)20-16-30)51(4)42(58)34(21-17-29-12-8-7-9-13-29)47-40(56)33(23-25-63-5)46-39(32)55/h7-9,12-13,15-16,19-20,27,32-37,53H,6,10-11,14,17-18,21-26H2,1-5H3,(H,45,54)(H,46,55)(H,47,56)(H,48,57)(H,59,60)(H2,49,50,61)",XTDLZZLFKOTTLJ-UHFFFAOYSA-N,146684876,no,Nodularia,spumigena,CCY9414
CyanoMetDB_0751,Nodulapeptin 865,NP 865,Anabaenopeptin,,C44H63N7O11,865.4585559,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H63N7O11/c1-7-27(4)37(43(59)60)50-44(61)48-32-15-11-12-24-45-38(54)34(25-62-28(5)52)47-40(56)35(23-19-30-16-20-31(53)21-17-30)51(6)42(58)33(22-18-29-13-9-8-10-14-29)46-41(57)36(26(2)3)49-39(32)55/h8-10,13-14,16-17,20-21,26-27,32-37,53H,7,11-12,15,18-19,22-25H2,1-6H3,(H,45,54)(H,46,57)(H,47,56)(H,49,55)(H,59,60)(H2,48,50,61)",LJMYZXGDSMLVQH-UHFFFAOYSA-N,146684825,no,n.a.,n.a.,n.a.
CyanoMetDB_0752,Nodulapeptin 881a,NP 881a; Anabaenopeptin 883a,Anabaenopeptin,,C44H63N7O10S,881.4357124,O=C(N(C(CCC1=CC=CC=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(CCSC)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H63N7O10S/c1-6-28(2)37(43(58)59)50-44(60)49-32-19-13-14-25-45-38(53)35(27-61-29(3)52)48-41(56)36(23-21-31-17-11-8-12-18-31)51(4)42(57)34(22-20-30-15-9-7-10-16-30)47-40(55)33(24-26-62-5)46-39(32)54/h7-12,15-18,28,32-37H,6,13-14,19-27H2,1-5H3,(H,45,53)(H,46,54)(H,47,55)(H,48,56)(H,58,59)(H2,49,50,60)",COYVFWSNQRUPIO-UHFFFAOYSA-N,146684896,no,Nodularia,spumigena,"CCNP 1402 ; BY 1 ; CCY 9414 ; AV 1 ; CCNP 1427 ; 
CCNP1436 ; KAC7 ; KAC71"
CyanoMetDB_0753,Nodulapeptin 849,NP 849,Anabaenopeptin,,C44H63N7O10,849.4636413,O=C(N(C(CCC1=CC=CC=C1)C(NC(COC(C)=O)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C44H63N7O10/c1-7-28(4)37(43(58)59)50-44(60)48-32-20-14-15-25-45-38(53)34(26-61-29(5)52)47-40(55)35(24-22-31-18-12-9-13-19-31)51(6)42(57)33(23-21-30-16-10-8-11-17-30)46-41(56)36(27(2)3)49-39(32)54/h8-13,16-19,27-28,32-37H,7,14-15,20-26H2,1-6H3,(H,45,53)(H,46,56)(H,47,55)(H,49,54)(H,58,59)(H2,48,50,60)",NCWPSTXGSLXTDR-UHFFFAOYSA-N,146683778,no,Nodularia,spumigena,AV1
CyanoMetDB_0754,Micropeptin KT946,,Cyanopeptolin,Micropeptin,C44H62N6O15S,946.3993865,O=C(N[C@H]1[C@@H](OC([C@H](NC([C@@H](N(C([C@@H]([N@]2[C@H](O)CC[C@H](NC([C@@H](NC1=O)CCC3=CC=C(O)C=C3)=O)C2=O)[C@@H](CC)C)=O)C)CC4=CC=CC=C4)=O)[C@H](C)CC)=O)C)[C@@H](O)COS(=O)(O)=O,"InChI=1S/C44H62N6O15S/c1-7-24(3)35-44(60)65-26(5)36(48-40(56)33(52)23-64-66(61,62)63)41(57)45-30(19-16-27-14-17-29(51)18-15-27)38(54)46-31-20-21-34(53)50(42(31)58)37(25(4)8-2)43(59)49(6)32(39(55)47-35)22-28-12-10-9-11-13-28/h9-15,17-18,24-26,30-37,51-53H,7-8,16,19-23H2,1-6H3,(H,45,57)(H,46,54)(H,47,55)(H,48,56)(H,61,62,63)/t24-,25-,26+,30+,31+,32+,33+,34-,35-,36+,37+/m1/s1",ZXJCVWLIKQIRKG-BIUQYEHDSA-N,146683758,yes,Microcystis,n.a.,MB-K
CyanoMetDB_0755,Micropeptin MM850,Cyanopeptolin MM850,Cyanopeptolin,Micropeptin,C44H62N6O11,850.4476568,CC[C@H]([C@@H]1C(O[C@H](C)[C@@H](NC([C@H](O)CO)=O)C(N[C@H](CC(C)C)C(N[C@@H]2CC[C@H](OC)N([C@H](CC3=CC=CC=C3)C(N(C)[C@H](CC4=CC=CC=C4)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C44H62N6O11/c1-8-26(4)36-44(59)61-27(5)37(48-40(55)34(52)24-51)41(56)46-31(21-25(2)3)38(53)45-30-19-20-35(60-7)50(42(30)57)33(23-29-17-13-10-14-18-29)43(58)49(6)32(39(54)47-36)22-28-15-11-9-12-16-28/h9-18,25-27,30-37,51-52H,8,19-24H2,1-7H3,(H,45,53)(H,46,56)(H,47,54)(H,48,55)/t26-,27-,30-,31-,32-,33-,34-,35+,36-,37-/m1/s1",JRYZCWOROGUEPY-RRVYKHFZSA-N,,yes,Microcystis,n.a.,TAU IL-36
CyanoMetDB_0756,Apratyramide,,other linear peptide,linear depsipeptide,C44H60N4O10,804.4309441,COC1=CC=C(CC(N(C)C)C(OC(C(CC)C)C(NC(C(C)C)C(N(C)C(CC2=CC=C(O)C=C2)C(N(C)C(CC3=CC=C(O)C=C3)C(OC)=O)=O)=O)=O)=O)C=C1,"InChI=1S/C44H60N4O10/c1-11-28(4)39(58-44(55)36(46(5)6)25-31-16-22-34(56-9)23-17-31)40(51)45-38(27(2)3)42(53)47(7)35(24-29-12-18-32(49)19-13-29)41(52)48(8)37(43(54)57-10)26-30-14-20-33(50)21-15-30/h12-23,27-28,35-39,49-50H,11,24-26H2,1-10H3,(H,45,51)/t28-,35-,36-,37-,38-,39+/m0/s1",MOVAFFRTIYGUBZ-IRICIJSBSA-N,138671994,yes,Moorea, bouillonii ,n.a.
CyanoMetDB_0757,Dudawalamide B,,other cyclic peptide,other cyclic depsipeptide,C44H59N5O8,785.4363639,C[C@@H]1C(O[C@H](CCCC#C)C(C)(C)C(N[C@H](C(C)C)C(N(C)[C@H](CC2=CC=CC=C2)C(N3CCC[C@@H]3C(N(C)[C@H](CC4=CC=C(OC)C=C4)C(N1)=O)=O)=O)=O)=O)=O,"InChI=1S/C44H59N5O8/c1-10-11-13-20-36-44(5,6)43(55)46-37(28(2)3)41(53)48(8)35(27-30-17-14-12-15-18-30)40(52)49-25-16-19-33(49)39(51)47(7)34(38(50)45-29(4)42(54)57-36)26-31-21-23-32(56-9)24-22-31/h1,12,14-15,17-18,21-24,28-29,33-37H,11,13,16,19-20,25-27H2,2-9H3,(H,45,50)(H,46,55)/t29-,33-,34-,35-,36-,37-/m0/s1",HJYCXTGQLGFPMU-CKCVZSQNSA-N,132487928,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0758,Anabaenopeptin D,AP D,Anabaenopeptin,,C44H57N7O9,827.4217764,CC1C(=O)NC(C(=O)NCCCCC(C(=O)NC(C(=O)NC(C(=O)N1C)CCC2=CC=C(C=C2)O)C(C)C)NC(=O)NC(CC3=CC=CC=C3)C(=O)O)CC4=CC=CC=C4,"InChI=1S/C44H57N7O9/c1-27(2)37-41(56)46-34(23-20-29-18-21-32(52)22-19-29)42(57)51(4)28(3)38(53)47-35(25-30-13-7-5-8-14-30)39(54)45-24-12-11-17-33(40(55)50-37)48-44(60)49-36(43(58)59)26-31-15-9-6-10-16-31/h5-10,13-16,18-19,21-22,27-28,33-37,52H,11-12,17,20,23-26H2,1-4H3,(H,45,54)(H,46,56)(H,47,53)(H,50,55)(H,58,59)(H2,48,49,60)/t28-,33+,34-,35-,36-,37-/m0/s1",ROZAAMMJQDDESR-DGILKIICSA-N,12110711,no,Anabaena,n.a.,"202
A2/41"
CyanoMetDB_0759,Tiglicamide B,,other cyclic peptide,other cyclic depsipeptide,C44H57N7O12,875.4065203,C/C=C\1/C(=O)N[C@@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C(C)C)NC(=O)/C(=C/C)/C)C)CC3=CC=CC=C3)CCC(=O)O,"InChI=1S/C44H57N7O12/c1-8-24(5)37(55)50-35(23(3)4)42(60)48-32(21-28-15-17-29(52)18-16-28)41(59)51-36-26(7)63-44(62)33(22-27-13-11-10-12-14-27)49-40(58)31(19-20-34(53)54)47-39(57)30(9-2)46-38(56)25(6)45-43(36)61/h8-18,23,25-26,31-33,35-36,52H,19-22H2,1-7H3,(H,45,61)(H,46,56)(H,47,57)(H,48,60)(H,49,58)(H,50,55)(H,51,59)(H,53,54)/b24-8+,30-9-/t25-,26+,31+,32+,33-,35-,36-/m0/s1",HTQZRXGEFURKNL-RGQURIAKSA-N,44606523,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0760,Anabaenopeptin A,,Anabaenopeptin,,C44H57N7O10,843.4166911,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC3=CC=C(O)C=C3)=O)C(N[C@@H](C(C)C)C(N[C@@H](CCC4=CC=C(O)C=C4)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C44H57N7O10/c1-26(2)37-41(57)46-34(22-17-28-13-18-31(52)19-14-28)42(58)51(4)27(3)38(54)47-35(24-29-10-6-5-7-11-29)39(55)45-23-9-8-12-33(40(56)50-37)48-44(61)49-36(43(59)60)25-30-15-20-32(53)21-16-30/h5-7,10-11,13-16,18-21,26-27,33-37,52-53H,8-9,12,17,22-25H2,1-4H3,(H,45,55)(H,46,57)(H,47,54)(H,50,56)(H,59,60)(H2,48,49,61)/t27-,33+,34-,35-,36-,37-/m0/s1",JWVKNHDSRADFFA-IFWSNWNESA-N,10418092,yes,Anabaena/Dolichospermum,flos aquae,NRC 525-17
CyanoMetDB_0761,"(2S)-3-O-?-D-galactopyranosyl-1-O-(9Z,12Z-octadecadienoyl)-2-O-(4Z-hexadecenoyl)glycerol",,other linear non-peptide,,C44H78O9,750.5645841,CCCCC/C=C\C/C=C\CCCCCCCC(OC[C@@]([H])(OC(CC/C=C\CCCCCCCCCCC)=O)CO[C@H]1[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)C1)=O,"InChI=1S/C44H78O9/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-40(46)52-36-38(35-51-39-33-37(34-45)42(48)44(50)43(39)49)53-41(47)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,26,28,37-39,42-45,48-50H,3-10,12,14-16,19-25,27,29-36H2,1-2H3/b13-11-,18-17-,28-26-/t37-,38+,39-,42+,43+,44+/m1/s1",OFYWDHVUMKXXEW-BHDLHHIESA-N,,yes,Oscillatoria/Planktothrix,,# KMCC CY-11
CyanoMetDB_0762,Aurilide C,,other cyclic peptide,other cyclic depsipeptide,C43H73N5O10,819.5357436,CC/C=C(\C)/[C@@H]1[C@H]([C@H](C/C=C(/C(=O)O[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N(CC(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C)C)C(C)C)C)[C@H](C)CC)C)C(C)C)C(C)C)\C)O)C,"InChI=1S/C43H73N5O10/c1-17-19-27(10)37-29(12)31(49)21-20-28(11)42(55)57-36(25(7)8)38(51)45-34(24(5)6)40(53)48(16)35(26(9)18-2)41(54)46(14)22-32(50)44-33(23(3)4)39(52)47(15)30(13)43(56)58-37/h19-20,23-26,29-31,33-37,49H,17-18,21-22H2,1-16H3,(H,44,50)(H,45,51)/b27-19+,28-20+/t26-,29+,30+,31+,33+,34+,35+,36-,37-/m1/s1",BCIDYWRVGQFMIS-NOZRKBPESA-N,11585931,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0763,Symplostatin 1,,other linear peptide,linear depsipeptide,C43H70N6O6S,798.5077552,CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C3=NC=CS3)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)CC)N(C)C,"InChI=1S/C43H70N6O6S/c1-13-28(5)37(48(10)43(53)36(27(3)4)46-41(52)38(47(8)9)29(6)14-2)34(54-11)26-35(50)49-23-18-21-33(49)39(55-12)30(7)40(51)45-32(42-44-22-24-56-42)25-31-19-16-15-17-20-31/h15-17,19-20,22,24,27-30,32-34,36-39H,13-14,18,21,23,25-26H2,1-12H3,(H,45,51)(H,46,52)/t28-,29?,30+,32-,33-,34+,36-,37-,38-,39+/m0/s1",OJSUENRPBJADBN-XBZNCADQSA-N,10350382,yes,Symploca,hydnoides,n.a.
CyanoMetDB_0764,Izenamide A,,other cyclic peptide,other cyclic depsipeptide,C43H69N5O11,831.4993581,O[C@@H](C(C)C)C(O[C@@](C(C)C)([H])C(N[C@@H](CC(C)C)[C@@H](O)CC(N[C@]([C@@H](C)CC)([H])C(N[C@@H](C)C(N(C)[C@H](CC1=CC=CC=C1)C(N2CCC[C@H]2C(OC)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C43H69N5O11/c1-12-27(8)35(46-34(50)23-33(49)30(21-24(2)3)45-39(53)37(26(6)7)59-43(57)36(51)25(4)5)38(52)44-28(9)40(54)47(10)32(22-29-17-14-13-15-18-29)41(55)48-20-16-19-31(48)42(56)58-11/h13-15,17-18,24-28,30-33,35-37,49,51H,12,16,19-23H2,1-11H3,(H,44,52)(H,45,53)(H,46,50)/t27-,28-,30-,31-,32+,33-,35-,36-,37+/m0/s1",LTKVRJFDYIZQCP-ALAILQQQSA-N,132505928,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0765,Aeruginosin 892,,Aeruginosin,Depsipeptide,C43H68N6O14,892.4793509,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(C(O)=O)O4)C(OC(CCCCCCC)=O)CC3C1,"InChI=1S/C43H68N6O14/c1-4-5-6-7-8-11-33(52)61-31-21-25-20-29(38(56)46-16-9-10-17-47-43(44)45)49(28(25)22-32(31)62-42-36(55)34(53)35(54)37(63-42)41(59)60)40(58)27(18-23(2)3)48-39(57)30(51)19-24-12-14-26(50)15-13-24/h12-15,23,25,27-32,34-37,42,50-51,53-55H,4-11,16-22H2,1-3H3,(H,46,56)(H,48,57)(H,59,60)(H4,44,45,47)",MBKDOQVHLHHSHA-UHFFFAOYSA-N,146684794,no,n.a.,n.a.,n.a.
CyanoMetDB_0766,Apratoxin G,,other cyclic peptide,Lyngbya toxin,C43H67N5O8S,813.4710353,C[C@H]1C[C@H](O)[C@H](C)C2=NC(/C=C(C)\C(N[C@@H](CC3=CC=C(OC)C=C3)C(N(C)[C@@H](C)C(N(C)[C@@H](C(C)C)C(N(C)[C@@H](C)C(O[C@H](C(C)(C)C)C1)=O)=O)=O)=O)=O)CS2,"InChI=1S/C43H67N5O8S/c1-24(2)36-41(53)47(12)29(7)42(54)56-35(43(8,9)10)20-25(3)19-34(49)27(5)38-44-31(23-57-38)21-26(4)37(50)45-33(22-30-15-17-32(55-14)18-16-30)40(52)46(11)28(6)39(51)48(36)13/h15-18,21,24-25,27-29,31,33-36,49H,19-20,22-23H2,1-14H3,(H,45,50)/b26-21-/t25-,27-,28-,29-,31?,33-,34-,35-,36-/m0/s1",QYPABEUQMXOENV-NMOSBCMXSA-N,139292034,yes,Lyngbya,bouillonii ,PAL08–16
CyanoMetDB_0767,Apratoxin S7,,other cyclic peptide,Lyngbya toxin (peptide),C43H67N5O8S,813.4710353,CC[C@@H]([C@@H]1C(N2CCC[C@@H]2C(O[C@@H](C(C)(C)C)C[C@@H](C)C[C@H](O)CC3=N[C@@H](CS3)CCC(N[C@H](CC4=CC=C(OC)C=C4)C(N(C)[C@H](C)C(N1C)=O)=O)=O)=O)=O)C,"InChI=1S/C43H67N5O8S/c1-11-27(3)38-41(53)48-20-12-13-34(48)42(54)56-35(43(5,6)7)22-26(2)21-31(49)24-37-44-30(25-57-37)16-19-36(50)45-33(23-29-14-17-32(55-10)18-15-29)40(52)46(8)28(4)39(51)47(38)9/h14-15,17-18,26-28,30-31,33-35,38,49H,11-13,16,19-25H2,1-10H3,(H,45,50)/t26-,27-,28-,30-,31-,33-,34+,35-,38-/m0/s1",OLXQPAZGLQOODL-FADIRJKASA-N,102358115,yes,n.a.,n.a.,n.a.
CyanoMetDB_0768,Ribocyclophane E,,other cyclic non-peptide,Cyclophane,C43H67ClO11,794.4371907,CCCC[C@@H](CCCC[C@H](C)[C@H](C1=CC(=CC(=C1)O)O)OC(=O)C)C2=C(C=C(C=C2O)[C@@H]([C@@H](C)CCCCC(CCCC)Cl)O[C@H]3[C@@H]([C@@H]([C@@H](CO3)O)O)O)O,"InChI=1S/C43H67ClO11/c1-6-8-16-29(17-12-10-14-26(3)41(54-28(5)45)30-20-33(46)24-34(47)21-30)38-35(48)22-31(23-36(38)49)42(55-43-40(52)39(51)37(50)25-53-43)27(4)15-11-13-19-32(44)18-9-7-2/h20-24,26-27,29,32,37,39-43,46-52H,6-19,25H2,1-5H3/t26-,27-,29-,32?,37+,39+,40+,41+,42+,43-/m0/s1",SOQDHIOFRVNKJC-RIVOPLGOSA-N,139588673,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0769,Ribocyclophane D,,other cyclic non-peptide,Cyclophane,C43H66O11,758.4605129,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O[C@H]4[C@@H]([C@@H]([C@@H](CO4)O)O)O)C)CCCC)C(=C2)O)O)OC(=O)C)C,"InChI=1S/C43H66O11/c1-6-8-16-28-19-13-11-15-26(4)42(54-43-40(51)39(50)36(49)24-52-43)31-22-34(47)38(35(48)23-31)29(17-9-7-2)18-12-10-14-25(3)41(53-27(5)44)30-20-32(45)37(28)33(46)21-30/h20-23,25-26,28-29,36,39-43,45-51H,6-19,24H2,1-5H3/t25-,26-,28-,29-,36+,39+,40+,41+,42+,43-/m0/s1",PWWBCIPAUJDCLH-JPWHELPHSA-N,139588674,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0770,deoxy-Majusculamide D,deoxymajusculamide D,other linear peptide,linear peptide,C43H65N5O9,795.4782287,CC(N1C(C2CC([H])CN2C(C(C(C)C)N(C)C(C(C(C)OC(C)=O)NC(C(CC3=CC=C(OC)C=C3)N(C)C(C(C)CC(C)CCCC)=O)=O)=O)=O)=O)C=CC1=O,"InChI=1S/C43H65N5O9/c1-12-13-15-27(4)24-28(5)40(52)45(9)35(25-32-18-20-33(56-11)21-19-32)39(51)44-37(30(7)57-31(8)49)42(54)46(10)38(26(2)3)43(55)47-23-14-16-34(47)41(53)48-29(6)17-22-36(48)50/h17-22,26-30,34-35,37-38H,12-16,23-25H2,1-11H3,(H,44,51)",BIKVQCBBPZOYLU-UHFFFAOYSA-N,14104170,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0771,Apratoxin E,,other cyclic peptide,Lyngbya toxin (depsipeptide),C43H65N5O7S,795.4604706,CC[C@@H]([C@H]1C(N2CCC[C@H]2C(OC(C(C)(C)C)CC(C)C/C=C/C3=NC(CS3)CCC(N[C@@H](CC4=CC=C(OC)C=C4)C(N(C)[C@@H](C)C(N1C)=O)=O)=O)=O)=O)C,"InChI=1S/C43H65N5O7S/c1-11-28(3)38-41(52)48-23-13-15-34(48)42(53)55-35(43(5,6)7)24-27(2)14-12-16-37-44-31(26-56-37)19-22-36(49)45-33(25-30-17-20-32(54-10)21-18-30)40(51)46(8)29(4)39(50)47(38)9/h12,16-18,20-21,27-29,31,33-35,38H,11,13-15,19,22-26H2,1-10H3,(H,45,49)/b16-12+/t27?,28-,29-,31?,33-,34-,35?,38-/m0/s1",RDPZVJUUVDDQSB-UNLDUUMZSA-N,139583368,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_0772,Majusculamide D,,other linear peptide,linear peptide,C43H65N5O10,811.4731433,CC(N1C(C2CC(O)CN2C(C(C(C)C)N(C)C(C(C(C)OC(C)=O)NC(C(CC3=CC=C(OC)C=C3)N(C)C(C(C)CC(C)CCCC)=O)=O)=O)=O)=O)C=CC1=O,"InChI=1S/C43H65N5O10/c1-12-13-14-26(4)21-27(5)40(53)45(9)34(22-31-16-18-33(57-11)19-17-31)39(52)44-37(29(7)58-30(8)49)42(55)46(10)38(25(2)3)43(56)47-24-32(50)23-35(47)41(54)48-28(6)15-20-36(48)51/h15-20,25-29,32,34-35,37-38,50H,12-14,21-24H2,1-11H3,(H,44,52)",NKBHDXJJPQYANN-UHFFFAOYSA-N,14104168,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0774,Anabaenopeptin KT864,Anabaenopeptin F1,Anabaenopeptin,,C43H64N10O9,864.4857737,O=C([C@H](CCC1=CC=C(C=C1)O)NC([C@@H](NC([C@H](NC(NC(C(O)=O)CCCCNC(N)=N)=O)CCCCN2)=O)[C@H](C)CC)=O)N(C)[C@H](C(N[C@H](C2=O)CC3=CC=CC=C3)=O)C,"InChI=1S/C43H64N10O9/c1-5-26(2)35-39(58)48-32(22-19-28-17-20-30(54)21-18-28)40(59)53(4)27(3)36(55)49-34(25-29-13-7-6-8-14-29)37(56)46-23-11-9-15-31(38(57)52-35)50-43(62)51-33(41(60)61)16-10-12-24-47-42(44)45/h6-8,13-14,17-18,20-21,26-27,31-35,54H,5,9-12,15-16,19,22-25H2,1-4H3,(H,46,56)(H,48,58)(H,49,55)(H,52,57)(H,60,61)(H4,44,45,47)(H2,50,51,62)/t26-,27+,31-,32+,33?,34+,35+/m1/s1",GMRXPGXBRGYRPO-TXRVHQJBSA-N,146683759,yes,n.a.,n.a.,n.a.
CyanoMetDB_0775,Nodulapeptin 821,NP 821,Anabaenopeptin,,C43H63N7O9,821.4687266,O=C(N(C(CCC1=CC=CC=C1)C(NC(CO)C2=O)=O)C)C(NC(C(C(CC)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C43H63N7O9/c1-6-27(3)35-40(55)45-32(23-21-29-16-10-8-11-17-29)41(56)50(5)34(24-22-30-18-12-9-13-19-30)39(54)46-33(26-51)37(52)44-25-15-14-20-31(38(53)48-35)47-43(59)49-36(42(57)58)28(4)7-2/h8-13,16-19,27-28,31-36,51H,6-7,14-15,20-26H2,1-5H3,(H,44,52)(H,45,55)(H,46,54)(H,48,53)(H,57,58)(H2,47,49,59)",BDLKFDOXKGTMAT-UHFFFAOYSA-N,146683781,no,Nodularia,spumigena,"CCNP 1402 ; BY 1 ; AV 1 ; CCNP 1427 ; CCNP 1436 ; 
KAC7 ; KAC71"
CyanoMetDB_0776,Pitipeptolide D,,other cyclic peptide,other cyclic depsipeptide,C43H63N5O9,793.4625786,CC[C@H](C)[C@H]1C(=O)NCC(=O)O[C@H](C(C(=O)N[C@H](C(=O)N[C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1)[C@@H](C)CC)CC3=CC=CC=C3)C(C)C)(C)C)CCCC#C,"InChI=1S/C43H63N5O9/c1-10-13-15-22-32-43(8,9)42(55)47-34(26(4)5)39(52)45-30(24-29-19-16-14-17-20-29)41(54)57-36(28(7)12-3)40(53)48-23-18-21-31(48)37(50)46-35(27(6)11-2)38(51)44-25-33(49)56-32/h1,14,16-17,19-20,26-28,30-32,34-36H,11-13,15,18,21-25H2,2-9H3,(H,44,51)(H,45,52)(H,46,50)(H,47,55)/t27-,28-,30-,31-,32-,34-,35-,36-/m0/s1",JUWZHOPGNUQZRO-HTQBPSGHSA-N,54597385,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0777,Pitipeptolide F,,other cyclic peptide,other cyclic depsipeptide,C43H63N5O9,793.4625786,CC[C@H](C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)NCC(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O1)CC3=CC=CC=C3)C)C(C)C)(C)C)CCCC#C)C(C)C,"InChI=1S/C43H63N5O9/c1-11-13-15-22-32-43(8,9)42(55)46-35(27(5)6)39(52)47(10)31(24-29-19-16-14-17-20-29)41(54)57-36(28(7)12-2)40(53)48-23-18-21-30(48)37(50)45-34(26(3)4)38(51)44-25-33(49)56-32/h1,14,16-17,19-20,26-28,30-32,34-36H,12-13,15,18,21-25H2,2-10H3,(H,44,51)(H,45,50)(H,46,55)/t28-,30-,31-,32-,34-,35-,36-/m0/s1",MUYCJKBADGRSPP-NSYLWNNOSA-N,54597439,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0778,Pitipeptolide E,,other cyclic peptide,other cyclic depsipeptide,C43H63N5O9,793.4625786,CC[C@H]([C@H]1C(NCC(O[C@H](CCCC#C)C(C)(C)C(N[C@@H](C(C)C)C(N(C)[C@@H](CC2=CC=CC=C2)C(O[C@@H](C(C)C)C(N3CCC[C@H]3C(N1)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C43H63N5O9/c1-11-13-15-22-32-43(8,9)42(55)46-34(26(3)4)39(52)47(10)31(24-29-19-16-14-17-20-29)41(54)57-36(27(5)6)40(53)48-23-18-21-30(48)37(50)45-35(28(7)12-2)38(51)44-25-33(49)56-32/h1,14,16-17,19-20,26-28,30-32,34-36H,12-13,15,18,21-25H2,2-10H3,(H,44,51)(H,45,50)(H,46,55)/t28-,30-,31-,32-,34-,35-,36-/m0/s1",ZHHKJHQJBVODGP-NSYLWNNOSA-N,54597438,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0779,Dudawalamide C,,other cyclic peptide,Depsipeptides (cyclic),C43H63N5O9,793.4625786,CC([C@H]1C(N(C)C(C(C)C)C(O[C@H](C(C)C)C(N2CCCC2C(N(C)C(CC3=CC=CC=C3)C(NCC(O[C@@H](CCCC#C)C(C)(C)C(N1)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C43H63N5O9/c1-12-13-15-22-32-43(8,9)42(55)45-34(26(2)3)39(52)47(11)35(27(4)5)41(54)57-36(28(6)7)40(53)48-23-18-21-30(48)38(51)46(10)31(24-29-19-16-14-17-20-29)37(50)44-25-33(49)56-32/h1,14,16-17,19-20,26-28,30-32,34-36H,13,15,18,21-25H2,2-11H3,(H,44,50)(H,45,55)/t30-,31-,32-,34-,35-,36-/m0/s1",TVTZPUKLHDXORU-OGLQLMJVSA-N,132487929,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0780,Anabaenopeptin 877a,Anabaenopeptin 878 Arg in P1,Anabaenopeptin,,C43H63N11O9,877.4810227,O=C(NC(C(NC(C(NC(C(NC(C(NC1CC2=CC=CC=C2)=O)CC(NC)=O)=O)CCC3=CC=CC=C3)=O)C(CC)C)=O)CCCCNC1=O)NC(C(O)=O)CCCNC(N)=N,"InChI=1S/C43H63N11O9/c1-4-26(2)35-40(60)49-30(21-20-27-14-7-5-8-15-27)37(57)51-33(25-34(55)46-3)39(59)50-32(24-28-16-9-6-10-17-28)36(56)47-22-12-11-18-29(38(58)54-35)52-43(63)53-31(41(61)62)19-13-23-48-42(44)45/h5-10,14-17,26,29-33,35H,4,11-13,18-25H2,1-3H3,(H,46,55)(H,47,56)(H,49,60)(H,50,59)(H,51,57)(H,54,58)(H,61,62)(H4,44,45,48)(H2,52,53,63)",KEYICRLKLZSNGH-UHFFFAOYSA-N,146684811,no,Desmonostoc,n.a.,CENA386
CyanoMetDB_0781,Cyanopeptolin 959,,Cyanopeptolin,,C43H61N9O14S,959.4058689,O=C(NC(CCCNC(N)=N)C(NC1C(N(C(C(N(C(C(NC2C(C)CC)=O)CC3=CC=CC=C3)C)=O)CC4=CC=CC=C4)C(O)CC1)=O)=O)C(C(OC2=O)C)NC(C(COS(=O)(O)=O)O)=O,"InChI=1S/C43H61N9O14S/c1-5-24(2)34-42(61)66-25(3)35(50-38(57)32(53)23-65-67(62,63)64)39(58)47-28(17-12-20-46-43(44)45)36(55)48-29-18-19-33(54)52(40(29)59)31(22-27-15-10-7-11-16-27)41(60)51(4)30(37(56)49-34)21-26-13-8-6-9-14-26/h6-11,13-16,24-25,28-35,53-54H,5,12,17-23H2,1-4H3,(H,47,58)(H,48,55)(H,49,56)(H,50,57)(H4,44,45,46)(H,62,63,64)",JAQFKPSIKFQVIW-UHFFFAOYSA-N,146683917,no,n.a.,n.a.,n.a.
CyanoMetDB_0782,Micropeptin MM932,,Cyanopeptolin,Micropeptin,C43H60N6O15S,932.3837364,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](O)COS(=O)(O)=O)=O)C(N[C@@H](CC(C)C)C(N[C@H]2CC[C@@H](O)N([C@@H](CC3=CC=CC=C3)C(N(C)[C@@H](CC4=CC=C(O)C=C4)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C43H60N6O15S/c1-7-24(4)35-43(59)64-25(5)36(47-39(55)33(51)22-63-65(60,61)62)40(56)45-30(19-23(2)3)37(53)44-29-17-18-34(52)49(41(29)57)32(21-26-11-9-8-10-12-26)42(58)48(6)31(38(54)46-35)20-27-13-15-28(50)16-14-27/h8-16,23-25,29-36,50-52H,7,17-22H2,1-6H3,(H,44,53)(H,45,56)(H,46,54)(H,47,55)(H,60,61,62)/t24-,25-,29+,30+,31+,32+,33+,34-,35+,36+/m1/s1",VMKGLVPMHJPVSL-QFCPCIGDSA-N,,yes,Microcystis,n.a.,TAU IL-36
CyanoMetDB_0783,Micropeptin MM916,,Cyanopeptolin,Micropeptin,C43H60N6O14S,916.3888218,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](O)COS(=O)(O)=O)=O)C(N[C@@H](CC(C)C)C(N[C@H]2CC[C@@H](O)N([C@@H](CC3=CC=CC=C3)C(N(C)[C@@H](CC4=CC=CC=C4)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C43H60N6O14S/c1-7-25(4)35-43(58)63-26(5)36(47-39(54)33(50)23-62-64(59,60)61)40(55)45-30(20-24(2)3)37(52)44-29-18-19-34(51)49(41(29)56)32(22-28-16-12-9-13-17-28)42(57)48(6)31(38(53)46-35)21-27-14-10-8-11-15-27/h8-17,24-26,29-36,50-51H,7,18-23H2,1-6H3,(H,44,52)(H,45,55)(H,46,53)(H,47,54)(H,59,60,61)/t25-,26-,29+,30+,31+,32+,33+,34-,35+,36+/m1/s1",UDBOCRPVXNYVSH-HGYIOVOMSA-N,,yes,Microcystis,n.a.,TAU IL-36
CyanoMetDB_0784,Micropeptin MM836,,Cyanopeptolin,Micropeptin,C43H60N6O11,836.4320068,CC[C@H]([C@@H]1C(O[C@@H](C)[C@@H](NC([C@H](O)CO)=O)C(N[C@H](CC(C)C)C(N[C@@H]2CC[C@H](O)N([C@H](CC3=CC=CC=C3)C(N(C)[C@H](CC4=CC=CC=C4)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C43H60N6O11/c1-7-25(4)35-43(59)60-26(5)36(47-39(55)33(51)23-50)40(56)45-30(20-24(2)3)37(53)44-29-18-19-34(52)49(41(29)57)32(22-28-16-12-9-13-17-28)42(58)48(6)31(38(54)46-35)21-27-14-10-8-11-15-27/h8-17,24-26,29-36,50-52H,7,18-23H2,1-6H3,(H,44,53)(H,45,56)(H,46,54)(H,47,55)/t25-,26+,29-,30-,31-,32-,33-,34+,35-,36-/m1/s1",SCXNOQFFIUQBPJ-PSOZZUMASA-N,,yes,Microcystis,n.a.,TAU IL-36
CyanoMetDB_0785,Cyanopeptolin 1009,,Cyanopeptolin,,C43H60ClN9O15S,1009.361811,O=C(N[C@H]1[C@@H](OC(C(NC([C@@H](N(C([C@@H](N2[C@H](O)CC[C@H](NC([C@@H](NC1=O)CCCNC(N)=N)=O)C2=O)CC3=CC=C(Cl)C=C3)=O)C)CC4=CC=C(O)C=C4)=O)C(C)CC)=O)C)C(O)COS(=O)(O)=O,"InChI=1S/C43H60ClN9O15S/c1-5-22(2)34-42(63)68-23(3)35(51-38(59)32(55)21-67-69(64,65)66)39(60)48-28(7-6-18-47-43(45)46)36(57)49-29-16-17-33(56)53(40(29)61)31(20-24-8-12-26(44)13-9-24)41(62)52(4)30(37(58)50-34)19-25-10-14-27(54)15-11-25/h8-15,22-23,28-35,54-56H,5-7,16-21H2,1-4H3,(H,48,60)(H,49,57)(H,50,58)(H,51,59)(H4,45,46,47)(H,64,65,66)/t22?,23-,28-,29-,30-,31-,32?,33+,34?,35-/m0/s1",UMAGMRJJJXPBOF-LHECNMIUSA-N,146684702,no,n.a.,n.a.,n.a.
CyanoMetDB_0786,Benderamide A,,other cyclic peptide,Kulolide ,C43H57N5O7,755.4257992,O=C(N1[C@H](C(N([C@@H](CC2=CC=CC=C2)C3=O)C)=O)CCC1)[C@@H](N(C([C@@H](NC(C(C)(C)[C@@H](OC(C(N3)C)=O)CCCC#C)=O)C(C)C)=O)C)CC4=CC=CC=C4,"InChI=1S/C43H57N5O7/c1-9-10-13-24-35-43(5,6)42(54)45-36(28(2)3)40(52)47(8)34(27-31-21-16-12-17-22-31)39(51)48-25-18-23-32(48)38(50)46(7)33(26-30-19-14-11-15-20-30)37(49)44-29(4)41(53)55-35/h1,11-12,14-17,19-22,28-29,32-36H,10,13,18,23-27H2,2-8H3,(H,44,49)(H,45,54)/t29-,32-,33-,34-,35-,36-/m0/s1",UQBZXGHVULROAE-UJARKJSPSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0787,Aghardipeptin A,,other cyclic peptide,,C43H51N11O7,833.397293,O=C(N1C(C(NC(C(NCC(NC(CC(C)C)C2=O)=O)=O)CC3=CNC4=CC=CC=C43)=O)CCC1)C(NC(CNC(C(N2)CC5=CN=CN5)=O)=O)CC6=CNC7=CC=CC=C76,"InChI=1S/C43H51N11O7/c1-24(2)14-32-41(59)52-34(17-27-20-44-23-49-27)40(58)48-22-38(56)51-35(16-26-19-46-31-11-6-4-9-29(26)31)43(61)54-13-7-12-36(54)42(60)53-33(39(57)47-21-37(55)50-32)15-25-18-45-30-10-5-3-8-28(25)30/h3-6,8-11,18-20,23-24,32-36,45-46H,7,12-17,21-22H2,1-2H3,(H,44,49)(H,47,57)(H,48,58)(H,50,55)(H,51,56)(H,52,59)(H,53,60)",RGZSNQSMWRPTNL-UHFFFAOYSA-N,10724186,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0788,Caylobolide B,,other cyclic non-peptide,,C42H80O11,760.5700634,CCCCC(C)C1CC(CCC[C@@H](C[C@H](C[C@H](CCCC(CCCC(CCCC(CCC[C@H](C[C@H](CCCC(=CC(=O)O1)C)O)O)O)O)O)O)O)O)O,"InChI=1S/C42H80O11/c1-4-5-13-31(3)41-29-39(50)24-11-23-38(49)28-40(51)27-37(48)22-10-19-34(45)17-8-15-32(43)14-7-16-33(44)18-9-21-36(47)26-35(46)20-6-12-30(2)25-42(52)53-41/h25,31-41,43-51H,4-24,26-29H2,1-3H3/t31?,32?,33?,34?,35-,36+,37-,38-,39?,40-,41?/m0/s1",XCMPEWXFVPCAPO-FJSLAZIDSA-N,139585655,yes,Phormidium,n.a.,n.a.
CyanoMetDB_0789,Bacteriohopanetetrol from 'Anacystis montana',,other linear non-peptide,Triterpenoid,C42H75NO8,721.5492684,C[C@@H]1CC(C)(C)C(CC[C@]2(C)C3CCC4[C@@]2(C)CCC5[C@]4(C)CC[C@@H]5[C@H](C)CCC(O)C(O)C(O)CO[C@H]6[C@](O)(CO)[C@@H](O)[C@H](O)[C@H]6N)[C@]3(C)C1,"InChI=1S/C42H75NO8/c1-23-19-37(3,4)29-15-18-41(8)31(39(29,6)20-23)12-11-30-38(5)16-13-25(26(38)14-17-40(30,41)7)24(2)9-10-27(45)33(47)28(46)21-51-36-32(43)34(48)35(49)42(36,50)22-44/h23-36,44-50H,9-22,43H2,1-8H3/t23-,24-,25-,26?,27?,28?,29?,30?,31?,32-,33?,34-,35+,36-,38+,39+,40-,41-,42+/m1/s1",BROCRGCBAMKBLT-GHJREWIZSA-N,,yes,Anacystis,montana,n.a.
CyanoMetDB_0790,Cyanolide A,,other linear non-peptide,,C42H72O16,832.4820362,CC[C@@H]1C[C@@H]2C[C@@H](C([C@@H](O2)CC(=O)O[C@@H](C[C@@H]3C[C@@H](C([C@@H](O3)CC(=O)O1)(C)C)O[C@H]4[C@@H]([C@H]([C@@H](CO4)OC)OC)OC)CC)(C)C)O[C@H]5[C@@H]([C@H]([C@@H](CO5)OC)OC)OC,"InChI=1S/C42H72O16/c1-13-23-15-25-17-29(57-39-37(49-11)35(47-9)27(45-7)21-51-39)41(3,4)32(53-25)20-34(44)56-24(14-2)16-26-18-30(42(5,6)31(54-26)19-33(43)55-23)58-40-38(50-12)36(48-10)28(46-8)22-52-40/h23-32,35-40H,13-22H2,1-12H3/t23-,24-,25-,26-,27-,28-,29+,30+,31+,32+,35+,36+,37-,38-,39+,40+/m1/s1",DLSUXMZHOIJLGM-MNCMQQDLSA-N,46186625,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_0791,Viequeamide A,,other cyclic peptide,other cyclic depsipeptide,C42H69N5O10,803.5044434,CC[C@H](C)[C@@H]1C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)NC(C(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C(C)C)C)C(C)C)(C)C)CCCC#C)[C@@H](C)O)C(C)C)C,"InChI=1S/C42H69N5O10/c1-15-17-18-21-29-42(11,12)41(55)44-30(23(3)4)37(51)46(14)33(25(7)8)40(54)57-34(26(9)16-2)38(52)47-22-19-20-28(47)36(50)45(13)32(24(5)6)35(49)43-31(27(10)48)39(53)56-29/h1,23-34,48H,16-22H2,2-14H3,(H,43,49)(H,44,55)/t26-,27+,28-,29-,30-,31?,32-,33-,34+/m0/s1",WRHBDNJXUOKAGU-JKHSHXPWSA-N,71466917,yes,Rivularia,n.a.,n.a.
CyanoMetDB_0792,Dolastatin 10,,other linear peptide,,C42H68N6O6S,784.4921051,CC[C@H]([C@H](N(C([C@@H](NC([C@H](C(C)C)N(C)C)=O)C(C)C)=O)C)[C@H](OC)CC(N1CCC[C@H]1[C@H](OC)[C@H](C(N[C@H](C2=NC=CS2)CC3=CC=CC=C3)=O)C)=O)C,"InChI=1S/C42H68N6O6S/c1-13-28(6)37(47(10)42(52)35(26(2)3)45-40(51)36(27(4)5)46(8)9)33(53-11)25-34(49)48-22-17-20-32(48)38(54-12)29(7)39(50)44-31(41-43-21-23-55-41)24-30-18-15-14-16-19-30/h14-16,18-19,21,23,26-29,31-33,35-38H,13,17,20,22,24-25H2,1-12H3,(H,44,50)(H,45,51)/t28-,29-,31+,32+,33-,35+,36+,37+,38-/m1/s1",OFDNQWIFNXBECV-IBTREREISA-N,15597809,yes,Symploca,n.a.,VP642
CyanoMetDB_0793,Micropeptin LH925,,Cyanopeptolin,Micropeptin,C42H67N7O14S,925.446671,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)[C@@H](C)CC)O)CCCCN(C)C)NC(=O)C(COS(=O)(=O)O)O)C,"InChI=1S/C42H67N7O14S/c1-9-24(3)33-42(58)63-26(5)34(46-38(54)31(50)23-62-64(59,60)61)39(55)43-28(18-14-15-21-47(6)7)36(52)44-29-19-20-32(51)49(40(29)56)35(25(4)10-2)41(57)48(8)30(37(53)45-33)22-27-16-12-11-13-17-27/h11-13,16-17,24-26,28-35,50-51H,9-10,14-15,18-23H2,1-8H3,(H,43,55)(H,44,52)(H,45,53)(H,46,54)(H,59,60,61)/t24-,25-,26+,28-,29-,30-,31?,32+,33-,34-,35-/m0/s1",HPIIIDVGWCXNRX-QGMUOMCCSA-N,73054637,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0794,Tasiamide A,Tasiamide,other linear peptide,Carmabin,C42H67N7O10,829.4949414,CC[C@H](C)[C@@H](C(=O)NCC(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC)NC(=O)[C@H](CCC(=O)N)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H]([C@@H](C)CC)O,"InChI=1S/C42H67N7O10/c1-10-26(5)35(46-37(53)30(19-20-33(43)50)48(8)40(56)29(22-25(3)4)45-39(55)36(52)27(6)11-2)38(54)44-24-34(51)47(7)32(23-28-16-13-12-14-17-28)41(57)49-21-15-18-31(49)42(58)59-9/h12-14,16-17,25-27,29-32,35-36,52H,10-11,15,18-24H2,1-9H3,(H2,43,50)(H,44,54)(H,45,55)(H,46,53)/t26-,27-,29-,30-,31-,32+,35-,36-/m0/s1",LNEYJLFOLWPLKO-JQEFZHILSA-N,637436,yes,Symploca,n.a.,n.a.
CyanoMetDB_0795,Tasiamide E,,other linear peptide,linear depsipeptide,C42H67N7O10,829.4949414,O=C(CNC([C@H]([C@@H](C)CC)NC([C@H](CCC(N)=O)N(C)C([C@H](CC(C)C)NC([C@@H](O)CC(C)C)=O)=O)=O)=O)N(C)[C@@H](C(N1CCC[C@H]1C(OC)=O)=O)CC2=CC=CC=C2,"InChI=1S/C42H67N7O10/c1-10-27(6)36(46-37(53)30(18-19-34(43)51)48(8)40(56)29(21-25(2)3)45-38(54)33(50)22-26(4)5)39(55)44-24-35(52)47(7)32(23-28-15-12-11-13-16-28)41(57)49-20-14-17-31(49)42(58)59-9/h11-13,15-16,25-27,29-33,36,50H,10,14,17-24H2,1-9H3,(H2,43,51)(H,44,55)(H,45,54)(H,46,53)/t27-,29-,30-,31-,32+,33-,36-/m0/s1",NJVPZEXIAOQHHV-RLMVSLMISA-N,146683691,yes,Symploca,n.a.,n.a.
CyanoMetDB_0796,Aeruginosin 878A,,Aeruginosin,Depsipeptide,C42H66N6O14,878.4637008,O=C(NCCCCNC(N)=N)C1N(C(C(N(C)C(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(C(O)=O)O4)C(OC(CCCCC)=O)CC3C1,"InChI=1S/C42H66N6O14/c1-5-6-7-10-32(51)60-30-20-24-19-27(37(55)45-15-8-9-16-46-42(43)44)48(26(24)21-31(30)61-41-35(54)33(52)34(53)36(62-41)40(58)59)38(56)28(17-22(2)3)47(4)39(57)29(50)18-23-11-13-25(49)14-12-23/h11-14,22,24,26-31,33-36,41,49-50,52-54H,5-10,15-21H2,1-4H3,(H,45,55)(H,58,59)(H4,43,44,46)",BVGJFJKLLULPHN-UHFFFAOYSA-N,146684795,no,n.a.,n.a.,n.a.
CyanoMetDB_0797,Aeruginosin 878B,,Aeruginosin,Depsipeptide,C42H66N6O14,878.4637008,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(C(O)=O)O4)C(OC(CCCCCC)=O)CC3C1,"InChI=1S/C42H66N6O14/c1-4-5-6-7-10-32(51)60-30-20-24-19-28(37(55)45-15-8-9-16-46-42(43)44)48(27(24)21-31(30)61-41-35(54)33(52)34(53)36(62-41)40(58)59)39(57)26(17-22(2)3)47-38(56)29(50)18-23-11-13-25(49)14-12-23/h11-14,22,24,26-31,33-36,41,49-50,52-54H,4-10,15-21H2,1-3H3,(H,45,55)(H,47,56)(H,58,59)(H4,43,44,46)",IRHFUEWZMRVLLZ-UHFFFAOYSA-N,146684796,no,n.a.,n.a.,n.a.
CyanoMetDB_0800,Nodularin-Har,NOD-Har ;; [L-Harb] Nodularin,Nodularin,,C42H62N8O10,838.4588902,C/C=C1C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCCC/N=C(N)\N)C(N[C@@H](/C=C/C(C)=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(O)=O)CCC(N/1C)=O)=O)=O)=O)=O ,"InChI=1S/C42H62N8O10/c1-8-32-39(55)49-35(41(58)59)27(5)37(53)47-30(16-12-13-21-45-42(43)44)38(54)46-29(26(4)36(52)48-31(40(56)57)19-20-34(51)50(32)6)18-17-24(2)22-25(3)33(60-7)23-28-14-10-9-11-15-28/h8-11,14-15,17-18,22,25-27,29-31,33,35H,12-13,16,19-21,23H2,1-7H3,(H,46,54)(H,47,53)(H,48,52)(H,49,55)(H,56,57)(H,58,59)(H4,43,44,45)/b18-17+,24-22+,32-8-/t25-,26-,27-,29-,30-,31+,33-,35+/m0/s1",YCFHEUGHSRSOFR-LTNJPURBSA-N,10629347,yes,Nodularia,n.a.,PCC 7804
CyanoMetDB_0801,[Glu4(OMe)]NOD-R,,Nodularin,,C42H62N8O10,838.4588902,C/C=C1C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCC/N=C(N)\N)C(N[C@@H](/C=C/C(C)=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(OC)=O)CCC(N/1C)=O)=O)=O)=O)=O,"InChI=1S/C42H62N8O10/c1-9-32-39(55)49-35(40(56)57)27(5)37(53)47-30(16-13-21-45-42(43)44)38(54)46-29(26(4)36(52)48-31(41(58)60-8)19-20-34(51)50(32)6)18-17-24(2)22-25(3)33(59-7)23-28-14-11-10-12-15-28/h9-12,14-15,17-18,22,25-27,29-31,33,35H,13,16,19-21,23H2,1-8H3,(H,46,54)(H,47,53)(H,48,52)(H,49,55)(H,56,57)(H4,43,44,45)/b18-17+,24-22+,32-9-/t25-,26-,27-,29-,30-,31+,33-,35+/m0/s1",SKROSHQRBBELIN-NUGLJVOXSA-N,102252291,no,Nodularia,spumigena,n.a.
CyanoMetDB_0803,Anabaenopeptin E,,Anabaenopeptin,,C42H62N10O9,850.4701236,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@@H](C(O)=O)CCC/N=C(N)\N)=O)C(N[C@@H](C(C)C)C(NC(CCC3=CC(C)=C(O)C=C3)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C42H62N10O9/c1-24(2)34-38(57)47-30(18-16-28-17-19-33(53)25(3)22-28)39(58)52(5)26(4)35(54)48-32(23-27-12-7-6-8-13-27)36(55)45-20-10-9-14-29(37(56)51-34)49-42(61)50-31(40(59)60)15-11-21-46-41(43)44/h6-8,12-13,17,19,22,24,26,29-32,34,53H,9-11,14-16,18,20-21,23H2,1-5H3,(H,45,55)(H,47,57)(H,48,54)(H,51,56)(H,59,60)(H4,43,44,46)(H2,49,50,61)/t26-,29+,30?,31+,32-,34-/m0/s1",BSKBLBJGHGFEGG-KVBLEGFGSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0804,Anabaenopeptin B1,,Anabaenopeptin,,C42H62N10O9,850.4701236,O=C(N(C(C)C(NC(CC1=CC=CC=C1)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(CCCCNC(N)=N)C(O)=O)=O)=O)=O)CCC3=CC=C(O)C=C3,"InChI=1S/C42H62N10O9/c1-25(2)34-38(57)47-31(21-18-27-16-19-29(53)20-17-27)39(58)52(4)26(3)35(54)48-33(24-28-12-6-5-7-13-28)36(55)45-22-10-8-14-30(37(56)51-34)49-42(61)50-32(40(59)60)15-9-11-23-46-41(43)44/h5-7,12-13,16-17,19-20,25-26,30-34,53H,8-11,14-15,18,21-24H2,1-4H3,(H,45,55)(H,47,57)(H,48,54)(H,51,56)(H,59,60)(H4,43,44,46)(H2,49,50,61)",JYPYUUUIXQVAIG-UHFFFAOYSA-N,146684879,no,n.a.,n.a.,n.a.
CyanoMetDB_0805,Anabaenopeptin F,Anabaenopeptin DA850,Anabaenopeptin,,C42H62N10O9,850.4701236,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@@H](C(O)=O)CCC/N=C(N)\N)=O)C(N[C@@H]([C@H](C)CC)C(NC(CCC3=CC=C(O)C=C3)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C42H62N10O9/c1-5-25(2)34-38(57)47-31(21-18-27-16-19-29(53)20-17-27)39(58)52(4)26(3)35(54)48-33(24-28-12-7-6-8-13-28)36(55)45-22-10-9-14-30(37(56)51-34)49-42(61)50-32(40(59)60)15-11-23-46-41(43)44/h6-8,12-13,16-17,19-20,25-26,30-34,53H,5,9-11,14-15,18,21-24H2,1-4H3,(H,45,55)(H,47,57)(H,48,54)(H,51,56)(H,59,60)(H4,43,44,46)(H2,49,50,61)/t25-,26+,30-,31?,32-,33+,34+/m1/s1",RAUPUVQHUFXDQT-XQEBCNPXSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 204
CyanoMetDB_0806,Anabaenopeptin MM850,,Anabaenopeptin,,C42H62N10O9,850.4701236,C[C@H]1C(N[C@H](C(NCCCC[C@H](C(N[C@H](C(N[C@H](C(N1C)=O)CCC2=CC=C(C=C2)O)=O)C(C)C)=O)NC(NC(CCC/N=C(N)\N)C(OC)=O)=O)=O)CC3=CC=CC=C3)=O,"InChI=1S/C42H62N10O9/c1-25(2)34-38(57)47-31(21-18-27-16-19-29(53)20-17-27)39(58)52(4)26(3)35(54)48-33(24-28-12-7-6-8-13-28)36(55)45-22-10-9-14-30(37(56)51-34)49-42(60)50-32(40(59)61-5)15-11-23-46-41(43)44/h6-8,12-13,16-17,19-20,25-26,30-34,53H,9-11,14-15,18,21-24H2,1-5H3,(H,45,55)(H,47,57)(H,48,54)(H,51,56)(H4,43,44,46)(H2,49,50,60)/t26-,30+,31-,32?,33-,34-/m0/s1",GNKSRNVMNRVEML-ZCVHTXOTSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0808,Nodulapeptin 839,NP 839,Anabaenopeptin,,C42H61N7O9S,839.4251477,O=C(N(C(CCC1=CC=CC=C1)C(NC(CO)C2=O)=O)C)C(NC(C(CCSC)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C42H61N7O9S/c1-5-27(2)35(41(56)57)48-42(58)47-30-18-12-13-24-43-36(51)33(26-50)46-39(54)34(22-20-29-16-10-7-11-17-29)49(3)40(55)32(21-19-28-14-8-6-9-15-28)45-38(53)31(23-25-59-4)44-37(30)52/h6-11,14-17,27,30-35,50H,5,12-13,18-26H2,1-4H3,(H,43,51)(H,44,52)(H,45,53)(H,46,54)(H,56,57)(H2,47,48,58)",SUNCFXQAEXZGHO-UHFFFAOYSA-N,146683779,no,Nodularia,spumigena,"CCNP 1402 ; BY 1 ; CCY 9414 ; AV 1 ; CCNP 1427 ; 
CCNP1436 ; KAC7 ; KAC71"
CyanoMetDB_0809,Anabaenopeptin 807,AP 807,Anabaenopeptin,,C42H61N7O9,807.4530766,O=C(N(C(C)C(NC(CC1=CC=CC=C1)C2=O)=O)C)C(NC(C(C(CC)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=C(O)C=C3,"InChI=1S/C42H61N7O9/c1-7-25(3)34-39(54)44-32(22-19-28-17-20-30(50)21-18-28)40(55)49(6)27(5)36(51)45-33(24-29-14-10-9-11-15-29)37(52)43-23-13-12-16-31(38(53)47-34)46-42(58)48-35(41(56)57)26(4)8-2/h9-11,14-15,17-18,20-21,25-27,31-35,50H,7-8,12-13,16,19,22-24H2,1-6H3,(H,43,52)(H,44,54)(H,45,51)(H,47,53)(H,56,57)(H2,46,48,58)",DOYBAFJOBDCILF-UHFFFAOYSA-N,146684830,no,Nodularia,spumigena,KAC 11
CyanoMetDB_0810,Nodulapeptin 807,NP 807,Anabaenopeptin,,C42H61N7O9,807.4530766,O=C(N(C(CCC1=CC=CC=C1)C(NC(CO)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C42H61N7O9/c1-6-27(4)35(41(56)57)48-42(58)46-30-19-13-14-24-43-36(51)32(25-50)45-38(53)33(23-21-29-17-11-8-12-18-29)49(5)40(55)31(22-20-28-15-9-7-10-16-28)44-39(54)34(26(2)3)47-37(30)52/h7-12,15-18,26-27,30-35,50H,6,13-14,19-25H2,1-5H3,(H,43,51)(H,44,54)(H,45,53)(H,47,52)(H,56,57)(H2,46,48,58)",RPTCZWVFLDVHRZ-UHFFFAOYSA-N,146683780,no,Nodularia,spumigena,KAC70 ; KAC87
CyanoMetDB_0811,Schizopeptin 791,,Anabaenopeptin,,C42H61N7O8,791.458162,C[C@H]([C@H]1C(N[C@@H](CCC2=CC=CC=C2)C(N(C)[C@@H](C)C(N[C@@H](CC3=CC=CC=C3)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)[C@H](CC)C)=O)C(N1)=O)=O)=O)=O)=O)CC,"InChI=1S/C42H61N7O8/c1-7-26(3)34-39(53)44-32(23-22-29-17-11-9-12-18-29)40(54)49(6)28(5)36(50)45-33(25-30-19-13-10-14-20-30)37(51)43-24-16-15-21-31(38(52)47-34)46-42(57)48-35(41(55)56)27(4)8-2/h9-14,17-20,26-28,31-35H,7-8,15-16,21-25H2,1-6H3,(H,43,51)(H,44,53)(H,45,50)(H,47,52)(H,55,56)(H2,46,48,57)/t26-,27-,28-,31+,32-,33-,34-,35-/m0/s1",UHGIIADZWWCEKS-NDSQDYTJSA-N,10985632,yes,Schizothrix,n.a.,IL-208-2-2
CyanoMetDB_0812,[Ser6] Nodulapeptin B,[Ser6] NP B,Anabaenopeptin,,C42H61N7O11S,871.414977,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CO)C2=O)=O)C)C(NC(C(CCS(C)=O)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C42H61N7O11S/c1-5-26(2)35(41(57)58)48-42(59)47-30-13-9-10-23-43-36(52)33(25-50)46-39(55)34(21-17-28-14-18-29(51)19-15-28)49(3)40(56)32(20-16-27-11-7-6-8-12-27)45-38(54)31(44-37(30)53)22-24-61(4)60/h6-8,11-12,14-15,18-19,26,30-35,50-51H,5,9-10,13,16-17,20-25H2,1-4H3,(H,43,52)(H,44,53)(H,45,54)(H,46,55)(H,57,58)(H2,47,48,59)",HPWAFILCPDHQOK-UHFFFAOYSA-N,146684903,no,Nodularia,spumigena,CCY9414
CyanoMetDB_0813,Nodulapeptin 855a,NP 855a,Anabaenopeptin,,C42H61N7O10S,855.4200624,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CO)C2=O)=O)C)C(NC(C(CCSC)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C42H61N7O10S/c1-5-26(2)35(41(57)58)48-42(59)47-30-13-9-10-23-43-36(52)33(25-50)46-39(55)34(21-17-28-14-18-29(51)19-15-28)49(3)40(56)32(20-16-27-11-7-6-8-12-27)45-38(54)31(22-24-60-4)44-37(30)53/h6-8,11-12,14-15,18-19,26,30-35,50-51H,5,9-10,13,16-17,20-25H2,1-4H3,(H,43,52)(H,44,53)(H,45,54)(H,46,55)(H,57,58)(H2,47,48,59)",CWANKXLXOYMBBJ-UHFFFAOYSA-N,146684831,no,Nodularia,spumigena,"CCNP 1402 ; BY 1 ; CCY 9414 ; AV 1 ; CCNP 1427 ; 
CCNP1436 ; KAC7 ; KAC71"
CyanoMetDB_0814,Nodulapeptin 855b,NP 855b,Anabaenopeptin,,C42H61N7O10S,855.4200624,O=C(N(C(CCC1=CC=CC=C1)C(NC(CO)C2=O)=O)C)C(NC(C(CCS(C)=O)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C42H61N7O10S/c1-5-27(2)35(41(56)57)48-42(58)47-30-18-12-13-24-43-36(51)33(26-50)46-39(54)34(22-20-29-16-10-7-11-17-29)49(3)40(55)32(21-19-28-14-8-6-9-15-28)45-38(53)31(44-37(30)52)23-25-60(4)59/h6-11,14-17,27,30-35,50H,5,12-13,18-26H2,1-4H3,(H,43,51)(H,44,52)(H,45,53)(H,46,54)(H,56,57)(H2,47,48,58)",WTOJHHZFHCUTDI-UHFFFAOYSA-N,146684748,no,Nodularia,spumigena,n.a.
CyanoMetDB_0815,Nodulapeptin 823,NP 823,Anabaenopeptin,,C42H61N7O10,823.4479912,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CO)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(C(CC)C)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C42H61N7O10/c1-6-26(4)35(41(57)58)48-42(59)46-30-14-10-11-23-43-36(52)32(24-50)45-38(54)33(22-18-28-15-19-29(51)20-16-28)49(5)40(56)31(21-17-27-12-8-7-9-13-27)44-39(55)34(25(2)3)47-37(30)53/h7-9,12-13,15-16,19-20,25-26,30-35,50-51H,6,10-11,14,17-18,21-24H2,1-5H3,(H,43,52)(H,44,55)(H,45,54)(H,47,53)(H,57,58)(H2,46,48,59)",UOBGMYUXNSKBFF-UHFFFAOYSA-N,146684902,no,Nodularia,spumigena,KAC70 ; KAC87
CyanoMetDB_0816,Micropeptin 90,,Cyanopeptolin,Micropeptin;  Anabaenopeptilide,C42H59N9O15S,961.3851334,C[C@H]1[C@@H](C(N[C@@H](C(N[C@@H]2CC[C@@H](N(C2=O)[C@@H](C(N([C@@H](C(NC(C(O1)=O)C(C)C)=O)CC3=CC=C(C=C3)O)C)=O)CC4=CC=CC=C4)O)=O)CCC/N=C(N)\N)=O)NC(C(COS(=O)(O)=O)O)=O,"InChI=1S/C42H59N9O15S/c1-22(2)33-41(61)66-23(3)34(49-37(57)31(53)21-65-67(62,63)64)38(58)46-27(11-8-18-45-42(43)44)35(55)47-28-16-17-32(54)51(39(28)59)30(20-24-9-6-5-7-10-24)40(60)50(4)29(36(56)48-33)19-25-12-14-26(52)15-13-25/h5-7,9-10,12-15,22-23,27-34,52-54H,8,11,16-21H2,1-4H3,(H,46,58)(H,47,55)(H,48,56)(H,49,57)(H4,43,44,45)(H,62,63,64)/t23-,27+,28+,29+,30+,31?,32-,33?,34-/m0/s1",XYLRPTCPMWMQJO-DTZDLPBWSA-N,,yes,Microcystis,aeruginosa,NIES90
CyanoMetDB_0817,Anabaenopeptin 802,Anabaenopeptin 803,Anabaenopeptin,,C42H58N8O8,802.4377609,O=C(NC(C(C)C)C(O)=O)NC(CCCCNC(C(CC1=CC=CC=C1)NC(C(C)N(C2=O)C)=O)=O)C(NC(C(CC)C)C(NC2CC3=CNC4=CC=CC=C34)=O)=O,"InChI=1S/C42H58N8O8/c1-7-25(4)35-39(54)46-33(22-28-23-44-30-18-12-11-17-29(28)30)40(55)50(6)26(5)36(51)45-32(21-27-15-9-8-10-16-27)37(52)43-20-14-13-19-31(38(53)48-35)47-42(58)49-34(24(2)3)41(56)57/h8-12,15-18,23-26,31-35,44H,7,13-14,19-22H2,1-6H3,(H,43,52)(H,45,51)(H,46,54)(H,48,53)(H,56,57)(H2,47,49,58)",FMXKKRVABMYCJR-UHFFFAOYSA-N,146684812,no,Brasilonema; Desmonostoc,n.a.,[Brasilonema]CENA360;[Desmonostoc]CENA382
CyanoMetDB_0818,Kakeromamide A,,Cyclamide,,C42H58N6O7S,790.4087694,O=C(NC(C(C)C)C1=NC(C(NC(CCC)C(C)C2=O)=O)=CS1)C(N(C(C(CC3=CC=C(OC)C=C3)N(C(C(N2)C(C)C)=O)C)=O)C)CC4=CC=C(OC)C=C4,"InChI=1S/C42H58N6O7S/c1-11-12-31-26(6)37(49)46-36(25(4)5)42(53)48(8)34(22-28-15-19-30(55-10)20-16-28)41(52)47(7)33(21-27-13-17-29(54-9)18-14-27)39(51)45-35(24(2)3)40-44-32(23-56-40)38(50)43-31/h13-20,23-26,31,33-36H,11-12,21-22H2,1-10H3,(H,43,50)(H,45,51)(H,46,49)/t26-,31+,33+,34-,35-,36-/m0/s1",KLPNJQKYFZVGOK-GLMMOMNDSA-N,,yes,Moorea,bouillonii,n.a.
CyanoMetDB_0820,Cocosamide A,,other cyclic peptide,Trungapeptin,C42H57N5O7,743.4257992,CC(C)[C@H]1C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)NCC(=O)O[C@H](C(C(=O)N1)(C)C)CCCC=C)CC3=CC=CC=C3)C)CC4=CC=CC=C4)C,"InChI=1S/C42H57N5O7/c1-8-9-12-23-34-42(4,5)41(53)44-36(28(2)3)40(52)46(7)33(26-30-20-15-11-16-21-30)39(51)47-24-17-22-31(47)38(50)45(6)32(25-29-18-13-10-14-19-29)37(49)43-27-35(48)54-34/h8,10-11,13-16,18-21,28,31-34,36H,1,9,12,17,22-27H2,2-7H3,(H,43,49)(H,44,53)/t31-,32-,33-,34-,36-/m0/s1",DYRQQWGTDVBUND-NRYNYGQJSA-N,52952542,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0821,Cocosamide B,,other cyclic peptide,Trungapeptin,C42H55N5O7,741.4101491,CC(C)[C@H]1C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)NCC(=O)O[C@H](C(C(=O)N1)(C)C)CCCC#C)CC3=CC=CC=C3)C)CC4=CC=CC=C4)C ,"InChI=1S/C42H55N5O7/c1-8-9-12-23-34-42(4,5)41(53)44-36(28(2)3)40(52)46(7)33(26-30-20-15-11-16-21-30)39(51)47-24-17-22-31(47)38(50)45(6)32(25-29-18-13-10-14-19-29)37(49)43-27-35(48)54-34/h1,10-11,13-16,18-21,28,31-34,36H,9,12,17,22-27H2,2-7H3,(H,43,49)(H,44,53)/t31-,32-,33-,34-,36-/m0/s1",WQLPTPGNWCVEOG-NRYNYGQJSA-N,52952543,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0822,Guineamide G,,other cyclic peptide,Obyanamide,C42H55N5O7,741.4101491,CN(C(C1CCCN1C(C(CC2=CC=CC=C2)N(C)C3=O)=O)=O)C(C(NCC(OC(CCCC#C)C(C(NC3C(C)C)=O)(C)C)=O)=O)CC4=CC=CC=C4,"InChI=1S/C42H55N5O7/c1-8-9-12-23-34-42(4,5)41(53)44-36(28(2)3)40(52)46(7)33(26-30-20-15-11-16-21-30)39(51)47-24-17-22-31(47)38(50)45(6)32(25-29-18-13-10-14-19-29)37(49)43-27-35(48)54-34/h1,10-11,13-16,18-21,28,31-34,36H,9,12,17,22-27H2,2-7H3,(H,43,49)(H,44,53)",WQLPTPGNWCVEOG-UHFFFAOYSA-N,75972069,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0823,35-O-?-6 amino-6-deoxyglucopyranosyl-bacteriohopanetetrol,,other linear non-peptide,Triterpenoid,C41H73NO8,707.5336183,O[C@@H]1[C@@H](O)[C@H](O)[C@@H](CN)O[C@H]1OC[C@H](O)[C@H](O)[C@H](O)CC[C@H](C)[C@H]2C3CC[C@@]4(C)[C@]5(C)CCC6C(C)(C)CCC[C@]6(C)C5CCC4[C@@]3(C)CC2,"InChI=1S/C41H73NO8/c1-23(9-10-26(43)32(45)27(44)22-49-36-35(48)34(47)33(46)28(21-42)50-36)24-13-18-38(4)25(24)14-19-40(6)30(38)11-12-31-39(5)17-8-16-37(2,3)29(39)15-20-41(31,40)7/h23-36,43-48H,8-22,42H2,1-7H3/t23-,24-,25?,26+,27-,28+,29?,30?,31?,32+,33+,34-,35+,36+,38-,39-,40+,41+/m0/s1",HEUSSFSVKKVAFQ-UODGXBKSSA-N,,yes,Synechocystis,sp.,PCC 6714
CyanoMetDB_0824,Bacteriohopanetetrol,,other linear non-peptide,Triterpenoid,C41H73NO8,707.5336183,C[C@]12C(C(CCC2)(C)C)CC[C@@]3(C1CCC4[C@@]3(C)CCC5[C@]4(C)CC[C@@H]5[C@@H](CCC(C(C(O)CO[C@H]6[C@@](O)([C@H]([C@@H]([C@H]6N)O)O)CO)O)O)C)C,"InChI=1S/C41H73NO8/c1-23(9-10-26(44)32(46)27(45)21-50-35-31(42)33(47)34(48)41(35,49)22-43)24-13-18-37(4)25(24)14-19-39(6)29(37)11-12-30-38(5)17-8-16-36(2,3)28(38)15-20-40(30,39)7/h23-35,43-49H,8-22,42H2,1-7H3/t23-,24-,25?,26?,27?,28?,29?,30?,31-,32?,33-,34+,35-,37+,38+,39-,40-,41+/m1/s1",AGAUYSZNDYQXOM-WEVIMLSJSA-N,,yes,Synechocystis,n.a.,PCC 6714
CyanoMetDB_0825,Isodolastatin H,,other linear peptide,linear depsipeptide,C41H70N4O8,746.5193652,CN(C)[C@@H](C(C)C)C(N[C@@H]([C@H](CC)C)C(N(C)[C@@H]([C@@H](C)CC)[C@H](OC)CC(N1[C@H](CCC1)[C@H](OC)[C@H](C(O[C@H](CO)CC2=CC=CC=C2)=O)C)=O)=O)=O,"InChI=1S/C41H70N4O8/c1-13-27(5)35(42-39(48)36(26(3)4)43(8)9)40(49)44(10)37(28(6)14-2)33(51-11)24-34(47)45-22-18-21-32(45)38(52-12)29(7)41(50)53-31(25-46)23-30-19-16-15-17-20-30/h15-17,19-20,26-29,31-33,35-38,46H,13-14,18,21-25H2,1-12H3,(H,42,48)/t27-,28-,29+,31-,32+,33+,35-,36-,37-,38+/m0/s1",SFXKEJBUVQPGJV-NUMRLBQESA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0826,Oscillariolide,,other linear non-peptide,,C41H69BrO11,816.402326,CC1CC(CC(CC(=CC(=O)OC2CC(C1)OC2(C)C(C=C(C)CC(C(C)(C)C(CC(C(C)C(CC(CC(=C)C(=CBr)OC)O)O)O)O)O)O)C)C)O,"InChI=1S/C41H69BrO11/c1-23-11-24(2)17-39(50)52-38-20-31(14-25(3)13-29(43)12-23)53-41(38,9)37(49)16-26(4)15-35(47)40(7,8)36(48)21-33(46)28(6)32(45)19-30(44)18-27(5)34(22-42)51-10/h16-17,22-23,25,28-33,35-38,43-49H,5,11-15,18-21H2,1-4,6-10H3",PLLOEODSUMNSFG-UHFFFAOYSA-N,73817733,yes,Oscillatoria,sp.,n.a.
CyanoMetDB_0827,Aeruginosin 850,,Aeruginosin,Depsipeptide,C41H66N6O13,850.4687862,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(CO)O4)C(OC(CCCCC)=O)CC3C1,"InChI=1S/C41H66N6O13/c1-4-5-6-9-33(51)58-30-19-24-18-28(37(55)44-14-7-8-15-45-41(42)43)47(27(24)20-31(30)59-40-36(54)35(53)34(52)32(21-48)60-40)39(57)26(16-22(2)3)46-38(56)29(50)17-23-10-12-25(49)13-11-23/h10-13,22,24,26-32,34-36,40,48-50,52-54H,4-9,14-21H2,1-3H3,(H,44,55)(H,46,56)(H4,42,43,45)",RNJJAHMIEZTNON-UHFFFAOYSA-N,146684797,no,n.a.,n.a.,n.a.
CyanoMetDB_0830,Micropeptin MZ939A,,Cyanopeptolin,Micropeptin,C41H65N9O14S,939.437169,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](OS(=O)(O)=O)CO)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](OC)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C41H65N9O14S/c1-8-22(3)31-40(58)63-24(5)32(48-36(54)29(21-51)64-65(59,60)61)37(55)45-26(16-13-19-44-41(42)43)34(52)46-27-17-18-30(62-7)50(38(27)56)33(23(4)9-2)39(57)49(6)28(35(53)47-31)20-25-14-11-10-12-15-25/h10-12,14-15,22-24,26-33,51H,8-9,13,16-21H2,1-7H3,(H,45,55)(H,46,52)(H,47,53)(H,48,54)(H4,42,43,44)(H,59,60,61)/t22-,23-,24-,26+,27+,28+,29+,30-,31+,32+,33-/m1/s1",KAYMQKAMCDUXRP-QOUKPJRESA-N,,yes,Microcystis,n.a.,TAU IL-361
CyanoMetDB_0831,Micropeptin MZ939B,,Cyanopeptolin,Micropeptin,C41H65N9O14S,939.437169,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](O)COS(=O)(O)=O)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](OC)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C41H65N9O14S/c1-8-22(3)31-40(58)64-24(5)32(48-36(54)29(51)21-63-65(59,60)61)37(55)45-26(16-13-19-44-41(42)43)34(52)46-27-17-18-30(62-7)50(38(27)56)33(23(4)9-2)39(57)49(6)28(35(53)47-31)20-25-14-11-10-12-15-25/h10-12,14-15,22-24,26-33,51H,8-9,13,16-21H2,1-7H3,(H,45,55)(H,46,52)(H,47,53)(H,48,54)(H4,42,43,44)(H,59,60,61)/t22-,23-,24-,26+,27+,28+,29+,30-,31+,32+,33-/m1/s1",MAPYTJSQLKSZEZ-QOUKPJRESA-N,,yes,Microcystis,n.a.,TAU IL-361
CyanoMetDB_0832,Micropeptin MZ859,,Cyanopeptolin,Micropeptin,C41H65N9O11,859.4803539,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](O)CO)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](OC)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C41H65N9O11/c1-8-22(3)31-40(59)61-24(5)32(48-36(55)29(52)21-51)37(56)45-26(16-13-19-44-41(42)43)34(53)46-27-17-18-30(60-7)50(38(27)57)33(23(4)9-2)39(58)49(6)28(35(54)47-31)20-25-14-11-10-12-15-25/h10-12,14-15,22-24,26-33,51-52H,8-9,13,16-21H2,1-7H3,(H,45,56)(H,46,53)(H,47,54)(H,48,55)(H4,42,43,44)/t22-,23-,24-,26+,27+,28+,29+,30-,31+,32+,33-/m1/s1",FFTCTTXTQUKETH-QOUKPJRESA-N,,yes,Microcystis,n.a.,TAU IL-361
CyanoMetDB_0833,Micropeptin LH911C,,Cyanopeptolin,Micropeptin,C41H65N7O14S,911.431021,CC[C@H]([C@@H]1C(O[C@H](C)[C@@H](NC(C(O)COS(=O)(O)=O)=O)C(N[C@H](CCCCNC)C(N[C@@H]2CC[C@H](O)N([C@H]([C@@H](CC)C)C(N(C)[C@H](CC3=CC=CC=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C41H65N7O14S/c1-8-23(3)32-41(57)62-25(5)33(46-37(53)30(49)22-61-63(58,59)60)38(54)43-27(17-13-14-20-42-6)35(51)44-28-18-19-31(50)48(39(28)55)34(24(4)9-2)40(56)47(7)29(36(52)45-32)21-26-15-11-10-12-16-26/h10-12,15-16,23-25,27-34,42,49-50H,8-9,13-14,17-22H2,1-7H3,(H,43,54)(H,44,51)(H,45,52)(H,46,53)(H,58,59,60)/t23-,24-,25-,27-,28-,29-,30?,31+,32-,33-,34-/m1/s1",MUGOVXJAFCWIDZ-NBGCHSOJSA-N,,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0834,Ribocyclophane C,,other cyclic non-peptide,Cyclophane,C41H64O9,700.4550336,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H](CC3=CC(=C1C(=C3)O)O)C)CCCC)C(=C2)O)O)O[C@H]4[C@@H]([C@@H]([C@@H](CO4)O)O)O)C,"InChI=1S/C41H64O9/c1-5-7-15-28-18-12-10-14-26(4)40(50-41-39(48)38(47)35(46)24-49-41)30-22-33(44)37(34(45)23-30)29(16-8-6-2)17-11-9-13-25(3)19-27-20-31(42)36(28)32(43)21-27/h20-23,25-26,28-29,35,38-48H,5-19,24H2,1-4H3/t25-,26-,28-,29-,35+,38+,39+,40+,41-/m0/s1",OVFNKDBPAHWGCH-JIXPCORFSA-N,139588669,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0835,Ribocyclophane B,,other cyclic non-peptide,Cyclophane,C41H64O10,716.4499483,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O)C)CCCC)C(=C2)O)O)O[C@H]4[C@@H]([C@@H]([C@@H](CO4)O)O)O)C,"InChI=1S/C41H64O10/c1-5-7-15-26-18-12-10-14-25(4)40(51-41-39(49)38(48)34(46)23-50-41)29-21-32(44)36(33(45)22-29)27(16-8-6-2)17-11-9-13-24(3)37(47)28-19-30(42)35(26)31(43)20-28/h19-22,24-27,34,37-49H,5-18,23H2,1-4H3/t24-,25-,26-,27-,34+,37+,38+,39+,40+,41-/m0/s1",RPTQDUWXNJMHFS-SGDFNLODSA-N,139588670,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0836,Aeruginosin 865,,Aeruginosin,Depsipeptide,C41H64N6O14,864.4480508,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(C(O)=O)O4)C(OC(CCCCC)=O)CC3C1,"InChI=1S/C41H64N6O14/c1-4-5-6-9-31(50)59-29-19-23-18-27(36(54)44-14-7-8-15-45-41(42)43)47(26(23)20-30(29)60-40-34(53)32(51)33(52)35(61-40)39(57)58)38(56)25(16-21(2)3)46-37(55)28(49)17-22-10-12-24(48)13-11-22/h10-13,21,23,25-30,32-35,40,48-49,51-53H,4-9,14-20H2,1-3H3,(H,44,54)(H,46,55)(H,57,58)(H4,42,43,45)",GYBRMQYCKSSXID-UHFFFAOYSA-N,73774585,yes,Nostoc,n.a.,n.a.
CyanoMetDB_0837,Aeruginosin 848,,Aeruginosin,Depsipeptide,C41H64N6O13,848.4531361,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=CC=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(C(O)=O)O4)C(OC(CCCCC)=O)CC3C1,"InChI=1S/C41H64N6O13/c1-4-5-7-14-31(49)58-29-20-24-19-27(36(53)44-15-10-11-16-45-41(42)43)47(26(24)21-30(29)59-40-34(52)32(50)33(51)35(60-40)39(56)57)38(55)25(17-22(2)3)46-37(54)28(48)18-23-12-8-6-9-13-23/h6,8-9,12-13,22,24-30,32-35,40,48,50-52H,4-5,7,10-11,14-21H2,1-3H3,(H,44,53)(H,46,54)(H,56,57)(H4,42,43,45)",SCMZCDOVEOBXKC-UHFFFAOYSA-N,146684798,no,n.a.,n.a.,n.a.
CyanoMetDB_0838,Tasiamide C,,other linear peptide,Carmabin,C41H64N6O11,816.4633069,O=C(N(C)[C@H](CC1=CC=CC=C1)C(N2CCC[C@H]2C(OC)=O)=O)[C@@H](NC([C@@H](NC([C@@H](N(C)C([C@H](OC([C@H](C(C)C)O)=O)C(C)C)=O)CCC(N)=O)=O)[C@H](CC)C)=O)C,"InChI=1S/C41H64N6O11/c1-11-25(6)32(44-35(50)28(19-20-31(42)48)45(8)39(54)34(24(4)5)58-41(56)33(49)23(2)3)36(51)43-26(7)37(52)46(9)30(22-27-16-13-12-14-17-27)38(53)47-21-15-18-29(47)40(55)57-10/h12-14,16-17,23-26,28-30,32-34,49H,11,15,18-22H2,1-10H3,(H2,42,48)(H,43,51)(H,44,50)/t25-,26-,28-,29-,30+,32-,33-,34+/m0/s1",AHQNKBYNGPOOJC-MQGPFOMQSA-N,146683692,yes,Symploca,n.a.,n.a.
CyanoMetDB_0839,Antanapeptin C,,other cyclic peptide,"Trungapeptin, Depsipeptides (cyclic)",C41H64N4O8,740.472415,CCCCCC1C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O1)C(C)CC)C)C(C)C)CC3=CC=CC=C3)C)C(C)C)C,"InChI=1S/C41H64N4O8/c1-11-13-15-22-32-28(8)36(46)42-33(25(3)4)38(48)43(9)31(24-29-19-16-14-17-20-29)40(50)53-35(26(5)6)39(49)45-23-18-21-30(45)37(47)44(10)34(27(7)12-2)41(51)52-32/h14,16-17,19-20,25-28,30-35H,11-13,15,18,21-24H2,1-10H3,(H,42,46)/t27?,28?,30-,31-,32?,33-,34-,35-/m0/s1",NIFSOTSGUFBSPF-CVZHIFNESA-N,15546252,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0840,Hantupeptin C,,other cyclic peptide,Depsipeptide,C41H64N4O8,740.472415,CCCCC[C@H]1[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O1)C(C)C)C)CC3=CC=CC=C3)[C@@H](C)CC)C)C(C)C)C,"InChI=1S/C41H64N4O8/c1-11-13-15-22-31-28(8)36(46)42-33(25(3)4)39(49)44(10)35(27(7)12-2)41(51)53-32(24-29-19-16-14-17-20-29)38(48)45-23-18-21-30(45)37(47)43(9)34(26(5)6)40(50)52-31/h14,16-17,19-20,25-28,30-35H,11-13,15,18,21-24H2,1-10H3,(H,42,46)/t27-,28+,30-,31-,32-,33-,34-,35-/m0/s1",CQEZMRWKVFFGKE-MJZFXANDSA-N,45104032,yes,Lyngbya/Moorea,majuscula/producens,LT/PHB/002
CyanoMetDB_0841,Tiahuramide C,,other cyclic peptide,other cyclic depsipeptide,C41H64N4O8,740.472415,CCCCC[C@@H]1[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O1)[C@@H](C)CC)C)CC3=CC=CC=C3)C(C)C)C)C(C)C)C,"InChI=1S/C41H64N4O8/c1-11-13-15-22-31-28(8)36(46)42-33(25(3)4)39(49)43(9)34(26(5)6)40(50)53-32(24-29-19-16-14-17-20-29)38(48)45-23-18-21-30(45)37(47)44(10)35(27(7)12-2)41(51)52-31/h14,16-17,19-20,25-28,30-35H,11-13,15,18,21-24H2,1-10H3,(H,42,46)/t27-,28-,30-,31+,32-,33-,34-,35-/m0/s1",XLHASFYAUGQJAG-YYUBPKKPSA-N,139589991,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0842,Micropeptin HU1069,,Cyanopeptolin,Micropeptin,C41H64ClN9O18S2,1069.349926,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](OS(=O)(O)=O)COS(=O)(O)=O)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC(Cl)=C(OC)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C41H64ClN9O18S2/c1-8-20(3)31-40(59)68-22(5)32(49-36(55)29(69-71(63,64)65)19-67-70(60,61)62)37(56)46-25(11-10-16-45-41(43)44)34(53)47-26-13-15-30(52)51(38(26)57)33(21(4)9-2)39(58)50(6)27(35(54)48-31)18-23-12-14-28(66-7)24(42)17-23/h12,14,17,20-22,25-27,29-33,52H,8-11,13,15-16,18-19H2,1-7H3,(H,46,56)(H,47,53)(H,48,54)(H,49,55)(H4,43,44,45)(H,60,61,62)(H,63,64,65)/t20-,21-,22-,25-,26-,27-,29+,30+,31-,32-,33+/m0/s1",WOAMPBVZWZVESL-ORVHFKBCSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0843,Micropeptin HU989,,Cyanopeptolin,Micropeptin,C41H64ClN9O15S,989.3931113,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](O)COS(=O)(O)=O)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@H](C)C)C(N(C)[C@@H](CC3=CC(Cl)=C(OC)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C40H62ClN9O15S/c1-8-20(4)30-39(59)65-21(5)31(48-35(55)27(51)18-64-66(60,61)62)36(56)45-24(10-9-15-44-40(42)43)33(53)46-25-12-14-29(52)50(37(25)57)32(19(2)3)38(58)49(6)26(34(54)47-30)17-22-11-13-28(63-7)23(41)16-22/h11,13,16,19-21,24-27,29-32,51-52H,8-10,12,14-15,17-18H2,1-7H3,(H,45,56)(H,46,53)(H,47,54)(H,48,55)(H4,42,43,44)(H,60,61,62)/t20-,21-,24-,25-,26-,27+,29+,30-,31-,32+/m0/s1",XBMVIECAUHGESJ-RXDILXCRSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0844,Micropeptin HU909,,Cyanopeptolin,Micropeptin,C41H64ClN9O12,909.4362962,CC([C@H]1C(O[C@@H](C)[C@H](NC([C@H](O)CO)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](OC)[N@@]([C@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC(Cl)=C(OC)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C41H64ClN9O12/c1-9-21(4)33-39(59)50(6)27(18-23-12-14-29(61-7)24(42)17-23)35(55)48-31(20(2)3)40(60)63-22(5)32(49-36(56)28(53)19-52)37(57)46-25(11-10-16-45-41(43)44)34(54)47-26-13-15-30(62-8)51(33)38(26)58/h12,14,17,20-22,25-28,30-33,52-53H,9-11,13,15-16,18-19H2,1-8H3,(H,46,57)(H,47,54)(H,48,55)(H,49,56)(H4,43,44,45)/t21-,22-,25-,26-,27-,28+,30+,31-,32-,33+/m0/s1",LURNUBHCAYLVKT-DXUYWPFXSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0846,Microginin 478,,Microginin,,C41H63N5O9,769.4625786,O=C([C@@H]([C@@H](CCCCCCC)NC)O)N[C@@H](C(C)C)C(N(C)[C@@H](C(C)C)C(N([C@@H](CC1=CC=C(C=C1)O)C(N[C@H](C(O)=O)CC2=CC=C(C=C2)O)=O)C)=O)=O,"InChI=1S/C41H63N5O9/c1-9-10-11-12-13-14-31(42-6)36(49)38(51)44-34(25(2)3)39(52)46(8)35(26(4)5)40(53)45(7)33(24-28-17-21-30(48)22-18-28)37(50)43-32(41(54)55)23-27-15-19-29(47)20-16-27/h15-22,25-26,31-36,42,47-49H,9-14,23-24H2,1-8H3,(H,43,50)(H,44,51)(H,54,55)/t31-,32+,33+,34+,35+,36-/m1/s1",ZMXDUWZRGQQFIH-MLMLQBJQSA-N,,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_0847,Microginin 770,MG770 ; Microginin 769,Microginin,,C41H63N5O9,769.4625786,O=C(NC(CC1=CC=C(O)C=C1)C(O)=O)C(CCC2=CC=C(O)C=C2)NC(C(CC(C)C)NC(C(C(C)C)NC(C(O)C(NC)CCCCCCC)=O)=O)=O,"InChI=1S/C41H63N5O9/c1-7-8-9-10-11-12-31(42-6)36(49)40(53)46-35(26(4)5)39(52)44-33(23-25(2)3)38(51)43-32(22-17-27-13-18-29(47)19-14-27)37(50)45-34(41(54)55)24-28-15-20-30(48)21-16-28/h13-16,18-21,25-26,31-36,42,47-49H,7-12,17,22-24H2,1-6H3,(H,43,51)(H,44,52)(H,45,50)(H,46,53)(H,54,55)",YSNCVQPXJAIHHN-UHFFFAOYSA-N,146683730,no,Microcystis,n.a.,LTPNA08/09
CyanoMetDB_0848,Linear Nodularin-R,,Nodularin,,C41H62N8O11,842.4538048,C/C=C(N(C)C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@@H]([C@@H](OC)CC1=CC=CC=C1)C)N)=O)=O)/C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCC/N=C(N)\N)C(O)=O)=O)=O,"InChI=1S/C41H62N8O11/c1-8-31(37(53)48-34(40(58)59)26(5)36(52)46-29(38(54)55)15-12-20-45-41(43)44)49(6)33(50)19-18-30(39(56)57)47-35(51)25(4)28(42)17-16-23(2)21-24(3)32(60-7)22-27-13-10-9-11-14-27/h8-11,13-14,16-17,21,24-26,28-30,32,34H,12,15,18-20,22,42H2,1-7H3,(H,46,52)(H,47,51)(H,48,53)(H,54,55)(H,56,57)(H,58,59)(H4,43,44,45)/b17-16+,23-21+,31-8-/t24-,25-,26-,28-,29-,30+,32-,34+/m0/s1",NBEVZCVMXIFRCY-HSKGSTCASA-N,,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0849,[D-MeAbu]NOD-R,Dihydronodularin-R,Nodularin,,C41H62N8O10,826.4588902,C[C@@H](/C=C(C)/C=C/[C@H](NC1=O)[C@H](C)C(N[C@@H](C(O)=O)CCC(N(C)[C@@H](C(N[C@H]([C@H](C)C(N[C@H]1CCCNC(N)=N)=O)C(O)=O)=O)CC)=O)=O)[C@@H](OC)CC2=CC=CC=C2,"InChI=1S/C41H62N8O10/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/h9-11,13-14,16-17,21,24-26,28-32,34H,8,12,15,18-20,22H2,1-7H3,(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+/t24-,25-,26-,28-,29-,30?,31+,32?,34?/m0/s1",RLFXWEJNSCUBRW-HGUBKEHQSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0850,[L-MeAbu]NOD-R,Dihydronodularin-R,Nodularin,,C41H62N8O10,826.4588902,C[C@@H](/C=C(C)/C=C/[C@H](NC1=O)[C@H](C)C(N[C@@H](C(O)=O)CCC(N(C)[C@H](C(N[C@H]([C@H](C)C(N[C@H]1CCCNC(N)=N)=O)C(O)=O)=O)CC)=O)=O)[C@@H](OC)CC2=CC=CC=C2,"InChI=1S/C41H62N8O10/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/h9-11,13-14,16-17,21,24-26,28-32,34H,8,12,15,18-20,22H2,1-7H3,(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+/t24-,25-,26-,28-,29-,30?,31-,32?,34?/m0/s1",RLFXWEJNSCUBRW-CWQJLRENSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0851,Antanapeptin B,,other cyclic peptide,"Trungapeptin, Depsipeptides (cyclic)",C41H62N4O8,738.456765,CCC(C)[C@H]1C(=O)OC(C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1C)C(C)C)CC3=CC=CC=C3)C)C(C)C)C)CCCC=C,"InChI=1S/C41H62N4O8/c1-11-13-15-22-32-28(8)36(46)42-33(25(3)4)38(48)43(9)31(24-29-19-16-14-17-20-29)40(50)53-35(26(5)6)39(49)45-23-18-21-30(45)37(47)44(10)34(27(7)12-2)41(51)52-32/h11,14,16-17,19-20,25-28,30-35H,1,12-13,15,18,21-24H2,2-10H3,(H,42,46)/t27?,28?,30-,31-,32?,33-,34-,35-/m0/s1",LZACOZXZESEOFK-CVZHIFNESA-N,15546251,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0852,Hantupeptin B,,other linear peptide,Depsipeptide,C41H62N4O8,738.456765,CC[C@H](C)[C@H]1C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@H]([C@H](C(=O)N[C@H](C(=O)N1C)C(C)C)C)CCCC=C)C(C)C)C)CC3=CC=CC=C3,"InChI=1S/C41H62N4O8/c1-11-13-15-22-31-28(8)36(46)42-33(25(3)4)39(49)44(10)35(27(7)12-2)41(51)53-32(24-29-19-16-14-17-20-29)38(48)45-23-18-21-30(45)37(47)43(9)34(26(5)6)40(50)52-31/h11,14,16-17,19-20,25-28,30-35H,1,12-13,15,18,21-24H2,2-10H3,(H,42,46)/t27-,28+,30-,31-,32-,33-,34-,35-/m0/s1",MGCXOVOYIFZHHZ-MJZFXANDSA-N,45104031,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0853,Tiahuramide B,,other cyclic peptide,other cyclic depsipeptide,C41H62N4O8,738.456765,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1C)CC3=CC=CC=C3)C(C)C)C)C(C)C)C)CCCC=C,"InChI=1S/C41H62N4O8/c1-11-13-15-22-31-28(8)36(46)42-33(25(3)4)39(49)43(9)34(26(5)6)40(50)53-32(24-29-19-16-14-17-20-29)38(48)45-23-18-21-30(45)37(47)44(10)35(27(7)12-2)41(51)52-31/h11,14,16-17,19-20,25-28,30-35H,1,12-13,15,18,21-24H2,2-10H3,(H,42,46)/t27-,28-,30-,31+,32-,33-,34-,35-/m0/s1",STWXMGWZPNZIOX-YYUBPKKPSA-N,139589990,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0854,Planktopeptin BL843,,Cyanopeptolin,,C41H61N7O12,843.4378204,O[C@H]1N(C([C@H](CC1)NC([C@H](CC(C)C)N2)=O)=O)C([C@@H](C)O)C(N(C)[C@@H](CC3=CC=C(C=C3)OC)C(N[C@H](C(O[C@H]([C@@H](C2=O)NC([C@H]4NC(CC4)=O)=O)C)=O)[C@H](C)CC)=O)=O,"InChI=1S/C41H61N7O12/c1-9-21(4)32-41(58)60-23(6)33(46-35(52)26-14-16-30(50)42-26)38(55)44-28(18-20(2)3)36(53)43-27-15-17-31(51)48(39(27)56)34(22(5)49)40(57)47(7)29(37(54)45-32)19-24-10-12-25(59-8)13-11-24/h10-13,20-23,26-29,31-34,49,51H,9,14-19H2,1-8H3,(H,42,50)(H,43,53)(H,44,55)(H,45,54)(H,46,52)/t21-,22-,23+,26+,27+,28+,29+,31-,32+,33+,34?/m1/s1",NEBZXFVQFIUEIH-HIVMEVTRSA-N,,yes,Oscillatoria/Planktothrix,rubescens,n.a.
CyanoMetDB_0856,Microginin FR8,,Microginin,,C41H61N5O9,767.4469286,OC(C(N1C(CCC1)C(N(C(C(NC(C(NC(CC2=CC=C(C=C2)O)C(O)=O)=O)CC3=CC=C(O)C=C3)=O)CC(C)C)C)=O)=O)C(NC)CCCCCCC,"InChI=1S/C41H61N5O9/c1-6-7-8-9-10-12-31(42-4)36(49)40(53)46-22-11-13-34(46)39(52)45(5)35(23-26(2)3)38(51)43-32(24-27-14-18-29(47)19-15-27)37(50)44-33(41(54)55)25-28-16-20-30(48)21-17-28/h14-21,26,31-36,42,47-49H,6-13,22-25H2,1-5H3,(H,43,51)(H,44,50)(H,54,55)",WRCXHFBAHUTWIQ-UHFFFAOYSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0857,Microginin 767,,Microginin,,C41H61N5O9,767.4469286,OC(C(NC(C(N(C(C(N1C(C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)CCC1)=O)C(CC)C)C)=O)CC3=CC=C(O)C=C3)=O)C(NC)CCCCCCC,"InChI=1S/C41H61N5O9/c1-6-8-9-10-11-13-31(42-4)36(49)38(51)43-32(24-27-15-19-29(47)20-16-27)39(52)45(5)35(26(3)7-2)40(53)46-23-12-14-34(46)37(50)44-33(41(54)55)25-28-17-21-30(48)22-18-28/h15-22,26,31-36,42,47-49H,6-14,23-25H2,1-5H3,(H,43,51)(H,44,50)(H,54,55)",IFMJJUPZIKGJIU-UHFFFAOYSA-N,146683918,no,n.a.,n.a.,n.a.
CyanoMetDB_0858,Microginin KR767,,Microginin,,C41H61N5O9,767.4469286,O[C@@H]([C@H](CCCCCCC)NC)C(N[C@H](CC1=CC=C(C=C1)O)C(N([C@@H](CC(C)C)C(N2[C@@H](CCC2)C(N[C@@H](C(O)=O)CC3=CC=C(C=C3)O)=O)=O)C)=O)=O,"InChI=1S/C41H61N5O9/c1-6-7-8-9-10-12-31(42-4)36(49)38(51)43-32(24-27-14-18-29(47)19-15-27)39(52)45(5)35(23-26(2)3)40(53)46-22-11-13-34(46)37(50)44-33(41(54)55)25-28-16-20-30(48)21-17-28/h14-21,26,31-36,42,47-49H,6-13,22-25H2,1-5H3,(H,43,51)(H,44,50)(H,54,55)/t31-,32+,33+,34-,35-,36-/m0/s1",PUNOWWCAVNLVNA-VBBYNRSSSA-N,146683786,yes,n.a.,n.a.,n.a.
CyanoMetDB_0859,Anabaenopeptin C,,Anabaenopeptin,,C41H60N8O9,808.4483255,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@@H](C(O)=O)CCCCN)=O)C(N[C@@H](C(C)C)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C41H60N8O9/c1-25(2)34-38(54)44-31(21-18-27-16-19-29(50)20-17-27)39(55)49(4)26(3)35(51)45-33(24-28-12-6-5-7-13-28)36(52)43-23-11-9-14-30(37(53)48-34)46-41(58)47-32(40(56)57)15-8-10-22-42/h5-7,12-13,16-17,19-20,25-26,30-34,50H,8-11,14-15,18,21-24,42H2,1-4H3,(H,43,52)(H,44,54)(H,45,51)(H,48,53)(H,56,57)(H2,46,47,58)/t26-,30+,31-,32+,33-,34-/m0/s1",VNOIUJQJSYNRHB-LJSCDKKUSA-N,146682033,yes,Anabaena/Dolichospermum,n.a.,90
CyanoMetDB_0860,[6(Z)?Adda3]NOD-R,,Nodularin,,C41H60N8O10,824.4432402,C/C=C1C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCC/N=C(N)\N)C(N[C@@H](/C=C/C(C)=C\[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(O)=O)CCC(N/1C)=O)=O)=O)=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-IHMFIWEKSA-N,10079160,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0861,Nodularin-R,NOD-R,Nodularin,,C41H60N8O10,824.4432402,C/C=C\1/C(=O)N[C@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H]([C@@H](C(=O)N[C@H](CCC(=O)N1C)C(=O)O)C)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC)/C)CCCN=C(N)N)C)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,14217092,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0862,Microginin KR801,,Microginin,,C41H60ClN5O9,801.4079562,O[C@@H]([C@H](CCCCCCCCl)NC)C(N[C@H](CC1=CC=C(C=C1)O)C(N([C@@H](CC(C)C)C(N2[C@@H](CCC2)C(N[C@@H](C(O)=O)CC3=CC=C(C=C3)O)=O)=O)C)=O)=O,"InChI=1S/C41H60ClN5O9/c1-26(2)23-35(40(54)47-22-10-12-34(47)37(51)45-33(41(55)56)25-28-15-19-30(49)20-16-28)46(4)39(53)32(24-27-13-17-29(48)18-14-27)44-38(52)36(50)31(43-3)11-8-6-5-7-9-21-42/h13-20,26,31-36,43,48-50H,5-12,21-25H2,1-4H3,(H,44,52)(H,45,51)(H,55,56)/t31-,32+,33+,34-,35-,36-/m0/s1",JVWJLDYSLLPVBU-VBBYNRSSSA-N,146683787,yes,n.a.,n.a.,n.a.
CyanoMetDB_0863,Antanapeptin A,,other cyclic peptide,"Trungapeptin, Depsipeptides (cyclic)",C41H60N4O8,736.4411149,CCC(C)[C@H]1C(=O)OC(C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1C)C(C)C)CC3=CC=CC=C3)C)C(C)C)C)CCCC#C,"InChI=1S/C41H60N4O8/c1-11-13-15-22-32-28(8)36(46)42-33(25(3)4)38(48)43(9)31(24-29-19-16-14-17-20-29)40(50)53-35(26(5)6)39(49)45-23-18-21-30(45)37(47)44(10)34(27(7)12-2)41(51)52-32/h1,14,16-17,19-20,25-28,30-35H,12-13,15,18,21-24H2,2-10H3,(H,42,46)/t27?,28?,30-,31-,32?,33-,34-,35-/m0/s1",HEWGADDUUGVTPF-CVZHIFNESA-N,15546250,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0864,Hantupeptin A,,other cyclic peptide,alkaloid,C41H60N4O8,736.4411149,CC[C@H](C)[C@H]1C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@H](C(C(=O)N[C@H](C(=O)N1C)C(C)C)C)CCCC#C)C(C)C)C)CC3=CC=CC=C3,"InChI=1S/C41H60N4O8/c1-11-13-15-22-31-28(8)36(46)42-33(25(3)4)39(49)44(10)35(27(7)12-2)41(51)53-32(24-29-19-16-14-17-20-29)38(48)45-23-18-21-30(45)37(47)43(9)34(26(5)6)40(50)52-31/h1,14,16-17,19-20,25-28,30-35H,12-13,15,18,21-24H2,2-10H3,(H,42,46)/t27-,28?,30-,31-,32-,33-,34-,35-/m0/s1",QEERUAVEBIAUIV-QUIBGUPGSA-N,25210138,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0865,Tiahuramide A,,other cyclic peptide,other cyclic depsipeptide,C41H60N4O8,736.4411149,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1C)CC3=CC=CC=C3)C(C)C)C)C(C)C)C)CCCC#C,"InChI=1S/C41H60N4O8/c1-11-13-15-22-31-28(8)36(46)42-33(25(3)4)39(49)43(9)34(26(5)6)40(50)53-32(24-29-19-16-14-17-20-29)38(48)45-23-18-21-30(45)37(47)44(10)35(27(7)12-2)41(51)52-31/h1,14,16-17,19-20,25-28,30-35H,12-13,15,18,21-24H2,2-10H3,(H,42,46)/t27-,28-,30-,31+,32-,33-,34-,35-/m0/s1",SIPGTUASFOQAQV-YYUBPKKPSA-N,139589989,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0866,Oscillamide B,,Anabaenopeptin,,C41H60N10O9S,868.4265447,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@@H](C(O)=O)CCC/N=C(N)\N)=O)C(N[C@@H](CCSC)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C41H60N10O9S/c1-25-34(53)48-33(24-27-10-5-4-6-11-27)35(54)44-21-8-7-12-29(49-41(60)50-32(39(58)59)13-9-22-45-40(42)43)36(55)46-30(20-23-61-3)37(56)47-31(38(57)51(25)2)19-16-26-14-17-28(52)18-15-26/h4-6,10-11,14-15,17-18,25,29-33,52H,7-9,12-13,16,19-24H2,1-3H3,(H,44,54)(H,46,55)(H,47,56)(H,48,53)(H,58,59)(H4,42,43,45)(H2,49,50,60)/t25-,29+,30-,31-,32+,33-/m0/s1",GGWYPJGDZASPSW-IRCKBHOPSA-N,,yes,Oscillatoria/Planktothrix,agardhii,CCAP 1459/11A
CyanoMetDB_0867,Anabaenopeptin B,,Anabaenopeptin,,C41H60N10O9,836.4544736,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@@H](C(O)=O)CCC/N=C(N)\N)=O)C(N[C@@H](C(C)C)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C41H60N10O9/c1-24(2)33-37(56)46-30(20-17-26-15-18-28(52)19-16-26)38(57)51(4)25(3)34(53)47-32(23-27-11-6-5-7-12-27)35(54)44-21-9-8-13-29(36(55)50-33)48-41(60)49-31(39(58)59)14-10-22-45-40(42)43/h5-7,11-12,15-16,18-19,24-25,29-33,52H,8-10,13-14,17,20-23H2,1-4H3,(H,44,54)(H,46,56)(H,47,53)(H,50,55)(H,58,59)(H4,42,43,45)(H2,48,49,60)/t25-,29+,30-,31+,32-,33-/m0/s1",ZDOVFDLIJJGVQM-RRKFYBCGSA-N,,yes,Anabaena/Dolichospermum,flos aquae,NRC 525-17
CyanoMetDB_0868,Anabaenopeptin 820,[Hph4]anabaenopeptin F,Anabaenopeptin,,C41H60N10O8,820.4595589,O=C(N(C(C)C(NC(CC1=CC=CC=C1)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(CCCNC(N)=N)C(O)=O)=O)=O)=O)CCC3=CC=CC=C3,"InChI=1S/C41H60N10O8/c1-25(2)33-37(55)46-30(21-20-27-14-7-5-8-15-27)38(56)51(4)26(3)34(52)47-32(24-28-16-9-6-10-17-28)35(53)44-22-12-11-18-29(36(54)50-33)48-41(59)49-31(39(57)58)19-13-23-45-40(42)43/h5-10,14-17,25-26,29-33H,11-13,18-24H2,1-4H3,(H,44,53)(H,46,55)(H,47,52)(H,50,54)(H,57,58)(H4,42,43,45)(H2,48,49,59)",OVNYDRLDOUTKRF-UHFFFAOYSA-N,146683919,no,Microcystis,n.a.,n.a.
CyanoMetDB_0869,Anabaenopeptin J,AP J,Anabaenopeptin,,C41H59N7O9,793.4374265,CC[C@H]([C@H](NC(N[C@@H]1CCCCNC([C@H](CC2=CC=CC=C2)NC([C@H](C)N(C)C([C@H](CCC3=CC=C(O)C=C3)NC([C@H](C(C)C)NC1=O)=O)=O)=O)=O)=O)C(O)=O)C,"InChI=1S/C41H59N7O9/c1-7-25(4)34(40(55)56)47-41(57)45-30-15-11-12-22-42-36(51)32(23-28-13-9-8-10-14-28)44-35(50)26(5)48(6)39(54)31(21-18-27-16-19-29(49)20-17-27)43-38(53)33(24(2)3)46-37(30)52/h8-10,13-14,16-17,19-20,24-26,30-34,49H,7,11-12,15,18,21-23H2,1-6H3,(H,42,51)(H,43,53)(H,44,50)(H,46,52)(H,55,56)(H2,45,47,57)/t25-,26+,30-,31+,32+,33+,34+/m1/s1",QRBPBHIXDXCIEN-XNEPBORXSA-N,10652894,yes,Aphanizomenon,flos aquae,NIES 81
CyanoMetDB_0870,Largamide A,,other cyclic peptide,other cyclic depsipeptide,C41H59N7O12,841.4221704,C/C=C\1/C(=O)N[C@@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C(C)C)NC(=O)C=C(C)C)C)CC(C)C)CCC(=O)O,"InChI=1S/C41H59N7O12/c1-10-27-36(54)44-28(15-16-32(51)52)37(55)46-30(17-20(2)3)41(59)60-24(9)34(40(58)42-23(8)35(53)43-27)48-38(56)29(19-25-11-13-26(49)14-12-25)45-39(57)33(22(6)7)47-31(50)18-21(4)5/h10-14,18,20,22-24,28-30,33-34,49H,15-17,19H2,1-9H3,(H,42,58)(H,43,53)(H,44,54)(H,45,57)(H,46,55)(H,47,50)(H,48,56)(H,51,52)/b27-10-/t23-,24+,28+,29-,30-,33-,34-/m0/s1",HSCXMUJDRPVQBX-JCYRPJTLSA-N,16083539,yes,Oscillatoria/Planktothrix,,FL31-01
CyanoMetDB_0871,Microginin KR835,,Microginin,,C41H59Cl2N5O9,835.3689839,O[C@@H]([C@H](CCCCCCC(Cl)Cl)NC)C(N[C@H](CC1=CC=C(C=C1)O)C(N([C@@H](CC(C)C)C(N2[C@@H](CCC2)C(N[C@@H](C(O)=O)CC3=CC=C(C=C3)O)=O)=O)C)=O)=O,"InChI=1S/C41H59Cl2N5O9/c1-25(2)22-34(40(55)48-21-9-11-33(48)37(52)46-32(41(56)57)24-27-15-19-29(50)20-16-27)47(4)39(54)31(23-26-13-17-28(49)18-14-26)45-38(53)36(51)30(44-3)10-7-5-6-8-12-35(42)43/h13-20,25,30-36,44,49-51H,5-12,21-24H2,1-4H3,(H,45,53)(H,46,52)(H,56,57)/t30-,31+,32+,33-,34-,36-/m0/s1",FPYHKGATFMPWIC-ABESABPNSA-N,146683788,yes,n.a.,n.a.,n.a.
CyanoMetDB_0872,Anabaenopeptin MM823,,Anabaenopeptin,,C41H57N7O11,823.4116057,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@@H](C(O)=O)CCC(OC)=O)=O)C(N[C@@H](C(C)C)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C41H57N7O11/c1-24(2)34-38(54)43-30(19-16-26-14-17-28(49)18-15-26)39(55)48(4)25(3)35(51)44-32(23-27-11-7-6-8-12-27)36(52)42-22-10-9-13-29(37(53)47-34)45-41(58)46-31(40(56)57)20-21-33(50)59-5/h6-8,11-12,14-15,17-18,24-25,29-32,34,49H,9-10,13,16,19-23H2,1-5H3,(H,42,52)(H,43,54)(H,44,51)(H,47,53)(H,56,57)(H2,45,46,58)/t25-,29+,30-,31+,32-,34-/m0/s1",QMUCUTCRZSDMAY-CMJCPUHNSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0873,Nostocyclopeptide A3,,other linear peptide,,C41H56N8O9,804.4170254,CC[C@@H]([C@H]1C(N[C@@H](CO)C(N2C[C@@H](C)C[C@H]2C(N[C@@H](CC3=CC=C(C)C=C3)/C=N\[C@@H](CC4=CC=C(O)C=C4)C(NCC(N[C@H](CCC(N)=O)C(N1)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C41H56N8O9/c1-5-25(4)36-40(57)47-32(22-50)41(58)49-21-24(3)16-33(49)39(56)45-28(17-26-8-6-23(2)7-9-26)19-43-31(18-27-10-12-29(51)13-11-27)37(54)44-20-35(53)46-30(38(55)48-36)14-15-34(42)52/h6-13,19,24-25,28,30-33,36,50-51H,5,14-18,20-22H2,1-4H3,(H2,42,52)(H,44,54)(H,45,56)(H,46,53)(H,47,57)(H,48,55)/b43-19-/t24-,25-,28-,30+,31-,32-,33-,36-/m0/s1",IFBHVTFUCLENGH-VHTRSIFJSA-N,,yes,Nostoc,n.a.,ATCC 53789
CyanoMetDB_0874,Malevamide D,,other cyclic peptide,other cyclic depsipeptide,C40H68N4O8,732.5037152,CC[C@H](C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)O[C@@H](CC2=CC=CC=C2)CO)OC)OC)C(C)C)N(C)C,"InChI=1S/C40H68N4O8/c1-13-27(6)36(42(8)9)38(47)41-34(25(2)3)39(48)43(10)35(26(4)5)32(50-11)23-33(46)44-21-17-20-31(44)37(51-12)28(7)40(49)52-30(24-45)22-29-18-15-14-16-19-29/h14-16,18-19,25-28,30-32,34-37,45H,13,17,20-24H2,1-12H3,(H,41,47)/t27-,28+,30-,31-,32+,34-,35-,36-,37+/m0/s1",LERBYHJLOKXDNI-UUFHNPECSA-N,636710,yes,Symploca,hydnoides,n.a.
CyanoMetDB_0875,Almiramide A,,other linear peptide,Carmabin,C40H66N6O7,742.4992985,C[C@H](CCCCC(=O)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N,"InChI=1S/C40H66N6O7/c1-24(2)32(39(52)43(10)29(9)38(51)44(11)31(35(41)48)23-30-21-15-14-16-22-30)42-36(49)33(25(3)4)45(12)40(53)34(26(5)6)46(13)37(50)27(7)19-17-18-20-28(8)47/h14-16,21-22,24-27,29,31-34H,17-20,23H2,1-13H3,(H2,41,48)(H,42,49)/t27-,29+,31+,32+,33+,34+/m1/s1",WPASHCDGVMUZKC-GRPUOVBYSA-N,46237174,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0876,Almiramide C,,other linear peptide,Carmabin,C40H66N6O6,726.5043839,C[C@H](CCCCC=C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N,"InChI=1S/C40H66N6O6/c1-14-15-16-18-21-28(8)37(49)46(13)34(27(6)7)40(52)45(12)33(26(4)5)36(48)42-32(25(2)3)39(51)43(10)29(9)38(50)44(11)31(35(41)47)24-30-22-19-17-20-23-30/h14,17,19-20,22-23,25-29,31-34H,1,15-16,18,21,24H2,2-13H3,(H2,41,47)(H,42,48)/t28-,29+,31+,32+,33+,34+/m1/s1",QYTBDYVUMOVEHG-CWXFOQKSSA-N,46237304,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0877,Symplostatin 3,,other linear peptide,linear peptide,C40H66N4O9,746.4829797,CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@@H](C)C(=O)O[C@@H](CC2=CC=CC=C2)C(=O)O)OC)OC)N(C)C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)N(C)C,"InChI=1S/C40H66N4O9/c1-13-26(6)35(43(10)38(47)33(24(2)3)41-37(46)34(25(4)5)42(8)9)30(51-11)23-32(45)44-21-17-20-29(44)36(52-12)27(7)40(50)53-31(39(48)49)22-28-18-15-14-16-19-28/h14-16,18-19,24-27,29-31,33-36H,13,17,20-23H2,1-12H3,(H,41,46)(H,48,49)/t26-,27+,29-,30+,31-,33-,34-,35-,36+/m0/s1",PFMWLSLCVYOPSJ-SGUCCDCUSA-N,10485195,yes,Symploca,n.a.,VP452
CyanoMetDB_0878,Banyaside A,,other cyclic peptide,other cyclic depsipeptide,C40H64N8O19S,992.400843,CCCCCC(=O)O[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O[C@@H]2C[C@@H]3[C@@H]([C@]4(C2)[C@H]([C@@H](N3C(=O)[C@@H](CC(C)C)NC(=O)C(COS(=O)(=O)O)OC)C(=O)NCCC5=CCN(C5)C(=N)N)NC(=O)O4)O)CO)O)OC(=O)N,"InChI=1S/C40H64N8O19S/c1-5-6-7-8-26(50)65-30-29(66-38(43)56)28(51)24(17-49)64-36(30)63-21-14-23-32(52)40(15-21)31(46-39(57)67-40)27(34(54)44-11-9-20-10-12-47(16-20)37(41)42)48(23)35(55)22(13-19(2)3)45-33(53)25(61-4)18-62-68(58,59)60/h10,19,21-25,27-32,36,49,51-52H,5-9,11-18H2,1-4H3,(H3,41,42)(H2,43,56)(H,44,54)(H,45,53)(H,46,57)(H,58,59,60)/t21-,22-,23-,24-,25?,27-,28-,29+,30-,31+,32+,36+,40+/m1/s1",UQTGAESHECRZID-KPCQBTATSA-N,11297633,yes,Nostoc,n.a.,n.a.
CyanoMetDB_0879,Almiramide B,,other linear peptide,Carmabin,C40H64N6O6,724.4887338,C[C@H](CCCCC#C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N,"InChI=1S/C40H64N6O6/c1-14-15-16-18-21-28(8)37(49)46(13)34(27(6)7)40(52)45(12)33(26(4)5)36(48)42-32(25(2)3)39(51)43(10)29(9)38(50)44(11)31(35(41)47)24-30-22-19-17-20-23-30/h1,17,19-20,22-23,25-29,31-34H,15-16,18,21,24H2,2-13H3,(H2,41,47)(H,42,48)/t28-,29+,31+,32+,33+,34+/m1/s1",VQNWOYVWHDVFJY-CWXFOQKSSA-N,46237303,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0880,Micropeptin HU1021,,Cyanopeptolin,Micropeptin,C40H63N9O18S2,1021.373249,CC[C@@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](OS(=O)(O)=O)COS(=O)(O)=O)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC=C(O)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C40H63N9O18S2/c1-7-20(3)30-39(58)66-22(5)31(47-35(54)28(67-69(62,63)64)19-65-68(59,60)61)36(55)44-25(10-9-17-43-40(41)42)33(52)45-26-15-16-29(51)49(37(26)56)32(21(4)8-2)38(57)48(6)27(34(53)46-30)18-23-11-13-24(50)14-12-23/h11-14,20-22,25-32,50-51H,7-10,15-19H2,1-6H3,(H,44,55)(H,45,52)(H,46,53)(H,47,54)(H4,41,42,43)(H,59,60,61)(H,62,63,64)/t20-,21-,22-,25-,26-,27-,28+,29+,30-,31-,32+/m0/s1",QONBAISRUZCJFF-MZWRQBRJSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0881,Cyanopeptolin SS,Micropeptin MZ925-SO3,Cyanopeptolin,,C40H63N9O17S2,1005.378334,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)[C@@H](C)CC)O)CCCN=C(N)N)NC(=O)C(COS(=O)(=O)O)OS(=O)(=O)O)C,"InChI=1S/C40H63N9O17S2/c1-7-21(3)30-39(57)65-23(5)31(47-35(53)28(66-68(61,62)63)20-64-67(58,59)60)36(54)44-25(15-12-18-43-40(41)42)33(51)45-26-16-17-29(50)49(37(26)55)32(22(4)8-2)38(56)48(6)27(34(52)46-30)19-24-13-10-9-11-14-24/h9-11,13-14,21-23,25-32,50H,7-8,12,15-20H2,1-6H3,(H,44,54)(H,45,51)(H,46,52)(H,47,53)(H4,41,42,43)(H,58,59,60)(H,61,62,63)/t21-,22-,23+,25-,26-,27-,28?,29+,30-,31-,32-/m0/s1",KBCHLKMABDZVKD-LKAQEJCWSA-N,46881046,yes,n.a.,n.a.,n.a.
CyanoMetDB_0883,Cyanopeptolin S,Micropeptin MZ925,Cyanopeptolin,,C40H63N9O14S,925.4215189,CC[C@@H](C)[C@@H]1C(O[C@H]([C@@H](C(N[C@@H](C(N[C@@H]2CC[C@H](N(C2=O)[C@@H](C(N([C@@H](C(N1)=O)CC3=CC=CC=C3)C)=O)[C@H](C)CC)O)=O)CCC/N=C(N)\N)=O)NC(C(COS(=O)(O)=O)O)=O)C)=O,"InChI=1S/C40H63N9O14S/c1-7-21(3)30-39(58)63-23(5)31(47-35(54)28(50)20-62-64(59,60)61)36(55)44-25(15-12-18-43-40(41)42)33(52)45-26-16-17-29(51)49(37(26)56)32(22(4)8-2)38(57)48(6)27(34(53)46-30)19-24-13-10-9-11-14-24/h9-11,13-14,21-23,25-32,50-51H,7-8,12,15-20H2,1-6H3,(H,44,55)(H,45,52)(H,46,53)(H,47,54)(H4,41,42,43)(H,59,60,61)/t21-,22-,23+,25-,26-,27-,28?,29-,30-,31+,32-/m1/s1",LQLBUPVHKUILGJ-YDSQHRPJSA-N,23724558,yes,n.a.,n.a.,n.a.
CyanoMetDB_0884,Micropeptin MZ925,,Cyanopeptolin,Micropeptin,C40H63N9O14S,925.4215189,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](OS(=O)(O)=O)CO)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C40H63N9O14S/c1-7-21(3)30-39(58)62-23(5)31(47-35(54)28(20-50)63-64(59,60)61)36(55)44-25(15-12-18-43-40(41)42)33(52)45-26-16-17-29(51)49(37(26)56)32(22(4)8-2)38(57)48(6)27(34(53)46-30)19-24-13-10-9-11-14-24/h9-11,13-14,21-23,25-32,50-51H,7-8,12,15-20H2,1-6H3,(H,44,55)(H,45,52)(H,46,53)(H,47,54)(H4,41,42,43)(H,59,60,61)/t21-,22-,23-,25+,26+,27+,28+,29-,30+,31+,32-/m1/s1",CBOQYDTUADEFQZ-SBVJGUMKSA-N,,yes,Microcystis,n.a.,TAU IL-361
CyanoMetDB_0887,Micropeptin MZ845,,Cyanopeptolin,Micropeptin,C40H63N9O11,845.4647039,CC[C@H]([C@H]1C(O[C@H](C)[C@H](NC([C@@H](O)CO)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C40H63N9O11/c1-7-21(3)30-39(59)60-23(5)31(47-35(55)28(51)20-50)36(56)44-25(15-12-18-43-40(41)42)33(53)45-26-16-17-29(52)49(37(26)57)32(22(4)8-2)38(58)48(6)27(34(54)46-30)19-24-13-10-9-11-14-24/h9-11,13-14,21-23,25-32,50-52H,7-8,12,15-20H2,1-6H3,(H,44,56)(H,45,53)(H,46,54)(H,47,55)(H4,41,42,43)/t21-,22-,23-,25+,26+,27+,28+,29-,30+,31+,32-/m1/s1",TZLKEKWUQRMTBV-SBVJGUMKSA-N,,yes,Microcystis,n.a.,TAU IL-361
CyanoMetDB_0888,Micropeptin 478A,,Cyanopeptolin,Micropeptin,C40H62ClN9O15S,975.3774608,C[C@@H](CC)[C@@H]1NC([C@@H](N(C([C@H](N([C@@H](CC[C@@H]2NC([C@@H](NC([C@H]([C@@H](OC1=O)C)NC([C@@H](O)COS(=O)(O)=O)=O)=O)CCC/N=C(N)/N)=O)O)C2=O)[C@@H](CC)C)=O)C)CC3=CC(Cl)=C(O)C=C3)=O,"InChI=1S/C40H62ClN9O15S/c1-7-19(3)30-39(60)65-21(5)31(48-35(56)28(52)18-64-66(61,62)63)36(57)45-24(10-9-15-44-40(42)43)33(54)46-25-12-14-29(53)50(37(25)58)32(20(4)8-2)38(59)49(6)26(34(55)47-30)17-22-11-13-27(51)23(41)16-22/h11,13,16,19-21,24-26,28-32,51-53H,7-10,12,14-15,17-18H2,1-6H3,(H,45,57)(H,46,54)(H,47,55)(H,48,56)(H4,42,43,44)(H,61,62,63)/t19-,20+,21-,24-,25-,26-,28-,29+,30-,31-,32+/m0/s1",XQAUOXBHKXOGBQ-NXVVUEFESA-N,,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_0889,Tasipeptin B,,Cyanopeptolin,,C40H62N6O9,770.4578276,C[C@H]1OC([C@@H](NC([C@@H](N(C([C@@H](N2C([C@H](CC[C@H]2O)NC([C@@H](NC([C@H]1NC(CCC)=O)=O)CC(C)C)=O)=O)CC(C)C)=O)C)CC3=CC=CC=C3)=O)C(C)C)=O,"InChI=1S/C40H62N6O9/c1-10-14-31(47)43-34-25(8)55-40(54)33(24(6)7)44-36(50)29(21-26-15-12-11-13-16-26)45(9)39(53)30(20-23(4)5)46-32(48)18-17-27(38(46)52)41-35(49)28(19-22(2)3)42-37(34)51/h11-13,15-16,22-25,27-30,32-34,48H,10,14,17-21H2,1-9H3,(H,41,49)(H,42,51)(H,43,47)(H,44,50)/t25-,27+,28+,29+,30+,32-,33+,34+/m1/s1",SLJZYOVZWGGRQB-GRYOGVIMSA-N,9987747,yes,Symploca,n.a.,NIH 304
CyanoMetDB_0890,Tasiamide D,,other linear peptide,linear depsipeptide,C40H62N6O11,802.4476569,O=C(N[C@H](CC1=CC=CC=C1)C(N2CCC[C@H]2C(OC)=O)=O)[C@@H](NC([C@H](NC([C@@H](N(C)C([C@H](OC([C@H](C(C)C)O)=O)C(C)C)=O)CCC(N)=O)=O)[C@H](CC)C)=O)C,"InChI=1S/C40H62N6O11/c1-10-24(6)31(44-35(50)28(18-19-30(41)47)45(8)38(53)33(23(4)5)57-40(55)32(48)22(2)3)36(51)42-25(7)34(49)43-27(21-26-15-12-11-13-16-26)37(52)46-20-14-17-29(46)39(54)56-9/h11-13,15-16,22-25,27-29,31-33,48H,10,14,17-21H2,1-9H3,(H2,41,47)(H,42,51)(H,43,49)(H,44,50)/t24-,25-,27+,28-,29-,31+,32-,33+/m0/s1",MESKRLDNXYODAI-KCSPEMMSSA-N,146683693,yes,Symploca,n.a.,n.a.
CyanoMetDB_0891,Trungapeptin C,,other cyclic peptide,"Trungapeptin, 	Depsipeptides (cyclic)",C40H62N4O8,726.456765,CCCCC[C@@H]1[C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)O1)[C@@H](C)CC)CC3=CC=CC=C3)C(C)C)C)C(C)C)C,"InChI=1S/C40H62N4O8/c1-10-12-14-21-30-27(8)35(45)41-32(24(3)4)38(48)43(9)34(25(5)6)40(50)52-31(23-28-18-15-13-16-19-28)37(47)44-22-17-20-29(44)36(46)42-33(26(7)11-2)39(49)51-30/h13,15-16,18-19,24-27,29-34H,10-12,14,17,20-23H2,1-9H3,(H,41,45)(H,42,46)/t26-,27-,29-,30+,31-,32-,33-,34-/m0/s1",PFIIIBNSVVUPKA-URWRVPRISA-N,11994814,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0892,Micropeptin 478B,,Cyanopeptolin,Micropeptin,C40H62ClN9O18S2,1055.334276,C[C@@H](CC)[C@@H]1NC([C@@H](N(C([C@H](N([C@@H](CC[C@@H]2NC([C@@H](NC([C@H]([C@@H](OC1=O)C)NC([C@@H](OS(O)(=O)=O)COS(=O)(O)=O)=O)=O)CCC/N=C(N)/N)=O)O)C2=O)[C@@H](CC)C)=O)C)CC3=CC(Cl)=C(O)C=C3)=O,"InChI=1S/C40H62ClN9O18S2/c1-7-19(3)30-39(59)67-21(5)31(48-35(55)28(68-70(63,64)65)18-66-69(60,61)62)36(56)45-24(10-9-15-44-40(42)43)33(53)46-25-12-14-29(52)50(37(25)57)32(20(4)8-2)38(58)49(6)26(34(54)47-30)17-22-11-13-27(51)23(41)16-22/h11,13,16,19-21,24-26,28-32,51-52H,7-10,12,14-15,17-18H2,1-6H3,(H,45,56)(H,46,53)(H,47,54)(H,48,55)(H4,42,43,44)(H,60,61,62)(H,63,64,65)/t19-,20+,21-,24-,25-,26-,28-,29+,30-,31-,32+/m0/s1",SBCCONGDAHGETE-NXVVUEFESA-N,,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_0893,Micropeptin HU975,,Cyanopeptolin,"Micropeptin, Oscillapeptin",C40H62ClN9O15S,975.3774612,C[C@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](O)COS(=O)(O)=O)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC(Cl)=C(O)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)CC,"InChI=1S/C40H62ClN9O15S/c1-7-19(3)30-39(60)65-21(5)31(48-35(56)28(52)18-64-66(61,62)63)36(57)45-24(10-9-15-44-40(42)43)33(54)46-25-12-14-29(53)50(37(25)58)32(20(4)8-2)38(59)49(6)26(34(55)47-30)17-22-11-13-27(51)23(41)16-22/h11,13,16,19-21,24-26,28-32,51-53H,7-10,12,14-15,17-18H2,1-6H3,(H,45,57)(H,46,54)(H,47,55)(H,48,56)(H4,42,43,44)(H,61,62,63)/t19-,20-,21-,24-,25-,26-,28+,29+,30-,31-,32+/m0/s1",XQAUOXBHKXOGBQ-YJPKUWSYSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0894,Micropeptin HU895A,,Cyanopeptolin,Micropeptin,C40H62ClN9O12,895.4206462,CC([C@H]1C(O[C@@H](C)[C@H](NC([C@H](O)CO)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC(Cl)=C(OC)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C40H62ClN9O12/c1-8-20(4)32-38(59)49(6)26(17-22-11-13-28(61-7)23(41)16-22)34(55)47-30(19(2)3)39(60)62-21(5)31(48-35(56)27(52)18-51)36(57)45-24(10-9-15-44-40(42)43)33(54)46-25-12-14-29(53)50(32)37(25)58/h11,13,16,19-21,24-27,29-32,51-53H,8-10,12,14-15,17-18H2,1-7H3,(H,45,57)(H,46,54)(H,47,55)(H,48,56)(H4,42,43,44)/t20-,21-,24-,25-,26-,27+,29+,30-,31-,32+/m0/s1",FSJIJAPZQVZIBD-RXDILXCRSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0895,Micropeptin HU895B,,Cyanopeptolin,Micropeptin,C40H62ClN9O12,895.4206462,C[C@H]([C@H]1C(O[C@@H](C)[C@H](NC([C@H](O)CO)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC(Cl)=C(O)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)CC,"InChI=1S/C40H62ClN9O12/c1-7-19(3)30-39(61)62-21(5)31(48-35(57)28(53)18-51)36(58)45-24(10-9-15-44-40(42)43)33(55)46-25-12-14-29(54)50(37(25)59)32(20(4)8-2)38(60)49(6)26(34(56)47-30)17-22-11-13-27(52)23(41)16-22/h11,13,16,19-21,24-26,28-32,51-54H,7-10,12,14-15,17-18H2,1-6H3,(H,45,58)(H,46,55)(H,47,56)(H,48,57)(H4,42,43,44)/t19-,20-,21-,24-,25-,26-,28+,29+,30-,31-,32+/m0/s1",OAGGBVOJAIWXLZ-YJPKUWSYSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0896,Microginin 755B,,Microginin,,C40H61N5O9,755.4469286,CCCCCCCC(C(C(NC(C(N(C)C(C(N(C)C(CC1=CC=C(O)C=C1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CC(C)C)=O)C)=O)O)NC,"InChI=1S/C40H61N5O9/c1-8-9-10-11-12-13-31(41-5)35(48)37(50)42-26(4)38(51)45(7)34(22-25(2)3)39(52)44(6)33(24-28-16-20-30(47)21-17-28)36(49)43-32(40(53)54)23-27-14-18-29(46)19-15-27/h14-21,25-26,31-35,41,46-48H,8-13,22-24H2,1-7H3,(H,42,50)(H,43,49)(H,53,54)",RNKRRAYDCMRPRF-UHFFFAOYSA-N,146684921,no,n.a.,n.a.,n.a.
CyanoMetDB_0897,Microginin SD755,,Microginin,,C40H61N5O9,755.4469286,CCCCCC(C(C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N(C)[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)O)O)NC,"InChI=1S/C40H61N5O9/c1-7-8-9-10-11-12-30(41)35(48)38(51)44-34(25(4)5)39(52)45(6)33(21-24(2)3)37(50)42-31(22-26-13-17-28(46)18-14-26)36(49)43-32(40(53)54)23-27-15-19-29(47)20-16-27/h13-20,24-25,30-35,46-48H,7-12,21-23,41H2,1-6H3,(H,42,50)(H,43,49)(H,44,51)(H,53,54)",RYXSQGFBKPDUFA-UHFFFAOYSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0898,Microginin 756,,Microginin,,C40H61N5O9,755.4469286,O=C(NC(CC1=CC=C(O)C=C1)C(O)=O)C(CCC2=CC=C(O)C=C2)NC(C(CC(C)C)NC(C(C(C)C)NC(C(O)C(N[H])CCCCCCC)=O)=O)=O,"InChI=1S/C40H61N5O9/c1-6-7-8-9-10-11-30(41)35(48)39(52)45-34(25(4)5)38(51)43-32(22-24(2)3)37(50)42-31(21-16-26-12-17-28(46)18-13-26)36(49)44-33(40(53)54)23-27-14-19-29(47)20-15-27/h12-15,17-20,24-25,30-35,46-48H,6-11,16,21-23,41H2,1-5H3,(H,42,50)(H,43,51)(H,44,49)(H,45,52)(H,53,54)",IFKUPHYTIDOPIM-UHFFFAOYSA-N,146683731,no,Microcystis,n.a.,LTPNA08/09
CyanoMetDB_0899,Microginin 771,,Microginin,,C40H61N5O10,771.4418432,CCCCCCCC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(N(C)C(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CC(C)C)=O)C(O)C)=O)O)N,"InChI=1S/C40H61N5O10/c1-7-8-9-10-11-12-30(41)35(49)37(51)43-34(25(4)46)39(53)44(5)32(21-24(2)3)36(50)42-31(22-26-13-17-28(47)18-14-26)38(52)45(6)33(40(54)55)23-27-15-19-29(48)20-16-27/h13-20,24-25,30-35,46-49H,7-12,21-23,41H2,1-6H3,(H,42,50)(H,43,51)(H,54,55)",GUHPNOXZROGUDU-UHFFFAOYSA-N,146684922,no,n.a.,n.a.,n.a.
CyanoMetDB_0900,Cylindrofridin C,,other linear non-peptide,Cylindrofridin,C40H61ClO8,704.4054966,CCCC[C@@H](CCCC[C@H](C)[C@H](C1=CC(=CC(=C1)O)O)OC(=O)C)C2=C(C=C(C=C2O)[C@@H]([C@@H](C)CCCCC(CCCC)Cl)OC(=O)C)O,"InChI=1S/C40H61ClO8/c1-7-9-17-30(18-13-11-15-26(3)39(48-28(5)42)31-21-34(44)25-35(45)22-31)38-36(46)23-32(24-37(38)47)40(49-29(6)43)27(4)16-12-14-20-33(41)19-10-8-2/h21-27,30,33,39-40,44-47H,7-20H2,1-6H3/t26-,27-,30-,33?,39+,40+/m0/s1",GTRRNAAYKNENPF-ZQUJOIDOSA-N,127032791,yes,Cylindrospermum,stagnale,PCC 7417
CyanoMetDB_0902,Microphycin AL828,,other cyclic peptide,Microphycin,C40H60N8O11,828.4381548,CC[C@@H](C)[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N1)CCC(=O)O)CC(C)C)CC3=CC=C(C=C3)O)C(C)C,"InChI=1S/C40H60N8O11/c1-7-23(6)34-38(57)42-20-31(51)46-33(22(4)5)39(58)45-27(18-24-10-12-25(49)13-11-24)35(54)41-19-30(50)43-28(17-21(2)3)40(59)48-16-8-9-29(48)37(56)44-26(36(55)47-34)14-15-32(52)53/h10-13,21-23,26-29,33-34,49H,7-9,14-20H2,1-6H3,(H,41,54)(H,42,57)(H,43,50)(H,44,56)(H,45,58)(H,46,51)(H,47,55)(H,52,53)/t23-,26+,27+,28+,29+,33+,34+/m1/s1",SSIHLNZUUQPOFJ-VYHNOVTMSA-N,139587984,yes,n.a.,n.a.,n.a.
CyanoMetDB_0903,Trungapeptin B,,other cyclic peptide,"Trungapeptin, 	Depsipeptides (cyclic)",C40H60N4O8,724.4411149,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1)CC3=CC=CC=C3)C(C)C)C)C(C)C)C)CCCC=C,"InChI=1S/C40H60N4O8/c1-10-12-14-21-30-27(8)35(45)41-32(24(3)4)38(48)43(9)34(25(5)6)40(50)52-31(23-28-18-15-13-16-19-28)37(47)44-22-17-20-29(44)36(46)42-33(26(7)11-2)39(49)51-30/h10,13,15-16,18-19,24-27,29-34H,1,11-12,14,17,20-23H2,2-9H3,(H,41,45)(H,42,46)/t26-,27-,29-,30+,31-,32-,33-,34-/m0/s1",IDJQDBKNSIDYDH-URWRVPRISA-N,11994816,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0904,Cyanostatin B,,Microginin,Cyanostatin,C40H59N5O9,753.4312785,CCCCCCC[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N(C)[C@@H](C(C)CC)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)O)O)N,"InChI=1S/C40H59N5O9/c1-5-7-8-9-10-12-30(41)35(48)37(50)42-31(23-26-14-18-28(46)19-15-26)38(51)44(4)34(25(3)6-2)39(52)45-22-11-13-33(45)36(49)43-32(40(53)54)24-27-16-20-29(47)21-17-27/h14-21,25,30-35,46-48H,5-13,22-24,41H2,1-4H3,(H,42,50)(H,43,49)(H,53,54)/t25-,30+,31-,32-,33-,34-,35-/m0/s1",BDDHCMIGYUBMCI-YGKFCERESA-N,11445627,yes,n.a.,n.a.,n.a.
CyanoMetDB_0905,Carmabin B,,other linear peptide,Carmabin,C40H59N5O7,721.4414493,CC(CCCCC(=O)C)CC(C)C(=O)N(C)C(CC1=CC=CC=C1)C(=O)NC(C)C(=O)N(C)C(C)C(=O)N(C)C(CC2=CC=C(C=C2)OC)C(=O)N,"InChI=1S/C40H59N5O7/c1-26(15-13-14-16-28(3)46)23-27(2)38(49)45(8)35(25-31-17-11-10-12-18-31)37(48)42-29(4)39(50)43(6)30(5)40(51)44(7)34(36(41)47)24-32-19-21-33(52-9)22-20-32/h10-12,17-22,26-27,29-30,34-35H,13-16,23-25H2,1-9H3,(H2,41,47)(H,42,48)",FZTCTTODSSJQQB-UHFFFAOYSA-N,10771165,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0906,[DMAdda3]NOD-R,,Nodularin,,C40H58N8O10,810.4275901,C/C=C1C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](/C=C/C(C)=C/[C@@H]([C@@H](O)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(O)=O)CCC(N/1C)=O)=O)=O)=O)=O ,"InChI=1S/C40H58N8O10/c1-7-30-37(54)47-33(39(57)58)25(5)35(52)45-28(14-11-19-43-40(41)42)36(53)44-27(24(4)34(51)46-29(38(55)56)17-18-32(50)48(30)6)16-15-22(2)20-23(3)31(49)21-26-12-9-8-10-13-26/h7-10,12-13,15-16,20,23-25,27-29,31,33,49H,11,14,17-19,21H2,1-6H3,(H,44,53)(H,45,52)(H,46,51)(H,47,54)(H,55,56)(H,57,58)(H4,41,42,43)/b16-15+,22-20+,30-7-/t23-,24-,25-,27-,28-,29+,31-,33+/m0/s1",PUTRVMDQKQUTHJ-CMVAVZGQSA-N,,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0907,[D?Asp1]NOD-R,Desmethylnodularin-R,Nodularin,,C40H58N8O10,810.4275901,C/C=C\1/C(=O)N[C@H](CC(=O)N[C@H](C(=O)N[C@H]([C@@H](C(=O)N[C@H](CCC(=O)N1C)C(=O)O)C)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC)/C)CCCN=C(N)N)C(=O)O,"InChI=1S/C40H58N8O10/c1-7-31-37(53)47-30(39(56)57)22-33(49)44-28(14-11-19-43-40(41)42)36(52)45-27(25(4)35(51)46-29(38(54)55)17-18-34(50)48(31)5)16-15-23(2)20-24(3)32(58-6)21-26-12-9-8-10-13-26/h7-10,12-13,15-16,20,24-25,27-30,32H,11,14,17-19,21-22H2,1-6H3,(H,44,49)(H,45,52)(H,46,51)(H,47,53)(H,54,55)(H,56,57)(H4,41,42,43)/b16-15+,23-20+,31-7-/t24-,25-,27-,28-,29+,30+,32-/m0/s1",XCXOONWZLHJQJA-RKKFSPRGSA-N,10056208,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0908,[dhb5]NOD-R,,Nodularin,,C40H58N8O10,810.4275901,C/C=C1C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCC/N=C(N)\N)C(N[C@@H](/C=C/C(C)=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(O)=O)CCC(N/1)=O)=O)=O)=O)=O,"InChI=1S/C40H58N8O10/c1-7-27-36(52)48-33(39(56)57)25(5)35(51)46-29(14-11-19-43-40(41)42)37(53)45-28(24(4)34(50)47-30(38(54)55)17-18-32(49)44-27)16-15-22(2)20-23(3)31(58-6)21-26-12-9-8-10-13-26/h7-10,12-13,15-16,20,23-25,28-31,33H,11,14,17-19,21H2,1-6H3,(H,44,49)(H,45,53)(H,46,51)(H,47,50)(H,48,52)(H,54,55)(H,56,57)(H4,41,42,43)/b16-15+,22-20+,27-7-/t23-,24-,25-,28-,29-,30+,31-,33+/m0/s1",GWNYQTAZKANWTF-NQXHTJFWSA-N,102080694,no,Nodularia,spumigena,n.a.
CyanoMetDB_0909,Microginin 99A,Microginin 99-A,Microginin,,C40H58ClN5O9,771.3973915,CC(C[C@H](NC([C@@H](NC(C[C@H](N)CCCCCCCCl)=O)CC1=CC=C(O)C=C1)=O)C(N([C@@H](C(N2CCC[C@@H]2C(O)=O)=O)CC3=CC=C(O)C=C3)C)=O)C,"InChI=1S/C40H58ClN5O8/c1-26(2)22-33(38(51)45(3)35(24-28-14-18-31(48)19-15-28)39(52)46-21-9-11-34(46)40(53)54)44-37(50)32(23-27-12-16-30(47)17-13-27)43-36(49)25-29(42)10-7-5-4-6-8-20-41/h12-19,26,29,32-35,47-48H,4-11,20-25,42H2,1-3H3,(H,43,49)(H,44,50)(H,53,54)/t29-,32+,33+,34-,35-/m1/s1",DRNVSYAWHUZNCC-AYRLMPCTSA-N,,yes,Microcystis,aeruginosa,NIES 99
CyanoMetDB_0910,Antanapeptin D,,other cyclic peptide,"Trungapeptin, Depsipeptides (cyclic)",C40H58N4O8,722.4254648,CC1C(OC(=O)[C@@H](N(C(=O)[C@@H]2CCCN2C(=O)[C@@H](OC(=O)[C@@H](N(C(=O)[C@@H](NC1=O)C(C)C)C)CC3=CC=CC=C3)C(C)C)C)C(C)C)CCCC#C,"InChI=1S/C40H58N4O8/c1-11-12-14-21-31-27(8)35(45)41-32(24(2)3)37(47)42(9)30(23-28-18-15-13-16-19-28)39(49)52-34(26(6)7)38(48)44-22-17-20-29(44)36(46)43(10)33(25(4)5)40(50)51-31/h1,13,15-16,18-19,24-27,29-34H,12,14,17,20-23H2,2-10H3,(H,41,45)/t27?,29-,30-,31?,32-,33-,34-/m0/s1",HGDNKULJQQBFCT-DQNVORKUSA-N,10865453,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0911,Trungapeptin A,Veraguamide F,other cyclic peptide,"Trungapeptin, 	Depsipeptides (cyclic)",C40H58N4O8,722.4254648,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1)CC3=CC=CC=C3)C(C)C)C)C(C)C)C)CCCC#C,"InChI=1S/C40H58N4O8/c1-10-12-14-21-30-27(8)35(45)41-32(24(3)4)38(48)43(9)34(25(5)6)40(50)52-31(23-28-18-15-13-16-19-28)37(47)44-22-17-20-29(44)36(46)42-33(26(7)11-2)39(49)51-30/h1,13,15-16,18-19,24-27,29-34H,11-12,14,17,20-23H2,2-9H3,(H,41,45)(H,42,46)/t26-,27-,29-,30+,31-,32-,33-,34-/m0/s1",ZSVZJFSZXRBSGU-URWRVPRISA-N,11994813,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0912,Microginin GH787,,Microginin,,C40H58ClN5O9,787.3923062,O[C@@H]([C@@H](CCCCCCCCl)N)C(N[C@@H](CC1=CC=C(C=C1)O)C(N([C@H]([C@H](C)CC)C(N2[C@@H](CCC2)C(N[C@@H](C(O)=O)CC3=CC=C(C=C3)O)=O)=O)C)=O)=O,"InChI=1S/C40H58ClN5O9/c1-4-25(2)34(39(53)46-22-10-12-33(46)36(50)44-32(40(54)55)24-27-15-19-29(48)20-16-27)45(3)38(52)31(23-26-13-17-28(47)18-14-26)43-37(51)35(49)30(42)11-8-6-5-7-9-21-41/h13-20,25,30-35,47-49H,4-12,21-24,42H2,1-3H3,(H,43,51)(H,44,50)(H,54,55)/t25-,30-,31+,32-,33+,34-,35+/m1/s1",XYGVUPXPWWMUAK-UYFULXBISA-N,,yes,Microcystis,n.a.,TAU IL-337
CyanoMetDB_0913,Microginin KR787,,Microginin,,C40H58ClN5O9,787.3923062,O[C@@H]([C@H](CCCCCCCCl)N)C(N[C@H](CC1=CC=C(C=C1)O)C(N([C@@H](CC(C)C)C(N2[C@@H](CCC2)C(N[C@@H](C(O)=O)CC3=CC=C(C=C3)O)=O)=O)C)=O)=O,"InChI=1S/C40H58ClN5O9/c1-25(2)22-34(39(53)46-21-9-11-33(46)36(50)44-32(40(54)55)24-27-14-18-29(48)19-15-27)45(3)38(52)31(23-26-12-16-28(47)17-13-26)43-37(51)35(49)30(42)10-7-5-4-6-8-20-41/h12-19,25,30-35,47-49H,4-11,20-24,42H2,1-3H3,(H,43,51)(H,44,50)(H,54,55)/t30-,31+,32+,33-,34-,35-/m0/s1",LDCCHPQMLCMPIZ-RDWYLJQVSA-N,146683789,yes,n.a.,n.a.,n.a.
CyanoMetDB_0914,Tiglicamide C,,other cyclic peptide,other cyclic depsipeptide,C40H57N7O13S,875.3735061,C/C=C\1/C(=O)N[C@@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@@H](CC2=CC=C(C=C2)O)NC(=O)[C@H](C(C)C)NC(=O)/C(=C/C)/C)C)CCS(=O)C)CCC(=O)O,"InChI=1S/C40H57N7O13S/c1-9-21(5)33(51)46-31(20(3)4)38(56)45-29(19-24-11-13-25(48)14-12-24)37(55)47-32-23(7)60-40(58)28(17-18-61(8)59)44-36(54)27(15-16-30(49)50)43-35(53)26(10-2)42-34(52)22(6)41-39(32)57/h9-14,20,22-23,27-29,31-32,48H,15-19H2,1-8H3,(H,41,57)(H,42,52)(H,43,53)(H,44,54)(H,45,56)(H,46,51)(H,47,55)(H,49,50)/b21-9+,26-10-/t22-,23+,27+,28-,29+,31-,32-,61?/m0/s1",LNZZAPVTOPDKIB-RDIOVHBBSA-N,44606682,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_0915,Dudawalamide A,,other cyclic peptide,Depsipeptides (cyclic),C40H57N5O9,751.4156284,CC[C@@H]([C@@H]1C(N2CCC[C@@H]2C(N(C)[C@@H](CC3=CC=CC=C3)C(NCC(O[C@H](CCCC#C)C(C)(C)C(O[C@H](C)C(N[C@H](C)C(N1C)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C40H57N5O9/c1-10-12-14-21-31-40(6,7)39(52)53-27(5)34(47)42-26(4)36(49)44(9)33(25(3)11-2)38(51)45-22-17-20-29(45)37(50)43(8)30(23-28-18-15-13-16-19-28)35(48)41-24-32(46)54-31/h1,13,15-16,18-19,25-27,29-31,33H,11-12,14,17,20-24H2,2-9H3,(H,41,48)(H,42,47)",HWUUCABYFFQZHH-UHFFFAOYSA-N,101481164,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0916,Carmabin A,,other linear peptide,Carmabin,C40H57N5O6,703.4308846,CC(CCCCC#C)CC(C)C(=O)N(C)C(CC1=CC=CC=C1)C(=O)NC(C)C(=O)N(C)C(C)C(=O)N(C)C(CC2=CC=C(C=C2)OC)C(=O)N,"InChI=1S/C40H57N5O6/c1-10-11-12-14-17-27(2)24-28(3)38(48)45(8)35(26-31-18-15-13-16-19-31)37(47)42-29(4)39(49)43(6)30(5)40(50)44(7)34(36(41)46)25-32-20-22-33(51-9)23-21-32/h1,13,15-16,18-23,27-30,34-35H,11-12,14,17,24-26H2,2-9H3,(H2,41,46)(H,42,47)/t27?,28?,29-,30-,34-,35-/m0/s1",BRWIYXLUWTZWGU-PBQPNXEGSA-N,16757536,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0917,Nodularin-V,Motupurin; [L?Val2]Nodularin,Nodularin,,C40H57N5O10,767.4105431,C/C=C1C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](C(C)C)C(N[C@@H](/C=C/C(C)=C/[C@@H]([C@@H](OC)CC2=CC=CC=C2)C)[C@H](C)C(N[C@@H](C(O)=O)CCC(N/1C)=O)=O)=O)=O)=O,"InChI=1S/C40H57N5O10/c1-10-30-37(49)44-34(40(53)54)26(7)36(48)43-33(22(2)3)38(50)41-28(25(6)35(47)42-29(39(51)52)18-19-32(46)45(30)8)17-16-23(4)20-24(5)31(55-9)21-27-14-12-11-13-15-27/h10-17,20,22,24-26,28-29,31,33-34H,18-19,21H2,1-9H3,(H,41,50)(H,42,47)(H,43,48)(H,44,49)(H,51,52)(H,53,54)/b17-16+,23-20+,30-10-/t24-,25-,26-,28-,29+,31-,33-,34+/m0/s1",GIRIHYQVGVTBIP-NJYUBDSESA-N,4369034,yes,n.a.,n.a.,n.a.
CyanoMetDB_0918,Microginin 99B,Microginin 99-B,Microginin,,C40H57Cl2N5O8,805.3584192,CC(C[C@H](NC([C@@H](NC(C[C@H](N)CCCCCCC(Cl)Cl)=O)CC1=CC=C(O)C=C1)=O)C(N([C@H](C(N2CCCC2C(O)=O)=O)CC3=CC=C(O)C=C3)C)=O)C,"InChI=1S/C40H57Cl2N5O8/c1-25(2)21-32(38(52)46(3)34(23-27-14-18-30(49)19-15-27)39(53)47-20-8-10-33(47)40(54)55)45-37(51)31(22-26-12-16-29(48)17-13-26)44-36(50)24-28(43)9-6-4-5-7-11-35(41)42/h12-19,25,28,31-35,48-49H,4-11,20-24,43H2,1-3H3,(H,44,50)(H,45,51)(H,54,55)/t28-,31+,32+,33+,34+/m1/s1",OTFWURFIRFWLHX-FGOVDBOFSA-N,10652936,yes,Microcystis,aeruginosa,NIES 99
CyanoMetDB_0919,Myxol (II),,other linear non-peptide,,C40H56O3,584.4229457,CC1=C(C(CC(C1)O)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C/[C@H](C(C)(C)O)O)/C)/C,"InChI=1S/C40H56O3/c1-30(18-13-20-32(3)21-15-23-34(5)25-27-38(42)40(9,10)43)16-11-12-17-31(2)19-14-22-33(4)24-26-37-35(6)28-36(41)29-39(37,7)8/h11-27,36,38,41-43H,28-29H2,1-10H3/b12-11+,18-13+,19-14+,21-15+,26-24+,27-25+,30-16+,31-17+,32-20+,33-22+,34-23+/t36?,38-/m1/s1",JJPMVSRTRMLHST-BZLQNNQZSA-N,139291909,yes,Oscillatoria/Planktothrix,limosa,n.a.
CyanoMetDB_0920,Microginin 764,,Microginin,,C40H56N6O9,764.4108774,OC(C(CCCCCCC)NC)C(NC(C(C)O)C(N1CCCC1C(NC(CC2=CC=C(C=C2)O)C(NC(C(O)=O)CC3=CC(C=CC=C4)=C4N3)=O)=O)=O)=O,"InChI=1S/C40H56N6O9/c1-4-5-6-7-8-14-30(41-3)35(49)38(52)45-34(24(2)47)39(53)46-20-11-15-33(46)37(51)43-31(21-25-16-18-28(48)19-17-25)36(50)44-32(40(54)55)23-27-22-26-12-9-10-13-29(26)42-27/h9-10,12-13,16-19,22,24,30-35,41-42,47-49H,4-8,11,14-15,20-21,23H2,1-3H3,(H,43,51)(H,44,50)(H,45,52)(H,54,55)",HQZPMNNNCIUMAW-UHFFFAOYSA-N,146683920,no,n.a.,n.a.,n.a.
CyanoMetDB_0921,Microginin FR10,,Microginin,,C40H56N6O8,748.4159628,OC(C(CCCCCCC)N)C(NC(C(C)C)C(N1CCCC1C(NC(CC2=CC=C(C=C2)O)C(NC(C(O)=O)CC3=CC(C=CC=C4)=C4N3)=O)=O)=O)=O,"InChI=1S/C40H56N6O8/c1-4-5-6-7-8-13-29(41)35(48)38(51)45-34(24(2)3)39(52)46-20-11-15-33(46)37(50)43-31(21-25-16-18-28(47)19-17-25)36(49)44-32(40(53)54)23-27-22-26-12-9-10-14-30(26)42-27/h9-10,12,14,16-19,22,24,29,31-35,42,47-48H,4-8,11,13,15,20-21,23,41H2,1-3H3,(H,43,50)(H,44,49)(H,45,51)(H,53,54)",GGLFYCCOURDGIU-UHFFFAOYSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_0922,Guineamide F,,other cyclic peptide,Obyanamide,C40H55N5O7,717.4101491,CCCC1C(C(=O)N[C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)NCC(=O)O1)CC3=CC=CC=C3)C)CC4=CC=CC=C4)C)C(C)C)(C)C,"InChI=1S/C40H55N5O7/c1-8-16-32-40(4,5)39(51)42-34(26(2)3)38(50)44(7)31(24-28-19-13-10-14-20-28)37(49)45-22-15-21-29(45)36(48)43(6)30(23-27-17-11-9-12-18-27)35(47)41-25-33(46)52-32/h9-14,17-20,26,29-32,34H,8,15-16,21-25H2,1-7H3,(H,41,47)(H,42,51)/t29-,30-,31-,32?,34-/m0/s1",HGABVVDKSKHSGK-AILSMDFESA-N,10930574,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0923,Nostocyclopeptide A2,,other linear peptide,,C40H54N8O9,790.4013754,CC[C@@H]([C@H]1C(N[C@@H](CO)C(N2C[C@@H](C)C[C@H]2C(N[C@@H](CC3=CC=CC=C3)/C=N\[C@@H](CC4=CC=C(O)C=C4)C(NCC(N[C@H](CCC(N)=O)C(N1)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C40H54N8O9/c1-4-24(3)35-39(56)46-31(22-49)40(57)48-21-23(2)16-32(48)38(55)44-27(17-25-8-6-5-7-9-25)19-42-30(18-26-10-12-28(50)13-11-26)36(53)43-20-34(52)45-29(37(54)47-35)14-15-33(41)51/h5-13,19,23-24,27,29-32,35,49-50H,4,14-18,20-22H2,1-3H3,(H2,41,51)(H,43,53)(H,44,55)(H,45,52)(H,46,56)(H,47,54)/b42-19-/t23-,24-,27-,29+,30-,31-,32-,35-/m0/s1",OYHPNVXZUBWKJE-NDJHOONXSA-N,,yes,Nostoc,n.a.,ATCC 53789
CyanoMetDB_0924,Kasumigamide,,other linear peptide,,C40H50N8O9,786.3700752,C1=CC=C(C=C1)C[C@H](C(=O)NCCC(=O)N[C@H](CC2=CNC3=CC=CC=C32)[C@H](CC(=O)N[C@H](CCCN=C(N)N)C(=O)N[C@H]([C@@H](C4=CC=CC=C4)O)C(=O)O)O)O,"InChI=1S/C40H50N8O9/c41-40(42)44-18-9-16-29(37(54)48-35(39(56)57)36(53)25-12-5-2-6-13-25)46-34(52)22-31(49)30(21-26-23-45-28-15-8-7-14-27(26)28)47-33(51)17-19-43-38(55)32(50)20-24-10-3-1-4-11-24/h1-8,10-15,23,29-32,35-36,45,49-50,53H,9,16-22H2,(H,43,55)(H,46,52)(H,47,51)(H,48,54)(H,56,57)(H4,41,42,44)/t29-,30-,31+,32-,35-,36-/m0/s1",WUXSZVRSSSITPJ-XDWCYEPESA-N,133562461,yes,Microcystis,aeruginosa,NIES 87
CyanoMetDB_0925,Synechoxanthin,,other linear non-peptide,,C40H44O4,588.3239599,CC1=C(C=CC(=C1C)C(=O)O)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C2=C(C(=C(C=C2)C(=O)O)C)C)\C)\C)/C)/C,"InChI=1S/C40H44O4/c1-27(15-11-17-29(3)19-21-35-23-25-37(39(41)42)33(7)31(35)5)13-9-10-14-28(2)16-12-18-30(4)20-22-36-24-26-38(40(43)44)34(8)32(36)6/h9-26H,1-8H3,(H,41,42)(H,43,44)/b10-9+,15-11+,16-12+,21-19+,22-20+,27-13+,28-14+,29-17+,30-18+",BFYXFUUHZKWAJW-TUOVYMBRSA-N,44237248,yes,Synechococcus,n.a.,PCC 7002
CyanoMetDB_0926,Aeruginoguanidine 98C,Aeruginoguanidine 98-C,other linear peptide,Microguanidine,C39H67N9O15S3,997.391876,C/C(CCC(O)C(C)=C)=C/CNC(NCCC[C@H](NC)C(N([C@H](C(N[C@H](C)[C@H](OS(=O)(O)=O)C1=CC=C(OS(=O)(O)=O)C(COS(=O)(O)=O)=C1)=O)CCCNC(NC/C=C(C)/C)=N)C)=O)=N,"InChI=1S/C39H67N9O15S3/c1-25(2)17-21-45-38(40)44-20-10-12-32(48(8)37(51)31(42-7)11-9-19-43-39(41)46-22-18-27(5)13-15-33(49)26(3)4)36(50)47-28(6)35(63-66(58,59)60)29-14-16-34(62-65(55,56)57)30(23-29)24-61-64(52,53)54/h14,16-18,23,28,31-33,35,42,49H,3,9-13,15,19-22,24H2,1-2,4-8H3,(H,47,50)(H3,40,44,45)(H3,41,43,46)(H,52,53,54)(H,55,56,57)(H,58,59,60)/b27-18-/t28-,31+,32+,33?,35+/m1/s1",KCMMTAKLPUUDDC-PWVVLFCASA-N,10033948,yes,Microcystis,aeruginosa,NIES 98
CyanoMetDB_0927,Aeruginoguanidine 98A,Aeruginoguanidine 98-A,other cyclic peptide,Microguanidine,C39H67N9O14S3,981.3969614,C[C@@H](NC([C@@H](N(C([C@@H](NC)CCCNC(NC/C=C(CC/C=C(C)\C)/C)=N)=O)C)CCCNC(NC/C=C(C)/C)=N)=O)[C@H](OS(=O)(O)=O)C1=CC(COS(=O)(O)=O)=C(OS(=O)(O)=O)C=C1,"InChI=1S/C39H67N9O14S3/c1-26(2)12-9-13-28(5)19-23-46-39(41)43-20-10-14-32(42-7)37(50)48(8)33(15-11-21-44-38(40)45-22-18-27(3)4)36(49)47-29(6)35(62-65(57,58)59)30-16-17-34(61-64(54,55)56)31(24-30)25-60-63(51,52)53/h12,16-19,24,29,32-33,35,42H,9-11,13-15,20-23,25H2,1-8H3,(H,47,49)(H3,40,44,45)(H3,41,43,46)(H,51,52,53)(H,54,55,56)(H,57,58,59)/b28-19-/t29-,32+,33+,35+/m1/s1",FZNIATZASYIKQE-KRJWMNQKSA-N,10486135,yes,Microcystis,aeruginosa,NIES 98
CyanoMetDB_0928,Microcolin A,,other linear peptide,"Microcolin, Mirabimide",C39H65N5O9,747.4782287,CCCC[C@@H](C[C@@H](C(N([C@H](C(N[C@H](C(N([C@H](C(N1C[C@@H](O)C[C@H]1C(N2[C@@H](C)C=CC2=O)=O)=O)C(C)C)C)=O)[C@@H](OC(C)=O)C)=O)CC(C)C)C)=O)C)C,"InChI=1S/C39H65N5O9/c1-13-14-15-24(6)19-25(7)36(49)41(11)30(18-22(2)3)35(48)40-33(27(9)53-28(10)45)38(51)42(12)34(23(4)5)39(52)43-21-29(46)20-31(43)37(50)44-26(8)16-17-32(44)47/h16-17,22-27,29-31,33-34,46H,13-15,18-21H2,1-12H3,(H,40,48)/t24-,25-,26-,27-,29-,30-,31-,33-,34-/m0/s1",MSXKGFVHTYHBSG-KOZCCWCESA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0929,Microcolin B,,other linear peptide,"Microcolin, Mirabimide",C39H65N5O8,731.4833141,CCCC[C@@H](C[C@@H](C(N([C@H](C(N[C@H](C(N([C@H](C(N1CCC[C@H]1C(N2[C@@H](C)C=CC2=O)=O)=O)C(C)C)C)=O)C(OC(C)=O)C)=O)CC(C)C)C)=O)C)C,"InChI=1S/C39H65N5O8/c1-13-14-16-25(6)22-26(7)36(48)41(11)31(21-23(2)3)35(47)40-33(28(9)52-29(10)45)38(50)42(12)34(24(4)5)39(51)43-20-15-17-30(43)37(49)44-27(8)18-19-32(44)46/h18-19,23-28,30-31,33-34H,13-17,20-22H2,1-12H3,(H,40,47)/t25-,26-,27-,28?,30-,31-,33-,34-/m0/s1",MNASOWORUXKEPP-RHYVYHQSSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0930,Veraguamide K,,other linear peptide,Trungapeptin,C39H65BrN4O9,812.393493,CCC(C)C(C(=O)N1CCCC1C(=O)N(C)C(C(C)C)C(=O)OCC)OC(=O)C(C(C)C)N(C)C(=O)C(C(C)C)NC(=O)C(C)C(CCCC#CBr)O,"InChI=1S/C39H65BrN4O9/c1-13-26(9)33(37(49)44-22-18-19-28(44)35(47)42(11)31(24(5)6)38(50)52-14-2)53-39(51)32(25(7)8)43(12)36(48)30(23(3)4)41-34(46)27(10)29(45)20-16-15-17-21-40/h23-33,45H,13-16,18-20,22H2,1-12H3,(H,41,46)",LUHSXKWLOOLDHE-UHFFFAOYSA-N,53262801,yes,Oscillatoria/Planktothrix,margaritifera,n.a.
CyanoMetDB_0931,Aeruginosin NOL7,,Aeruginosin,,C39H64N6O10,776.4683923,O=C(N[C@H](C(N1C(C(NC(CO)CCCNC(N)=N)=O)C[C@H]2[C@@H]1CC(OC3OC(CO)C(O)C3O)CC2)=O)CC4=CC=C(O)C=C4)CCCCCCCCC,"InChI=1S/C39H64N6O10/c1-2-3-4-5-6-7-8-11-33(49)44-29(19-24-12-15-27(48)16-13-24)37(53)45-30-21-28(54-38-35(51)34(50)32(23-47)55-38)17-14-25(30)20-31(45)36(52)43-26(22-46)10-9-18-42-39(40)41/h12-13,15-16,25-26,28-32,34-35,38,46-48,50-51H,2-11,14,17-23H2,1H3,(H,43,52)(H,44,49)(H4,40,41,42)/t25-,26?,28?,29-,30-,31-,32?,34?,35?,38?/m0/s1",NABUGTAZUYSAPR-COFVMNJTSA-N,,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0932,Kulomo’opunalide 1,,other cyclic peptide,Trungapeptin,C39H64N4O8,716.472415,C#CCCC[C@](OC([C@](N(C([C@]1([H])CCCN1C([C@](O2)([H])[C@@](CC)([H])C)=O)=O)C)([H])[C@](CC)([H])C)=O)([H])[C@](/C(O)=N/[C@@](C(N([C@@](C2=O)([H])[C@@](CC)([H])C)C)=O)([H])C(C)C)([H])C,"InChI=1S/C39H64N4O8/c1-13-17-18-21-29-27(10)34(44)40-30(23(5)6)36(46)42(12)32(25(8)15-3)39(49)51-33(26(9)16-4)37(47)43-22-19-20-28(43)35(45)41(11)31(24(7)14-2)38(48)50-29/h1,23-33H,14-22H2,2-12H3,(H,40,44)/t24-,25+,26+,27+,28+,29-,30+,31+,32+,33+/m1/s1",XKNNLKAOFMYXTB-RGOZYGIMNA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0933,Veraguamide E,,other cyclic peptide,Trungapeptin,C39H64N4O8,716.472415,CC[C@H](C)[C@H]1C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)C)CCCC#C)C(C)C)C)[C@@H](C)CC)[C@@H](C)CC)C,"InChI=1S/C39H64N4O8/c1-13-17-18-21-29-27(10)34(44)40-30(24(7)14-2)36(46)42(12)32(25(8)15-3)39(49)51-33(26(9)16-4)37(47)43-22-19-20-28(43)35(45)41(11)31(23(5)6)38(48)50-29/h1,23-33H,14-22H2,2-12H3,(H,40,44)/t24-,25-,26-,27-,28-,29+,30-,31-,32-,33-/m0/s1",YKOAWVLIPQAKNV-ADVLKQFPSA-N,53355451,yes,Symploca,hydnoides,n.a.
CyanoMetDB_0934,Banyaside B,,other cyclic peptide,other cyclic depsipeptide,C39H63N7O18S,949.3950294,CCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2C[C@@H]3[C@@H]([C@]4(C2)[C@H]([C@@H](N3C(=O)[C@@H](CC(C)C)NC(=O)C(COS(=O)(=O)O)OC)C(=O)NCCC5=CCN(C5)C(=N)N)NC(=O)O4)O)O)O)O,"InChI=1S/C39H63N7O18S/c1-5-6-7-8-26(47)60-17-24-28(48)29(49)30(50)36(63-24)62-21-14-23-32(51)39(15-21)31(44-38(55)64-39)27(34(53)42-11-9-20-10-12-45(16-20)37(40)41)46(23)35(54)22(13-19(2)3)43-33(52)25(59-4)18-61-65(56,57)58/h10,19,21-25,27-32,36,48-51H,5-9,11-18H2,1-4H3,(H3,40,41)(H,42,53)(H,43,52)(H,44,55)(H,56,57,58)/t21-,22-,23-,24-,25?,27-,28-,29+,30-,31+,32+,36+,39+/m1/s1",KJFWBWHYMLHCPE-LVWAXZRWSA-N,11445971,yes,Nostoc,n.a.,n.a.
CyanoMetDB_0935,Aeruginosin 822,,Aeruginosin,Depsipeptide,C39H62N6O13,822.4374861,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(CO)O4)C(OC(CCC)=O)CC3C1,"InChI=1S/C39H62N6O13/c1-4-7-31(49)56-28-17-22-16-26(35(53)42-12-5-6-13-43-39(40)41)45(25(22)18-29(28)57-38-34(52)33(51)32(50)30(19-46)58-38)37(55)24(14-20(2)3)44-36(54)27(48)15-21-8-10-23(47)11-9-21/h8-11,20,22,24-30,32-34,38,46-48,50-52H,4-7,12-19H2,1-3H3,(H,42,53)(H,44,54)(H4,40,41,43)",HQWLBDUIMYDJHD-UHFFFAOYSA-N,146684799,no,n.a.,n.a.,n.a.
CyanoMetDB_0936,Micropeptin LH911A,,Cyanopeptolin,Micropeptin,C39H61N9O14S,911.4058689,CN1[C@H](C(N[C@@H](C(O[C@H]([C@@H](C(N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)C([C@@H](CC)C)C1=O)=O)=O)CCC/N=C(N)/N)=O)NC(C(COS(O)(=O)=O)O)=O)C)=O)C(C)C)=O)CC3=CC=CC=C3,"InChI=1S/C39H61N9O14S/c1-7-21(4)31-37(56)47(6)26(18-23-12-9-8-10-13-23)33(52)45-29(20(2)3)38(57)62-22(5)30(46-34(53)27(49)19-61-63(58,59)60)35(54)43-24(14-11-17-42-39(40)41)32(51)44-25-15-16-28(50)48(31)36(25)55/h8-10,12-13,20-22,24-31,49-50H,7,11,14-19H2,1-6H3,(H,43,54)(H,44,51)(H,45,52)(H,46,53)(H4,40,41,42)(H,58,59,60)/t21-,22+,24+,25+,26+,27?,28-,29-,30+,31?/m1/s1",JYIHYFZAIPDBTI-KDPWGPJXSA-N,,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0937,Micropeptin LH911B,,Cyanopeptolin,Micropeptin,C39H61N9O14S,911.4058689,C[C@H](O1)[C@@H](C(N[C@H](C(N[C@@H]2C(N([C@@H](CC2)O)[C@H](C(N([C@H](C(NC([C@@H](CC)C)C1=O)=O)CC3=CC=CC=C3)C)=O)C(C)C)=O)=O)CCC/N=C(N)/N)=O)NC(C(COS(O)(=O)=O)O)=O,"InChI=1S/C39H61N9O14S/c1-7-21(4)29-38(57)62-22(5)30(46-34(53)27(49)19-61-63(58,59)60)35(54)43-24(14-11-17-42-39(40)41)32(51)44-25-15-16-28(50)48(36(25)55)31(20(2)3)37(56)47(6)26(33(52)45-29)18-23-12-9-8-10-13-23/h8-10,12-13,20-22,24-31,49-50H,7,11,14-19H2,1-6H3,(H,43,54)(H,44,51)(H,45,52)(H,46,53)(H4,40,41,42)(H,58,59,60)/t21-,22+,24+,25+,26+,27?,28-,29?,30+,31+/m1/s1",MCHKPVCODNVXBZ-GHCFYIALSA-N,,yes,Microcystis,n.a.,TAU IL-37
CyanoMetDB_0938,Microginin 711,,Microginin,,C39H61N5O7,711.4570993,O=C(N(C)C(C(NC(C(NC(C(O)=O)CC1=CC=C(O)C=C1)=O)CC2=CC=C(O)C=C2)=O)CC(C)C)C(C(C)C)NCC(CCCCCCC)N,"InChI=1S/C39H61N5O7/c1-7-8-9-10-11-12-29(40)24-41-35(26(4)5)38(49)44(6)34(21-25(2)3)37(48)42-32(22-27-13-17-30(45)18-14-27)36(47)43-33(39(50)51)23-28-15-19-31(46)20-16-28/h13-20,25-26,29,32-35,41,45-46H,7-12,21-24,40H2,1-6H3,(H,42,48)(H,43,47)(H,50,51)",PGCVTSQVAKRVDX-UHFFFAOYSA-N,146684923,no,n.a.,n.a.,n.a.
CyanoMetDB_0939,Planktocyclin,,other cyclic peptide,,C39H60N8O8S,800.4254821,CC(C)C[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)NCC(=O)N1)C(C)C)CC3=CC=CC=C3)CCSC)C(C)C,"InChI=1S/C39H60N8O8S/c1-22(2)18-27-36(52)46-32(23(3)4)38(54)43-26(15-17-56-7)35(51)44-28(19-25-12-9-8-10-13-25)34(50)40-21-31(49)45-33(24(5)6)39(55)47-16-11-14-29(47)37(53)41-20-30(48)42-27/h8-10,12-13,22-24,26-29,32-33H,11,14-21H2,1-7H3,(H,40,50)(H,41,53)(H,42,48)(H,43,54)(H,44,51)(H,45,49)(H,46,52)/t26-,27-,28-,29-,32-,33-/m0/s1",ZMRRRONVXWEVSB-ODNAPOIPSA-N,23655167,yes,Oscillatoria/Planktothrix,rubescens,n.a.
CyanoMetDB_0940,Brintonamide A,,other cyclic peptide,other cyclic depsipeptide,C39H60N6O9,756.4421775,CC[C@H](C)[C@@H](O)C(N1[C@H](C(NCC(N(C)[C@@H](CC(C)C)C(N[C@@H](C)C(N(C)[C@H](CC2=CC=CC=C2)C(N3[C@H](C(OC)=O)CCC3)=O)=O)=O)=O)=O)CCC1)=O,"InChI=1S/C39H60N6O9/c1-9-25(4)33(47)38(52)44-19-13-17-28(44)34(48)40-23-32(46)42(6)30(21-24(2)3)35(49)41-26(5)36(50)43(7)31(22-27-15-11-10-12-16-27)37(51)45-20-14-18-29(45)39(53)54-8/h10-12,15-16,24-26,28-31,33,47H,9,13-14,17-23H2,1-8H3,(H,40,48)(H,41,49)/t25-,26-,28-,29-,30-,31+,33+/m0/s1",VTNRKBDEFHTOLI-IUEZVBNUSA-N,145951877,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_0941,Aeruginosin 836,,Aeruginosin,Depsipeptide,C39H60N6O14,836.4167506,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(C(O)=O)O4)C(OC(CCC)=O)CC3C1,"InChI=1S/C39H60N6O14/c1-4-7-29(48)57-27-17-21-16-25(34(52)42-12-5-6-13-43-39(40)41)45(24(21)18-28(27)58-38-32(51)30(49)31(50)33(59-38)37(55)56)36(54)23(14-19(2)3)44-35(53)26(47)15-20-8-10-22(46)11-9-20/h8-11,19,21,23-28,30-33,38,46-47,49-51H,4-7,12-18H2,1-3H3,(H,42,52)(H,44,53)(H,55,56)(H4,40,41,43)",CGBKZECZSYDECP-UHFFFAOYSA-N,146684800,no,n.a.,n.a.,n.a.
CyanoMetDB_0942,Micropeptin HU1041,,Cyanopeptolin,Micropeptin,C39H60ClN9O18S2,1041.318626,CC([C@H]1C(O[C@@H](C)[C@H](NC([C@H](OS(=O)(O)=O)COS(=O)(O)=O)=O)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](O)[N@@]([C@H]([C@H](CC)C)C(N(C)[C@@H](CC3=CC(Cl)=C(O)C=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C39H60ClN9O18S2/c1-7-19(4)31-37(57)48(6)25(16-21-10-12-26(50)22(40)15-21)33(53)46-29(18(2)3)38(58)66-20(5)30(47-34(54)27(67-69(62,63)64)17-65-68(59,60)61)35(55)44-23(9-8-14-43-39(41)42)32(52)45-24-11-13-28(51)49(31)36(24)56/h10,12,15,18-20,23-25,27-31,50-51H,7-9,11,13-14,16-17H2,1-6H3,(H,44,55)(H,45,52)(H,46,53)(H,47,54)(H4,41,42,43)(H,59,60,61)(H,62,63,64)/t19-,20-,23-,24-,25-,27+,28+,29-,30-,31+/m0/s1",CDNBDTGIQPIOQU-HDHVQNDTSA-N,,yes,Microcystis,n.a.,TAU IL-342
CyanoMetDB_0943,Microginin 742A,,Microginin,,C39H59N5O9,741.4312785,CCCCCCCC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CC(C)C)=O)C)=O)O)NC,"InChI=1S/C39H59N5O9/c1-7-8-9-10-11-12-30(40-5)34(47)37(50)41-25(4)38(51)44(6)33(21-24(2)3)36(49)42-31(22-26-13-17-28(45)18-14-26)35(48)43-32(39(52)53)23-27-15-19-29(46)20-16-27/h13-20,24-25,30-34,40,45-47H,7-12,21-23H2,1-6H3,(H,41,50)(H,42,49)(H,43,48)(H,52,53)",AQINXMPZZHMZRR-UHFFFAOYSA-N,77923722,no,n.a.,n.a.,n.a.
CyanoMetDB_0944,Microginin 742C,,Microginin,,C39H59N5O9,741.4312785,CCCCCCCC(C(C(NC(C(N(C)C(C(N(C)C(CC1=CC=C(O)C=C1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CC(C)C)=O)C)=O)O)N,"InChI=1S/C39H59N5O9/c1-7-8-9-10-11-12-30(40)34(47)36(49)41-25(4)37(50)44(6)33(21-24(2)3)38(51)43(5)32(23-27-15-19-29(46)20-16-27)35(48)42-31(39(52)53)22-26-13-17-28(45)18-14-26/h13-20,24-25,30-34,45-47H,7-12,21-23,40H2,1-6H3,(H,41,49)(H,42,48)(H,52,53)",CFPZJODEBABGTA-UHFFFAOYSA-N,146684924,no,n.a.,n.a.,n.a.
CyanoMetDB_0945,Guineamide E,,other cyclic peptide,Obyanamide,C39H59N5O9,741.4312785,CCCC1C(C(=O)O[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N2CCC[C@H]2C(=O)N([C@@H](C(=O)NCC(=O)O1)CC3=CC=CC=C3)C)C(C)C)C)C)C(C)C)(C)C,"InChI=1S/C39H59N5O9/c1-11-16-29-39(7,8)38(51)53-32(24(4)5)34(47)41-25(6)35(48)43(10)31(23(2)3)37(50)44-20-15-19-27(44)36(49)42(9)28(21-26-17-13-12-14-18-26)33(46)40-22-30(45)52-29/h12-14,17-18,23-25,27-29,31-32H,11,15-16,19-22H2,1-10H3,(H,40,46)(H,41,47)/t25-,27-,28+,29?,31-,32-/m0/s1",WIFAOXKADBNEPT-SVBROBQKSA-N,10876378,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0946,Microginin FR2,,Microginin,,C38H55N5O10,741.3949,OC(C(CCCCCCC)NC)C(NC(C(C)O)C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(NC(C(O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C38H55N5O10/c1-4-5-6-7-8-10-28(39-3)33(47)36(50)42-32(23(2)44)37(51)43-20-9-11-31(43)35(49)40-29(21-24-12-16-26(45)17-13-24)34(48)41-30(38(52)53)22-25-14-18-27(46)19-15-25/h12-19,23,28-33,39,44-47H,4-11,20-22H2,1-3H3,(H,40,49)(H,41,48)(H,42,50)(H,52,53)",UJVLZLPEXZJNMA-UHFFFAOYSA-N,77923722,no,Microcystis,aeruginosa,NPCD-01
CyanoMetDB_0947,Nostoginin BN741,,Microginin,,C39H59N5O9,741.4312785,O[C@@H]([C@H](CCCCC)N)C(N[C@H](C(N([C@@H]([C@H](CC)C)C(N([C@@H](CC1=CC=C(C=C1)O)C(N[C@H](C(O)=O)CC2=CC=C(O)C=C2)=O)C)=O)C)=O)C(C)C)=O,"InChI=1S/C39H59N5O9/c1-8-10-11-12-29(40)34(47)36(49)42-32(23(3)4)37(50)44(7)33(24(5)9-2)38(51)43(6)31(22-26-15-19-28(46)20-16-26)35(48)41-30(39(52)53)21-25-13-17-27(45)18-14-25/h13-20,23-24,29-34,45-47H,8-12,21-22,40H2,1-7H3,(H,41,48)(H,42,49)(H,52,53)/t24-,29-,30-,31-,32-,33-,34-/m0/s1",LMTZMDMYSIVNCR-KOQODJNWSA-N,10462730,yes,Nostoc,n.a.,TAU IL-235
CyanoMetDB_0948,Microginin 757,,Microginin,,C39H59N5O10,757.4261931,OC(C(NC(C(N(C(CC(C)C)C(NC(C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)CC2=CC=C(O)C=C2)=O)C)=O)C(O)C)=O)C(N)CCCCCCC,"InChI=1S/C39H59N5O10/c1-6-7-8-9-10-11-29(40)34(48)37(51)43-33(24(4)45)38(52)44(5)32(20-23(2)3)36(50)41-30(21-25-12-16-27(46)17-13-25)35(49)42-31(39(53)54)22-26-14-18-28(47)19-15-26/h12-19,23-24,29-34,45-48H,6-11,20-22,40H2,1-5H3,(H,41,50)(H,42,49)(H,43,51)(H,53,54)",FXNVBPMPLYGNFO-UHFFFAOYSA-N,146683921,no,n.a.,n.a.,n.a.
CyanoMetDB_0949,Microginin 791,,Microginin,,C39H58ClN5O10,791.3872208,NC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CC(C)C)=O)C(O)C)=O)O)CCCCCCCCl,"InChI=1S/C39H58ClN5O10/c1-23(2)20-32(45(4)38(53)33(24(3)46)44-37(52)34(49)29(41)10-8-6-5-7-9-19-40)36(51)42-30(21-25-11-15-27(47)16-12-25)35(50)43-31(39(54)55)22-26-13-17-28(48)18-14-26/h11-18,23-24,29-34,46-49H,5-10,19-22,41H2,1-4H3,(H,42,51)(H,43,50)(H,44,52)(H,54,55)",BPQYLQCHIXXZQB-UHFFFAOYSA-N,146684925,no,n.a.,n.a.,n.a.
CyanoMetDB_0950,Microginin 739B,,Microginin,,C39H57N5O9,739.4156284,CCCCCCCC(C(C(NC(C(NC(C(N1C(C(N(C)C(C(O)=O)CC2=CC=C(O)C=C2)=O)CCC1)=O)CC3=CC=C(O)C=C3)=O)C(C)C)=O)O)N,"InChI=1S/C39H57N5O9/c1-5-6-7-8-9-11-29(40)34(47)36(49)42-33(24(2)3)35(48)41-30(22-25-13-17-27(45)18-14-25)37(50)44-21-10-12-31(44)38(51)43(4)32(39(52)53)23-26-15-19-28(46)20-16-26/h13-20,24,29-34,45-47H,5-12,21-23,40H2,1-4H3,(H,41,48)(H,42,49)(H,52,53)",ZJFHHVNIKZVNFO-UHFFFAOYSA-N,146684926,no,n.a.,n.a.,n.a.
CyanoMetDB_0951,Microginin FR6,,Microginin,,C39H57N5O9,739.4156284,OC(C(CCCCCCC)NC)C(NC(C(C)C)C(N1CCCC1C(NC(CC2=CC=C(C=C2)O)C(NC(C(O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C39H57N5O9/c1-5-6-7-8-9-11-29(40-4)34(47)37(50)43-33(24(2)3)38(51)44-21-10-12-32(44)36(49)41-30(22-25-13-17-27(45)18-14-25)35(48)42-31(39(52)53)23-26-15-19-28(46)20-16-26/h13-20,24,29-34,40,45-47H,5-12,21-23H2,1-4H3,(H,41,49)(H,42,48)(H,43,50)(H,52,53)",NJWZGPDFAVDNQA-UHFFFAOYSA-N,146683922,no,n.a.,n.a.,n.a.
CyanoMetDB_0952,Carbamidocyclophane G,,other cyclic non-peptide,"Carbamidocyclophane, Cyclophane",C39H55Cl4NO8,805.2681785,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1OC(=O)C)C=C3O)O)CCCC(Cl)Cl)C)OC(=O)N)O)CCCC(Cl)Cl,"InChI=1S/C39H55Cl4NO8/c1-24-12-4-6-14-28(17-9-11-19-43-41)36-33(48)22-30(23-34(36)49)38(52-39(44)50)25(2)13-5-7-15-27(16-8-10-18-42-40)35-31(46)20-29(21-32(35)47)37(24)51-26(3)45/h18-25,27-28,37-38,46-49H,4-17H2,1-3H3,(H2,44,50)",BKNUCPFWLJZHQY-UHFFFAOYSA-N,,yes,Nostoc,n.a.,n.a.
CyanoMetDB_0953,Microginin FR9,,Microginin,,C39H54N6O9,750.3952273,OC(C(CCCCCCC)N)C(NC(C(C)O)C(N1CCCC1C(NC(CC2=CC=C(C=C2)O)C(NC(C(O)=O)CC3=CC(C=CC=C4)=C4N3)=O)=O)=O)=O,"InChI=1S/C39H54N6O9/c1-3-4-5-6-7-12-28(40)34(48)37(51)44-33(23(2)46)38(52)45-19-10-14-32(45)36(50)42-30(20-24-15-17-27(47)18-16-24)35(49)43-31(39(53)54)22-26-21-25-11-8-9-13-29(25)41-26/h8-9,11,13,15-18,21,23,28,30-34,41,46-48H,3-7,10,12,14,19-20,22,40H2,1-2H3,(H,42,50)(H,43,49)(H,44,51)(H,53,54)",MCMDDENRFTYQNV-UHFFFAOYSA-N,146683923,no,n.a.,n.a.,n.a.
CyanoMetDB_0954,Scytonemide B,,other cyclic peptide,other cyclic depsipeptide,C39H53N7O12,811.3752202,CCCCCC1CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)O1)CC(=O)O)CCCNC(=O)N)CC2=CC=C(C=C2)O)CC3=CC=CC=C3)CO,"InChI=1S/C39H53N7O12/c1-2-3-5-11-26-20-32(49)42-31(22-47)37(55)45-28(18-23-9-6-4-7-10-23)36(54)44-29(19-24-13-15-25(48)16-14-24)35(53)43-27(12-8-17-41-39(40)57)34(52)46-30(21-33(50)51)38(56)58-26/h4,6-7,9-10,13-16,26-31,47-48H,2-3,5,8,11-12,17-22H2,1H3,(H,42,49)(H,43,53)(H,44,54)(H,45,55)(H,46,52)(H,50,51)(H3,40,41,57)/t26?,27-,28+,29+,30+,31+/m1/s1",ONZIPRUJMWNLDH-REVKYEQOSA-N,50900767,yes,Scytonema,hofmannii ,UTEX 1834
CyanoMetDB_0955,Bartoloside H,,other linear non-peptide,Bartoloside,C38H66Cl2O6,688.4236452,CCCCCCCCCC(CCCCCC1=CC(=C(C(=C1)O[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCC(CCCCCC)Cl)O)Cl,"InChI=1S/C38H66Cl2O6/c1-3-5-7-9-10-11-16-22-31(40)23-17-12-14-20-29-26-33(41)32(25-19-13-18-24-30(39)21-15-8-6-4-2)35(27-29)46-38-37(44)36(43)34(42)28-45-38/h26-27,30-31,34,36-38,41-44H,3-25,28H2,1-2H3/t30?,31?,34-,36+,37-,38+/m1/s1",SNZCABRUTZVTFC-KJIMCQFPSA-N,132582912,yes,Synechocystis,salina ,LEGE 06099
CyanoMetDB_0956,Veraguamide L,,other linear peptide,Trungapeptin,C38H63BrN4O9,798.377843,CCOC(=O)C(C(C)C)N(C)C(=O)C1CCCN1C(=O)C(C(C)C)OC(=O)C(C(C)C)N(C)C(=O)C(C(C)C)NC(=O)C(C)C(CCCC#CBr)O,"InChI=1S/C38H63BrN4O9/c1-13-51-37(49)30(23(4)5)41(11)34(46)27-18-17-21-43(27)36(48)32(25(8)9)52-38(50)31(24(6)7)42(12)35(47)29(22(2)3)40-33(45)26(10)28(44)19-15-14-16-20-39/h22-32,44H,13-15,17-19,21H2,1-12H3,(H,40,45)",XFJWITCKHVUBEG-UHFFFAOYSA-N,53262812,yes,Oscillatoria/Planktothrix,margaritifera,n.a.
CyanoMetDB_0957,Veraguamide D,,other cyclic peptide,Trungapeptin,C38H62N4O8,702.456765,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1C)[C@@H](C)CC)C(C)C)C)C(C)C)C)CCCC#C,"InChI=1S/C38H62N4O8/c1-13-16-17-20-28-26(10)33(43)39-29(22(4)5)35(45)40(11)30(23(6)7)37(47)50-32(25(9)15-3)36(46)42-21-18-19-27(42)34(44)41(12)31(24(8)14-2)38(48)49-28/h1,22-32H,14-21H2,2-12H3,(H,39,43)/t24-,25-,26-,27-,28+,29-,30-,31-,32-/m0/s1",IAJYQKUPYJPDLQ-QLLVAUIFSA-N,53355450,yes,Symploca,hydnoides,n.a.
CyanoMetDB_0958,Kulomo’opunalide 2,,other cyclic peptide,Trungapeptin,C38H62N4O8,702.456765,C#CCCC[C@](OC([C@](N(C([C@]1([H])CCCN1C([C@](O2)([H])C(C)C)=O)=O)C)([H])[C@@](CC)([H])C)=O)([H])[C@](/C(O)=N/[C@@](C(N([C@@](C2=O)([H])[C@@](CC)([H])C)C)=O)([H])C(C)C)([H])C,"InChI=1S/C38H62N4O8/c1-13-16-17-20-28-26(10)33(43)39-29(22(4)5)35(45)41(12)31(25(9)15-3)38(48)50-32(23(6)7)36(46)42-21-18-19-27(42)34(44)40(11)30(24(8)14-2)37(47)49-28/h1,22-32H,14-21H2,2-12H3,(H,39,43)/t24-,25-,26-,27-,28+,29-,30-,31-,32-/m0/s1",SQJXSQNFTGGEAI-IGYKWALXNA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_0959,Micropeptin MZ771,,Cyanopeptolin,Micropeptin,C38H61N9O8,771.46431,CC[C@H]([C@H]1C(O[C@H](C)[C@H](N)C(N[C@@H](CCC/N=C(N)\N)C(N[C@H]2CC[C@@H](OC)[N@@]([C@H]([C@@H](CC)C)C(N(C)[C@@H](CC3=CC=CC=C3)C(N1)=O)=O)C2=O)=O)=O)=O)C,"InChI=1S/C38H61N9O8/c1-8-21(3)30-37(53)55-23(5)29(39)34(50)43-25(16-13-19-42-38(40)41)32(48)44-26-17-18-28(54-7)47(35(26)51)31(22(4)9-2)36(52)46(6)27(33(49)45-30)20-24-14-11-10-12-15-24/h10-12,14-15,21-23,25-31H,8-9,13,16-20,39H2,1-7H3,(H,43,50)(H,44,48)(H,45,49)(H4,40,41,42)/t21-,22-,23-,25+,26+,27+,28-,29+,30+,31-/m1/s1",JVWJZPMAMBSFIP-KNLSNHRISA-N,,yes,Microcystis,n.a.,TAU IL-361
CyanoMetDB_0960,Anabaenopeptin I,,Anabaenopeptin,,C38H61N7O9,759.4530766,CC[C@H]([C@H](NC(N[C@@H]1CCCCNC([C@H](CC(C)C)NC([C@H](C)N(C)C([C@H](CCC2=CC=C(O)C=C2)NC([C@H](C(C)C)NC1=O)=O)=O)=O)=O)=O)C(O)=O)C,"InChI=1S/C38H61N7O9/c1-9-23(6)31(37(52)53)44-38(54)42-27-12-10-11-19-39-33(48)29(20-21(2)3)41-32(47)24(7)45(8)36(51)28(18-15-25-13-16-26(46)17-14-25)40-35(50)30(22(4)5)43-34(27)49/h13-14,16-17,21-24,27-31,46H,9-12,15,18-20H2,1-8H3,(H,39,48)(H,40,50)(H,41,47)(H,43,49)(H,52,53)(H2,42,44,54)/t23-,24+,27-,28+,29+,30+,31+/m1/s",WPCJIMNKFPGERC-GHZAOGIZSA-N,10676592,yes,Aphanizomenon,flos aquae,NIES 81
CyanoMetDB_0961,Cylindrofridin B,,other linear non-peptide,Cylindrofridin,C38H59ClO7,662.3949319,CCCC[C@@H](CCCC[C@H](C)[C@H](C1=CC(=CC(=C1)O)O)OC(=O)C)C2=C(C=C(C=C2O)[C@@H]([C@@H](C)CCCCC(CCCC)Cl)O)O,"InChI=1S/C38H59ClO7/c1-6-8-16-28(17-12-10-15-26(4)38(46-27(5)40)30-20-32(41)24-33(42)21-30)36-34(43)22-29(23-35(36)44)37(45)25(3)14-11-13-19-31(39)18-9-7-2/h20-26,28,31,37-38,41-45H,6-19H2,1-5H3/t25-,26-,28-,31?,37+,38+/m0/s1",OALOPYYRKWCJGW-KIWBYYFGSA-N,127032790,yes,Cylindrospermum,stagnale,PCC 7417
CyanoMetDB_0962,Brintonamide B,,other linear peptide,linear depsipeptide,C38H58N6O9,742.4265275,CC(C)C(O)C(N1C(C(NCC(N(C)C(CC(C)C)C(NC(C)C(N(C)C(CC2=CC=CC=C2)C(N3C(C(OC)=O)CCC3)=O)=O)=O)=O)=O)CCC1)=O,"InChI=1S/C38H58N6O9/c1-23(2)20-29(41(6)31(45)22-39-33(47)27-16-12-18-43(27)37(51)32(46)24(3)4)34(48)40-25(5)35(49)42(7)30(21-26-14-10-9-11-15-26)36(50)44-19-13-17-28(44)38(52)53-8/h9-11,14-15,23-25,27-30,32,46H,12-13,16-22H2,1-8H3,(H,39,47)(H,40,48)/t25-,27-,28-,29-,30+,32+/m0/s1",JQMRBQCVOQBYQU-BANKALSUSA-N,145949555,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_0963,Carbamidocyclophane E,,other cyclic non-peptide,Cyclophane,C38H58N2O8,670.4193168,CCCCC1CCCC[C@@H]([C@H](C2=CC(=C(C(CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCC)C(=C2)O)O)OC(=O)N)C,"InChI=1S/C38H58N2O8/c1-5-7-15-25-17-11-9-13-23(3)36(48-38(40)46)28-21-31(43)34(32(44)22-28)26(16-8-6-2)18-12-10-14-24(4)35(47-37(39)45)27-19-29(41)33(25)30(42)20-27/h19-26,35-36,41-44H,5-18H2,1-4H3,(H2,39,45)(H2,40,46)/t23-,24-,25?,26?,35+,36+/m0/s1",MMNOSSIKVRRNRZ-MJVHAFATSA-N,16216032,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0964,Itralamide B,,other cyclic peptide,other cyclic depsipeptide,C38H58Cl2N6O8,796.3693183,C[C@@H]1[C@@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@@H](C(=O)N[C@H](C(=O)O1)C(C)C)CC2=CC=CC=C2)C)C)C)C(C)C)C)C)N(C)C(=O)CC(C)C(Cl)Cl,"InChI=1S/C38H58Cl2N6O8/c1-20(2)29-36(51)44(10)24(7)35(50)45(11)27(19-26-16-14-13-15-17-26)34(49)42-30(21(3)4)38(53)54-25(8)31(37(52)43(9)23(6)33(48)41-29)46(12)28(47)18-22(5)32(39)40/h13-17,20-25,27,29-32H,18-19H2,1-12H3,(H,41,48)(H,42,49)/t22?,23-,24-,25+,27+,29+,30-,31-/m0/s1",SZZBMDKRUBNFQR-ONAOHADISA-N,44479476,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0965,Cyanostatin A,,Microginin,Cyanostatin,C38H57N5O9,727.4156284,CCCCCCC[C@H]([C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CCC2=CC=C(C=C2)O)C(=O)O)O)N,"InChI=1S/C38H57N5O9/c1-6-7-8-9-10-11-29(39)33(46)36(49)40-24(4)34(47)42-32(23(2)3)37(50)43(5)31(22-26-14-19-28(45)20-15-26)35(48)41-30(38(51)52)21-16-25-12-17-27(44)18-13-25/h12-15,17-20,23-24,29-33,44-46H,6-11,16,21-22,39H2,1-5H3,(H,40,49)(H,41,48)(H,42,47)(H,51,52)/t24-,29+,30-,31-,32-,33-/m0/s1",DPARKGLYGYXUCH-CNYVOHIJSA-N,11787461,yes,n.a.,n.a.,n.a.
CyanoMetDB_0966,Microginin FR1,,Microginin,,C38H57N5O9,727.4156284,CCCCCCCC(C(C(=O)NC(C)C(=O)N(C)C(CC(C)C)C(=O)NC(CC1=CC=C(C=C1)O)C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O)O)N,"InChI=1S/C38H57N5O9/c1-6-7-8-9-10-11-29(39)33(46)36(49)40-24(4)37(50)43(5)32(20-23(2)3)35(48)41-30(21-25-12-16-27(44)17-13-25)34(47)42-31(38(51)52)22-26-14-18-28(45)19-15-26/h12-19,23-24,29-33,44-46H,6-11,20-22,39H2,1-5H3,(H,40,49)(H,41,48)(H,42,47)(H,51,52)/t24-,29+,30-,31-,32-,33-/m0/s1",BQGPJXHWGIKJKY-CNYVOHIJSA-N,11556730,yes,n.a.,n.a.,n.a.
CyanoMetDB_0967,Microginin 743,,Microginin,,C38H57N5O10,743.4105431,CCCCCCCC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CC(C)C)=O)CO)=O)O)N,"InChI=1S/C38H57N5O10/c1-5-6-7-8-9-10-28(39)33(47)36(50)42-31(22-44)37(51)43(4)32(19-23(2)3)35(49)40-29(20-24-11-15-26(45)16-12-24)34(48)41-30(38(52)53)21-25-13-17-27(46)18-14-25/h11-18,23,28-33,44-47H,5-10,19-22,39H2,1-4H3,(H,40,49)(H,41,48)(H,42,50)(H,52,53)",BAXHGTFYPXBRRP-UHFFFAOYSA-N,146684927,no,n.a.,n.a.,n.a.
CyanoMetDB_0969,Carbamidocyclophane D,,other cyclic non-peptide,Cyclophane,C38H57ClN2O8,704.3803445,CCCCC1CCCC[C@@H]([C@H](C2=CC(=C(C(CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCCCl)C(=C2)O)O)OC(=O)N)C,"InChI=1S/C38H57ClN2O8/c1-4-5-14-25-15-8-6-12-23(2)36(49-38(41)47)28-21-31(44)34(32(45)22-28)26(17-10-11-18-39)16-9-7-13-24(3)35(48-37(40)46)27-19-29(42)33(25)30(43)20-27/h19-26,35-36,42-45H,4-18H2,1-3H3,(H2,40,46)(H2,41,47)/t23-,24-,25?,26?,35+,36+/m0/s1",YSZWKXRRCFZDNI-MJVHAFATSA-N,16216031,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0970,Carbamidocyclophane M,,other cyclic non-peptide,Cyclophane,C38H57BrN2O8,748.32983,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCCBr)C(=C2)O)O)OC(=O)N)C,"InChI=1S/C38H57BrN2O8/c1-4-5-14-25-15-8-6-12-23(2)36(49-38(41)47)28-21-31(44)34(32(45)22-28)26(17-10-11-18-39)16-9-7-13-24(3)35(48-37(40)46)27-19-29(42)33(25)30(43)20-27/h19-26,35-36,42-45H,4-18H2,1-3H3,(H2,40,46)(H2,41,47)/t23-,24-,25-,26+,35+,36+/m0/s1",GMONSDQGAGUQRU-YXTQZPCGSA-N,139590350,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0971,Microginin 761A,,Microginin,,C38H56ClN5O9,761.3766561,NC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CC(C)C)=O)C)=O)O)CCCCCCCCl,"InChI=1S/C38H56ClN5O9/c1-23(2)20-32(44(4)37(51)24(3)41-36(50)33(47)29(40)10-8-6-5-7-9-19-39)35(49)42-30(21-25-11-15-27(45)16-12-25)34(48)43-31(38(52)53)22-26-13-17-28(46)18-14-26/h11-18,23-24,29-33,45-47H,5-10,19-22,40H2,1-4H3,(H,41,50)(H,42,49)(H,43,48)(H,52,53)",GWMQIVOSRJRODQ-UHFFFAOYSA-N,146684928,no,n.a.,n.a.,n.a.
CyanoMetDB_0972,Carbamidocyclophane C,,other cyclic non-peptide,"Carbamidocyclophane, Cyclophane",C38H56Cl2N2O8,738.3413722,CCCCC1CCCC[C@@H]([C@H](C2=CC(=C(C(CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCC(Cl)Cl)C(=C2)O)O)OC(=O)N)C,"InChI=1S/C38H56Cl2N2O8/c1-4-5-13-24-14-8-6-11-22(2)36(50-38(42)48)27-20-30(45)34(31(46)21-27)25(16-10-17-32(39)40)15-9-7-12-23(3)35(49-37(41)47)26-18-28(43)33(24)29(44)19-26/h18-25,32,35-36,43-46H,4-17H2,1-3H3,(H2,41,47)(H2,42,48)/t22-,23-,24?,25?,35+,36+/m0/s1",GTNWJJTZQLWLEN-BSSQUUOISA-N,16216030,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0973,Carbamidocyclophane N,,other cyclic non-peptide,Cyclophane,C38H56Br2N2O8,826.240343,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1OC(=O)N)C=C3O)O)CCCCBr)C)OC(=O)N)O)CCCCBr,"InChI=1S/C38H56Br2N2O8/c1-23-11-3-5-13-25(15-7-9-17-39)34-31(45)21-28(22-32(34)46)36(50-38(42)48)24(2)12-4-6-14-26(16-8-10-18-40)33-29(43)19-27(20-30(33)44)35(23)49-37(41)47/h19-26,35-36,43-46H,3-18H2,1-2H3,(H2,41,47)(H2,42,48)/t23-,24-,25+,26+,35+,36+/m0/s1",WRARFMLYIOUCLD-LHTGRSOQSA-N,139590351,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_0974,Carbamidocyclophane O,,other cyclic non-peptide,Cyclophane,C38H56Br2N2O8,826.240343,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCC(Br)Br)C(=C2)O)O)OC(=O)N)C,"InChI=1S/C38H56Br2N2O8/c1-4-5-13-24-14-8-6-11-22(2)36(50-38(42)48)27-20-30(45)34(31(46)21-27)25(16-10-17-32(39)40)15-9-7-12-23(3)35(49-37(41)47)26-18-28(43)33(24)29(44)19-26/h18-25,32,35-36,43-46H,4-17H2,1-3H3,(H2,41,47)(H2,42,48)/t22-,23-,24-,25+,35+,36+/m0/s1",FVWPSKYVDXFOTC-CCNIBDGSSA-N,139590352,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_0975,Microginin FR5,,Microginin,,C38H55N5O9,725.3999784,OC(C(CCCCCCC)N)C(NC(C(C)C)C(N1CCCC1C(NC(CC2=CC=C(C=C2)O)C(NC(C(O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C38H55N5O9/c1-4-5-6-7-8-10-28(39)33(46)36(49)42-32(23(2)3)37(50)43-20-9-11-31(43)35(48)40-29(21-24-12-16-26(44)17-13-24)34(47)41-30(38(51)52)22-25-14-18-27(45)19-15-25/h12-19,23,28-33,44-46H,4-11,20-22,39H2,1-3H3,(H,40,48)(H,41,47)(H,42,49)(H,51,52)",KXRLIMLXCPEJPD-UHFFFAOYSA-N,146683924,no,n.a.,n.a.,n.a.
CyanoMetDB_0976,Microginin 742B,,Microginin,,C38H55N5O10,741.394893,CCCCCCCC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(N(C)C(C(O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)CO)=O)O)NC,"InChI=1S/C38H55N5O10/c1-4-5-6-7-8-10-28(39-2)33(47)35(49)41-30(23-44)37(51)43-20-9-11-31(43)34(48)40-29(21-24-12-16-26(45)17-13-24)36(50)42(3)32(38(52)53)22-25-14-18-27(46)19-15-25/h12-19,28-33,39,44-47H,4-11,20-23H2,1-3H3,(H,40,48)(H,41,49)(H,52,53)",VYJQKLBLZQMFCB-UHFFFAOYSA-N,146684929,no,n.a.,n.a.,n.a.
CyanoMetDB_0977,Microginin FR4,,Microginin,,C38H55N5O10,741.394893,O[C@H]([C@H](CCCCCCC)NC)C(N[C@H]([C@@H](C)O)C(N1CCC[C@@H]1C(N[C@@H](CC2=CC=C(C=C2)O)C(N[C@@H](C(O)=O)CC3=CC=C(C=C3)O)=O)=O)=O)=O,"InChI=1S/C38H55N5O10/c1-4-5-6-7-8-10-28(39-3)33(47)36(50)42-32(23(2)44)37(51)43-20-9-11-31(43)35(49)40-29(21-24-12-16-26(45)17-13-24)34(48)41-30(38(52)53)22-25-14-18-27(46)19-15-25/h12-19,23,28-33,39,44-47H,4-11,20-22H2,1-3H3,(H,40,49)(H,41,48)(H,42,50)(H,52,53)/t23-,28+,29-,30-,31-,32?,33-/m0/s1",UJVLZLPEXZJNMA-BZQGRHKVSA-N,146683790,yes,n.a.,n.a.,n.a.
CyanoMetDB_0978,Carbamidocyclophane B,,other cyclic non-peptide,"Carbamidocyclophane, Cyclophane",C38H55Cl3N2O8,772.3023998,C[C@H]1CCCCC(C2=C(C=C(C=C2O)[C@@H]([C@H](CCCCC(C3=C(C=C([C@@H]1OC(=O)N)C=C3O)O)CCCC(Cl)Cl)C)OC(=O)N)O)CCCCCl,"InChI=1S/C38H55Cl3N2O8/c1-22-10-3-5-12-24(14-7-8-17-39)33-28(44)18-26(19-29(33)45)35(50-37(42)48)23(2)11-4-6-13-25(15-9-16-32(40)41)34-30(46)20-27(21-31(34)47)36(22)51-38(43)49/h18-25,32,35-36,44-47H,3-17H2,1-2H3,(H2,42,48)(H2,43,49)/t22-,23-,24?,25?,35+,36+/m0/s1",PXEFELGJKKNAPC-BSSQUUOISA-N,16215903,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0979,Lyngbyabellin D,,other linear non-peptide,Peptolide,C38H55Cl2N3O13S2,895.2553366,CCCC(=O)N[C@H]([C@@H](CC(=O)OC[C@H](C1=NC(=CS1)C(=O)O[C@@H](CCCC(C)(Cl)Cl)[C@@H](C)C(=O)O[C@@H](C2=NC(=CS2)C(=O)OC)[C@](C)(CC)O)O)OC(=O)C)C(C)C,"InChI=1S/C38H55Cl2N3O13S2/c1-10-13-28(46)43-30(20(3)4)27(54-22(6)44)16-29(47)53-17-25(45)32-41-24(19-57-32)36(50)55-26(14-12-15-38(8,39)40)21(5)34(48)56-31(37(7,51)11-2)33-42-23(18-58-33)35(49)52-9/h18-21,25-27,30-31,45,51H,10-17H2,1-9H3,(H,43,46)/t21-,25-,26+,27-,30+,31+,37+/m1/s1",VDFRHOQVEAPBIB-JSFAYXRVSA-N,10930970,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_0980,Lyngbyabellin F,,other linear non-peptide,Peptolide,C38H55Cl2N3O13S2,895.2553366,CCCC(=O)N[C@@H](CC(C)C)[C@@H](CC(=O)OC[C@H](C1=NC(=CS1)C(=O)O[C@@H](CCCC(C)(Cl)Cl)[C@H](C)C(=O)O[C@H](C2=NC(=CS2)C(=O)OC)C(C)(C)O)O)OC(=O)C,"InChI=1S/C38H55Cl2N3O13S2/c1-10-12-29(46)41-23(15-20(2)3)28(54-22(5)44)16-30(47)53-17-26(45)32-42-25(19-57-32)36(50)55-27(13-11-14-38(8,39)40)21(4)34(48)56-31(37(6,7)51)33-43-24(18-58-33)35(49)52-9/h18-21,23,26-28,31,45,51H,10-17H2,1-9H3,(H,41,46)/t21-,23-,26+,27-,28+,31+/m0/s1",UJOHOMHVFQPIEM-HPZYSZHWSA-N,11549705,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0981,Lyngbyabellin I,,other linear non-peptide,Peptolide,C38H55Cl2N3O12S2,879.260422,CCCC(=O)N[C@@H](CC(C)C)[C@@H](CC(=O)OC[C@H](C1=NC(=CS1)C(=O)O[C@@H](CCCC(C)(Cl)Cl)[C@H](C)C(=O)O[C@H](C2=NC(=CS2)C(=O)OC)C(C)C)O)OC(=O)C,"InChI=1S/C38H55Cl2N3O12S2/c1-10-12-30(46)41-24(15-20(2)3)29(53-23(7)44)16-31(47)52-17-27(45)33-42-26(19-56-33)37(50)54-28(13-11-14-38(8,39)40)22(6)35(48)55-32(21(4)5)34-43-25(18-57-34)36(49)51-9/h18-22,24,27-29,32,45H,10-17H2,1-9H3,(H,41,46)/t22-,24-,27+,28-,29+,32-/m0/s1",YUYKAWWLMZGIMI-AVOCOOMJSA-N,11556973,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_0982,Carbamidocyclophane P,,other cyclic non-peptide,Cyclophane,C38H55Br3N2O8,904.150856,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1OC(=O)N)C=C3O)O)CCCC(Br)Br)C)OC(=O)N)O)CCCCBr,"InChI=1S/C38H55Br3N2O8/c1-22-10-3-5-12-24(14-7-8-17-39)33-28(44)18-26(19-29(33)45)35(50-37(42)48)23(2)11-4-6-13-25(15-9-16-32(40)41)34-30(46)20-27(21-31(34)47)36(22)51-38(43)49/h18-25,32,35-36,44-47H,3-17H2,1-2H3,(H2,42,48)(H2,43,49)/t22-,23-,24+,25+,35+,36+/m0/s1",CXYLXULFSYHSRC-IULTZZOBSA-N,139590353,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_0983,Carbamidocyclophane A,,other cyclic non-peptide,"Carbamidocyclophane, Cyclophane",C38H54Cl4N2O8,806.2634275,C[C@H]1CCCCC(C2=C(C=C(C=C2O)[C@@H]([C@H](CCCCC(C3=C(C=C([C@@H]1OC(=O)N)C=C3O)O)CCCC(Cl)Cl)C)OC(=O)N)O)CCCC(Cl)Cl,"InChI=1S/C38H54Cl4N2O8/c1-21-9-3-5-11-23(13-7-15-31(39)40)34-29(47)19-26(20-30(34)48)36(52-38(44)50)22(2)10-4-6-12-24(14-8-16-32(41)42)33-27(45)17-25(18-28(33)46)35(21)51-37(43)49/h17-24,31-32,35-36,45-48H,3-16H2,1-2H3,(H2,43,49)(H2,44,50)/t21-,22-,23?,24?,35+,36+/m0/s1",KQQDTKLGLAIGOF-TXPPAELQSA-N,16215902,yes,Nostoc,n.a.,CAVN 10
CyanoMetDB_0984,Carbamidocyclophane Q,,other cyclic non-peptide,Cyclophane,C38H54Br4N2O8,982.061369,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1OC(=O)N)C=C3O)O)CCCC(Br)Br)C)OC(=O)N)O)CCCC(Br)Br,"InChI=1S/C38H54Br4N2O8/c1-21-9-3-5-11-23(13-7-15-31(39)40)34-29(47)19-26(20-30(34)48)36(52-38(44)50)22(2)10-4-6-12-24(14-8-16-32(41)42)33-27(45)17-25(18-28(33)46)35(21)51-37(43)49/h17-24,31-32,35-36,45-48H,3-16H2,1-2H3,(H2,43,49)(H2,44,50)/t21-,22-,23+,24+,35+,36+/m0/s1",OHWUDMVJYPQYDU-PLKRWIMUSA-N,139590354,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_0985,Wainunuamide,,other cyclic peptide,Cyanobactine,C38H51N9O7,745.39115,O=C(N1[C@H](C(NCC2=O)=O)CCC1)[C@H](CCC3)N3C([C@@H](NC([C@@H]4CCCN4C([C@H](CC5=CC=CC=C5)NC([C@@H](N2)CC(C)C)=O)=O)=O)CC6=CNC=N6)=O,"InChI=1S/C38H51N9O7/c1-23(2)17-26-33(49)43-27(18-24-9-4-3-5-10-24)36(52)45-14-7-12-30(45)35(51)44-28(19-25-20-39-22-41-25)37(53)47-16-8-13-31(47)38(54)46-15-6-11-29(46)34(50)40-21-32(48)42-26/h3-5,9-10,20,22-23,26-31H,6-8,11-19,21H2,1-2H3,(H,39,41)(H,40,50)(H,42,48)(H,43,49)(H,44,51)/t26-,27-,28-,29-,30-,31-/m0/s1",FPXIHDRBZNLDSM-HPMAGDRPSA-N,11967081,yes,n.a.,n.a.,n.a.
CyanoMetDB_0986,Cryptophycin 309,,Cryptophycin,,C38H49Cl2N3O9,761.2845856,CC1CNC(=O)C(NC(=O)C=CCC(OC(=O)C(OC1=O)CC(C)(C)C)C(C)C(C(C2=CC=CC=C2)Cl)OC(=O)CN)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C38H49Cl2N3O9/c1-22-21-42-35(46)27(18-24-15-16-29(49-6)26(39)17-24)43-31(44)14-10-13-28(50-37(48)30(51-36(22)47)19-38(3,4)5)23(2)34(52-32(45)20-41)33(40)25-11-8-7-9-12-25/h7-12,14-17,22-23,27-28,30,33-34H,13,18-21,41H2,1-6H3,(H,42,46)(H,43,44)/b14-10+/t22-,23+,27-,28+,30+,33+,34-/m1/s1",BQNYKEYUFWVGDV-XMERVSSLSA-N,12989712,yes,n.a.,n.a.,n.a.
CyanoMetDB_0987,Patellamide D,,other linear non-peptide,,C38H48N8O6S2,776.3138236,CC[C@H](C)[C@H]1C2=N[C@@H]([C@H](O2)C)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=N[C@@H]([C@H](O4)C)C(=O)N[C@@H](C5=NC(=CS5)C(=O)N1)C)[C@@H](C)CC)CC6=CC=CC=C6,"InChI=1S/C38H48N8O6S2/c1-8-18(3)27-35-45-29(21(6)51-35)33(49)39-20(5)37-41-25(16-53-37)31(47)43-28(19(4)9-2)36-46-30(22(7)52-36)34(50)40-24(15-23-13-11-10-12-14-23)38-42-26(17-54-38)32(48)44-27/h10-14,16-22,24,27-30H,8-9,15H2,1-7H3,(H,39,49)(H,40,50)(H,43,47)(H,44,48)/t18-,19-,20+,21+,22+,24+,27-,28-,29-,30-/m0/s1",HZUISCIYFHWTKA-WLCQTKGUSA-N,149086,yes,n.a.,n.a.,n.a.
CyanoMetDB_0988,Tolyporphin B,,other cyclic non-peptide,porphyrins,C38H44N4O9,700.310829,CC1C(CC(C(O1)C2(C3=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C6C(=CC(=CC(=N3)C2=O)N6)C)(C)C7C(CC(C(O7)C)O)OC(=O)C)C)C)O)O,"InChI=1S/C38H44N4O9/c1-16-9-22-11-31-37(6,35-29(46)14-27(44)18(3)49-35)33(47)25(41-31)10-21-8-17(2)24(39-21)13-32-38(7,34(48)26(42-32)12-23(16)40-22)36-30(51-20(5)43)15-28(45)19(4)50-36/h8-13,18-19,27-30,35-36,39-40,44-46H,14-15H2,1-7H3",LXLDOKHNFJEFAC-UHFFFAOYSA-N,73092035,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_0989,Tolyporphin C,,other cyclic non-peptide,porphyrins,C38H44N4O9,700.310829,CC1C(CC(C(O1)C2(C3=NC(=CC4=C(C=C(N4)C=C5C(C(=O)C(=N5)C=C6C=C(C(=C3)N6)C)(C)C7C(CC(C(O7)C)O)OC(=O)C)C)C2=O)C)O)O,"InChI=1S/C38H44N4O9/c1-16-9-22-11-31-38(7,36-30(51-20(5)43)15-28(45)19(4)50-36)33(47)25(41-31)10-21-8-17(2)24(39-21)13-32-37(6,34(48)26(42-32)12-23(16)40-22)35-29(46)14-27(44)18(3)49-35/h8-13,18-19,27-30,35-36,39-40,44-46H,14-15H2,1-7H3",SZACMGUKZJAHEE-UHFFFAOYSA-N,85084151,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_0990,Almiramide F,,other linear peptide,Carmabin,C37H66N6O7,706.4992985,C[C@H](CCCCC#C[H])C(N([C@H](C(N([C@H](C(N[C@H](C(N([C@H](C(N[C@H](C(N)=O)CO)=O)[C@H](C)CC)C)=O)[C@H](C)CC)=O)C(C)C)C)=O)C(C)C)C)=O,"InChI=1S/C37H66N6O7/c1-14-17-18-19-20-26(10)35(48)42(12)30(23(6)7)37(50)41(11)29(22(4)5)33(46)40-28(24(8)15-2)36(49)43(13)31(25(9)16-3)34(47)39-27(21-44)32(38)45/h1,22-31,44H,15-21H2,2-13H3,(H2,38,45)(H,39,47)(H,40,46)/t24-,25-,26-,27+,28+,29+,30+,31+/m1/s1",OZHOGVIXTZUCBE-DCJDAKHGSA-N,146683794,No,Oscillatoria,nigroviridis,n.a.
CyanoMetDB_0991,Almiramide D,,other linear peptide,Carmabin,C37H66N6O6,690.5043839,C[C@H](CCCCC#C[H])C(N([C@H](C(N([C@H](C(N[C@H](C(N([C@H](C(N[C@H](C(N)=O)C)=O)[C@H](C)CC)C)=O)[C@H](C)CC)=O)C(C)C)C)=O)C(C)C)C)=O,"InChI=1S/C37H66N6O6/c1-15-18-19-20-21-26(10)35(47)42(13)30(23(6)7)37(49)41(12)29(22(4)5)33(45)40-28(24(8)16-2)36(48)43(14)31(25(9)17-3)34(46)39-27(11)32(38)44/h1,22-31H,16-21H2,2-14H3,(H2,38,44)(H,39,46)(H,40,45)/t24-,25-,26-,27+,28+,29+,30+,31+/m1/s1",NMCPLXDFOONXSK-DCJDAKHGSA-N,146683795,yes,Oscillatoria,nigroviridis,n.a.
CyanoMetDB_0992,Veraguamide I,,other cyclic peptide,Trungapeptin,C37H64N4O8,692.472415,CCCCC[C@H]1[C@@H](C)C(N[C@H](C(C)C)C(N(C)[C@H](C(C)C)C(O[C@H]([C@@H](CC)C)C(N2CCC[C@@H]2C(N(C)[C@H](C(C)C)C(O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C37H64N4O8/c1-13-15-16-19-27-25(10)32(42)38-28(21(3)4)34(44)40(12)30(23(7)8)37(47)49-31(24(9)14-2)35(45)41-20-17-18-26(41)33(43)39(11)29(22(5)6)36(46)48-27/h21-31H,13-20H2,1-12H3,(H,38,42)",DOBIBZDFHDCVHA-UHFFFAOYSA-N,75995949,yes,Oscillatoria/Planktothrix,margaritifera,n.a.
CyanoMetDB_0993,Bartoloside F,,other linear non-peptide,Bartoloside,C37H64Cl2O6,674.4079952,CCCCCCCCC(CCCCCC1=CC(=C(C(=C1)O[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCC(CCCCCC)Cl)O)Cl,"InChI=1S/C37H64Cl2O6/c1-3-5-7-9-10-15-21-30(39)22-16-11-13-19-28-25-32(40)31(24-18-12-17-23-29(38)20-14-8-6-4-2)34(26-28)45-37-36(43)35(42)33(41)27-44-37/h25-26,29-30,33,35-37,40-43H,3-24,27H2,1-2H3/t29?,30?,33-,35+,36-,37+/m1/s1",IWIZOMWAHIZTOM-ZQWJTRQNSA-N,132582909,yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_0994,Desacetylmicrocolin B,,other linear peptide,,C37H63N5O7,689.4727494,CCCC[C@@H](C)C[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N2[C@H](C=CC2=O)C,"InChI=1S/C37H63N5O7/c1-12-13-15-24(6)21-25(7)34(46)39(10)29(20-22(2)3)33(45)38-31(27(9)43)36(48)40(11)32(23(4)5)37(49)41-19-14-16-28(41)35(47)42-26(8)17-18-30(42)44/h17-18,22-29,31-32,43H,12-16,19-21H2,1-11H3,(H,38,45)/t24-,25-,26+,27-,28+,29+,31+,32+/m1/s1",LMOADMWPBSXHHB-CRVYFHMBSA-N,10532657,yes,Lyngbya,polychroa,n.a.
CyanoMetDB_0995,Veraguamide G,,other cyclic peptide,Trungapeptin,C37H62N4O8,690.456765,CC[C@H](C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C(C)C)C)C(C)C)C)CCCC=C)C(C)C)C,"InChI=1S/C37H62N4O8/c1-13-15-16-19-27-25(10)32(42)38-28(21(3)4)34(44)40(12)30(23(7)8)37(47)49-31(24(9)14-2)35(45)41-20-17-18-26(41)33(43)39(11)29(22(5)6)36(46)48-27/h13,21-31H,1,14-20H2,2-12H3,(H,38,42)/t24-,25-,26-,27+,28-,29-,30-,31-/m0/s1",DUFQJKUNMNJPAD-AVCHBABLSA-N,53355453,yes,Symploca,hydnoides,n.a.
CyanoMetDB_0996,Hoiamide C,,other linear non-peptide,,C37H62N4O7S3,770.3780639,CCC[C@@H](C)[C@@H]([C@H](C)[C@H]([C@@H](C)[C@H](CC1=NC(=CS1)C2=N[C@@](CS2)(C)C3=N[C@@](CS3)(C)C(=O)N[C@@H]([C@@H](C)CC)[C@H]([C@@H](C)C(=O)OCC)O)OC)O)O,"InChI=1S/C37H62N4O7S3/c1-12-15-21(5)29(42)23(7)30(43)22(6)26(47-11)16-27-38-25(17-49-27)32-40-37(10,19-50-32)35-41-36(9,18-51-35)34(46)39-28(20(4)13-2)31(44)24(8)33(45)48-14-3/h17,20-24,26,28-31,42-44H,12-16,18-19H2,1-11H3,(H,39,46)/t20-,21+,22-,23-,24+,26-,28-,29-,30-,31-,36+,37+/m0/s1",STGNMXQTWDOGSE-FUVSMVGWSA-N,46919101,yes,Symploca,n.a., PCC 8002
CyanoMetDB_0997,Microginin 91C,Microginin 91-C,Microginin,,C37H61N5O8,703.4520139,N[C@@H](CCCCCCC([H])[H])[C@@H](C(N[C@@H]([C@@H](C)CC)C(N(C)[C@H](CC(C)C)C(N1CCC[C@@H]1C(N[C@H](C(O)=O)CC2=CC=C(C=C2)O)=O)=O)=O)=O)O,"InChI=1S/C37H61N5O8/c1-7-9-10-11-12-14-27(38)32(44)34(46)40-31(24(5)8-2)36(48)41(6)30(21-23(3)4)35(47)42-20-13-15-29(42)33(45)39-28(37(49)50)22-25-16-18-26(43)19-17-25/h16-19,23-24,27-32,43-44H,7-15,20-22,38H2,1-6H3,(H,39,45)(H,40,46)(H,49,50)/t24-,27+,28-,29-,30-,31-,32+/m0/s1",ADNMWMDCUDFUHQ-GPRDHDTNSA-N,10259197,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_0998,Aeruginosin NOL6,,Aeruginosin,,C37H60N6O10,748.4370922,O=C(CCCCCCC)N[C@@H](CC1=CC=C(C=C1)O)C(N2[C@H](C(NC(CCCNC(N)=N)CO)=O)C[C@H]3[C@@H]2CC(CC3)OC4OC(C(C4O)O)CO)=O,"InChI=1S/C37H60N6O10/c1-2-3-4-5-6-9-31(47)42-27(17-22-10-13-25(46)14-11-22)35(51)43-28-19-26(52-36-33(49)32(48)30(21-45)53-36)15-12-23(28)18-29(43)34(50)41-24(20-44)8-7-16-40-37(38)39/h10-11,13-14,23-24,26-30,32-33,36,44-46,48-49H,2-9,12,15-21H2,1H3,(H,41,50)(H,42,47)(H4,38,39,40)/t23-,24?,26?,27-,28-,29-,30?,32?,33?,36?/m0/s1",CPAIOLGWYVYZPF-FAQOGLRESA-N,146683742,yes,Nodularia,spumigena,n.a.
CyanoMetDB_0999,Veraguamide C,,other cyclic peptide,Trungapeptin,C37H60N4O8,688.4411149,CC[C@H](C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C(C)C)C)C(C)C)C)CCCC#C)C(C)C)C,"InChI=1S/C37H60N4O8/c1-13-15-16-19-27-25(10)32(42)38-28(21(3)4)34(44)40(12)30(23(7)8)37(47)49-31(24(9)14-2)35(45)41-20-17-18-26(41)33(43)39(11)29(22(5)6)36(46)48-27/h1,21-31H,14-20H2,2-12H3,(H,38,42)/t24-,25-,26-,27+,28-,29-,30-,31-/m0/s1",DOTFUBBQWCBCSH-AVCHBABLSA-N,53355338,yes,Symploca,hydnoides,n.a.
CyanoMetDB_1000,Microginin 91D,Microginin 91-D,Microginin,,C37H60ClN5O8,737.4130416,N[C@@H](CCCCCCC(Cl)[H])[C@@H](C(N[C@@H]([C@@H](C)CC)C(N(C)[C@H](CC(C)C)C(N1CCC[C@@H]1C(N[C@H](C(O)=O)CC2=CC=C(C=C2)O)=O)=O)=O)=O)O,"InChI=1S/C37H60ClN5O8/c1-6-24(4)31(41-34(47)32(45)27(39)13-10-8-7-9-11-19-38)36(49)42(5)30(21-23(2)3)35(48)43-20-12-14-29(43)33(46)40-28(37(50)51)22-25-15-17-26(44)18-16-25/h15-18,23-24,27-32,44-45H,6-14,19-22,39H2,1-5H3,(H,40,46)(H,41,47)(H,50,51)/t24-,27+,28-,29-,30-,31-,32+/m0/s1",VERJLHWODWFYHF-GPRDHDTNSA-N,10485138,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_1001,Microginin 91E,Microginin 91-E,Microginin,,C37H59Cl2N5O8,771.3740693,N[C@@H](CCCCCCC(Cl)Cl)[C@@H](C(N[C@@H]([C@@H](C)CC)C(N(C)[C@H](CC(C)C)C(N1CCC[C@@H]1C(N[C@H](C(O)=O)CC2=CC=C(C=C2)O)=O)=O)=O)=O)O,"InChI=1S/C37H59Cl2N5O8/c1-6-23(4)31(42-34(48)32(46)26(40)12-9-7-8-10-14-30(38)39)36(50)43(5)29(20-22(2)3)35(49)44-19-11-13-28(44)33(47)41-27(37(51)52)21-24-15-17-25(45)18-16-24/h15-18,22-23,26-32,45-46H,6-14,19-21,40H2,1-5H3,(H,41,47)(H,42,48)(H,51,52)/t23-,26+,27-,28-,29-,31-,32+/m0/s1",AJANMHKQVWDPQL-PPLCFEHASA-N,,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_1002,Dragonamide A,35-epi-dragonamide,other linear peptide,Carmabin,C37H59N5O5,653.45162,C[C@@H](C(N([C@H](C(N([C@H](C(N([C@H](C(N([C@H](C(N)=O)CC1=CC=CC=C1)C)=O)C(C)C)C)=O)C(C)C)C)=O)C(C)C)C)=O)CCCCC#C,"InChI=1S/C37H59N5O5/c1-13-14-15-17-20-27(8)34(44)40(10)31(25(4)5)36(46)42(12)32(26(6)7)37(47)41(11)30(24(2)3)35(45)39(9)29(33(38)43)23-28-21-18-16-19-22-28/h1,16,18-19,21-22,24-27,29-32H,14-15,17,20,23H2,2-12H3,(H2,38,43)/t27-,29+,30+,31+,32+/m1/s1",LFBMRFDBJDFLTN-UGMRNKNYSA-N,10055075,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1003,Veraguamide A,,other cyclic peptide,Trungapeptin,C37H59BrN4O8,766.351628,CC[C@H](C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C(C)C)C)C(C)C)C)CCCC#CBr)C(C)C)C,"InChI=1S/C37H59BrN4O8/c1-12-24(8)31-35(46)42-20-16-17-26(42)33(44)40(10)29(22(4)5)36(47)49-27(18-14-13-15-19-38)25(9)32(43)39-28(21(2)3)34(45)41(11)30(23(6)7)37(48)50-31/h21-31H,12-14,16-18,20H2,1-11H3,(H,39,43)/t24-,25-,26-,27+,28-,29-,30-,31-/m0/s1",WWYBIFCBAWCPFI-AVCHBABLSA-N,53355336,yes,Oscillatoria/Planktothrix,margaritifera,n.a.
CyanoMetDB_1004,Aeruginosin NAL4,,Aeruginosin,,C37H58N6O10,746.4214421,O=C(CCCCCCC)N[C@@H](CC1=CC=C(C=C1)O)C(N2[C@H](C(NC(CCCNC(N)=N)C=O)=O)C[C@H]3[C@@H]2CC(CC3)OC4OC(C(C4O)O)CO)=O,"InChI=1S/C37H58N6O10/c1-2-3-4-5-6-9-31(47)42-27(17-22-10-13-25(46)14-11-22)35(51)43-28-19-26(52-36-33(49)32(48)30(21-45)53-36)15-12-23(28)18-29(43)34(50)41-24(20-44)8-7-16-40-37(38)39/h10-11,13-14,20,23-24,26-30,32-33,36,45-46,48-49H,2-9,12,15-19,21H2,1H3,(H,41,50)(H,42,47)(H4,38,39,40)/t23-,24?,26?,27-,28-,29-,30?,32?,33?,36?/m0/s1",KCMPXGXUUZANFE-FAQOGLRESA-N,146683743,yes,Nodularia,spumigena,n.a.
CyanoMetDB_1005,Dragonamide E,,other linear peptide,Carmabin,C37H57N5O5,651.43597,CC(C)[C@@H](C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)/C(=C/CCCC#C)/C,"InChI=1S/C37H57N5O5/c1-13-14-15-17-20-27(8)34(44)40(10)31(25(4)5)36(46)42(12)32(26(6)7)37(47)41(11)30(24(2)3)35(45)39(9)29(33(38)43)23-28-21-18-16-19-22-28/h1,16,18-22,24-26,29-32H,14-15,17,23H2,2-12H3,(H2,38,43)/b27-20+/t29-,30-,31-,32-/m0/s1",CWZFOUVOKBTZQE-BWDCGURESA-N,44627610,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1006,Nostocyclopeptide A1,,other cyclic peptide,,C37H56N8O9,756.4170254,CC[C@@H]([C@H]1C(N[C@@H](CO)C(N2C[C@@H](C)C[C@H]2C(N[C@@H](CC(C)C)/C([H])=N/[C@@H](CC3=CC=C(O)C=C3)C(NCC(N[C@H](CCC(N)=O)C(N1)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C37H56N8O9/c1-6-22(5)32-36(53)43-28(19-46)37(54)45-18-21(4)14-29(45)35(52)41-24(13-20(2)3)16-39-27(15-23-7-9-25(47)10-8-23)33(50)40-17-31(49)42-26(34(51)44-32)11-12-30(38)48/h7-10,16,20-22,24,26-29,32,46-47H,6,11-15,17-19H2,1-5H3,(H2,38,48)(H,40,50)(H,41,52)(H,42,49)(H,43,53)(H,44,51)/b39-16+/t21-,22-,24-,26+,27-,28-,29-,32-/m0/s1",TZHROWIOAVYSMP-DOPKCXIESA-N,,yes,Nostoc,n.a.,ATCC 53789
CyanoMetDB_1007,Carbamidocyclophane R,,other cyclic non-peptide,Cyclophane,C37H56BrNO7,705.324016,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCCBr)C(=C2)O)O)O)C,"InChI=1S/C37H56BrNO7/c1-4-5-14-25-15-8-6-12-23(2)35(44)27-19-29(40)34(30(41)20-27)26(17-10-11-18-38)16-9-7-13-24(3)36(46-37(39)45)28-21-31(42)33(25)32(43)22-28/h19-26,35-36,40-44H,4-18H2,1-3H3,(H2,39,45)/t23-,24-,25-,26+,35+,36+/m0/s1",ABRCNJSDUYUPRX-YXTQZPCGSA-N,139590355,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_1008,Microginin 713,"Microginin 713A, Microginin",Microginin,,C37H55N5O9,713.3999784,CCCCCCCC(C(C(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)O)O)N,"InChI=1S/C37H55N5O9/c1-6-7-8-9-10-11-28(38)32(45)35(48)39-23(4)33(46)41-31(22(2)3)36(49)42(5)30(21-25-14-18-27(44)19-15-25)34(47)40-29(37(50)51)20-24-12-16-26(43)17-13-24/h12-19,22-23,28-32,43-45H,6-11,20-21,38H2,1-5H3,(H,39,48)(H,40,47)(H,41,46)(H,50,51)/t23-,28?,29-,30-,31-,32?/m0/s1",KPCUJSJUCHBAJR-UIDDANAXSA-N,139587209,yes,Microcystis,aeruginosa,NIES 100
CyanoMetDB_1009,Lyngbyapeptin A,,other linear peptide,Lyngbya toxin,C37H55N5O6S,697.3873057,CCC(C)C(C(=O)N1CCCC1C2=NC=CS2)N(C)C(=O)C(CC(C)C)N(C)C(=O)C(CC3=CC=C(C=C3)OC)N(C)C(=O)/C=C(\C)/OC,"InChI=1S/C37H55N5O6S/c1-11-25(4)33(37(46)42-19-12-13-29(42)34-38-18-20-49-34)41(8)36(45)30(21-24(2)3)40(7)35(44)31(39(6)32(43)22-26(5)47-9)23-27-14-16-28(48-10)17-15-27/h14-18,20,22,24-25,29-31,33H,11-13,19,21,23H2,1-10H3/b26-22+",HTBQLUDZPAANPB-XTCLZLMSSA-N,21775293,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1010,Microginin 729,,Microginin,,C37H55N5O10,729.394893,CCCCCCCC(C(C(NC(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)CC2=CC=C(O)C=C2)=O)C(C)C)=O)CO)=O)O)N,"InChI=1S/C37H55N5O10/c1-5-6-7-8-9-10-27(38)32(46)35(49)40-29(21-43)33(47)41-31(22(2)3)36(50)42(4)30(20-24-13-17-26(45)18-14-24)34(48)39-28(37(51)52)19-23-11-15-25(44)16-12-23/h11-18,22,27-32,43-46H,5-10,19-21,38H2,1-4H3,(H,39,48)(H,40,49)(H,41,47)(H,51,52)",XSFWUQAXHYZUPF-UHFFFAOYSA-N,146684930,no,n.a.,n.a.,n.a.
CyanoMetDB_1011,Carbamidocyclophane S,,other cyclic non-peptide,Cyclophane,C37H55Br2NO7,783.234529,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)N)C)CCCC(Br)Br)C(=C2)O)O)O)C,"InChI=1S/C37H55Br2NO7/c1-4-5-13-24-14-8-6-11-22(2)35(45)26-18-28(41)34(29(42)19-26)25(16-10-17-32(38)39)15-9-7-12-23(3)36(47-37(40)46)27-20-30(43)33(24)31(44)21-27/h18-25,32,35-36,41-45H,4-17H2,1-3H3,(H2,40,46)/t22-,23-,24-,25+,35+,36+/m0/s1",LVFPFIWBRYXLNE-CCNIBDGSSA-N,139590356,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_1012,Microginin 747B,,Microginin,,C37H54ClN5O9,747.361006,NC(C(C(NC(C(NC(C(N(C)C(CC1=CC=C(O)C=C1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)C(C)C)=O)C)=O)O)CCCCCCCCl,"InChI=1S/C37H54ClN5O9/c1-22(2)31(42-33(47)23(3)40-35(49)32(46)28(39)10-8-6-5-7-9-19-38)36(50)43(4)30(21-25-13-17-27(45)18-14-25)34(48)41-29(37(51)52)20-24-11-15-26(44)16-12-24/h11-18,22-23,28-32,44-46H,5-10,19-21,39H2,1-4H3,(H,40,49)(H,41,48)(H,42,47)(H,51,52)",SKVUFSAOYWVJAQ-UHFFFAOYSA-N,146684931,no,n.a.,n.a.,n.a.
CyanoMetDB_1013,Microginin 715,,Microginin,,C37H54ClN5O7,715.3711768,O=C(N1C(C(NC(C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)CC3=CC=C(O)C=C3)=O)CCC1)C(C(C)C)NCC(CCCCCCCCl)N,"InChI=1S/C37H54ClN5O7/c1-24(2)33(40-23-27(39)9-6-4-3-5-7-19-38)36(48)43-20-8-10-32(43)35(47)41-30(21-25-11-15-28(44)16-12-25)34(46)42-31(37(49)50)22-26-13-17-29(45)18-14-26/h11-18,24,27,30-33,40,44-45H,3-10,19-23,39H2,1-2H3,(H,41,47)(H,42,46)(H,49,50)",DQFXPMMPHQQNFQ-UHFFFAOYSA-N,146684932,no,n.a.,n.a.,n.a.
CyanoMetDB_1014,Carbamidocyclophane T,,other cyclic non-peptide,Cyclophane,C37H54Br3NO7,861.145042,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1O)C=C3O)O)CCCC(Br)Br)C)OC(=O)N)O)CCCCBr,"InChI=1S/C37H54Br3NO7/c1-22-10-3-5-12-24(14-7-8-17-38)33-30(44)20-27(21-31(33)45)36(48-37(41)47)23(2)11-4-6-13-25(15-9-16-32(39)40)34-28(42)18-26(35(22)46)19-29(34)43/h18-25,32,35-36,42-46H,3-17H2,1-2H3,(H2,41,47)/t22-,23-,24+,25+,35+,36+/m0/s1",RSYMSFYFRRTHOX-IULTZZOBSA-N,139590357,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_1015,Microginin FR3,,Microginin,,C37H53N5O10,727.3792429,O[C@H]([C@H](CCCCCCC)N)C(N[C@H]([C@@H](C)O)C(N1CCC[C@@H]1C(N[C@@H](CC2=CC=C(C=C2)O)C(N[C@@H](C(O)=O)CC3=CC=C(C=C3)O)=O)=O)=O)=O,"InChI=1S/C37H53N5O10/c1-3-4-5-6-7-9-27(38)32(46)35(49)41-31(22(2)43)36(50)42-19-8-10-30(42)34(48)39-28(20-23-11-15-25(44)16-12-23)33(47)40-29(37(51)52)21-24-13-17-26(45)18-14-24/h11-18,22,27-32,43-46H,3-10,19-21,38H2,1-2H3,(H,39,48)(H,40,47)(H,41,49)(H,51,52)/t22-,27+,28-,29-,30-,31?,32-/m0/s1",MQLHZIBESRENLM-WPTGQUBASA-N,146683791,yes,n.a.,n.a.,n.a.
CyanoMetDB_1016,Carbamidocyclophane F,,other cyclic non-peptide,"Carbamidocyclophane, Cyclophane",C37H53Cl4NO7,763.2576139,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1O)C=C3O)O)CCCC(Cl)Cl)C)OC(=O)N)O)CCCC(Cl)Cl,"InChI=1S/C37H53Cl4NO7/c1-21-9-3-5-11-24(14-8-16-32(40)41)34-29(45)19-26(20-30(34)46)36(49-37(42)48)22(2)10-4-6-12-23(13-7-15-31(38)39)33-27(43)17-25(35(21)47)18-28(33)44/h17-24,31-32,35-36,43-47H,3-16H2,1-2H3,(H2,42,48)/t21-,22-,23+,24+,35+,36+/m0/s1",LOIXDLJXZACZEY-PLKRWIMUSA-N,102126547,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1017,Carbamidocyclophane U,,other cyclic non-peptide,Cyclophane,C37H53Br4NO7,939.055555,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1O)C=C3O)O)CCCC(Br)Br)C)OC(=O)N)O)CCCC(Br)Br,"InChI=1S/C37H53Br4NO7/c1-21-9-3-5-11-24(14-8-16-32(40)41)34-29(45)19-26(20-30(34)46)36(49-37(42)48)22(2)10-4-6-12-23(13-7-15-31(38)39)33-27(43)17-25(35(21)47)18-28(33)44/h17-24,31-32,35-36,43-47H,3-16H2,1-2H3,(H2,42,48)/t21-,22-,23+,24+,35+,36+/m0/s1",IUDYVLGONCYFPN-PLKRWIMUSA-N,139590358,yes,Nostoc,n.a.,CAVN2
CyanoMetDB_1018,Aeruginosin KB676,,Aeruginosin,,C37H52N6O6,676.3948334,OC1=CC=C(C[C@H](C(N[C@@H](C(N2[C@H](C(NCCCCN(C/C=C(C)/C)C(N)=N)=O)C[C@H]3[C@@H]2C[C@@H](O)CC3)=O)CC4=CC=CC=C4)=O)O)C=C1,"InChI=1S/C37H52N6O6/c1-24(2)16-19-42(37(38)39)18-7-6-17-40-34(47)32-22-27-12-15-29(45)23-31(27)43(32)36(49)30(20-25-8-4-3-5-9-25)41-35(48)33(46)21-26-10-13-28(44)14-11-26/h3-5,8-11,13-14,16,27,29-33,44-46H,6-7,12,15,17-23H2,1-2H3,(H3,38,39)(H,40,47)(H,41,48)/t27-,29-,30+,31-,32-,33+/m0/s1",VUIOUJILJQINJJ-VDVPGJEISA-N,146683772,yes,n.a.,n.a.,n.a.
CyanoMetDB_1019,Microginin 761B,,Microginin,,C37H52ClN5O10,761.3402706,NC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(NC(C(O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)C(C)O)=O)O)CCCCCCCCl,"InChI=1S/C37H52ClN5O10/c1-22(44)31(42-35(50)32(47)27(39)8-5-3-2-4-6-18-38)36(51)43-19-7-9-30(43)34(49)40-28(20-23-10-14-25(45)15-11-23)33(48)41-29(37(52)53)21-24-12-16-26(46)17-13-24/h10-17,22,27-32,44-47H,2-9,18-21,39H2,1H3,(H,40,49)(H,41,48)(H,42,50)(H,52,53)",NWKXLGDOMIUDOE-UHFFFAOYSA-N,146684933,no,n.a.,n.a.,n.a.
CyanoMetDB_1020,Dragomabin,,other linear peptide,Carmabin,C37H51N5O6,661.3839344,C[C@@H](CCCCC#C)C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](C)C(=O)N(C)[C@@H](C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N,"InChI=1S/C37H51N5O6/c1-9-10-11-13-16-25(2)35(45)42(7)32(24-28-17-14-12-15-18-28)34(44)39-26(3)36(46)40(5)27(4)37(47)41(6)31(33(38)43)23-29-19-21-30(48-8)22-20-29/h1,12,14-15,17-22,25-27,31-32H,10-11,13,16,23-24H2,2-8H3,(H2,38,43)(H,39,44)/t25-,26-,27-,31-,32-/m0/s1",JAYHQHZOWYDLDQ-PONGSQKHSA-N,16737469,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1021,Lyngbyabellin J,,Cyclamide,Peptolide,C37H51Cl2N3O12S2,863.2291218,CCCC(=O)N[C@H]([C@@H](CC(=O)O[C@@H]1COC(=O)C2=CSC(=N2)[C@H](OC(=O)[C@H]([C@@H](OC(=O)C3=CSC1=N3)CCCC(C)(Cl)Cl)C)[C@](C)(CC)O)OC(=O)C)C(C)C,"InChI=1S/C37H51Cl2N3O12S2/c1-9-12-27(44)42-29(19(3)4)25(51-21(6)43)15-28(45)52-26-16-50-34(47)22-17-56-32(41-22)30(36(7,49)10-2)54-33(46)20(5)24(13-11-14-37(8,38)39)53-35(48)23-18-55-31(26)40-23/h17-20,24-26,29-30,49H,9-16H2,1-8H3,(H,42,44)/t20-,24-,25+,26+,29-,30-,36-/m0/s1",PJUBBMCDPRNVHH-BQOOCNCZSA-N,46939789,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1022,Lyngbyabellin E,,Cyclamide,Peptolide,C37H51Cl2N3O12S2,863.2291218,CCCC(=O)N[C@@H](CC(C)C)[C@@H](CC(=O)O[C@@H]1COC(=O)C2=CSC(=N2)[C@@H](OC(=O)[C@H]([C@@H](OC(=O)C3=CSC1=N3)CCCC(C)(Cl)Cl)C)C(C)(C)O)OC(=O)C,"InChI=1S/C37H51Cl2N3O12S2/c1-9-11-28(44)40-22(14-19(2)3)26(51-21(5)43)15-29(45)52-27-16-50-34(47)23-17-56-32(42-23)30(36(6,7)49)54-33(46)20(4)25(12-10-13-37(8,38)39)53-35(48)24-18-55-31(27)41-24/h17-20,22,25-27,30,49H,9-16H2,1-8H3,(H,40,44)/t20-,22-,25-,26+,27+,30+/m0/s1",UQKCUAHEIXPDOS-GCKMHMQYSA-N,11622047,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1023,Lyngbyabellin H,,Cyclamide,Peptolide,C37H51Cl2N3O11S2,847.2342072,CCCC(=O)N[C@@H](CC(C)C)[C@@H](CC(=O)O[C@@H]1COC(=O)C2=CSC(=N2)[C@@H](OC(=O)[C@H]([C@@H](OC(=O)C3=CSC1=N3)CCCC(C)(Cl)Cl)C)C(C)C)OC(=O)C,"InChI=1S/C37H51Cl2N3O11S2/c1-9-11-29(44)40-23(14-19(2)3)27(50-22(7)43)15-30(45)51-28-16-49-35(47)24-17-55-33(42-24)31(20(4)5)53-34(46)21(6)26(12-10-13-37(8,38)39)52-36(48)25-18-54-32(28)41-25/h17-21,23,26-28,31H,9-16H2,1-8H3,(H,40,44)/t21-,23-,26-,27+,28+,31-/m0/s1",ITOVGLCUPKAIBT-YORCCMEASA-N,11585973,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1024,Almiramide E,,other linear peptide,Carmabin,C36H64N6O6,676.4887338,C[C@H](CCCCC#C[H])C(N([C@H](C(N[C@H](C(N[C@H](C(N([C@H](C(N[C@H](C(N)=O)C)=O)[C@H](C)CC)C)=O)[C@H](C)CC)=O)C(C)C)=O)C(C)C)C)=O,"InChI=1S/C36H64N6O6/c1-14-17-18-19-20-25(10)35(47)41(12)29(22(6)7)33(45)39-27(21(4)5)32(44)40-28(23(8)15-2)36(48)42(13)30(24(9)16-3)34(46)38-26(11)31(37)43/h1,21-30H,15-20H2,2-13H3,(H2,37,43)(H,38,46)(H,39,45)(H,40,44)/t23-,24-,25-,26+,27+,28+,29+,30+/m1/s1",KQSQXKSUNVGZND-RZJBPMIPSA-N,,No,Oscillatoria,nigroviridis,n.a.
CyanoMetDB_1025,Almiramide G,,other linear peptide,Carmabin,C36H64N6O6,676.4887338,C[C@H](CCCCC#C[H])C(N([C@H](C(N(C)[C@H](C(N[C@H](C(N([C@H](C(N[C@H](C(N)=O)C)=O)[C@H](C)CC)C)=O)C(C)C)=O)C(C)C)=O)C(C)C)C)=O,"InChI=1S/C36H64N6O6/c1-15-17-18-19-20-25(10)34(46)41(13)29(23(7)8)36(48)40(12)28(22(5)6)32(44)39-27(21(3)4)35(47)42(14)30(24(9)16-2)33(45)38-26(11)31(37)43/h1,21-30H,16-20H2,2-14H3,(H2,37,43)(H,38,45)(H,39,44)/t24-,25-,26+,27+,28+,29+,30+/m1/s1",WYBMPHZGMQSBQX-WKXXOEGVSA-N,146683797,No,Oscillatoria,nigroviridis,n.a.
CyanoMetDB_1026,Almiramide H,,other linear peptide,Carmabin,C36H64N6O6,676.4887338,C[C@H](CCCCC#C[H])C(N([C@H](C(N(C)[C@H](C(N[C@H](C(N([C@H](C(NCC(N)=O)=O)[C@H](C)CC)C)=O)[C@H](CC)C)=O)C(C)C)=O)C(C)C)C)=O,"InChI=1S/C36H64N6O6/c1-14-17-18-19-20-26(10)34(46)41(12)30(23(6)7)36(48)40(11)29(22(4)5)33(45)39-28(24(8)15-2)35(47)42(13)31(25(9)16-3)32(44)38-21-27(37)43/h1,22-26,28-31H,15-21H2,2-13H3,(H2,37,43)(H,38,44)(H,39,45)/t24-,25+,26+,28-,29-,30-,31-/m0/s1",WJHGYDMMCIISCQ-XLJOYULLSA-N,,No,Oscillatoria,nigroviridis,n.a.
CyanoMetDB_1027,Bartoloside G,,other linear non-peptide,Bartoloside,C36H63ClO6,626.4313174,CCCCCCCCCCCCCC1=CC(=C(C(=C1)O[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCC(CCCCCC)Cl)O,"InChI=1S/C36H63ClO6/c1-3-5-7-9-10-11-12-13-14-15-17-21-28-25-31(38)30(24-20-16-19-23-29(37)22-18-8-6-4-2)33(26-28)43-36-35(41)34(40)32(39)27-42-36/h25-26,29,32,34-36,38-41H,3-24,27H2,1-2H3/t29?,32-,34+,35-,36+/m1/s1",LZMVCENJBDTSPS-VFHZWBAFSA-N,132582910,yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_1028,Glucosylsucrose derivative 4,,other cyclic non-peptide,cyclodextrin,C36H62O31,990.3275052,C(C1[C@@H]([C@H]([C@](O1)(CO)OC2C(C(C(C(O2)CO)O)O)O[C@@H]3[C@H](C([C@@H](C(O3)CO)O)O)O[C@@H]4C(C([C@@H](C(O4)CO)O)O)O[C@@H]5[C@H](C([C@@H](C(O5)CO)O)O)O[C@@H]6C(C([C@@H](C(O6)CO)O)O)O)O)O)O,"InChI=1S/C36H62O31/c37-1-8-14(44)20(50)25(55)31(57-8)62-26-21(51)15(45)9(2-38)58-32(26)63-27-22(52)16(46)10(3-39)59-33(27)64-28-23(53)17(47)11(4-40)60-34(28)65-29-24(54)18(48)12(5-41)61-35(29)67-36(7-43)30(56)19(49)13(6-42)66-36/h8-35,37-56H,1-7H2/t8?,9?,10?,11?,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+/m1/s1",VKWVLHGKQXORNI-JIUNEZRZSA-N,139584025,yes,Nostoc,ellipsosporum,n.a.
CyanoMetDB_1029,Veraguamide J,,other cyclic peptide,Trungapeptin,C36H62N4O8,678.456765,CCCCC[C@H]1[C@@H](C)C(N[C@H](C(C)C)C(N(C)[C@H](C(C)C)C(OC(C(C)C)C(N2CCC[C@@H]2C(N(C)[C@H](C(C)C)C(O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C36H62N4O8/c1-13-14-15-18-26-24(10)31(41)37-27(20(2)3)33(43)39(12)29(22(6)7)36(46)48-30(23(8)9)34(44)40-19-16-17-25(40)32(42)38(11)28(21(4)5)35(45)47-26/h20-30H,13-19H2,1-12H3,(H,37,41)",VJYQPLSJYQMFHT-UHFFFAOYSA-N,53355788,yes,Oscillatoria/Planktothrix,margaritifera,n.a.
CyanoMetDB_1030,Janadolide,,other cyclic peptide,other cyclic depsipeptide,C36H61N5O7,675.4570993,C/C(CC[C@H]1C)=C\[C@@H](C(C)(C)C)OC([C@H](CC(C)C)N(C)C([C@H](C)N(C)C(CNC([C@H](C(C)C)NC([C@H]2N(C1=O)CCC2)=O)=O)=O)=O)=O,"InChI=1S/C36H61N5O7/c1-21(2)18-27-35(47)48-28(36(8,9)10)19-23(5)15-16-24(6)33(45)41-17-13-14-26(41)31(43)38-30(22(3)4)32(44)37-20-29(42)39(11)25(7)34(46)40(27)12/h19,21-22,24-28,30H,13-18,20H2,1-12H3,(H,37,44)(H,38,43)/b23-19+",NEGZFRNAAJQQEG-FCDQGJHFSA-N,,yes,Okeania,n.a.,n.a.
CyanoMetDB_1031,Bartoloside I,,other linear non-peptide,Bartoloside,C36H61Cl3O6,694.3533728,CCCCCCCC(CCCCCC1=CC(=C(C(=C1)O[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCC(CCCCCC)Cl)O)(Cl)Cl,"InChI=1S/C36H61Cl3O6/c1-3-5-7-9-16-22-36(38,39)23-17-11-12-18-27-24-30(40)29(21-15-10-14-20-28(37)19-13-8-6-4-2)32(25-27)45-35-34(43)33(42)31(41)26-44-35/h24-25,28,31,33-35,40-43H,3-23,26H2,1-2H3/t28?,31-,33+,34-,35+/m1/s1",LWFZKXMCJDHBNJ-SLKDEOFASA-N,132582914,yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_1032,Microginin 725,,Microginin,,C36H60ClN5O8,725.4130416,NC(C(C(NC(C(N(C)C(C(N(C)C(CC(C)C)C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)=O)CC(C)C)=O)C)=O)O)CCCCCCCCl,"InChI=1S/C36H60ClN5O8/c1-22(2)19-29(32(45)40-28(36(49)50)21-25-14-16-26(43)17-15-25)41(6)35(48)30(20-23(3)4)42(7)34(47)24(5)39-33(46)31(44)27(38)13-11-9-8-10-12-18-37/h14-17,22-24,27-31,43-44H,8-13,18-21,38H2,1-7H3,(H,39,46)(H,40,45)(H,49,50)",KKMPGXZFHNAKNE-UHFFFAOYSA-N,146684934,no,n.a.,n.a.,n.a.
CyanoMetDB_1033,Veraguamide H,,other cyclic peptide,Trungapeptin,C36H58N4O8,674.4254648,C[C@@H]1[C@H](CCCC#C)OC([C@@H](C(C)C)N(C)C([C@H]2CCCN2C([C@@H](C(C)C)OC([C@@H](C(C)C)N(C)C([C@@H](C(C)C)NC1=O)=O)=O)=O)=O)=O,"InChI=1S/C36H58N4O8/c1-13-14-15-18-26-24(10)31(41)37-27(20(2)3)33(43)39(12)29(22(6)7)36(46)48-30(23(8)9)34(44)40-19-16-17-25(40)32(42)38(11)28(21(4)5)35(45)47-26/h1,20-30H,14-19H2,2-12H3,(H,37,41)",ORNJUOMQOSTPOV-UHFFFAOYSA-N,53355787,yes,Oscillatoria/Planktothrix,margaritifera,n.a.
CyanoMetDB_1034,Caldoramide,,other linear peptide,Dolastatin-linear,C37H59N5O6,669.4465347,CN([C@H](C(N[C@H](C(N([C@H](C(N([C@H](C(N1C(C=C([C@@H]1CC2=CC=CC=C2)OC)=O)=O)[C@H](CC)C)C)=O)C(C)C)C)=O)C(C)C)=O)C(C)C)C,"InChI=1S/C37H59N5O6/c1-14-25(8)33(37(47)42-27(28(48-13)21-29(42)43)20-26-18-16-15-17-19-26)41(12)36(46)32(24(6)7)40(11)35(45)30(22(2)3)38-34(44)31(23(4)5)39(9)10/h15-19,21-25,27,30-33H,14,20H2,1-13H3,(H,38,44)/t25-,27-,30-,31-,32-,33-/m0/s1",MQACVRQXFMGXAV-VAJPBVADSA-N,134152487,yes,Caldora,penicillata,n.a.
CyanoMetDB_1035,Veraguamide B,,other cyclic peptide,Trungapeptin,C36H57BrN4O8,752.335978,C[C@H]1[C@H](OC(=O)[C@@H](N(C(=O)[C@@H]2CCCN2C(=O)[C@@H](OC(=O)[C@@H](N(C(=O)[C@@H](NC1=O)C(C)C)C)C(C)C)C(C)C)C)C(C)C)CCCC#CBr,"InChI=1S/C36H57BrN4O8/c1-20(2)27-33(44)40(11)29(22(5)6)36(47)49-30(23(7)8)34(45)41-19-15-16-25(41)32(43)39(10)28(21(3)4)35(46)48-26(17-13-12-14-18-37)24(9)31(42)38-27/h20-30H,12-13,15-17,19H2,1-11H3,(H,38,42)/t24-,25-,26+,27-,28-,29-,30-/m0/s1",UQYHDSHIIDYSSP-PYYGQVSISA-N,53355337,yes,Symploca,hydnoides,n.a.
CyanoMetDB_1036,Microginin 757B,,Microginin,,C36H57Cl2N5O8,757.3584192,OC(C(N1C(C(NC(C(C)C)C(N(C)C(CC(C)C)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)=O)CCC1)=O)C(N)CCCCCCC(Cl)Cl,"InChI=1S/C36H57Cl2N5O8/c1-21(2)19-28(33(47)40-26(36(50)51)20-23-14-16-24(44)17-15-23)42(5)34(48)30(22(3)4)41-32(46)27-12-10-18-43(27)35(49)31(45)25(39)11-8-6-7-9-13-29(37)38/h14-17,21-22,25-31,44-45H,6-13,18-20,39H2,1-5H3,(H,40,47)(H,41,46)(H,50,51)",ASZGJLSRMKWZDG-UHFFFAOYSA-N,146684935,no,n.a.,n.a.,n.a.
CyanoMetDB_1037,Microginin 299D,,Microginin,,C36H57Cl2N5O8,757.3584192,N[C@H](CCCCCCC(Cl)Cl)[C@H](C(N[C@@H](C(C)C)C(N([C@@H](C(C)C)C(N([C@H](CC1=CC=C(C=C1)O)C(N2[C@H](CCC2)C(O)=O)=O)C)=O)C)=O)=O)O,"InChI=1S/C36H57Cl2N5O8/c1-21(2)29(40-32(46)31(45)25(39)12-9-7-8-10-14-28(37)38)34(48)42(6)30(22(3)4)35(49)41(5)27(20-23-15-17-24(44)18-16-23)33(47)43-19-11-13-26(43)36(50)51/h15-18,21-22,25-31,44-45H,7-14,19-20,39H2,1-6H3,(H,40,46)(H,50,51)/t25-,26-,27-,29+,30+,31-/m1/s1",HTFQBZAJDJYYJL-AQDTXAMBSA-N,,yes,Microcystis,aeruginosa,NIES 299
CyanoMetDB_1038,Merocyclophane D,,other cyclic non-peptide,Cyclophane,C36H56O6,584.4076895,C[C@@H]1CCCCC[C@@H](C2=C(C=C(C=C2O)[C@@H](CCCCC[C@@H](C3=C(C=C1C=C3O)O)CCCCO)C)O)CCCCO,"InChI=1S/C36H56O6/c1-25-13-5-3-7-15-28(18-10-12-20-38)36-33(41)23-30(24-34(36)42)26(2)14-6-4-8-16-27(17-9-11-19-37)35-31(39)21-29(25)22-32(35)40/h21-28,37-42H,3-20H2,1-2H3/t25-,26-,27-,28-/m1/s1",CGYZQENMSDXRIW-BIYDSLDMSA-N,132967469,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1039,Merocyclophane C,,other cyclic non-peptide,Cyclophane,C36H56O5,568.4127749,CCCC[C@H]1CCCCC[C@H](C2=CC(=C([C@H](CCCCC[C@H](C3=CC(=C1C(=C3)O)O)C)CCCCO)C(=C2)O)O)C,"InChI=1S/C36H56O5/c1-4-5-16-27-17-10-6-8-14-26(3)30-23-33(40)36(34(41)24-30)28(19-12-13-20-37)18-11-7-9-15-25(2)29-21-31(38)35(27)32(39)22-29/h21-28,37-41H,4-20H2,1-3H3/t25-,26-,27+,28-/m1/s1",HSRXNKIXELDMBE-ZZXHUEHTSA-N,139588675,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1040,Merocyclophane A,,other cyclic non-peptide,Cyclophane,C36H56O4,552.4178603,CCCC[C@H]1CCCCC[C@H](C2=CC(=C([C@H](CCCCC[C@H](C3=CC(=C1C(=C3)O)O)C)CCCC)C(=C2)O)O)C,"InChI=1S/C36H56O4/c1-5-7-17-27-19-13-9-11-15-26(4)30-23-33(39)36(34(40)24-30)28(18-8-6-2)20-14-10-12-16-25(3)29-21-31(37)35(27)32(38)22-29/h21-28,37-40H,5-20H2,1-4H3/t25-,26-,27+,28+/m1/s1",PHTDAEUHHMVZMQ-VIJSPRBVSA-N,62706357,yes,Nostoc,n.a.,UIC 10062
CyanoMetDB_1041,Scytonemide A,,other linear peptide,,C36H56N8O9,744.4170254,CC[C@@H]([C@H]1C(N[C@@H](CO)C(N[C@@H](C(C)C)C(N[C@@H](CC(C)C)/C=N\[C@@H](CC2=CC=C(O)C=C2)C(NCC(N[C@H](CCC(N)=O)C(N1)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C36H56N8O9/c1-7-21(6)31-36(53)42-27(18-45)34(51)43-30(20(4)5)35(52)40-23(14-19(2)3)16-38-26(15-22-8-10-24(46)11-9-22)32(49)39-17-29(48)41-25(33(50)44-31)12-13-28(37)47/h8-11,16,19-21,23,25-27,30-31,45-46H,7,12-15,17-18H2,1-6H3,(H2,37,47)(H,39,49)(H,40,52)(H,41,48)(H,42,53)(H,43,51)(H,44,50)/b38-16-/t21-,23-,25+,26-,27-,30-,31-/m0/s1",HJKXQQVDTIEFDD-FAVUQDIBSA-N,,yes,Scytonema,hofmannii ,UTEX 1834
CyanoMetDB_1042,Guineamide D,,other cyclic peptide,Obyanamide,C36H56N4O9,688.4047294,CCCC1C(C(=O)O[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N([C@@H](C(=O)NCC(=O)N1)CC2=CC=C(C=C2)OC)C)C(C)C)C(C)C)C)C(C)C)C,"InChI=1S/C36H56N4O9/c1-12-13-26-23(8)35(45)48-31(22(6)7)34(44)40(10)29(20(2)3)36(46)49-30(21(4)5)33(43)39(9)27(32(42)37-19-28(41)38-26)18-24-14-16-25(47-11)17-15-24/h14-17,20-23,26-27,29-31H,12-13,18-19H2,1-11H3,(H,37,42)(H,38,41)/t23?,26?,27-,29+,30+,31+/m1/s1",UFZHQKNOTHZBQG-WRCAOINYSA-N,11966884,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1043,Cylindrocyclophane A1,,other cyclic non-peptide,Cyclophane,C36H55ClO6,618.3687172,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O)C)CCCCCl)C(=C2)O)O)O)C,"InChI=1S/C36H55ClO6/c1-4-5-14-25-15-8-6-12-23(2)36(43)28-21-31(40)34(32(41)22-28)26(17-10-11-18-37)16-9-7-13-24(3)35(42)27-19-29(38)33(25)30(39)20-27/h19-26,35-36,38-43H,4-18H2,1-3H3/t23-,24-,25-,26+,35+,36+/m0/s1",XZVMPRPAUUDNLD-YXTQZPCGSA-N,46939423,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1044,Cylindrocyclophane C1,,other cyclic non-peptide,Cyclophane,C36H55ClO5,602.3738026,CCCC[C@H]1CCCC[C@@H](CC2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O)C)CCCCCl)C(=C2)O)O)C,"InChI=1S/C36H55ClO5/c1-4-5-14-27-15-8-6-12-24(2)19-26-20-30(38)34(31(39)21-26)28(17-10-11-18-37)16-9-7-13-25(3)36(42)29-22-32(40)35(27)33(41)23-29/h20-25,27-28,36,38-42H,4-19H2,1-3H3/t24-,25-,27-,28+,36+/m0/s1",ADIDLTWFZOYUMC-OECKDMSPSA-N,46939502,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1045,Merocyclophane B,,other cyclic non-peptide,Cyclophane,C36H54O5,566.3971248,CCCC[C@H]1CCCCC[C@H](C2=CC(=O)C(=C(C2=O)O)[C@H](CCCCC[C@H](C3=CC(=C1C(=C3)O)O)C)CCCC)C,"InChI=1S/C36H54O5/c1-5-7-17-26-19-13-10-12-16-25(4)29-23-32(39)34(36(41)35(29)40)27(18-8-6-2)20-14-9-11-15-24(3)28-21-30(37)33(26)31(38)22-28/h21-27,37-38,41H,5-20H2,1-4H3/t24-,25-,26+,27+/m1/s1",CRPYYHQISGFROO-XDZXDJIYSA-N,62706358,yes,Nostoc,n.a.,UIC 10062
CyanoMetDB_1046,Aeruginoside 126A,,Aeruginosin,,C36H54N6O9,714.3952273,CC(C[C@@H](NC([C@H](O)CC1=CC=CC=C1)=O)C(N2[C@H]3C[C@H](OC4C(O)C(O)C(O)CO4)CC[C@H]3C[C@H]2C(NCCC5=CCN(C(N)=N)C5)=O)=O)C ,"InChI=1S/C36H54N6O9/c1-20(2)14-25(40-33(48)28(43)15-21-6-4-3-5-7-21)34(49)42-26-17-24(51-35-31(46)30(45)29(44)19-50-35)9-8-23(26)16-27(42)32(47)39-12-10-22-11-13-41(18-22)36(37)38/h3-7,11,20,23-31,35,43-46H,8-10,12-19H2,1-2H3,(H3,37,38)(H,39,47)(H,40,48)/t23-,24+,25+,26-,27-,28+,29?,30?,31?,35?/m0/s1",ZLUQPKGCJYFQGT-YJVKJUGDSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1047,Aeruginosin 794A,,Aeruginosin,,C36H54N6O12S,794.3520424,O[C@@H]1[C@H]([C@@H](CO[C@@H]1O[C@]2(C[C@]3([H])N([C@](C(NCCC4=CCN(C4)C(N)=[NH2+])=O)(C[C@@]3(CC2)[H])[H])C([C@H](NC([C@@H](CC5=CC=CC=C5)O)=O)CC(C)C)=O)[H])OS(=O)([O-])=O)O,"InChI=1S/C36H54N6O12S/c1-20(2)14-25(40-33(47)28(43)15-21-6-4-3-5-7-21)34(48)42-26-17-24(53-35-31(45)30(44)29(19-52-35)54-55(49,50)51)9-8-23(26)16-27(42)32(46)39-12-10-22-11-13-41(18-22)36(37)38/h3-7,11,20,23-31,35,43-45H,8-10,12-19H2,1-2H3,(H3,37,38)(H,39,46)(H,40,47)(H,49,50,51)/t23-,24+,25+,26-,27-,28+,29+,30-,31+,35+/m0/s1",WGDCSNNASVTIHQ-PUWCCGQOSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1048,Nostocyclophane D,,other cyclic non-peptide,Cyclophane,C36H54Cl2O6,652.3297449,CCCC[C@H]1CCC[C@H](C[C@H](C2=CC(=C([C@H](CCC[C@H](C[C@H](C3=CC(=C1C(=C3)O)O)OC)Cl)CCCC)C(=C2)O)O)OC)Cl,"InChI=1S/C36H54Cl2O6/c1-5-7-11-23-13-9-15-27(37)21-34(44-4)26-19-31(41)36(32(42)20-26)24(12-8-6-2)14-10-16-28(38)22-33(43-3)25-17-29(39)35(23)30(40)18-25/h17-20,23-24,27-28,33-34,39-42H,5-16,21-22H2,1-4H3/t23-,24-,27+,28+,33+,34+/m0/s1",FYBKUFIZQMYJHP-QENHJSLFSA-N,5491582,yes,Nostoc,linckia (Roth) Bornet,UTEX B1932
CyanoMetDB_1049,Cylindrocyclophane A2,,other cyclic non-peptide,Cyclophane,C36H54Cl2O6,652.3297449,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O)C)CCCC(Cl)Cl)C(=C2)O)O)O)C,"InChI=1S/C36H54Cl2O6/c1-4-5-13-24-14-8-6-11-22(2)36(44)27-20-30(41)34(31(42)21-27)25(16-10-17-32(37)38)15-9-7-12-23(3)35(43)26-18-28(39)33(24)29(40)19-26/h18-25,32,35-36,39-44H,4-17H2,1-3H3/t22-,23-,24-,25+,35+,36+/m0/s1",LERNCFONJSWYRR-CCNIBDGSSA-N,46939339,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1050,Cylindrocyclophane C2,,other cyclic non-peptide,Cyclophane,C36H54Cl2O5,636.3348302,CCCC[C@H]1CCCC[C@@H](CC2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O)C)CCCC(Cl)Cl)C(=C2)O)O)C,"InChI=1S/C36H54Cl2O5/c1-4-5-13-26-14-8-6-11-23(2)18-25-19-29(39)34(30(40)20-25)27(16-10-17-33(37)38)15-9-7-12-24(3)36(43)28-21-31(41)35(26)32(42)22-28/h19-24,26-27,33,36,39-43H,4-18H2,1-3H3/t23-,24-,26-,27+,36+/m0/s1",NEHSJAVXGQMVJK-JSTSWHIPSA-N,46939426,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1051,Itralamide A,,other cyclic peptide,other cyclic depsipeptide,C36H54Cl2N6O8,768.3380181,C[C@@H]1[C@@H](C(=O)N([C@H](C(=O)N[C@@H](C(=O)N([C@H](C(=O)N([C@@H](C(=O)N[C@H](C(=O)O1)C)CC2=CC=CC=C2)C)C)C)C)C(C)C)C)N(C)C(=O)CC(C)C(Cl)Cl,"InChI=1S/C36H54Cl2N6O8/c1-19(2)28-32(47)39-21(4)33(48)41(8)23(6)34(49)42(9)26(18-25-15-13-12-14-16-25)31(46)40-22(5)36(51)52-24(7)29(35(50)44(28)11)43(10)27(45)17-20(3)30(37)38/h12-16,19-24,26,28-30H,17-18H2,1-11H3,(H,39,47)(H,40,46)/t20?,21-,22+,23+,24-,26-,28+,29+/m1/s1",KCTXBLDAYCJREC-AQWYKPIYSA-N,44479219,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1052,Lyngbyapeptin D,,other linear peptide,,C36H53N5O6S,683.3716556,CC(C)C[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C2=NC=CS2)N(C)C(=O)[C@H](CC3=CC=C(C=C3)OC)N(C)C(=O)/C=C(\C)/OC,"InChI=1S/C36H53N5O6S/c1-23(2)20-29(35(44)40(8)32(24(3)4)36(45)41-18-11-12-28(41)33-37-17-19-48-33)39(7)34(43)30(38(6)31(42)21-25(5)46-9)22-26-13-15-27(47-10)16-14-26/h13-17,19,21,23-24,28-30,32H,11-12,18,20,22H2,1-10H3/b25-21+/t28-,29-,30-,32-/m0/s1",VAZIRJJDQHGFJU-YMGIVACDSA-N,46939791,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1053,15-norlyngbyapeptin A,,other linear peptide,,C36H53N5O6S,683.3716556,CC[C@H](C)[C@@H](C(=O)N1CCC[C@H]1C2=NC=CS2)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC3=CC=C(C=C3)O)N(C)C(=O)/C=C(\C)/OC,"InChI=1S/C36H53N5O6S/c1-10-24(4)32(36(46)41-18-11-12-28(41)33-37-17-19-48-33)40(8)35(45)29(20-23(2)3)39(7)34(44)30(22-26-13-15-27(42)16-14-26)38(6)31(43)21-25(5)47-9/h13-17,19,21,23-24,28-30,32,42H,10-12,18,20,22H2,1-9H3/b25-21+/t24-,28-,29-,30-,32-/m0/s1",IDOJVVBVKWRUSO-CYUNKOHBSA-N,11115111,yes,Lyngbya,n.a.,VP417
CyanoMetDB_1054,Palmyramide A,,other cyclic peptide,other cyclic depsipeptide,C36H53N3O9,671.3781803,CCC[C@@H]1C(C(=O)O[C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@@H](C(=O)N[C@H](C(=O)O1)C(C)C)C(C)C)C)CC3=CC=CC=C3)C)(C)C,"InChI=1S/C36H53N3O9/c1-10-15-27-36(7,8)35(45)46-23(6)33(43)47-26(20-24-16-12-11-13-17-24)32(42)39-19-14-18-25(39)31(41)38(9)29(22(4)5)30(40)37-28(21(2)3)34(44)48-27/h11-13,16-17,21-23,25-29H,10,14-15,18-20H2,1-9H3,(H,37,40)/t23-,25-,26-,27+,28-,29+/m0/s1",QXWOTWUQMDHDCF-UEPNLWJJSA-N,45380200,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1055,Aeruginosin 748A,,Aeruginosin,,C36H53ClN6O9,748.356255,O[C@@H]1[C@@H](O)[C@H](O)CO[C@@H]1O[C@@]2([H])C[C@@](N(C([C@@H]([C@H](Cl)C(C)C)NC([C@H](O)CC3=CC=CC=C3)=O)=O)[C@]([H])(C(NCCC4=CCN(C(N)=N)C4)=O)C5)([H])[C@@]5([H])CC2,"InChI=1S/C36H53ClN6O9/c1-19(2)28(37)29(41-33(49)26(44)14-20-6-4-3-5-7-20)34(50)43-24-16-23(52-35-31(47)30(46)27(45)18-51-35)9-8-22(24)15-25(43)32(48)40-12-10-21-11-13-42(17-21)36(38)39/h3-7,11,19,22-31,35,44-47H,8-10,12-18H2,1-2H3,(H3,38,39)(H,40,48)(H,41,49)/t22-,23+,24-,25-,26+,27+,28+,29+,30-,31+,35+/m0/s1",GZXHMSCKGJEQRD-ZVMVZCEHSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1056,Aeruginosin 828A,,Aeruginosin,,C36H53ClN6O12S,828.31307,O[C@@H]1[C@@H](O)[C@H](OS(=O)([O-])=O)CO[C@]1([H])O[C@@]2([H])C[C@@](N(C([C@]([C@H](Cl)C(C)C)([H])NC([C@H](O)CC3=CC=CC=C3)=O)=O)[C@]([H])(C(NCCC4=CCN(C(N)=[NH2+])C4)=O)C5)([H])[C@@]5([H])CC2,"InChI=1S/C36H53ClN6O12S/c1-19(2)28(37)29(41-33(48)26(44)14-20-6-4-3-5-7-20)34(49)43-24-16-23(54-35-31(46)30(45)27(18-53-35)55-56(50,51)52)9-8-22(24)15-25(43)32(47)40-12-10-21-11-13-42(17-21)36(38)39/h3-7,11,19,22-31,35,44-46H,8-10,12-18H2,1-2H3,(H3,38,39)(H,40,47)(H,41,48)(H,50,51,52)/t22-,23+,24-,25-,26+,27+,28+,29+,30-,31+,35+/m0/s1",HYNIADFDZGMLAA-ZVMVZCEHSA-N,132550257,yes,Oscillatoria/Planktothrix,,91/1
CyanoMetDB_1057,Cylindrocyclophane A3,,other cyclic non-peptide,Cyclophane,C36H53Cl3O6,686.2907725,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1O)C=C3O)O)CCCC(Cl)Cl)C)O)O)CCCCCl,"InChI=1S/C36H53Cl3O6/c1-22-10-3-5-12-24(14-7-8-17-37)33-28(40)18-26(19-29(33)41)35(44)23(2)11-4-6-13-25(15-9-16-32(38)39)34-30(42)20-27(36(22)45)21-31(34)43/h18-25,32,35-36,40-45H,3-17H2,1-2H3/t22-,23-,24+,25+,35+,36+/m0/s1",LHICTIBASFRESH-IULTZZOBSA-N,46939338,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1058,Cylindrocyclophane C3,,other cyclic non-peptide,Cyclophane,C36H53Cl3O5,670.2958579,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C(C1)C=C3O)O)CCCC(Cl)Cl)C)O)O)CCCCCl,"InChI=1S/C36H53Cl3O5/c1-23-10-3-5-12-26(14-7-8-17-37)35-31(42)21-28(22-32(35)43)36(44)24(2)11-4-6-13-27(15-9-16-33(38)39)34-29(40)19-25(18-23)20-30(34)41/h19-24,26-27,33,36,40-44H,3-18H2,1-2H3/t23-,24-,26+,27+,36+/m0/s1",GTLHTVNKXAOYFH-NEYNPXGUSA-N,46939425,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1059,Cylindrocyclophane A4,,other cyclic non-peptide,Cyclophane,C36H52Cl4O6,720.2518002,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1O)C=C3O)O)CCCC(Cl)Cl)C)O)O)CCCC(Cl)Cl,"InChI=1S/C36H52Cl4O6/c1-21-9-3-5-11-23(13-7-15-31(37)38)34-29(43)19-26(20-30(34)44)36(46)22(2)10-4-6-12-24(14-8-16-32(39)40)33-27(41)17-25(35(21)45)18-28(33)42/h17-24,31-32,35-36,41-46H,3-16H2,1-2H3/t21-,22-,23+,24+,35+,36+/m0/s1",NCSNQRGCQJNJTK-PLKRWIMUSA-N,46939337,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1060,Cylindrocyclophane C4,,other cyclic non-peptide,Cyclophane,C36H52Cl4O5,704.2568856,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C(C1)C=C3O)O)CCCC(Cl)Cl)C)O)O)CCCC(Cl)Cl,"InChI=1S/C36H52Cl4O5/c1-22-9-3-5-11-26(14-8-16-33(39)40)35-30(43)20-27(21-31(35)44)36(45)23(2)10-4-6-12-25(13-7-15-32(37)38)34-28(41)18-24(17-22)19-29(34)42/h18-23,25-26,32-33,36,41-45H,3-17H2,1-2H3/t22-,23-,25+,26+,36+/m0/s1",WKPXZZKUCLAECJ-KFCUGCEISA-N,46939424,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1061,Cylindrocyclophane F4,,other cyclic non-peptide,Cyclophane,C36H52Cl4O4,688.261971,C[C@H]1CCCC[C@@H](C2=C(C=C(C[C@H](CCCC[C@@H](C3=C(C=C(C1)C=C3O)O)CCCC(Cl)Cl)C)C=C2O)O)CCCC(Cl)Cl,"InChI=1S/C36H52Cl4O4/c1-23-9-3-5-11-27(13-7-15-33(37)38)36-31(43)21-26(22-32(36)44)18-24(2)10-4-6-12-28(14-8-16-34(39)40)35-29(41)19-25(17-23)20-30(35)42/h19-24,27-28,33-34,41-44H,3-18H2,1-2H3/t23-,24-,27+,28+/m0/s1",QZEVGBIFKZJWPF-KBJUPQRZSA-N,46939503,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1062,Cylindrocyclophane B4,Cylindrocyclophane AB4,other cyclic non-peptide,Cyclophane,C36H52Br4O6,896.049741,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1O)C=C3O)O)CCCC(Br)Br)C)O)O)CCCC(Br)Br,"InChI=1S/C36H52Br4O6/c1-21-9-3-5-11-23(13-7-15-31(37)38)34-29(43)19-26(20-30(34)44)36(46)22(2)10-4-6-12-24(14-8-16-32(39)40)33-27(41)17-25(35(21)45)18-28(33)42/h17-24,31-32,35-36,41-46H,3-16H2,1-2H3/t21-,22-,23+,24+,35+,36+/m0/s1",OAOGUBBGJGDGQT-PLKRWIMUSA-N,46939504,yes,Cylindrospermum ,licheniforme,n.a.
CyanoMetDB_1063,Microginin T2,,Microginin,,C36H51N5O9,697.3686782,NC(CCCCCCC[H])C(C(N[C@H](C)C(N1[C@H](CCC1)C(N[C@H](CC2=CC=C(C=C2)O)C(N[C@H](CC3=CC=C(C=C3)O)C(O)=O)=O)=O)=O)=O)O,"InChI=1S/C36H51N5O9/c1-3-4-5-6-7-9-27(37)31(44)34(47)38-22(2)35(48)41-19-8-10-30(41)33(46)39-28(20-23-11-15-25(42)16-12-23)32(45)40-29(36(49)50)21-24-13-17-26(43)18-14-24/h11-18,22,27-31,42-44H,3-10,19-21,37H2,1-2H3,(H,38,47)(H,39,46)(H,40,45)(H,49,50)/t22-,27?,28-,29-,30-,31?/m1/s1",LHYLVKUSFWTIOX-WJKUKWHSSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1064,Microginin 713B,,Microginin,,C36H51N5O10,713.3635929,CCCCCCCC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(NC(CC3=CC=C(O)C=C3)C(O)=O)=O)=O)=O)CO)=O)O)N,"InChI=1S/C36H51N5O10/c1-2-3-4-5-6-8-26(37)31(45)34(48)40-29(21-42)35(49)41-18-7-9-30(41)33(47)38-27(19-22-10-14-24(43)15-11-22)32(46)39-28(36(50)51)20-23-12-16-25(44)17-13-23/h10-17,26-31,42-45H,2-9,18-21,37H2,1H3,(H,38,47)(H,39,46)(H,40,48)(H,50,51)",JSVJSIBNAWXLCR-UHFFFAOYSA-N,146684936,no,n.a.,n.a.,n.a.
CyanoMetDB_1065,Microginin T1,,Microginin,,C36H50ClN5O9,731.3297059,NC(CCCCCCCCl)C(C(N[C@H](C)C(N1[C@H](CCC1)C(N[C@H](CC2=CC=C(C=C2)O)C(N[C@H](CC3=CC=C(C=C3)O)C(O)=O)=O)=O)=O)=O)O,"InChI=1S/C36H50ClN5O9/c1-22(39-34(48)31(45)27(38)8-5-3-2-4-6-18-37)35(49)42-19-7-9-30(42)33(47)40-28(20-23-10-14-25(43)15-11-23)32(46)41-29(36(50)51)21-24-12-16-26(44)17-13-24/h10-17,22,27-31,43-45H,2-9,18-21,38H2,1H3,(H,39,48)(H,40,47)(H,41,46)(H,50,51)/t22-,27?,28-,29-,30-,31?/m1/s1",XWZAKNSJDTWNRF-WJKUKWHSSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1066,Microginin 747A,,Microginin,,C36H50ClN5O10,747.3246205,NC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(NC(C(O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)CO)=O)O)CCCCCCCCl,"InChI=1S/C36H50ClN5O10/c37-17-5-3-1-2-4-7-26(38)31(46)34(49)41-29(21-43)35(50)42-18-6-8-30(42)33(48)39-27(19-22-9-13-24(44)14-10-22)32(47)40-28(36(51)52)20-23-11-15-25(45)16-12-23/h9-16,26-31,43-46H,1-8,17-21,38H2,(H,39,48)(H,40,47)(H,41,49)(H,51,52)",IEFYVENCGJIZIJ-UHFFFAOYSA-N,146684937,no,n.a.,n.a.,n.a.
CyanoMetDB_1067,Microginin 765,,Microginin,,C36H49Cl2N5O9,765.2907336,NC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(NC(C(O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)C)=O)O)CCCCCCC(Cl)Cl,"InChI=1S/C36H49Cl2N5O9/c1-21(40-34(49)31(46)26(39)7-4-2-3-5-9-30(37)38)35(50)43-18-6-8-29(43)33(48)41-27(19-22-10-14-24(44)15-11-22)32(47)42-28(36(51)52)20-23-12-16-25(45)17-13-23/h10-17,21,26-31,44-46H,2-9,18-20,39H2,1H3,(H,40,49)(H,41,48)(H,42,47)(H,51,52)",RUVSWVJIBKXISF-UHFFFAOYSA-N,146684938,no,n.a.,n.a.,n.a.
CyanoMetDB_1068,Cryptophycin 65,,Cryptophycin,,C36H48ClN3O8,685.3129932,O=C(C(CC(C)C)O)O[C@@H](CC=CC(N[C@@H](C(NC[C@@H](C(NC)=O)C)=O)CC1=CC(Cl)=C(C=C1)OC)=O)[C@@H]([C@@H]2[C@@H](C3=CC=CC=C3)O2)C,"InChI=1S/C36H48ClN3O8/c1-21(2)17-28(41)36(45)47-29(23(4)32-33(48-32)25-11-8-7-9-12-25)13-10-14-31(42)40-27(35(44)39-20-22(3)34(43)38-5)19-24-15-16-30(46-6)26(37)18-24/h7-12,14-16,18,21-23,27-29,32-33,41H,13,17,19-20H2,1-6H3,(H,38,43)(H,39,44)(H,40,42)/t22-,23-,27+,28?,29-,32+,33+/m0/s1",PGVXSTILHTXSDU-XOTIQRFYSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1069,Cryptophycin E,Cryptophycin 5 ;  Cryptophycin E methyl ester,Cryptophycin,,C36H47ClN2O9,686.2970088,C[C@H](CNC(=O)[C@H](CC1=CC(=C(C=C1)OC)Cl)NC(=O)/C=C/C[C@@H]([C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)OC(=O)[C@H](CC(C)C)O)C(=O)OC,"InChI=1S/C36H47ClN2O9/c1-21(2)17-28(40)36(44)47-29(23(4)32-33(48-32)25-11-8-7-9-12-25)13-10-14-31(41)39-27(34(42)38-20-22(3)35(43)46-6)19-24-15-16-30(45-5)26(37)18-24/h7-12,14-16,18,21-23,27-29,32-33,40H,13,17,19-20H2,1-6H3,(H,38,42)(H,39,41)/b14-10+/t22-,23+,27+,28+,29+,32-,33-/m1/s1",XGAUXAIUGBBANH-FFGCSCSXSA-N,11765188,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1070,Cryptophycin 9,,Cryptophycin,,C36H47ClN2O9,686.2970088,CC1CNC(C(CC2=CC(Cl)=C(OC)C=C2)NC(/C=C/CC(C(C(O)C(OC)C3=CC=CC=C3)C)OC(C(CC(C)C)OC1=O)=O)=O)=O,"InChI=1S/C36H47ClN2O9/c1-21(2)17-30-36(44)47-28(23(4)32(41)33(46-6)25-11-8-7-9-12-25)13-10-14-31(40)39-27(34(42)38-20-22(3)35(43)48-30)19-24-15-16-29(45-5)26(37)18-24/h7-12,14-16,18,21-23,27-28,30,32-33,41H,13,17,19-20H2,1-6H3,(H,38,42)(H,39,40)/b14-10+",DALYSCNHWIQSMV-GXDHUFHOSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1071,Cryptophycin 296,,Cryptophycin,,C36H46Cl2N2O8,704.2631218,CC1CNC(=O)C(NC(=O)C=CCC(OC(=O)C(OC1=O)CC(C)(C)C)C(C)C(C(C2=CC=CC=C2)Cl)O)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C36H46Cl2N2O8/c1-21-20-39-33(43)26(18-23-15-16-28(46-6)25(37)17-23)40-30(41)14-10-13-27(22(2)32(42)31(38)24-11-8-7-9-12-24)47-35(45)29(48-34(21)44)19-36(3,4)5/h7-12,14-17,21-22,26-27,29,31-32,42H,13,18-20H2,1-6H3,(H,39,43)(H,40,41)/b14-10+/t21-,22-,26-,27+,29+,31+,32-/m1/s1",HAWHVCSXRLAZSS-HFMWIOSNSA-N,12989711,no,n.a.,n.a.,n.a.
CyanoMetDB_1072,Cryptophycin 55,,Cryptophycin,,C36H46Cl2N2O8,704.2631218,CC(C)CC1C(=O)OC(CC=CC(=O)NC(C(=O)NCC(C(=O)O1)(C)C)CC2=CC(=C(C=C2)OC)Cl)C(C)C(C(C3=CC=CC=C3)Cl)O,"InChI=1S/C36H46Cl2N2O8/c1-21(2)17-29-34(44)47-27(22(3)32(42)31(38)24-11-8-7-9-12-24)13-10-14-30(41)40-26(19-23-15-16-28(46-6)25(37)18-23)33(43)39-20-36(4,5)35(45)48-29/h7-12,14-16,18,21-22,26-27,29,31-32,42H,13,17,19-20H2,1-6H3,(H,39,43)(H,40,41)/b14-10+/t22-,26+,27-,29-,31-,32+/m0/s1",MXZDFWPOJAPNJL-VIVUCZJBSA-N,9896488,yes,n.a.,n.a.,n.a.
CyanoMetDB_1073,Ulongamide C,,Cyclamide,Depsipeptide,C36H45N5O7S,691.30397,CCC[C@@H]1[C@H](C(=O)O[C@H](C(=O)N(C(C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C)C)C,"InChI=1S/C36H45N5O7S/c1-7-11-27-21(2)36(47)48-23(4)34(45)41(6)30(19-25-14-16-26(42)17-15-25)35(46)40(5)29(18-24-12-9-8-10-13-24)32(44)37-22(3)33-39-28(20-49-33)31(43)38-27/h8-10,12-17,20-23,27,29-30,42H,7,11,18-19H2,1-6H3,(H,37,44)(H,38,43)/t21-,22+,23+,27-,29+,30?/m1/s1",PETFICLABWDIHU-OVYCRQNXSA-N,139588607,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1074,Cryptophycin 53,,Cryptophycin,,C36H45ClN2O8,668.2864441,CC(C)CC1C(=O)OC(CC=CC(=O)NC(C(=O)NCC(C(=O)O1)(C)C)CC2=CC(=C(C=C2)OC)Cl)C(C)C3C(O3)C4=CC=CC=C4,"InChI=1S/C36H45ClN2O8/c1-21(2)17-29-34(42)45-27(22(3)31-32(47-31)24-11-8-7-9-12-24)13-10-14-30(40)39-26(19-23-15-16-28(44-6)25(37)18-23)33(41)38-20-36(4,5)35(43)46-29/h7-12,14-16,18,21-22,26-27,29,31-32H,13,17,19-20H2,1-6H3,(H,38,41)(H,39,40)/b14-10+/t22-,26+,27?,29-,31-,32-/m0/s1",LSXOBYNBRKOTIQ-OXZZJQJUSA-N,76210636,yes,n.a.,n.a.,n.a.
CyanoMetDB_1075,Cryptophycin 52,,Cryptophycin,,C36H45ClN2O8,668.2864441,CC(C)CC1C(=O)OC(CC=CC(=O)NC(C(=O)NCC(C(=O)O1)(C)C)CC2=CC(=C(C=C2)OC)Cl)C(C)C3C(O3)C4=CC=CC=C4,"InChI=1S/C36H45ClN2O8/c1-21(2)17-29-34(42)45-27(22(3)31-32(47-31)24-11-8-7-9-12-24)13-10-14-30(40)39-26(19-23-15-16-28(44-6)25(37)18-23)33(41)38-20-36(4,5)35(43)46-29/h7-12,14-16,18,21-22,26-27,29,31-32H,13,17,19-20H2,1-6H3,(H,38,41)(H,39,40)/b14-10+/t22-,26+,27?,29-,31+,32+/m0/s1",LSXOBYNBRKOTIQ-MQHIEMKOSA-N,76210638,yes,n.a.,n.a.,n.a.
CyanoMetDB_1076,Cryptophycin 292,,Cryptophycin,,C36H45ClN2O8,668.2864441,CC1CNC(=O)C(NC(=O)C=CCC(OC(=O)C(OC1=O)CC(C)(C)C)C(C)C2C(O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)Cl,"InChI=1S/C36H45ClN2O8/c1-21-20-38-33(41)26(18-23-15-16-28(44-6)25(37)17-23)39-30(40)14-10-13-27(22(2)31-32(47-31)24-11-8-7-9-12-24)45-35(43)29(46-34(21)42)19-36(3,4)5/h7-12,14-17,21-22,26-27,29,31-32H,13,18-20H2,1-6H3,(H,38,41)(H,39,40)/b14-10-/t21-,22+,26-,27+,29+,31-,32-/m1/s1",ZRRVVBCEQVHKRK-AJHJWEKLSA-N,101078491,yes,n.a.,n.a.,n.a.
CyanoMetDB_1077,Cryptophycin 51,,Cryptophycin,,C36H45ClN2O7,652.2915295,CC(C)CC1C(=O)OC(CC=CC(=O)NC(C(=O)NCC(C(=O)O1)(C)C)CC2=CC(=C(C=C2)OC)Cl)C(C)C=CC3=CC=CC=C3,"InChI=1S/C36H45ClN2O7/c1-23(2)19-31-34(42)45-29(24(3)15-16-25-11-8-7-9-12-25)13-10-14-32(40)39-28(21-26-17-18-30(44-6)27(37)20-26)33(41)38-22-36(4,5)35(43)46-31/h7-12,14-18,20,23-24,28-29,31H,13,19,21-22H2,1-6H3,(H,38,41)(H,39,40)/b14-10+,16-15+/t24-,28-,29+,31+/m1/s1",LTVIBOLRUXBENE-MSXGYFQQSA-N,9852572,yes,n.a.,n.a.,n.a.
CyanoMetDB_1078,Tolyporphin D,,other cyclic non-peptide,porphyrins,C36H42N4O8,658.3002643,CC1C(CC(C(O1)C2(C3=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C6C(=CC(=CC(=N3)C2=O)N6)C)(C)C7C(CC(C(O7)C)O)O)C)C)O)O,"InChI=1S/C36H42N4O8/c1-15-8-20-10-29-35(5,33-27(43)13-25(41)17(3)47-33)31(45)23(39-29)9-19-7-16(2)22(37-19)12-30-36(6,32(46)24(40-30)11-21(15)38-20)34-28(44)14-26(42)18(4)48-34/h7-12,17-18,25-28,33-34,37-38,41-44H,13-14H2,1-6H3",BHWKRHXUDXJMFO-UHFFFAOYSA-N,139583393,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1079,Bartoloside K,,other linear non-peptide,Bartoloside,C35H60Cl2O6,646.3766951,CCCCCCC(CCCCCC1=CC(=C(C(=C1)O[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCC(CCCCCC)Cl)O)Cl,"InChI=1S/C35H60Cl2O6/c1-3-5-7-12-18-27(36)20-14-9-11-17-26-23-30(38)29(22-16-10-15-21-28(37)19-13-8-6-4-2)32(24-26)43-35-34(41)33(40)31(39)25-42-35/h23-24,27-28,31,33-35,38-41H,3-22,25H2,1-2H3/t27?,28?,31-,33+,34-,35+/m1/s1",LJLORIMRLLORHA-LNSHLUEESA-N,132582913,yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_1080,Hoiamide D,,other linear non-peptide,,C35H58N4O7S3,742.3467637,C[C@H](CCC)[C@H](O)[C@@H]([C@@H](O)[C@H]([C@@H](OC)CC1=NC(C2=N[C@](C3=N[C@@](C(N[C@H]([C@@H](O)[C@H](C(O)=O)C)[C@H](CC)C)=O)(C)CS3)(C)CS2)=CS1)C)C,"InChI=1S/C35H58N4O7S3/c1-11-13-19(4)27(40)21(6)28(41)20(5)24(46-10)14-25-36-23(15-47-25)30-38-35(9,17-48-30)33-39-34(8,16-49-33)32(45)37-26(18(3)12-2)29(42)22(7)31(43)44/h15,18-22,24,26-29,40-42H,11-14,16-17H2,1-10H3,(H,37,45)(H,43,44)/t18-,19+,20-,21-,22+,24-,26-,27-,28-,29-,34-,35+/m0/s1",QJJZOVMGNCPTJN-AODGVFFVSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1081,Aeruginosin 752,,Aeruginosin,,C35H56N6O12,752.3956213,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(CO)O4)C(O)CC3C1,"InChI=1S/C35H56N6O12/c1-17(2)11-21(40-32(50)25(45)12-18-5-7-20(43)8-6-18)33(51)41-22-15-26(52-34-30(48)29(47)28(46)27(16-42)53-34)24(44)14-19(22)13-23(41)31(49)38-9-3-4-10-39-35(36)37/h5-8,17,19,21-30,34,42-48H,3-4,9-16H2,1-2H3,(H,38,49)(H,40,50)(H4,36,37,39)",FJTRLBMZPVQPHE-UHFFFAOYSA-N,146684970,no,n.a.,n.a.,n.a.
CyanoMetDB_1082,Aeruginosin 736,,Aeruginosin,,C35H56N6O11,736.4007066,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(CO)O4)CCC3C1,"InChI=1S/C35H56N6O11/c1-18(2)13-23(40-32(49)26(44)14-19-5-8-21(43)9-6-19)33(50)41-24-16-22(51-34-30(47)29(46)28(45)27(17-42)52-34)10-7-20(24)15-25(41)31(48)38-11-3-4-12-39-35(36)37/h5-6,8-9,18,20,22-30,34,42-47H,3-4,7,10-17H2,1-2H3,(H,38,48)(H,40,49)(H4,36,37,39)",TXGSALMCYNQFOW-UHFFFAOYSA-N,146684971,no,n.a.,n.a.,n.a.
CyanoMetDB_1083,Aeruginosin NOL5,,Aeruginosin,,C35H56N6O10,720.405792,O=C(CCCCC)N[C@@H](CC1=CC=C(C=C1)O)C(N2[C@@H](C[C@H]3[C@@H]2CC(CC3)OC4OC(C(C4O)O)CO)C(NC(CO)CCCNC(N)=N)=O)=O,"InChI=1S/C35H56N6O10/c1-2-3-4-7-29(45)40-25(15-20-8-11-23(44)12-9-20)33(49)41-26-17-24(50-34-31(47)30(46)28(19-43)51-34)13-10-21(26)16-27(41)32(48)39-22(18-42)6-5-14-38-35(36)37/h8-9,11-12,21-22,24-28,30-31,34,42-44,46-47H,2-7,10,13-19H2,1H3,(H,39,48)(H,40,45)(H4,36,37,38)/t21-,22?,24?,25-,26-,27-,28?,30?,31?,34?/m0/s1",NCDCOQKFTYCKNK-STPCJELOSA-N,146683744,yes,Nodularia,spumigena,n.a.
CyanoMetDB_1084,Aeruginosin 766,,Aeruginosin,,C35H54N6O13,766.3748858,O=C(NCCCCNC(N)=N)C1N(C(C(NC(C(O)CC2=CC=C(O)C=C2)=O)CC(C)C)=O)C3CC(OC4C(O)C(O)C(O)C(C(O)=O)O4)C(O)CC3C1,"InChI=1S/C35H54N6O13/c1-16(2)11-20(40-31(49)24(44)12-17-5-7-19(42)8-6-17)32(50)41-21-15-25(53-34-28(47)26(45)27(46)29(54-34)33(51)52)23(43)14-18(21)13-22(41)30(48)38-9-3-4-10-39-35(36)37/h5-8,16,18,20-29,34,42-47H,3-4,9-15H2,1-2H3,(H,38,48)(H,40,49)(H,51,52)(H4,36,37,39)",YFSWUYQJNLOZQP-UHFFFAOYSA-N,146684801,no,n.a.,n.a.,n.a.
CyanoMetDB_1085,Izenamide C,,other linear peptide,linear depsipeptide,C35H54N4O9,674.3890793,OC(C(C)C)C(OC(C(CC)C)C(NC(C(C)CC)C(NCC(N(C(CC1=CC=CC=C1)C(N2CCCC2C(OC)=O)=O)C)=O)=O)=O)=O,"InChI=1S/C35H54N4O9/c1-9-22(5)28(37-32(43)30(23(6)10-2)48-35(46)29(41)21(3)4)31(42)36-20-27(40)38(7)26(19-24-15-12-11-13-16-24)33(44)39-18-14-17-25(39)34(45)47-8/h11-13,15-16,21-23,25-26,28-30,41H,9-10,14,17-20H2,1-8H3,(H,36,42)(H,37,43)/t22-,23-,25-,26+,28-,29-,30+/m0/s1",ZOVBJSDLILDXCH-AXFAPSIESA-N,132505929,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1086,Microginin 704,Microginin 690 methyl ester,Microginin,,C35H52N4O9S,704.3455004,CCCCCCC[C@@H]([C@@H](C(=O)N(C)[C@@H](CCS(=O)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C(=O)O)O)N,"InChI=1S/C35H52N4O9S/c1-5-6-7-8-9-10-27(36)31(41)34(44)39(2)30(19-20-49(4)47)33(43)37-28(21-23-11-15-25(40)16-12-23)32(42)38-29(35(45)46)22-24-13-17-26(48-3)18-14-24/h11-18,27-31,40-41H,5-10,19-22,36H2,1-4H3,(H,37,43)(H,38,42)(H,45,46)",IQSISHQRPPTNJD-FEBNODRBSA-N,139589896,yes,Microcystis,aeruginosa,UTEX LB2385
CyanoMetDB_1087,Microginin 688,,Microginin,,C35H52N4O8S,688.3505858,CCCCCCC[C@H]([C@H](C(N(C)C(CCSC)C(N[C@H](CC1=CC=C(C=C1)O)C(N[C@@H](C(O)=O)CC2=CC=C(C=C2)OC)=O)=O)=O)O)N,"InChI=1S/C35H52N4O8S/c1-5-6-7-8-9-10-27(36)31(41)34(44)39(2)30(19-20-48-4)33(43)37-28(21-23-11-15-25(40)16-12-23)32(42)38-29(35(45)46)22-24-13-17-26(47-3)18-14-24/h11-18,27-31,40-41H,5-10,19-22,36H2,1-4H3,(H,37,43)(H,38,42)(H,45,46)/t27-,28-,29-,30?,31-/m1/s1",YBOKOXXNVMZSMN-MWWUBFDHSA-N,,no,Microcystis,aeruginosa,TAU IL-374
CyanoMetDB_1088,Guineamide C,,other cyclic peptide,Obyanamide,C35H52N4O7,640.3836,CCC(C)C1C(=O)N([C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)NC(C(C(=O)O1)C)CCCC#C)C)C)C(C)C)CC2=CC=C(C=C2)OC)C,"InChI=1S/C35H52N4O7/c1-11-13-14-15-27-23(6)35(44)46-30(22(5)12-2)34(43)39(9)28(20-25-16-18-26(45-10)19-17-25)32(41)37-29(21(3)4)33(42)38(8)24(7)31(40)36-27/h1,16-19,21-24,27-30H,12-15,20H2,2-10H3,(H,36,40)(H,37,41)/t22?,23?,24-,27?,28-,29-,30?/m0/s1",LTQSSFDXKQDYDB-RGHLRUQMSA-N,10054915,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1089,Anachelin-H,,other linear peptide,Siderophore,C35H51N6O14,779.3457768,CC([C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@H]1CC2=CC(=C(C=C2[N+](C1)(C)C)O)O)NC(=O)C[C@H](C[C@H]([C@@H](CO)NC(=O)C3=CC=CC=C3O)O)O)O,"InChI=1S/C35H50N6O14/c1-17(45)31(40-30(51)11-20(46)10-27(48)22(14-42)37-32(52)21-6-4-5-7-26(21)47)35(55)39-24(16-44)34(54)38-23(15-43)33(53)36-19-8-18-9-28(49)29(50)12-25(18)41(2,3)13-19/h4-7,9,12,17,19-20,22-24,27,31,42-46,48H,8,10-11,13-16H2,1-3H3,(H7-,36,37,38,39,40,47,49,50,51,52,53,54,55)/p+1/t17?,19-,20-,22+,23-,24-,27+,31+/m0/s1",RTZSUJWUBYBFSE-OMSCKNLYSA-O,24205476,yes,Anabaena,cylindrica,n.a.
CyanoMetDB_1090,Ulongamide E,,Cyclamide,Depsipeptide,C35H51N5O7S,685.3509202,CCC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)C(C)C)C)CC3=CC=C(C=C3)O)C)[C@@H](C)CC)C,"InChI=1S/C35H51N5O7S/c1-10-12-25-21(6)35(46)47-29(20(5)11-2)34(45)39(8)27(17-23-13-15-24(41)16-14-23)33(44)40(9)28(19(3)4)31(43)36-22(7)32-38-26(18-48-32)30(42)37-25/h13-16,18-22,25,27-29,41H,10-12,17H2,1-9H3,(H,36,43)(H,37,42)/t20-,21-,22-,25+,27-,28-,29-/m0/s1",WTSNBJFZSIXNHV-QPJFRRSWSA-N,11050722,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1091,Aeruginosin 103A,Aeruginosin 103-A,Aeruginosin,,C35H48N6O8,680.3533625,CCO[C@@H]1[C@H](CCCN1C(=N)N)NC(=O)C2CC3CCC(CC3N2C(=O)[C@@H](CC4=CC=C(C=C4)O)NC(=O)[C@@H](CC5=CC=C(C=C5)O)O)O,"InChI=1S/C35H48N6O8/c1-2-49-34-26(4-3-15-40(34)35(36)37)38-31(46)29-18-22-9-14-25(44)19-28(22)41(29)33(48)27(16-20-5-10-23(42)11-6-20)39-32(47)30(45)17-21-7-12-24(43)13-8-21/h5-8,10-13,22,25-30,34,42-45H,2-4,9,14-19H2,1H3,(H3,36,37)(H,38,46)(H,39,47)/t22?,25?,26-,27+,28?,29?,30+,34+/m0/s1",ZHFMOYWZDUNUOY-IQYNOVPGSA-N,10009777,yes,Microcystis,viridis,NIES 103
CyanoMetDB_1092,Belamide A,,other linear peptide,,C35H48N4O5,604.3624707,CC(C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)N2[C@H](C(=CC2=O)OC)CC3=CC=CC=C3)N(C)C,"InChI=1S/C35H48N4O5/c1-23(2)31(36(5)6)34(42)38(8)32(24(3)4)35(43)37(7)28(21-26-18-14-11-15-19-26)33(41)39-27(29(44-9)22-30(39)40)20-25-16-12-10-13-17-25/h10-19,22-24,27-28,31-32H,20-21H2,1-9H3",JMMZSASROFIHRA-UHFFFAOYSA-N,,yes,Symploca,n.a.,n.a.
CyanoMetDB_1093,Cryptophycin 13,,Cryptophycin,,C35H45ClN2O9,672.2813587,C[C@H]([C@H](CC=CC(N[C@@H](C(NC[C@@H](C(O)=O)C)=O)CC1=CC(Cl)=C(C=C1)OC)=O)OC([C@H](CC(C)C)O)=O)[C@H]2[C@H](O2)C3=CC=CC=C3,"InChI=1S/C35H45ClN2O9/c1-20(2)16-27(39)35(44)46-28(22(4)31-32(47-31)24-10-7-6-8-11-24)12-9-13-30(40)38-26(33(41)37-19-21(3)34(42)43)18-23-14-15-29(45-5)25(36)17-23/h6-11,13-15,17,20-22,26-28,31-32,39H,12,16,18-19H2,1-5H3,(H,37,41)(H,38,40)(H,42,43)/t21-,22+,26+,27-,28-,31-,32+/m0/s1",AYWVFWGYELBEQQ-WWZQIEMHSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1094,Cryptophycin 15,,Cryptophycin,,C35H45ClN2O9,672.2813587,O=C(OC(C(C)C(O)C(O)C1=CC=CC=C1)C/C=C/C(NC(CC2=CC(Cl)=C(OC)C=C2)C(NCC(C)C(O3)=O)=O)=O)C3CC(C)C,"InChI=1S/C35H45ClN2O9/c1-20(2)16-29-35(44)46-27(22(4)31(40)32(41)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(42)37-19-21(3)34(43)47-29)18-23-14-15-28(45-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32,40-41H,12,16,18-19H2,1-5H3,(H,37,42)(H,38,39)/b13-9+",JGMGQTJWUKUQAC-UKTHLTGXSA-N,14501059,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1095,Cryptophycin 26,Cryptophycin-26,Cryptophycin,Depsipeptide,C35H45ClN2O8,656.2864441,C[C@@H]1CNC(=O)[C@H](NC(=O)C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)C[C@@H]([C@H](C)/C=C/C2=CC=CC=C2)O)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C35H45ClN2O8/c1-21(2)15-31-35(43)45-26(18-29(39)22(3)11-12-24-9-7-6-8-10-24)19-32(40)38-28(33(41)37-20-23(4)34(42)46-31)17-25-13-14-30(44-5)27(36)16-25/h6-14,16,21-23,26,28-29,31,39H,15,17-20H2,1-5H3,(H,37,41)(H,38,40)/b12-11+/t22-,23-,26-,28-,29+,31+/m1/s1",JVTODUXHSHCQOJ-VYCCHRMBSA-N,10794404,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1096,Cryptophycin 30,Cryptophycin-30,Cryptophycin,Depsipeptide,C35H45ClN2O8,656.2864441,C[C@@H]1CNC(=O)[C@H](NC(=O)C[C@@H](C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)O)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C35H45ClN2O8/c1-21(2)15-31-35(43)45-30(22(3)11-12-24-9-7-6-8-10-24)18-26(39)19-32(40)38-28(33(41)37-20-23(4)34(42)46-31)17-25-13-14-29(44-5)27(36)16-25/h6-14,16,21-23,26,28,30-31,39H,15,17-20H2,1-5H3,(H,37,41)(H,38,40)/b12-11+/t22-,23-,26-,28-,30+,31+/m1/s1",JFPRSGZLRPUHFQ-NPFQDIQASA-N,10651921,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1097,Cryptophycin 25,,Cryptophycin,,C35H44BrClN2O8,734.196957,O=C1OC(C/C=C/C(NC(C(NCC(C(OC1CC(C)C)=O)C)=O)CC2=CC(Cl)=C(C=C2)OC)=O)C(C(C(C3=CC=CC=C3)Br)O)C,"InChI=1S/C35H44BrClN2O8/c1-20(2)16-29-35(44)46-27(22(4)32(41)31(36)24-10-7-6-8-11-24)12-9-13-30(40)39-26(33(42)38-19-21(3)34(43)47-29)18-23-14-15-28(45-5)25(37)17-23/h6-11,13-15,17,20-22,26-27,29,31-32,41H,12,16,18-19H2,1-5H3,(H,38,42)(H,39,40)/b13-9+",HFOAOOZWWATFPH-UKTHLTGXSA-N,,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1098,Cryptophycin B,Cryptophycin 2,Cryptophycin,,C35H44N2O8,620.3097664,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC=C(C=C4)OC,"InChI=1S/C35H44N2O8/c1-21(2)18-29-35(41)43-28(23(4)31-32(45-31)25-10-7-6-8-11-25)12-9-13-30(38)37-27(19-24-14-16-26(42-5)17-15-24)33(39)36-20-22(3)34(40)44-29/h6-11,13-17,21-23,27-29,31-32H,12,18-20H2,1-5H3,(H,36,39)(H,37,38)/b13-9+/t22-,23+,27-,28+,29+,31-,32-/m1/s1",YFGZFQNBPSCWPN-FOLMERSESA-N,5468424,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1099,Cryptophycin D,Cryptophycin 4,Cryptophycin,,C35H44N2O7,604.3148518,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC=C(C=C3)OC,"InChI=1S/C35H44N2O7/c1-23(2)20-31-35(41)43-30(24(3)14-15-26-10-7-6-8-11-26)12-9-13-32(38)37-29(21-27-16-18-28(42-5)19-17-27)33(39)36-22-25(4)34(40)44-31/h6-11,13-19,23-25,29-31H,12,20-22H2,1-5H3,(H,36,39)(H,37,38)/b13-9+,15-14+/t24-,25-,29-,30+,31+/m1/s1",IEYSWBYGDJSUEZ-FBLQQVRNSA-N,10371453,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1100,Cryptophycin 338,,Cryptophycin,,C35H44ClN3O7,653.2867785,[H][C@@]1(C/C=C\C(N[C@@H](C(NC[C@H](C(O[C@H]2CC(C)C)=O)C)=O)CC3=CC=C(C(Cl)=C3)OC)=O)N=C2O[C@H]([C@@H]([C@H]1C)O)C4=CC=CC=C4,"InChI=1S/C35H44ClN3O7/c1-20(2)16-29-34-39-26(22(4)31(41)32(46-34)24-10-7-6-8-11-24)12-9-13-30(40)38-27(33(42)37-19-21(3)35(43)45-29)18-23-14-15-28(44-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32,41H,12,16,18-19H2,1-5H3,(H,37,42)(H,38,40)/b13-9-/t21-,22+,26+,27-,29+,31-,32+/m1/s1",APUYYDMPDPOBEU-JWUIAJGNSA-N,101033690,no,n.a.,n.a.,n.a.
CyanoMetDB_1101,Cryptophycin 8,,Cryptophycin,,C35H44Cl2N2O8,690.2474718,CC1CNC(=O)C(NC(=O)C=CCC(OC(=O)C(OC1=O)CC(C)C)C(C)C(C(C2=CC=CC=C2)Cl)O)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C35H44Cl2N2O8/c1-20(2)16-29-35(44)46-27(22(4)32(41)31(37)24-10-7-6-8-11-24)12-9-13-30(40)39-26(33(42)38-19-21(3)34(43)47-29)18-23-14-15-28(45-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32,41H,12,16,18-19H2,1-5H3,(H,38,42)(H,39,40)/b13-9+/t21-,22+,26-,27+,29+,31+,32-/m1/s1",TVIRNGFXQVMMGB-OFWIHYRESA-N,9918016,yes,n.a.,n.a.,n.a.
CyanoMetDB_1102,Spiroidesin,,other linear peptide,Spumigin,C35H43N3O7,617.3101007,CCCCCC(=O)N[C@H](CCC1=CC=C(C=C1)O)C(=O)N[C@@H](CCC2=CC=C(C=C2)O)C(=O)N[C@H](CC3=CC=CC=C3)C(=O)O,"InChI=1S/C35H43N3O7/c1-2-3-5-10-32(41)36-29(21-15-24-11-17-27(39)18-12-24)33(42)37-30(22-16-25-13-19-28(40)20-14-25)34(43)38-31(35(44)45)23-26-8-6-4-7-9-26/h4,6-9,11-14,17-20,29-31,39-40H,2-3,5,10,15-16,21-23H2,1H3,(H,36,41)(H,37,42)(H,38,43)(H,44,45)/t29-,30+,31-/m1/s1",XFLVJFHNXBWJDL-MJSOWUPRSA-N,637849,yes,Anabaena,spiroides,n.a.
CyanoMetDB_1103,Cryptophycin C,Cryptophycin 3,Cryptophycin,,C35H43ClN2O7,638.2758794,C[C@@H]1CNC(=O)[C@@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C35H43ClN2O7/c1-22(2)18-31-35(42)44-29(23(3)14-15-25-10-7-6-8-11-25)12-9-13-32(39)38-28(33(40)37-21-24(4)34(41)45-31)20-26-16-17-30(43-5)27(36)19-26/h6-11,13-17,19,22-24,28-29,31H,12,18,20-21H2,1-5H3,(H,37,40)(H,38,39)/b13-9+,15-14+/t23-,24-,28+,29+,31+/m1/s1",QLGFKEFRTAOKJU-FDUWFYLVSA-N,10258579,no (X-ray crystallography),Nostoc,n.a.,GSV 224
CyanoMetDB_1104,Cryptophycin A,"Cryptophycin 1, Cryptophycin",Cryptophycin,,C35H43ClN2O8,654.2707941,C[C@@H]1CNC(=O)[C@@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)Cl,"InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)/b13-9+/t21-,22+,26+,27+,29+,31-,32-/m1/s1",PSNOPSMXOBPNNV-XUMGCJJFSA-N,6504906,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1105,Cryptophycin 54,Cryptophycin-54,Cryptophycin,,C35H43ClN2O8,654.2707941,CC[C@H](C)[C@H]1C(=O)O[C@@H](C/C=C/C(=O)N[C@@H](C(=O)NC[C@H](C(=O)O1)C)CC2=CC(=C(C=C2)OC)Cl)[C@H](C)[C@@H]3[C@H](O3)C4=CC=CC=C4,"InChI=1S/C35H43ClN2O8/c1-6-20(2)30-35(42)44-27(22(4)31-32(45-31)24-11-8-7-9-12-24)13-10-14-29(39)38-26(33(40)37-19-21(3)34(41)46-30)18-23-15-16-28(43-5)25(36)17-23/h7-12,14-17,20-22,26-27,30-32H,6,13,18-19H2,1-5H3,(H,37,40)(H,38,39)/b14-10+/t20-,21+,22-,26+,27-,30-,31+,32+/m0/s1",LFFZZUVEDYUSEH-JVQJDRCSSA-N,10794382,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1106,Cryptophycin 327,Cryptophycin-327,Cryptophycin,,C35H43ClN2O8,654.2707941,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C\C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)Cl,"InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)/b13-9-/t21-,22+,26-,27+,29+,31-,32-/m1/s1",PSNOPSMXOBPNNV-GKPRUIBSSA-N,11422411,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1107,Cryptophycin 38,Cryptophycin-38,Cryptophycin,,C35H43ClN2O8,654.2707941,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@H]2[C@@H](O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)Cl,"InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)/b13-9+/t21-,22+,26-,27+,29+,31+,32+/m1/s1",PSNOPSMXOBPNNV-PJIUNSFYSA-N,10699481,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1108,Cryptophycin 101,,Cryptophycin,,C35H43ClN2O8,654.2707941,O=C(OC(C(C)C1C(O1)C2=CC=CC=C2)C/C=C/C(NC(CC3=CC(Cl)=C(OC)C=C3)C(NCC(C)C(O4)=O)=O)=O)C4C(C)CC,"InChI=1S/C35H43ClN2O8/c1-6-20(2)30-35(42)44-27(22(4)31-32(45-31)24-11-8-7-9-12-24)13-10-14-29(39)38-26(33(40)37-19-21(3)34(41)46-30)18-23-15-16-28(43-5)25(36)17-23/h7-12,14-17,20-22,26-27,30-32H,6,13,18-19H2,1-5H3,(H,37,40)(H,38,39)/b14-10+",LFFZZUVEDYUSEH-GXDHUFHOSA-N,,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1109,Cryptophycin 77,,Cryptophycin,,C35H43ClN2O8,654.2707941,CC1CNC(=O)C(NC(=O)C=CCC(OC(=O)C(OC1=O)CC(C)C)C(C)C2C(O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)Cl,"InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)/b13-9+/t21-,22+,26-,27+,29+,31+,32-/m1/s1",PSNOPSMXOBPNNV-OFWIHYRESA-N,11377284,yes,n.a.,n.a.,n.a.
CyanoMetDB_1110,Cryptophycin 39,,Cryptophycin,,C35H43ClN2O8,654.2707941,CC1CNC(=O)C(NC(=O)C=CCC(OC(=O)C(OC1=O)CC(C)C)C(C)C2C(O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)Cl,"InChI=1S/C35H43ClN2O8/c1-20(2)16-29-35(42)44-27(22(4)31-32(46-31)24-10-7-6-8-11-24)12-9-13-30(39)38-26(33(40)37-19-21(3)34(41)45-29)18-23-14-15-28(43-5)25(36)17-23/h6-11,13-15,17,20-22,26-27,29,31-32H,12,16,18-19H2,1-5H3,(H,37,40)(H,38,39)",PSNOPSMXOBPNNV-LQJYTIKWSA-N,9852601,,n.a.,n.a.,n.a.
CyanoMetDB_1111,Cryptophycin 18,Cryptophycin-18,Cryptophycin,,C35H43ClN2O7,638.2758794,CC[C@H](C)[C@H]1C(=O)O[C@@H](C/C=C/C(=O)N[C@@H](C(=O)NC[C@H](C(=O)O1)C)CC2=CC(=C(C=C2)OC)Cl)[C@H](C)/C=C/C3=CC=CC=C3,"InChI=1S/C35H43ClN2O7/c1-6-22(2)32-35(42)44-29(23(3)15-16-25-11-8-7-9-12-25)13-10-14-31(39)38-28(33(40)37-21-24(4)34(41)45-32)20-26-17-18-30(43-5)27(36)19-26/h7-12,14-19,22-24,28-29,32H,6,13,20-21H2,1-5H3,(H,37,40)(H,38,39)/b14-10+,16-15+/t22-,23+,24+,28+,29-,32-/m0/s1",CCZRCVCMUDRTLT-JLDLTTNLSA-N,10722782,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1112,Cryptophycin 46,,Cryptophycin,,C35H43ClN2O7,638.2758794,CC1CNC(C(CC2=CC(Cl)=C(OC)C=C2)NC(/C=C/CC(C(/C=C/C3=CC=CC=C3)C)OC(C(CC(C)C)OC1=O)=O)=O)=O,"InChI=1S/C35H43ClN2O7/c1-22(2)18-31-35(42)44-29(23(3)14-15-25-10-7-6-8-11-25)12-9-13-32(39)38-28(33(40)37-21-24(4)34(41)45-31)20-26-16-17-30(43-5)27(36)19-26/h6-11,13-17,19,22-24,28-29,31H,12,18,20-21H2,1-5H3,(H,37,40)(H,38,39)/b13-9+,15-14+",QLGFKEFRTAOKJU-BBXOWAOSSA-N,10258579,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1113,Cryptophycin 31,Cryptophycin-31,Cryptophycin,,C35H42Cl2N2O8,688.2318217,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC(=C(C(=C4)Cl)OC)Cl,"InChI=1S/C35H42Cl2N2O8/c1-19(2)14-28-35(43)45-27(21(4)30-31(47-30)23-10-7-6-8-11-23)12-9-13-29(40)39-26(33(41)38-18-20(3)34(42)46-28)17-22-15-24(36)32(44-5)25(37)16-22/h6-11,13,15-16,19-21,26-28,30-31H,12,14,17-18H2,1-5H3,(H,38,41)(H,39,40)/b13-9+/t20-,21+,26-,27+,28+,30-,31-/m1/s1",JZEHVSOMRIGJDV-GBGDOJRGSA-N,10556556,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1114,Cryptophycin 175,,Cryptophycin,,C35H42Cl2N2O7,672.2369071,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC(=C(C(=C3)Cl)OC)Cl,"InChI=1S/C35H42Cl2N2O7/c1-21(2)16-30-35(43)45-29(22(3)14-15-24-10-7-6-8-11-24)12-9-13-31(40)39-28(33(41)38-20-23(4)34(42)46-30)19-25-17-26(36)32(44-5)27(37)18-25/h6-11,13-15,17-18,21-23,28-30H,12,16,19-20H2,1-5H3,(H,38,41)(H,39,40)/b13-9+,15-14+/t22-,23-,28-,29+,30+/m1/s1",WTWQLCDDGYJOLG-GAWFYVAGSA-N,10604522,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1115,Takinolide dimer,,other linear non-peptide,,C34H64O6,568.4702898,CCCCCCCCCCC[C@@]1(CCCC(=O)O[C@@](CCCC(=O)O1)(CCCCCCCCCCC)CO)CO,"InChI=1S/C34H64O6/c1-3-5-7-9-11-13-15-17-19-25-33(29-35)27-21-23-32(38)40-34(30-36,28-22-24-31(37)39-33)26-20-18-16-14-12-10-8-6-4-2/h35-36H,3-30H2,1-2H3/t33-,34-/m1/s1",OTCVHAIYZWVNGN-KKLWWLSJSA-N,44222047,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1116,Aeruginoguanidine 98B,Aeruginoguanidine 98-B,other linear peptide,Microguanidine,C34H59N9O14S3,913.3343611,C/C(CC/C=C(C)\C)=C/CNC(NCCC[C@@H](C(N(C)[C@@H](CCCNC(N)=N)C(N[C@@H]([C@@H](C1=CC=C(C(COS(=O)(O)=O)=C1)OS(=O)(O)=O)OS(=O)(O)=O)C)=O)=O)NC)=N,"InChI=1S/C34H59N9O14S3/c1-22(2)10-7-11-23(3)16-19-41-34(37)40-18-8-12-27(38-5)32(45)43(6)28(13-9-17-39-33(35)36)31(44)42-24(4)30(57-60(52,53)54)25-14-15-29(56-59(49,50)51)26(20-25)21-55-58(46,47)48/h10,14-16,20,24,27-28,30,38H,7-9,11-13,17-19,21H2,1-6H3,(H,42,44)(H4,35,36,39)(H3,37,40,41)(H,46,47,48)(H,49,50,51)(H,52,53,54)/b23-16-/t24-,27+,28+,30+/m1/s1",IHRXSAMVVJTBKE-JDFJJDLRSA-N,9988341,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1117,Bartoloside J,,other linear non-peptide,Bartoloside,C34H59ClO6,598.4000173,CCCCCCCCCCCC1=CC(=C(C(=C1)O[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCC(CCCCCC)Cl)O,"InChI=1S/C34H59ClO6/c1-3-5-7-9-10-11-12-13-15-19-26-23-29(36)28(22-18-14-17-21-27(35)20-16-8-6-4-2)31(24-26)41-34-33(39)32(38)30(37)25-40-34/h23-24,27,30,32-34,36-39H,3-22,25H2,1-2H3/t27?,30-,32+,33-,34+/m1/s1",OTVIJJKBILNRLT-WPQQXQCVSA-N,132582915,yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_1118,Bartoloside E,,other linear non-peptide,Bartoloside,C34H58Cl2O6,632.361045,CCCCCCC(CCCCCC1=C(C=C(C=C1O[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCCC(CCCC)Cl)O)Cl,"InChI=1S/C34H58Cl2O6/c1-3-5-7-12-18-27(36)20-14-10-15-21-28-29(37)22-25(16-11-8-9-13-19-26(35)17-6-4-2)23-31(28)42-34-33(40)32(39)30(38)24-41-34/h22-23,26-27,30,32-34,37-40H,3-21,24H2,1-2H3/t26?,27?,30-,32+,33-,34+/m1/s1",NYUHMGANIQYFOK-ANHKVXBOSA-N,132582908,yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_1119,Mirabimide D,,other linear peptide,Microcolin/Mirabimide,C34H56N4O8,648.4098148,CN([C@H](C(O[C@H](C(N(C)[C@H](C(N1[C@@H](C(N2[C@@H](C(OC)=CC2=O)C(C)C)=O)CCC1)=O)C(C)C)=O)[C@H](CC)C)=O)CC(C)C)C(C)=O,"InChI=1S/C34H56N4O8/c1-13-22(8)30(46-34(44)25(17-19(2)3)35(10)23(9)39)33(43)36(11)29(21(6)7)32(42)37-16-14-15-24(37)31(41)38-27(40)18-26(45-12)28(38)20(4)5/h18-22,24-25,28-30H,13-17H2,1-12H3/t22-,24+,25-,28+,29-,30-/m0/s1",VMCRBPTYWASLCC-SLFXSCPESA-N,146683644,yes,Scytonema,mirabilis,n.a.
CyanoMetDB_1120,Biselyngbyaside B,,other cyclic non-peptide,,C34H54O10,622.3716979,C/C(C/C=C/C)=C/[C@H](O1)C/C=C/C=C/C[C@@H](/C=C([C@H](CC(O)C[C@H](CC1=O)O[C@H](O[C@@H]([C@H]([C@@H]2OC)O)CO)[C@@H]2O)OC)\C)C,"InChI=1S/C34H54O10/c1-7-8-13-23(3)17-26-15-12-10-9-11-14-22(2)16-24(4)28(40-5)19-25(36)18-27(20-30(37)42-26)43-34-32(39)33(41-6)31(38)29(21-35)44-34/h7-12,16-17,22,25-29,31-36,38-39H,13-15,18-21H2,1-6H3/b8-7+,11-9+,12-10+,23-17-,24-16+/t22-,25?,26+,27+,28-,29+,31+,32+,33-,34+/m0/s1",SRKYZJUVGQRPRX-LXWQCCDISA-N,44140287,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1121,Aeruginoside 126B,,Aeruginosin,,C34H54N6O9,690.3952273,O[C@@H](C(N[C@@H](C(N1[C@H](C(NCCCCNC(N)=N)=O)C[C@H]2[C@@H]1C[C@H](OC3OCC(O)C(O)C3O)CC2)=O)CC(C)C)=O)CC4=CC=CC=C4,"InChI=1S/C34H54N6O9/c1-19(2)14-23(39-31(46)26(41)15-20-8-4-3-5-9-20)32(47)40-24-17-22(49-33-29(44)28(43)27(42)18-48-33)11-10-21(24)16-25(40)30(45)37-12-6-7-13-38-34(35)36/h3-5,8-9,19,21-29,33,41-44H,6-7,10-18H2,1-2H3,(H,37,45)(H,39,46)(H4,35,36,38)/t21-,22+,23+,24-,25-,26+,27?,28?,29?,33?/m0/s1",JUHSPAYJBZKQRH-UVOPMWESSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1122,Aeruginosin 205A,Aeruginosin 205-A,Aeruginosin,,C34H53ClN6O12S,804.31307,O=C(N[C@H]([C@@H](O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)CO1)C(C)C)C(N2C3C(CCC(Cl)C3)CC2C(NCCCCNC(N)=N)=O)=O)[C@@H](OS(=O)(O)=O)CC4=CC=CC=C4,"InChI=1S/C34H53ClN6O12S/c1-18(2)29(52-33-28(44)27(43)24(42)17-51-33)26(40-31(46)25(53-54(48,49)50)14-19-8-4-3-5-9-19)32(47)41-22-16-21(35)11-10-20(22)15-23(41)30(45)38-12-6-7-13-39-34(36)37/h3-5,8-9,18,20-29,33,42-44H,6-7,10-17H2,1-2H3,(H,38,45)(H,40,46)(H4,36,37,39)(H,48,49,50)/t20?,21?,22?,23?,24-,25?,26-,27+,28-,29+,33-/m1/s1",DZCMECJEYSAXKP-IKUHNMOBSA-N,10440383,yes,Oscillatoria/Planktothrix,agardhii,n.a.
CyanoMetDB_1124,Aeruginosin 205B,Aeruginosin 205-B,Aeruginosin,,C34H53ClN6O12S,804.31307,O=C(N[C@@H]([C@H](O[C@@H]1[C@H](O)[C@@H](O)[C@H](O)CO1)C(C)C)C(N2C3C(CCC(Cl)C3)CC2C(NCCCCNC(N)=N)=O)=O)[C@H](OS(=O)(O)=O)CC4=CC=CC=C4,"InChI=1S/C34H53ClN6O12S/c1-18(2)29(52-33-28(44)27(43)24(42)17-51-33)26(40-31(46)25(53-54(48,49)50)14-19-8-4-3-5-9-19)32(47)41-22-16-21(35)11-10-20(22)15-23(41)30(45)38-12-6-7-13-39-34(36)37/h3-5,8-9,18,20-29,33,42-44H,6-7,10-17H2,1-2H3,(H,38,45)(H,40,46)(H4,36,37,39)(H,48,49,50)/t20?,21?,22?,23?,24-,25?,26+,27+,28-,29-,33-/m1/s1",DZCMECJEYSAXKP-ITIDXPILSA-N,10350415,yes,Oscillatoria/Planktothrix,agardhii,n.a.
CyanoMetDB_1125,Biselyngbyaside C,,other cyclic non-peptide,,C34H52O11,636.3509625,C/C(C/C=C/C)=C/[C@@H](C[C@H]1C=C[C@H](C[C@H](C)/C=C(C)/[C@@H](OC)C/C=C/[C@@H](O[C@@H]([C@@H]2O)O[C@H](CO)[C@@H](O)[C@@H]2OC)C3)OO1)OC3=O,"InChI=1S/C34H52O11/c1-7-8-10-21(2)16-27-18-26-14-13-25(44-45-26)17-22(3)15-23(4)28(39-5)12-9-11-24(19-30(36)41-27)42-34-32(38)33(40-6)31(37)29(20-35)43-34/h7-9,11,13-16,22,24-29,31-35,37-38H,10,12,17-20H2,1-6H3/b8-7+,11-9+,21-16-,23-15+/t22-,24-,25-,26-,27+,28+,29-,31-,32-,33+,34-/m1/s1",DOHISILMGRURNG-KIUKYKQOSA-N,60166167,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1126,Biselyngbyaside D,,other cyclic non-peptide,,C34H52O11,636.3509625,C/C(C/C=C/C)=C/[C@@H](C/C=C/C=C/C[C@H](C)[C@H](OO)C([C@@H](OC)C/C=C/[C@@H](O[C@@H]([C@@H]1O)O[C@H](CO)[C@@H](O)[C@@H]1OC)C2)=C)OC2=O,"InChI=1S/C34H52O11/c1-7-8-14-22(2)19-25-16-12-10-9-11-15-23(3)32(45-39)24(4)27(40-5)18-13-17-26(20-29(36)42-25)43-34-31(38)33(41-6)30(37)28(21-35)44-34/h7-13,17,19,23,25-28,30-35,37-39H,4,14-16,18,20-21H2,1-3,5-6H3/b8-7+,11-9+,12-10+,17-13+,22-19-/t23-,25+,26+,27-,28+,30+,31+,32?,33-,34+/m0/s1",FNRWIRHWUOZXPS-VSKVEOSLSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1127,nostoc-756,,other linear non-peptide,Mycosporine?like amino acids,C34H52N4O15,756.342917,OCC(O)(C1)CC(NC(CCCNC(CC(O)(C/2)CO)=C(OC)C2=N\CCCC(NC3=C(C(CC(CO)(C3)O)=O)OC)C(O)=O)C(O)=O)=C(OC)C1=O,"InChI=1S/C34H52N4O15/c1-51-27-21(35-8-4-6-19(30(44)45)37-23-12-33(49,17-40)14-25(42)28(23)52-2)10-32(48,16-39)11-22(27)36-9-5-7-20(31(46)47)38-24-13-34(50,18-41)15-26(43)29(24)53-3/h19-20,35,37-41,48-50H,4-18H2,1-3H3,(H,44,45)(H,46,47)/b36-22+",SAEJXBKGZRJMFO-HPNXWYHWSA-N,,yes,Nostoc,commune,n.a.
CyanoMetDB_1128,Aeruginosin 596A,,Aeruginosin,,C34H52Cl2N6O13S,854.2690123,CCCC(C(C(=O)N1C2CC(CCC2CC1C(=O)NCCCCN=C(N)N)Cl)NC(=O)C(CC3=CC(=C(C=C3)O)Cl)O)OC4C(C(C(CO4)OS(=O)(=O)O)O)O,"InChI=1S/C34H52Cl2N6O13S/c1-2-5-25(54-33-29(46)28(45)26(16-53-33)55-56(50,51)52)27(41-31(48)24(44)13-17-6-9-23(43)20(36)12-17)32(49)42-21-15-19(35)8-7-18(21)14-22(42)30(47)39-10-3-4-11-40-34(37)38/h6,9,12,18-19,21-22,24-29,33,43-46H,2-5,7-8,10-11,13-16H2,1H3,(H,39,47)(H,41,48)(H4,37,38,40)(H,50,51,52)/t18-,19+,21-,22-,24+,25+,26+,27-,28-,29+,33+/m0/s1",VQMZAYAWSOZYFZ-CIBMRDTASA-N,101051312,no,n.a.,n.a.,n.a.
CyanoMetDB_1129,Aeruginosin 596B,,Aeruginosin,,C34H52Cl2N6O13S,854.2690123,CCCC(C(C(=O)N1C2CC(CCC2CC1C(=O)NCCCCN=C(N)N)Cl)NC(=O)C(CC3=CC(=C(C=C3)O)Cl)O)OC4C(C(C(CO4)O)OS(=O)(=O)O)O,"InChI=1S/C34H52Cl2N6O13S/c1-2-5-26(54-33-28(46)29(25(45)16-53-33)55-56(50,51)52)27(41-31(48)24(44)13-17-6-9-23(43)20(36)12-17)32(49)42-21-15-19(35)8-7-18(21)14-22(42)30(47)39-10-3-4-11-40-34(37)38/h6,9,12,18-19,21-22,24-29,33,43-46H,2-5,7-8,10-11,13-16H2,1H3,(H,39,47)(H,41,48)(H4,37,38,40)(H,50,51,52)/t18-,19+,21-,22-,24+,25+,26+,27-,28+,29-,33+/m0/s1",FWJMSRYQGHJHJZ-QJFKFTQUSA-N,101051313,no,n.a.,n.a.,n.a.
CyanoMetDB_1130,Banyasin A,,other cyclic peptide,,C34H51N9O8,713.3860596,CC1C(N[C@H](C(N([C@H](C(N[C@H](C(N[C@H](C(NC1C/C=C/CC)=O)C)=O)CC(O)=O)=O)CC2=CC=CC=C2)C)=O)CCC/N=C(N)/NC(NC)=O)=O,"InChI=1S/C34H51N9O8/c1-6-7-9-15-23-20(2)28(46)40-24(16-12-17-37-33(35)42-34(51)36-4)32(50)43(5)26(18-22-13-10-8-11-14-22)31(49)41-25(19-27(44)45)30(48)38-21(3)29(47)39-23/h7-11,13-14,20-21,23-26H,6,12,15-19H2,1-5H3,(H,38,48)(H,39,47)(H,40,46)(H,41,49)(H,44,45)(H4,35,36,37,42,51)/b9-7+/t20?,21-,23?,24-,25-,26-/m0/s1",OPFHYLNKVKPGNV-IBXWVKCVSA-N,11399857,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1131,Manauealide C,,other cyclic non-peptide,Lyngbya toxin,C34H50O11,634.3353124,CC1CC(C23CC(C(C(O2)C(C)CCC(C4=CC(=CC=C4)O)OC)C)OC(=O)CC(OC(=O)CC1(O3)O)C(C)OC(=O)C)(C)C,"InChI=1S/C34H50O11/c1-19(12-13-26(40-8)24-10-9-11-25(36)14-24)31-21(3)28-17-34(44-31)32(6,7)16-20(2)33(39,45-34)18-30(38)42-27(15-29(37)43-28)22(4)41-23(5)35/h9-11,14,19-22,26-28,31,36,39H,12-13,15-18H2,1-8H3/t19?,20-,21+,22?,26?,27-,28+,31-,33+,34+/m1/s1",TYIVYKUKAGDZDP-DJAXVPBXSA-N,10508288,yes,Gracilaria,coronopifolia,n.a.
CyanoMetDB_1132,Microginin 690,,Microginin,,C34H50N4O9S,690.3298504,CCCCCCC[C@@H](N)[C@@H](O)C(N[C@@H](C(N(C)[C@@H](C(N[C@@H](C(O)=O)CC1=CC=C(O)C=C1)=O)CCS(C)=O)=O)CC2=CC=C(O)C=C2)=O,"InChI=1S/C34H50N4O9S/c1-4-5-6-7-8-9-26(35)30(41)32(43)36-27(20-22-10-14-24(39)15-11-22)33(44)38(2)29(18-19-48(3)47)31(42)37-28(34(45)46)21-23-12-16-25(40)17-13-23/h10-17,26-30,39-41H,4-9,18-21,35H2,1-3H3,(H,36,43)(H,37,42)(H,45,46)/t26-,27-,28-,29-,30-,48?/m1/s1",XQNUUSDGKKQDOZ-HSUXGAPZSA-N,,yes,Microcystis,aeruginosa,UTEX LB2385
CyanoMetDB_1133,Microginin 674,,Microginin,,C34H50N4O8S,674.3349358,CCCCCCC[C@@H](N)[C@@H](O)C(N[C@@H](C(N(C)[C@@H](C(N[C@@H](C(O)=O)CC1=CC=C(O)C=C1)=O)CCSC)=O)CC2=CC=C(O)C=C2)=O,"InChI=1S/C34H50N4O8S/c1-4-5-6-7-8-9-26(35)30(41)32(43)36-27(20-22-10-14-24(39)15-11-22)33(44)38(2)29(18-19-47-3)31(42)37-28(34(45)46)21-23-12-16-25(40)17-13-23/h10-17,26-30,39-41H,4-9,18-21,35H2,1-3H3,(H,36,43)(H,37,42)(H,45,46)/t26-,27-,28-,29-,30-/m1/s1",KZYJLFZLBGWRQQ-XZTOTZIXSA-N,,yes,Microcystis,aeruginosa,UTEX LB2385
CyanoMetDB_1134,Ulongamide D,,Cyclamide,Depsipeptide,C34H49N5O7S,671.3352701,CCC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)C(C)C)C)CC3=CC=C(C=C3)O)C)C(C)C)C,"InChI=1S/C34H49N5O7S/c1-10-11-24-20(6)34(45)46-28(19(4)5)33(44)38(8)26(16-22-12-14-23(40)15-13-22)32(43)39(9)27(18(2)3)30(42)35-21(7)31-37-25(17-47-31)29(41)36-24/h12-15,17-21,24,26-28,40H,10-11,16H2,1-9H3,(H,35,42)(H,36,41)/t20-,21-,24+,26-,27-,28-/m0/s1",FRWFEXMWAJIROC-FEHSMJKKSA-N,10952495,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1135,Yanucamide B,,other cyclic peptide,other cyclic depsipeptide,C34H49N3O7,611.3570509,CC[C@H](C)[C@H]1C(=O)O[C@H](C(=O)N([C@@H](C(=O)NCCC(=O)OC(C(C(=O)N1)(C)C)CCCC#C)CC2=CC=CC=C2)C)C(C)C,"InChI=1S/C34H49N3O7/c1-9-11-13-18-26-34(6,7)33(42)36-28(23(5)10-2)32(41)44-29(22(3)4)31(40)37(8)25(21-24-16-14-12-15-17-24)30(39)35-20-19-27(38)43-26/h1,12,14-17,22-23,25-26,28-29H,10-11,13,18-21H2,2-8H3,(H,35,39)(H,36,42)/t23-,25-,26?,28+,29+/m1/s1",YGNYZDWBKLMWKA-TUMCGKKHSA-N,44575210,yes,Lyngbya/Moorea; Schizothrix,[Lyngbya/Moorea]majuscula/producens,n.a.
CyanoMetDB_1136,Aeruginosin KT650,Micropeptin KT650,Aeruginosin,,C34H46N6O7,650.3427978,CC(=O)O[C@H](CC1=CC=C(C=C1)O)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)N3[C@@H]4C[C@@H](CC[C@@H]4C[C@@H]3C(=O)NCCCCN=C(N)N)O,"InChI=1S/C34H46N6O7/c1-21(41)47-30(18-23-9-12-25(42)13-10-23)32(45)39-27(17-22-7-3-2-4-8-22)33(46)40-28-20-26(43)14-11-24(28)19-29(40)31(44)37-15-5-6-16-38-34(35)36/h2-4,7-10,12-13,24,26-30,42-43H,5-6,11,14-20H2,1H3,(H,37,44)(H,39,45)(H4,35,36,38)/t24-,26-,27-,28-,29-,30-/m1/s1",HUKJPWVQXNHUJQ-HMDGCWDXSA-N,57333041,yes,n.a.,n.a.,n.a.
CyanoMetDB_1137,Aeruginosin A,Oscillarin,Aeruginosin,,C34H44N6O5,616.3373185,O=C(NCCC1=CCN(C(N)=N)C1)[C@H]2N(C([C@H](NC([C@@H](CC3=CC=CC=C3)O)=O)CC4=CC=CC=C4)=O)[C@@]5([H])C[C@H](O)CC[C@@]5([H])C2,"InChI=1S/C34H44N6O5/c35-34(36)39-16-14-24(21-39)13-15-37-31(43)29-19-25-11-12-26(41)20-28(25)40(29)33(45)27(17-22-7-3-1-4-8-22)38-32(44)30(42)18-23-9-5-2-6-10-23/h1-10,14,25-30,41-42H,11-13,15-21H2,(H3,35,36)(H,37,43)(H,38,44)/t25-,26+,27+,28-,29-,30+/m0/s1",YNAKQOCSOOKXJP-VCNFNBSBSA-N,5289082,yes,Oscillatoria/Planktothrix,agardhii,B2 83
CyanoMetDB_1138,Cryptophycin 24,Arenastatin A,Cryptophycin,,C34H42N2O8,606.2941163,C[C@@H]([C@@H]1C/C=C/C(=O)N[C@@H](C(=O)NCCC(=O)O[C@H](C(=O)O1)CC(C)C)CC2=CC=C(C=C2)OC)[C@@H]3[C@H](O3)C4=CC=CC=C4,"InChI=1S/C34H42N2O8/c1-21(2)19-28-34(40)43-27(22(3)31-32(44-31)24-9-6-5-7-10-24)11-8-12-29(37)36-26(33(39)35-18-17-30(38)42-28)20-23-13-15-25(41-4)16-14-23/h5-10,12-16,21-22,26-28,31-32H,11,17-20H2,1-4H3,(H,35,39)(H,36,37)/b12-8+/t22-,26+,27-,28-,31+,32+/m0/s1",GPUHMLPBKTYERL-DEIZWQRYSA-N,9938734,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1139,Cryptophycin 43,Cryptophycin-43,Cryptophycin,,C34H42N2O7,590.2992017,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC=C(C=C3)O,"InChI=1S/C34H42N2O7/c1-22(2)19-30-34(41)42-29(23(3)13-14-25-9-6-5-7-10-25)11-8-12-31(38)36-28(20-26-15-17-27(37)18-16-26)32(39)35-21-24(4)33(40)43-30/h5-10,12-18,22-24,28-30,37H,11,19-21H2,1-4H3,(H,35,39)(H,36,38)/b12-8+,14-13+/t23-,24-,28-,29+,30+/m1/s1",MPPCENBEKXDXSB-WGEPZXCHSA-N,10769731,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1140,Cryptophycin 63,,Cryptophycin,,C34H42Cl2N2O8,676.2318217,O=C(O[C@H](C[C@H](O)[C@H](Cl)C1=CC=CC=C1)C/C=C/C(N[C@H](CC2=CC(Cl)=C(OC)C=C2)C(NC[C@@H](C)C(O3)=O)=O)=O)[C@H]3CC(C)C,"InChI=1S/C34H42Cl2N2O8/c1-20(2)15-29-34(43)45-24(18-27(39)31(36)23-9-6-5-7-10-23)11-8-12-30(40)38-26(32(41)37-19-21(3)33(42)46-29)17-22-13-14-28(44-4)25(35)16-22/h5-10,12-14,16,20-21,24,26-27,29,31,39H,11,15,17-19H2,1-4H3,(H,37,41)(H,38,40)/b12-8+/t21-,24+,26-,27+,29-,31-/m1/s1",HXIRQOOASMSNNB-YNRVWBGASA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1141,Cryptophycin 16,Cryptophycin-16,Cryptophycin,,C34H41ClN2O8,640.255144,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)O)Cl,"InChI=1S/C34H41ClN2O8/c1-19(2)15-28-34(42)43-27(21(4)30-31(45-30)23-9-6-5-7-10-23)11-8-12-29(39)37-25(17-22-13-14-26(38)24(35)16-22)32(40)36-18-20(3)33(41)44-28/h5-10,12-14,16,19-21,25,27-28,30-31,38H,11,15,17-18H2,1-4H3,(H,36,40)(H,37,39)/b12-8+/t20-,21+,25-,27+,28+,30-,31-/m1/s1",JPWBUGOVDPESSU-RNGXCZKDSA-N,10604177,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1142,Cryptophycin 50,Cryptophycin-50,Cryptophycin,,C34H41ClN2O8,640.255144,CCC[C@H]1C(=O)O[C@@H](C/C=C/C(=O)N[C@@H](C(=O)NC[C@H](C(=O)O1)C)CC2=CC(=C(C=C2)OC)Cl)[C@H](C)[C@@H]3[C@H](O3)C4=CC=CC=C4,"InChI=1S/C34H41ClN2O8/c1-5-10-28-34(41)43-26(21(3)30-31(45-30)23-11-7-6-8-12-23)13-9-14-29(38)37-25(32(39)36-19-20(2)33(40)44-28)18-22-15-16-27(42-4)24(35)17-22/h6-9,11-12,14-17,20-21,25-26,28,30-31H,5,10,13,18-19H2,1-4H3,(H,36,39)(H,37,38)/b14-9+/t20-,21+,25-,26+,28+,30-,31-/m1/s1",KBYSXVZAIWIWEC-WOFDPGDDSA-N,10722801,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1143,Cryptophycin 40,Cryptophycin-40,Cryptophycin,,C34H41ClN2O8,640.255144,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)C[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC(=C(C=C4)OC)Cl,"InChI=1S/C34H41ClN2O8/c1-20(2)15-29-34(41)43-24(18-28-31(44-28)23-9-6-5-7-10-23)11-8-12-30(38)37-26(32(39)36-19-21(3)33(40)45-29)17-22-13-14-27(42-4)25(35)16-22/h5-10,12-14,16,20-21,24,26,28-29,31H,11,15,17-19H2,1-4H3,(H,36,39)(H,37,38)/b12-8+/t21-,24+,26-,28-,29+,31-/m1/s1",AQLHQIPWEIVGRR-IPGIDAFISA-N,10699331,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1144,Cryptophycin 107,,Cryptophycin,,C34H41ClN2O8,640.255144,O=C(NC(CC1=CC(Cl)=C(OC)C=C1)C(NCC(C)C2=O)=O)/C=C/CC(OC(C(CC(C)C)O2)=O)CC3C(C4=CC=CC=C4)O3,"InChI=1S/C34H41ClN2O8/c1-20(2)15-29-34(41)43-24(18-28-31(44-28)23-9-6-5-7-10-23)11-8-12-30(38)37-26(32(39)36-19-21(3)33(40)45-29)17-22-13-14-27(42-4)25(35)16-22/h5-10,12-14,16,20-21,24,26,28-29,31H,11,15,17-19H2,1-4H3,(H,36,39)(H,37,38)/b12-8+/t21-,24+,26-,28-,29+,31+/m1/s1",AQLHQIPWEIVGRR-XYOKQWHBSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1145,Cryptophycin 21,,Cryptophycin,,C34H41ClN2O8,640.255144,CC(C)CC1C(=O)OC(CC=CC(=O)NC(C(=O)NCCC(=O)O1)CC2=CC(=C(C=C2)OC)Cl)C(C)C3C(O3)C4=CC=CC=C4,"InChI=1S/C34H41ClN2O8/c1-20(2)17-28-34(41)44-26(21(3)31-32(45-31)23-9-6-5-7-10-23)11-8-12-29(38)37-25(33(40)36-16-15-30(39)43-28)19-22-13-14-27(42-4)24(35)18-22/h5-10,12-14,18,20-21,25-26,28,31-32H,11,15-17,19H2,1-4H3,(H,36,40)(H,37,38)/b12-8+/t21-,25-,26+,28+,31-,32+/m1/s1",ATKRDMWWPRZLSY-MCTRNWQUSA-N,15280748,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1146,Cryptophycin 17,Cryptophycin-17,Cryptophycin,,C34H41ClN2O7,624.2602294,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC(=C(C=C3)O)Cl,"InChI=1S/C34H41ClN2O7/c1-21(2)17-30-34(42)43-29(22(3)13-14-24-9-6-5-7-10-24)11-8-12-31(39)37-27(19-25-15-16-28(38)26(35)18-25)32(40)36-20-23(4)33(41)44-30/h5-10,12-16,18,21-23,27,29-30,38H,11,17,19-20H2,1-4H3,(H,36,40)(H,37,39)/b12-8+,14-13+/t22-,23-,27-,29+,30+/m1/s1",XUZKJXAKKMKMBV-VPXKJLAISA-N,10699160,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1147,Cryptophycin 19,Cryptophycin-19,Cryptophycin,,C34H41ClN2O7,624.2602294,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)C(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C34H41ClN2O7/c1-21(2)31-34(41)43-28(22(3)14-15-24-10-7-6-8-11-24)12-9-13-30(38)37-27(32(39)36-20-23(4)33(40)44-31)19-25-16-17-29(42-5)26(35)18-25/h6-11,13-18,21-23,27-28,31H,12,19-20H2,1-5H3,(H,36,39)(H,37,38)/b13-9+,15-14+/t22-,23-,27-,28+,31+/m1/s1",OVOJAAKFACTXHX-IJAGWASISA-N,10555920,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1148,Cryptophycin 28,Cryptophycin-28,Cryptophycin,,C34H41ClN2O7,624.2602294,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)C/C=C/C2=CC=CC=C2)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C34H41ClN2O7/c1-22(2)18-30-34(41)43-26(13-8-12-24-10-6-5-7-11-24)14-9-15-31(38)37-28(32(39)36-21-23(3)33(40)44-30)20-25-16-17-29(42-4)27(35)19-25/h5-12,15-17,19,22-23,26,28,30H,13-14,18,20-21H2,1-4H3,(H,36,39)(H,37,38)/b12-8+,15-9+/t23-,26-,28-,30+/m1/s1",YMZVKVLSUBCSND-DWEOSBBHSA-N,10508182,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1149,Cryptophycin 29,Cryptophycin-29,Cryptophycin,,C34H41ClN2O7,624.2602294,C[C@H](/C=C/C1=CC=CC=C1)[C@@H]2C/C=C/C(=O)N[C@@H](C(=O)NCCC(=O)O[C@H](C(=O)O2)CC(C)C)CC3=CC(=C(C=C3)OC)Cl,"InChI=1S/C34H41ClN2O7/c1-22(2)19-30-34(41)44-28(23(3)13-14-24-9-6-5-7-10-24)11-8-12-31(38)37-27(33(40)36-18-17-32(39)43-30)21-25-15-16-29(42-4)26(35)20-25/h5-10,12-16,20,22-23,27-28,30H,11,17-19,21H2,1-4H3,(H,36,40)(H,37,38)/b12-8+,14-13+/t23-,27-,28+,30+/m1/s1",XFXOMGLTDWTPTP-SEZBCZDQSA-N,10371754,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1150,Cryptophycin 49,Cryptophycin-49,Cryptophycin,,C34H41ClN2O7,624.2602294,CCC[C@H]1C(=O)O[C@@H](C/C=C/C(=O)N[C@@H](C(=O)NC[C@H](C(=O)O1)C)CC2=CC(=C(C=C2)OC)Cl)[C@H](C)/C=C/C3=CC=CC=C3,"InChI=1S/C34H41ClN2O7/c1-5-10-30-34(41)43-28(22(2)15-16-24-11-7-6-8-12-24)13-9-14-31(38)37-27(32(39)36-21-23(3)33(40)44-30)20-25-17-18-29(42-4)26(35)19-25/h6-9,11-12,14-19,22-23,27-28,30H,5,10,13,20-21H2,1-4H3,(H,36,39)(H,37,38)/b14-9+,16-15+/t22-,23-,27-,28+,30+/m1/s1",YEERJYOOOZZKJG-WZRSQFIPSA-N,11802061,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1151,Cryptophycin 23,Cryptophycin-23,Cryptophycin,,C34H40Cl2N2O8,674.2161717,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)[C@@H]2[C@H](O2)C3=CC=CC=C3)CC4=CC(=C(C(=C4)Cl)O)Cl,"InChI=1S/C34H40Cl2N2O8/c1-18(2)13-27-34(43)44-26(20(4)30-31(46-30)22-9-6-5-7-10-22)11-8-12-28(39)38-25(32(41)37-17-19(3)33(42)45-27)16-21-14-23(35)29(40)24(36)15-21/h5-10,12,14-15,18-20,25-27,30-31,40H,11,13,16-17H2,1-4H3,(H,37,41)(H,38,39)/b12-8+/t19-,20+,25-,26+,27+,30-,31-/m1/s1",WNKVYYZASJQZMX-YFBMXWBHSA-N,10699692,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1152,Cryptophycin 326,Cryptophycin-326,Cryptophycin,,C34H40Cl2N2O8,674.2161717,C[C@@H]([C@@H]1C/C=C/C(=O)N[C@@H](C(=O)NCCC(=O)O[C@H](C(=O)O1)CC(C)C)CC2=CC(=C(C(=C2)Cl)OC)Cl)[C@@H]3[C@H](O3)C4=CC=CC=C4,"InChI=1S/C34H40Cl2N2O8/c1-19(2)15-27-34(42)45-26(20(3)30-31(46-30)22-9-6-5-7-10-22)11-8-12-28(39)38-25(33(41)37-14-13-29(40)44-27)18-21-16-23(35)32(43-4)24(36)17-21/h5-10,12,16-17,19-20,25-27,30-31H,11,13-15,18H2,1-4H3,(H,37,41)(H,38,39)/b12-8+/t20-,25+,26-,27-,30+,31+/m0/s1",CMKDWVQADDGVPU-QXLIMSJFSA-N,11169871,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1153,Cryptophycin 45,Cryptophycin-45,Cryptophycin,,C34H40Cl2N2O7,658.221257,C[C@@H]1CNC(=O)[C@H](NC(=O)/C=C/C[C@H](OC(=O)[C@@H](OC1=O)CC(C)C)[C@H](C)/C=C/C2=CC=CC=C2)CC3=CC(=C(C(=C3)Cl)O)Cl,"InChI=1S/C34H40Cl2N2O7/c1-20(2)15-29-34(43)44-28(21(3)13-14-23-9-6-5-7-10-23)11-8-12-30(39)38-27(32(41)37-19-22(4)33(42)45-29)18-24-16-25(35)31(40)26(36)17-24/h5-10,12-14,16-17,20-22,27-29,40H,11,15,18-19H2,1-4H3,(H,37,41)(H,38,39)/b12-8+,14-13+/t21-,22-,27-,28+,29+/m1/s1",ISTUVLRTAHDXQL-DQHTXJPTSA-N,10746911,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1154,Tolyporphin E,,other cyclic non-peptide,porphyrins,C34H36N4O8,628.2533141,CC1C(CC(C(O1)C2(C3=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C6C(=CC(=CC(=N3)C2=O)N6)C)(C)OC(=O)C)C)C)OC(=O)C)O,"InChI=1S/C34H36N4O8/c1-15-9-21-11-28-33(6,32-27(45-18(4)39)14-26(41)17(3)44-32)30(42)24(37-28)10-20-8-16(2)23(35-20)13-29-34(7,46-19(5)40)31(43)25(38-29)12-22(15)36-21/h8-13,17,26-27,32,35-36,41H,14H2,1-7H3",ORIYDESLCYSDRU-UHFFFAOYSA-N,139587192,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1155,Dragonamide B,,other linear peptide,Carmabin,C33H59N5O5,605.45162,C[C@@H](CCCCC#C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N,"InChI=1S/C33H59N5O5/c1-15-16-17-18-19-24(10)30(40)36(12)26(21(4)5)32(42)38(14)28(23(8)9)33(43)37(13)27(22(6)7)31(41)35(11)25(20(2)3)29(34)39/h1,20-28H,16-19H2,2-14H3,(H2,34,39)/t24-,25-,26-,27-,28-/m0/s1",DMKFTARWVIEXGT-XLIKFSOKSA-N,16737470,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1156,Dragonamide C,,other linear peptide,Carmabin,C33H57N5O6,619.4308846,CC(C)[C@@H](C(=O)N)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)/C=C(\CCCC#C)/OC,"InChI=1S/C33H57N5O6/c1-15-16-17-18-24(44-14)19-25(39)35(10)27(21(4)5)31(41)37(12)29(23(8)9)33(43)38(13)28(22(6)7)32(42)36(11)26(20(2)3)30(34)40/h1,19-23,26-29H,16-18H2,2-14H3,(H2,34,40)/b24-19+/t26-,27-,28-,29-/m0/s1",KDOGKGLXTJQXRR-USBBLSJNSA-N,24878746,yes,Lyngbya,polychroa,n.a.
CyanoMetDB_1157,Microginin 620A,,Microginin,,C33H56N4O7,620.4149002,CCCCCCCC(C(C(NC(C(N(C)C(C(N(C)C(CC1=CC=C(O)C=C1)C(O)=O)=O)CC(C)C)=O)C(C)C)=O)O)NC,"InChI=1S/C33H56N4O7/c1-9-10-11-12-13-14-25(34-6)29(39)30(40)35-28(22(4)5)32(42)36(7)26(19-21(2)3)31(41)37(8)27(33(43)44)20-23-15-17-24(38)18-16-23/h15-18,21-22,25-29,34,38-39H,9-14,19-20H2,1-8H3,(H,35,40)(H,43,44)",BVOBIHWGOVWVCP-UHFFFAOYSA-N,146684939,no,n.a.,n.a.,n.a.
CyanoMetDB_1158,Microginin 620B,,Microginin,,C33H56N4O7,620.4149002,CCCCCCCC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)CC(C)C)=O)CC(C)C)=O)O)NC,"InChI=1S/C33H56N4O7/c1-8-9-10-11-12-13-25(34-6)29(39)31(41)35-26(18-21(2)3)32(42)37(7)28(19-22(4)5)30(40)36-27(33(43)44)20-23-14-16-24(38)17-15-23/h14-17,21-22,25-29,34,38-39H,8-13,18-20H2,1-7H3,(H,35,41)(H,36,40)(H,43,44)",BHNWOFWIABVRBK-UHFFFAOYSA-N,146684940,no,n.a.,n.a.,n.a.
CyanoMetDB_1159,Mirabimide A,,other linear peptide,Microcolin/Mirabimide,C33H56N4O7,620.4149002,CN([C@H](C(O[C@H](C(N(C)[C@H](C(N1[C@@H](C(N2[C@@H](C(OC)=CC2=O)C(C)C)=O)CCC1)=O)C(C)C)=O)[C@H](CC)C)=O)CC(C)C)C,"InChI=1S/C33H56N4O7/c1-13-22(8)29(44-33(42)24(34(9)10)17-19(2)3)32(41)35(11)28(21(6)7)31(40)36-16-14-15-23(36)30(39)37-26(38)18-25(43-12)27(37)20(4)5/h18-24,27-29H,13-17H2,1-12H3/t22-,23+,24-,27+,28-,29-/m0/s1",HWFRVWXLBKHDOI-RKMTVKOKSA-N,146683645,yes,Scytonema,mirabilis,n.a.
CyanoMetDB_1160,Microginin 649,,Microginin,,C33H55N5O8,649.4050638,CCCCCCCC(C(C(NC(C(NC(C(NC(CC(C)C)C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)=O)C(C)C)=O)C)=O)O)N,"InChI=1S/C33H55N5O8/c1-7-8-9-10-11-12-24(34)28(40)32(44)35-21(6)29(41)38-27(20(4)5)31(43)36-25(17-19(2)3)30(42)37-26(33(45)46)18-22-13-15-23(39)16-14-22/h13-16,19-21,24-28,39-40H,7-12,17-18,34H2,1-6H3,(H,35,44)(H,36,43)(H,37,42)(H,38,41)(H,45,46)",GVNAHVNLGQRLGJ-UHFFFAOYSA-N,146684941,no,n.a.,n.a.,n.a.
CyanoMetDB_1161,Microginin 683,,Microginin,,C33H54ClN5O8,683.3660914,NC(C(C(NC(C(NC(C(NC(CC(C)C)C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)=O)C(C)C)=O)C)=O)O)CCCCCCCCl,"InChI=1S/C33H54ClN5O8/c1-19(2)17-25(30(43)38-26(33(46)47)18-22-12-14-23(40)15-13-22)37-31(44)27(20(3)4)39-29(42)21(5)36-32(45)28(41)24(35)11-9-7-6-8-10-16-34/h12-15,19-21,24-28,40-41H,6-11,16-18,35H2,1-5H3,(H,36,45)(H,37,44)(H,38,43)(H,39,42)(H,46,47)",AUVIZNMRPOJULG-UHFFFAOYSA-N,146684942,no,n.a.,n.a.,n.a.
CyanoMetDB_1162,Malyngamide J,,other linear non-peptide,Malyngamide,C33H53NO9,607.3720323,CCCCCCC[C@H](OC)C/C=C/CCC(NCCC([C@@]12[C@H]([C@H](O[C@H]3OC[C@H](OC)[C@@H](O)[C@@H]3OC)C=C(C)C2=O)O1)=C)=O,"InChI=1S/C33H53NO9/c1-7-8-9-10-12-15-24(38-4)16-13-11-14-17-27(35)34-19-18-23(3)33-30(37)22(2)20-25(31(33)43-33)42-32-29(40-6)28(36)26(39-5)21-41-32/h11,13,20,24-26,28-29,31-32,36H,3,7-10,12,14-19,21H2,1-2,4-6H3,(H,34,35)/b13-11+/t24-,25+,26-,28+,29-,31-,32+,33+/m0/s1",UZMVEOVJASEKLP-SRAVHFRASA-N,21673409,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1163,Microginin 717,,Microginin,,C33H53Cl2N5O8,717.3271191,NC(C(C(NC(C(NC(C(NC(CC(C)C)C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)=O)C(C)C)=O)C)=O)O)CCCCCCC(Cl)Cl,"InChI=1S/C33H53Cl2N5O8/c1-18(2)16-24(30(44)39-25(33(47)48)17-21-12-14-22(41)15-13-21)38-31(45)27(19(3)4)40-29(43)20(5)37-32(46)28(42)23(36)10-8-6-7-9-11-26(34)35/h12-15,18-20,23-28,41-42H,6-11,16-17,36H2,1-5H3,(H,37,46)(H,38,45)(H,39,44)(H,40,43)(H,47,48)",PGOCYMDESLNMJY-UHFFFAOYSA-N,146684943,no,n.a.,n.a.,n.a.
CyanoMetDB_1164,Porpoisamide B,,other cyclic peptide,other cyclic depsipeptide,C33H50N4O6,598.3730353,CCCCC[C@@H]1[C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@@H](C(=O)N[C@H](C(=O)N1)C)CC3=CC=CC=C3)C)[C@@H](C)CC)C,"InChI=1S/C33H50N4O6/c1-7-9-11-17-25-22(4)33(42)43-28(21(3)8-2)32(41)37-19-14-18-26(37)31(40)36(6)27(20-24-15-12-10-13-16-24)30(39)34-23(5)29(38)35-25/h10,12-13,15-16,21-23,25-28H,7-9,11,14,17-20H2,1-6H3,(H,34,39)(H,35,38)/t21-,22+,23-,25+,26-,27+,28-/m0/s1",JLTRPFNFKJZRBM-RQOKZZPKSA-N,57392123,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1165,Porpoisamide A,,other cyclic peptide,other cyclic depsipeptide,C33H50N4O6,598.3730353,CCCCC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@@H](C(=O)N[C@H](C(=O)N1)C)CC3=CC=CC=C3)C)[C@@H](C)CC)C,"InChI=1S/C33H50N4O6/c1-7-9-11-17-25-22(4)33(42)43-28(21(3)8-2)32(41)37-19-14-18-26(37)31(40)36(6)27(20-24-15-12-10-13-16-24)30(39)34-23(5)29(38)35-25/h10,12-13,15-16,21-23,25-28H,7-9,11,14,17-20H2,1-6H3,(H,34,39)(H,35,38)/t21-,22-,23-,25+,26-,27+,28-/m0/s1",JLTRPFNFKJZRBM-BKZRQWESSA-N,57392122,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1166,Yanucamide A,,other cyclic peptide,Yanucamide,C33H47N3O7,597.3414009,CC(C)[C@H]1C(=O)O[C@H](C(=O)N([C@@H](C(=O)NCCC(=O)OC(C(C(=O)N1)(C)C)CCCC#C)CC2=CC=CC=C2)C)C(C)C,"InChI=1S/C33H47N3O7/c1-9-10-12-17-25-33(6,7)32(41)35-27(21(2)3)31(40)43-28(22(4)5)30(39)36(8)24(20-23-15-13-11-14-16-23)29(38)34-19-18-26(37)42-25/h1,11,13-16,21-22,24-25,27-28H,10,12,17-20H2,2-8H3,(H,34,38)(H,35,41)/t24-,25?,27+,28+/m1/s1",UJLAUQGSVXILEB-AEDGQBGKSA-N,21668737,yes,Lyngbya/Moorea; Schizothrix,[Lyngbya/Moorea]majuscula/producens,n.a.
CyanoMetDB_1167,Antillatoxin-B,,other cyclic peptide,Lyngbya toxin (alkaloid),C33H47N3O5,565.3515716,C[C@@H]1[C@H](/C(C)=C/C(C)=C/C(C)(C)C)OC(CNC([C@H](CCC2=CC=CC=C2)N(C)C([C@H](C)NC(CC1=C)=O)=O)=O)=O,"InChI=1S/C33H47N3O5/c1-21(19-33(6,7)8)17-23(3)30-24(4)22(2)18-28(37)35-25(5)32(40)36(9)27(31(39)34-20-29(38)41-30)16-15-26-13-11-10-12-14-26/h10-14,17,19,24-25,27,30H,2,15-16,18,20H2,1,3-9H3,(H,34,39)(H,35,37)/b21-19+,23-17+/t24-,25-,27-,30-/m0/s1",WBQWYSKGOKXFTF-SVVRQYGJSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1168,Spumigin 652,SPU 652,Spumigin,Aeruginosin,C33H44N6O8,652.3220624,OC1=CC=C(CC(OC(C)=O)C(NC(CCC2=CC=C(O)C=C2)C(N3C(C(NC(C=O)CCCNC(N)=N)=O)C[C@H](C)C3)=O)=O)C=C1,"InChI=1S/C33H44N6O8/c1-20-16-28(30(44)37-24(19-40)4-3-15-36-33(34)35)39(18-20)32(46)27(14-9-22-5-10-25(42)11-6-22)38-31(45)29(47-21(2)41)17-23-7-12-26(43)13-8-23/h5-8,10-13,19-20,24,27-29,42-43H,3-4,9,14-18H2,1-2H3,(H,37,44)(H,38,45)(H4,34,35,36)/t20-,24?,27?,28?,29?/m0/s1",RGNYKGKCLHZFNV-RUKLUMRPSA-N,146684832,no,Nodularia,spumigena,"CCNP 1401, CCNP 1403, KAC 11"
CyanoMetDB_1169,Aeruginosin 102A,Aeruginosin 102-A ; Aeruginosin 102 A,Aeruginosin,,C33H44N6O11S,732.2788774,O[C@@H](C(N[C@H](CC1=CC=C(O)C=C1)C(N2C(C(N[C@@H]3C(O)N(C(N)=N)CCC3)=O)CC4C2CC(O)CC4)=O)=O)CC5=CC=C(OS(=O)(O)=O)C=C5,"InChI=1S/C33H44N6O11S/c34-33(35)38-13-1-2-24(31(38)45)36-29(43)27-16-20-7-10-22(41)17-26(20)39(27)32(46)25(14-18-3-8-21(40)9-4-18)37-30(44)28(42)15-19-5-11-23(12-6-19)50-51(47,48)49/h3-6,8-9,11-12,20,22,24-28,31,40-42,45H,1-2,7,10,13-17H2,(H3,34,35)(H,36,43)(H,37,44)(H,47,48,49)/t20?,22?,24-,25+,26?,27?,28+,31?/m0/s1",GIQUSRUOIKSAJD-HFWDDYMOSA-N,10101474,yes,Microcystis,viridis,NIES 102
CyanoMetDB_1170,Aeruginosin 102B,Aeruginosin 102-B ; Aeruginosin 102 B,Aeruginosin,,C33H44N6O11S,732.2788774,O[C@@H](C(N[C@H](CC1=CC=C(O)C=C1)C(N2C(C(N[C@H]3C(O)N(C(N)=N)CCC3)=O)CC4C2CC(O)CC4)=O)=O)CC5=CC=C(OS(=O)(O)=O)C=C5,"InChI=1S/C33H44N6O11S/c34-33(35)38-13-1-2-24(31(38)45)36-29(43)27-16-20-7-10-22(41)17-26(20)39(27)32(46)25(14-18-3-8-21(40)9-4-18)37-30(44)28(42)15-19-5-11-23(12-6-19)50-51(47,48)49/h3-6,8-9,11-12,20,22,24-28,31,40-42,45H,1-2,7,10,13-17H2,(H3,34,35)(H,36,43)(H,37,44)(H,47,48,49)/t20?,22?,24-,25-,26?,27?,28-,31?/m1/s1",GIQUSRUOIKSAJD-PEBUMYOCSA-N,10101473,yes,Microcystis,viridis,NIES 103
CyanoMetDB_1172,Cryptophycin 176,,Cryptophycin,,C33H39ClN2O8,626.2394939,C[C@@H]([C@@H]1C/C=C/C(=O)N[C@@H](C(=O)NCCC(=O)O[C@H](C(=O)O1)CC(C)C)CC2=CC(=C(C=C2)O)Cl)[C@@H]3[C@H](O3)C4=CC=CC=C4,"InChI=1S/C33H39ClN2O8/c1-19(2)16-27-33(41)43-26(20(3)30-31(44-30)22-8-5-4-6-9-22)10-7-11-28(38)36-24(32(40)35-15-14-29(39)42-27)18-21-12-13-25(37)23(34)17-21/h4-9,11-13,17,19-20,24,26-27,30-31,37H,10,14-16,18H2,1-3H3,(H,35,40)(H,36,38)/b11-7+/t20-,24+,26-,27-,30+,31+/m0/s1",ZOBPQYRFOOKIQZ-JZZSZVNESA-N,21591965,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1173,Phycoerythrobilin,,other linear non-peptide,Biliprotein,C33H38N4O6,586.279135,[H]C(N1)(CC2=N/C(C(CCC(O)=O)=C2C)=C/C3=C(CCC(O)=O)C(C)=C(/C=C4NC(C(C)C/4=CC)=O)N3)C(C)=C(C=C)C1=O,"InChI=1S/C33H38N4O6/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/h7-8,14-15,19,26,35H,2,9-13H2,1,3-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b20-7+,27-14+,28-15+",IGJXAXFFKKRFKU-CTGWGENTSA-N,,yes,Phormidium,persicinum,n.a.
CyanoMetDB_1174,Phycocyanobilin,,other linear non-peptide,Biliprotein,C33H38N4O6,586.279135,O=C(NC/1=C/C2=C(C)C(CCC(O)=O)=C(/C=C3N=C(/C=C4NC(C(CC)=C/4C)=O)C(C)=C/3CCC(O)=O)N2)C(C)C1=C/C,"InChI=1S/C33H38N4O6/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/h7,13-15,19,35H,8-12H2,1-6H3,(H,36,43)(H,37,42)(H,38,39)(H,40,41)/b20-7+,26-13+,27-14+,28-15+",INPDFIMLLXXDOQ-KJSSOSAUSA-N,,yes,Phormidium,persicinum,n.a.
CyanoMetDB_1175,Malyngolide dimer,,other linear non-peptide,,C32H60O6,540.4389897,CCCCCCCCC[C@]1(CC[C@H](C(=O)O[C@](CC[C@H](C(=O)O1)C)(CCCCCCCCC)CO)C)CO,"InChI=1S/C32H60O6/c1-5-7-9-11-13-15-17-21-31(25-33)23-19-27(3)30(36)38-32(26-34,24-20-28(4)29(35)37-31)22-18-16-14-12-10-8-6-2/h27-28,33-34H,5-26H2,1-4H3/t27-,28-,31+,32+/m1/s1",YUKFGKYWDWLMAR-CKROWEISSA-N,46211780,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1176,Dragonamide D,,other linear peptide,Carmabin,C32H55N5O6,605.4152,CC(C)[C@@H](C(=O)N)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)CC(=O)CCCC#C,"InChI=1S/C32H55N5O6/c1-14-15-16-17-23(38)18-24(39)34(10)26(20(4)5)30(41)36(12)28(22(8)9)32(43)37(13)27(21(6)7)31(42)35(11)25(19(2)3)29(33)40/h1,19-22,25-28H,15-18H2,2-13H3,(H2,33,40)/t25-,26-,27-,28-/m0/s1",AGFCKPZYFBZCBZ-LJWNLINESA-N,24878793,yes,Lyngbya,polychroa,n.a.
CyanoMetDB_1177,Microginin 606A,,Microginin,,C32H54N4O7,606.3992501,CCCCCCCC(C(C(NC(C(NC(C(N(C)C(CC1=CC=C(O)C=C1)C(O)=O)=O)CC(C)C)=O)C(C)C)=O)O)NC,"InChI=1S/C32H54N4O7/c1-8-9-10-11-12-13-24(33-6)28(38)30(40)35-27(21(4)5)29(39)34-25(18-20(2)3)31(41)36(7)26(32(42)43)19-22-14-16-23(37)17-15-22/h14-17,20-21,24-28,33,37-38H,8-13,18-19H2,1-7H3,(H,34,39)(H,35,40)(H,42,43)",JJYYAKSAIIOBMQ-UHFFFAOYSA-N,146684944,no,n.a.,n.a.,n.a.
CyanoMetDB_1178,Microginin 606B,,Microginin,,C32H54N4O7,606.3992501,CCCCCCCC(C(C(NC(C(N(C)C(C(N(C)C(CC1=CC=C(O)C=C1)C(O)=O)=O)CC(C)C)=O)C(C)C)=O)O)N,"InChI=1S/C32H54N4O7/c1-8-9-10-11-12-13-24(33)28(38)29(39)34-27(21(4)5)31(41)35(6)25(18-20(2)3)30(40)36(7)26(32(42)43)19-22-14-16-23(37)17-15-22/h14-17,20-21,24-28,37-38H,8-13,18-19,33H2,1-7H3,(H,34,39)(H,42,43)",ZTVCLQNALJYQRF-UHFFFAOYSA-N,146684945,no,n.a.,n.a.,n.a.
CyanoMetDB_1179,Mirabimide B,,other linear peptide,Microcolin/Mirabimide,C32H54N4O7,606.3992501,CN([C@H](C(O[C@H](C(N[C@H](C(N1[C@@H](C(N2[C@@H](C(OC)=CC2=O)C(C)C)=O)CCC1)=O)C(C)C)=O)[C@H](CC)C)=O)CC(C)C)C,"InChI=1S/C32H54N4O7/c1-12-21(8)28(43-32(41)23(34(9)10)16-18(2)3)29(38)33-26(19(4)5)31(40)35-15-13-14-22(35)30(39)36-25(37)17-24(42-11)27(36)20(6)7/h17-23,26-28H,12-16H2,1-11H3,(H,33,38)/t21-,22+,23-,26-,27+,28-/m0/s1",DMUKYVSONYODRF-IINHIXHCSA-N,146683646,yes,Scytonema,mirabilis,n.a.
CyanoMetDB_1180,Mirabimide C,,other linear peptide,Microcolin/Mirabimide,C32H54N4O7,606.3992501,CN([C@H](C(O[C@H](C(N(C)[C@H](C(N1[C@@H](C(N2[C@@H](C(OC)=CC2=O)C(C)C)=O)CCC1)=O)C(C)C)=O)C(C)C)=O)CC(C)C)C,"InChI=1S/C32H54N4O7/c1-18(2)16-23(33(9)10)32(41)43-28(21(7)8)31(40)34(11)27(20(5)6)30(39)35-15-13-14-22(35)29(38)36-25(37)17-24(42-12)26(36)19(3)4/h17-23,26-28H,13-16H2,1-12H3/t22-,23+,26-,27+,28+/m1/s1",YOTGKFHYVQWTJS-OZGQDTGISA-N,146683647,yes,Scytonema,mirabilis,n.a.
CyanoMetDB_1181,Aeruginosin NOL4,,Aeruginosin,,C32H52N6O6,616.3948334,O=C(CCCCCCC)N[C@H](C(N1[C@H](C(NC(CO)CCCNC(N)=N)=O)C[C@H]2[C@@H]1CC(O)CC2)=O)CC3=CC=C(O)C=C3 ,"InChI=1S/C32H52N6O6/c1-2-3-4-5-6-9-29(42)37-26(17-21-10-13-24(40)14-11-21)31(44)38-27-19-25(41)15-12-22(27)18-28(38)30(43)36-23(20-39)8-7-16-35-32(33)34/h10-11,13-14,22-23,25-28,39-41H,2-9,12,15-20H2,1H3,(H,36,43)(H,37,42)(H4,33,34,35)/t22-,23?,25?,26-,27-,28-/m0/s1",BTNHSCQRIDKKCL-NOSOXJMZSA-N,146683745,yes,Nodularia,spumigena,n.a.
CyanoMetDB_1182,Microginin KR604,,Microginin,,C32H52N4O7,604.3836,O[C@@H]([C@H](CCCCCCC)NC)C(N[C@H](CC1=CC=C(C=C1)O)C(N([C@@H](CC(C)C)C(N2[C@@H](CCC2)C(O)=O)=O)C)=O)=O,"InChI=1S/C32H52N4O7/c1-6-7-8-9-10-12-24(33-4)28(38)29(39)34-25(20-22-14-16-23(37)17-15-22)30(40)35(5)27(19-21(2)3)31(41)36-18-11-13-26(36)32(42)43/h14-17,21,24-28,33,37-38H,6-13,18-20H2,1-5H3,(H,34,39)(H,42,43)/t24-,25+,26-,27-,28-/m0/s1",GPDYVBKEQKRQEM-IXSXPGEMSA-N,146683792,yes,n.a.,n.a.,n.a.
CyanoMetDB_1183,Microginin KR638,,Microginin,,C32H51ClN4O7,638.3446277,O[C@@H]([C@H](CCCCCCCCl)NC)C(N[C@H](CC1=CC=C(C=C1)O)C(N([C@@H](CC(C)C)C(N2[C@@H](CCC2)C(O)=O)=O)C)=O)=O,"InChI=1S/C32H51ClN4O7/c1-21(2)19-27(31(42)37-18-10-12-26(37)32(43)44)36(4)30(41)25(20-22-13-15-23(38)16-14-22)35-29(40)28(39)24(34-3)11-8-6-5-7-9-17-33/h13-16,21,24-28,34,38-39H,5-12,17-20H2,1-4H3,(H,35,40)(H,43,44)/t24-,25+,26-,27-,28-/m0/s1",XKHYSDRFYVFNEQ-IXSXPGEMSA-N,146683793,yes,n.a.,n.a.,n.a.
CyanoMetDB_1184,Aeruginosin NAL3,NAL 3,Aeruginosin,,C32H50N6O6,614.3791834,O=C(CCCCCCC)N[C@H](C(N1[C@H](C(NC(C=O)CCCNC(N)=N)=O)C[C@H]2[C@@H]1CC(O)CC2)=O)CC3=CC=C(O)C=C3,"InChI=1S/C32H50N6O6/c1-2-3-4-5-6-9-29(42)37-26(17-21-10-13-24(40)14-11-21)31(44)38-27-19-25(41)15-12-22(27)18-28(38)30(43)36-23(20-39)8-7-16-35-32(33)34/h10-11,13-14,20,22-23,25-28,40-41H,2-9,12,15-19H2,1H3,(H,36,43)(H,37,42)(H4,33,34,35)/t22-,23?,25?,26-,27-,28-/m0/s1",VXNDIAFIQMKCRY-NOSOXJMZSA-N,146683746,yes,Nodularia,spumigena,n.a.
CyanoMetDB_1185,Debromoaplysiatoxin,,other cyclic non-peptide,Lyngbya toxin (alkaloid),C32H48O10,592.3247477,C[C@@H](O)[C@@H](C1)OC(C[C@@]2(O)[C@H](C)CC(C)(C)[C@]3(C[C@@H]([C@H](C)[C@H](O3)[C@@H](C)CC[C@H](OC)C4=CC=CC(O)=C4)OC1=O)O2)=O,"InChI=1S/C32H48O10/c1-18(11-12-24(38-7)22-9-8-10-23(34)13-22)29-20(3)26-16-32(41-29)30(5,6)15-19(2)31(37,42-32)17-28(36)39-25(21(4)33)14-27(35)40-26/h8-10,13,18-21,24-26,29,33-34,37H,11-12,14-17H2,1-7H3/t18-,19+,20-,21+,24?,25+,26-,29+,31-,32-/m0/s1",REAZZDPREXHWNV-WGFKPZAYSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1186,Manauealide A,,other cyclic non-peptide,Lyngbya toxin (alkaloid),C32H47ClO10,626.2857754,CC1CC(C23CC(C(C(O2)C(C)CCC(C4=CC(=C(C=C4)Cl)O)OC)C)OC(=O)CC(OC(=O)CC1(O3)O)C(C)O)(C)C,"InChI=1S/C32H47ClO10/c1-17(8-11-24(39-7)21-9-10-22(33)23(35)12-21)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17?,18-,19+,20?,24?,25-,26+,29-,31+,32+/m1/s1",IQIMZKXKJXCPHT-OSBQTIMZSA-N,10651594,yes,Gracilaria,coronopifolia,n.a.
CyanoMetDB_1187,Aplysiatoxin,Aplysiatoxin (AT),other cyclic non-peptide,Lyngbya toxin,C32H47BrO10,670.235261,C[C@@H](O)[C@@H](C1)OC(C[C@@]2(O)[C@H](C)CC(C)(C)[C@]3(C[C@@H]([C@H](C)[C@H](O3)[C@@H](C)CC[C@H](OC)C4=C(Br)C=CC(O)=C4)OC1=O)O2)=O,"InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)22-12-21(35)9-10-23(22)33)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24-,25+,26-,29+,31-,32-/m0/s1",RHJPBGWFGOAEID-OPUUOLMTSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1188,Manauealide B,,other cyclic non-peptide,Lyngbya toxin,C32H47BrO10,670.235261,CC1CC(C23CC(C(C(O2)C(C)CCC(C4=CC(=C(C=C4)Br)O)OC)C)OC(=O)CC(OC(=O)CC1(O3)O)C(C)O)(C)C,"InChI=1S/C32H47BrO10/c1-17(8-11-24(39-7)21-9-10-22(33)23(35)12-21)29-19(3)26-15-32(42-29)30(5,6)14-18(2)31(38,43-32)16-28(37)40-25(20(4)34)13-27(36)41-26/h9-10,12,17-20,24-26,29,34-35,38H,8,11,13-16H2,1-7H3/t17-,18+,19-,20+,24?,25+,26-,29+,31-,32-/m0/s1",YTEIBWLHCKUPNQ-OPUUOLMTSA-N,,yes,Gracilaria,coronopifolia,n.a.
CyanoMetDB_1189,Anhydrodebromoaplysiatoxin,,other cyclic non-peptide,Lyngbya toxin (alkaloid),C32H46O9,574.3141831,C[C@@H](O)[C@@H](C1)OC(CC2=C(C)CC(C)(C)[C@]3(C[C@@H]([C@H](C)[C@H](O3)[C@@H](C)CC[C@H](OC)C4=CC=CC(O)=C4)OC1=O)O2)=O,"InChI=1S/C32H46O9/c1-18(11-12-24(37-7)22-9-8-10-23(34)13-22)30-20(3)27-17-32(41-30)31(5,6)16-19(2)25(40-32)14-28(35)38-26(21(4)33)15-29(36)39-27/h8-10,13,18,20-21,24,26-27,30,33-34H,11-12,14-17H2,1-7H3/t18-,20-,21+,24?,26+,27-,30+,32+/m0/s1",HCEQACRMJXGKHI-PXLWUNTHSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1190,neo-debromoaplysiatoxin A,,other linear non-peptide,Aplysiatoxin,C32H46O10,590.3090977,OC1=CC=CC([C@H](CC[C@H](C)[C@@H](O[C@@]2(C(C[C@@](C)(O)C([C@@H]23)=O)(C)C)C4)[C@@H](C)[C@H]4OC(C[C@H]([C@@H](C)O)OC3=O)=O)OC)=C1,"InChI=1S/C32H46O10/c1-17(11-12-22(39-7)20-9-8-10-21(34)13-20)27-18(2)24-15-32(42-27)26(28(36)31(6,38)16-30(32,4)5)29(37)41-23(19(3)33)14-25(35)40-24/h8-10,13,17-19,22-24,26-27,33-34,38H,11-12,14-16H2,1-7H3/t17-,18-,19+,22-,23+,24-,26+,27+,31+,32-/m0/s1",MDZUICXVWBXOLO-ZNCFBNBISA-N,146683880,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1191,Aeruginosin TR642,,Aeruginosin,,C32H46N6O8,642.3377125,OC1=CC=C(C[C@@H](O)C(N[C@H]([C@@H](C)CC)C(N2[C@@H](C(NC3C(O)N(C(N)=N)C=CC3)=O)C[C@@H]4[C@H]2C[C@H](OC(C)=O)CC4)=O)=O)C=C1,"InChI=1S/C32H46N6O8/c1-4-17(2)27(36-29(43)26(41)14-19-7-10-21(40)11-8-19)31(45)38-24-16-22(46-18(3)39)12-9-20(24)15-25(38)28(42)35-23-6-5-13-37(30(23)44)32(33)34/h5,7-8,10-11,13,17,20,22-27,30,40-41,44H,4,6,9,12,14-16H2,1-3H3,(H3,33,34)(H,35,42)(H,36,43)/t17-,20+,22+,23?,24+,25+,26+,27+,30?/m0/s1",IPAUUKVDEGTVSH-GRAMBCKYSA-N,139590550,yes,n.a.,n.a.,n.a.
CyanoMetDB_1192,19-Bromoaplysiatoxin,,other cyclic non-peptide,,C32H46Br2O10,748.145774,C[C@@H](O)[C@@H](C1)OC(C[C@@]2(O)[C@H](C)CC(C)(C)[C@]3(C[C@@H]([C@H](C)[C@H](O3)[C@@H](C)CC[C@H](OC)C4=C(Br)C=C(Br)C(O)=C4)OC1=O)O2)=O,"InChI=1S/C32H46Br2O10/c1-16(8-9-24(40-7)20-10-23(36)22(34)11-21(20)33)29-18(3)26-14-32(43-29)30(5,6)13-17(2)31(39,44-32)15-28(38)41-25(19(4)35)12-27(37)42-26/h10-11,16-19,24-26,29,35-36,39H,8-9,12-15H2,1-7H3/t16-,17+,18-,19+,24?,25+,26-,29+,31-,32-/m0/s1",PIULICRFTROOFA-ZBUZRZQESA-N,,yes,Oscillatoria/Planktothrix,nigro-viridis ,n.a.
CyanoMetDB_1193,Ulongamide B,,Cyclamide,Depsipeptide,C32H45N5O7S,643.30397,CCC[C@@H]1[C@H](C(=O)O[C@H](C(=O)N(C(C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)C(C)C)C)CC3=CC=C(C=C3)O)C)C)C,"InChI=1S/C32H45N5O7S/c1-9-10-23-18(4)32(43)44-20(6)30(41)36(7)25(15-21-11-13-22(38)14-12-21)31(42)37(8)26(17(2)3)28(40)33-19(5)29-35-24(16-45-29)27(39)34-23/h11-14,16-20,23,25-26,38H,9-10,15H2,1-8H3,(H,33,40)(H,34,39)/t18-,19+,20+,23-,25?,26+/m1/s1",GGYQVLOCMGQKAQ-RJKFGBTCSA-N,139583605,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1194,Guineamide B,,other cyclic peptide,Obyanamide,C32H45N5O6S,627.3090554,C[C@H]1C2=NC(=CS2)C(=O)NC(C(C(=O)O[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)C(C)C)C)C(C)C)C)C,"InChI=1S/C32H45N5O6S/c1-17(2)25-30(40)36(8)24(15-22-13-11-10-12-14-22)28(39)34-21(7)29-35-23(16-44-29)27(38)33-20(6)19(5)32(42)43-26(18(3)4)31(41)37(25)9/h10-14,16-21,24-26H,15H2,1-9H3,(H,33,38)(H,34,39)/t19?,20?,21-,24-,25-,26-/m0/s1",HCDWKPJRUMSHJR-LYUNOVLRSA-N,10461639,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1195,Ulongamide A,,Cyclamide,Depsipeptide,C32H45N5O6S,627.3090554,CCC[C@@H]1[C@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)C(C)C)C)CC3=CC=CC=C3)C)C)C,"InChI=1S/C32H45N5O6S/c1-9-13-23-19(4)32(42)43-21(6)30(40)36(7)25(16-22-14-11-10-12-15-22)31(41)37(8)26(18(2)3)28(39)33-20(5)29-35-24(17-44-29)27(38)34-23/h10-12,14-15,17-21,23,25-26H,9,13,16H2,1-8H3,(H,33,39)(H,34,38)/t19-,20+,21+,23-,25+,26+/m1/s1",LKFYCKOJWDHZOF-XJRDRPONSA-N,10985040,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1196,Anhydroaplysiatoxin,,other cyclic peptide,Lyngbya toxin (alkaloid),C33H48O9,588.3298331,CC1=C2O[C@]3(C[C@H]([C@H](C)[C@@H](O3)[C@@H](C)CC[C@H](OC)C4=CC(O)=CC=C4)OC(C[C@H]([C@H](O)CC)OC(C2)=O)=O)C(C)(C)C1,"InChI=1S/C33H48O9/c1-8-24(35)27-16-30(37)40-28-18-33(32(5,6)17-20(3)26(41-33)15-29(36)39-27)42-31(21(28)4)19(2)12-13-25(38-7)22-10-9-11-23(34)14-22/h9-11,14,19,21,24-25,27-28,31,34-35H,8,12-13,15-18H2,1-7H3/t19-,21-,24+,25-,27+,28+,31-,33-/m0/s1",UUUOCJHEVCFLAY-LZSCGKFDSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1197,Spumigin 640,SPU 640,Spumigin,Aeruginosin,C32H44N6O8,640.3220624,OC1=CC=C(CC(OC(C)=O)C(NC(CCC2=CC=C(O)C=C2)C(N3C(C(NC(CO)CCCNC(N)=N)=O)CCC3)=O)=O)C=C1,"InChI=1S/C32H44N6O8/c1-20(40)46-28(18-22-8-13-25(42)14-9-22)30(44)37-26(15-10-21-6-11-24(41)12-7-21)31(45)38-17-3-5-27(38)29(43)36-23(19-39)4-2-16-35-32(33)34/h6-9,11-14,23,26-28,39,41-42H,2-5,10,15-19H2,1H3,(H,36,43)(H,37,44)(H4,33,34,35)",OKCXALXIVQJLMA-UHFFFAOYSA-N,146684833,no,Nodularia,spumigena,"CCNP 1401, CCNP 1403, KAC 11"
CyanoMetDB_1198,Aeruginosin KT608B,"Aeruginosin KT608, Micropeptin KT608",Aeruginosin,,C32H44N6O6,608.3322332,C1C[C@H](C[C@@H]2[C@H]1C[C@@H](N2C(=O)[C@@H](CC3=CC=CC=C3)NC(=O)[C@@H](CC4=CC=C(C=C4)O)O)C(=O)NCCCCN=C(N)N)O,"InChI=1S/C32H44N6O6/c33-32(34)36-15-5-4-14-35-29(42)27-18-22-10-13-24(40)19-26(22)38(27)31(44)25(16-20-6-2-1-3-7-20)37-30(43)28(41)17-21-8-11-23(39)12-9-21/h1-3,6-9,11-12,22,24-28,39-41H,4-5,10,13-19H2,(H,35,42)(H,37,43)(H4,33,34,36)/t22-,24-,25-,26-,27-,28-/m1/s1",HYPWKJJQJSEUDS-BYSSPFSSSA-N,57332918,yes,n.a.,n.a.,n.a.
CyanoMetDB_1199,Aeruginosin KT608A,,Aeruginosin,,C32H44N6O6,608.3322332,O=C([C@H](NC([C@@H](O)CC1=CC=C(O)C=C1)=O)CC2=CC=CC=C2)N3[C@@H](C(NCCCC/N=C(N)/N)=O)C[C@]4([H])[C@@]3([H])C[C@H](O)CC4,"InChI=1S/C32H44N6O6/c33-32(34)36-15-5-4-14-35-29(42)27-18-22-10-13-24(40)19-26(22)38(27)31(44)25(16-20-6-2-1-3-7-20)37-30(43)28(41)17-21-8-11-23(39)12-9-21/h1-3,6-9,11-12,22,24-28,39-41H,4-5,10,13-19H2,(H,35,42)(H,37,43)(H4,33,34,36)/t22-,24-,25-,26-,27-,28+/m1/s1",HYPWKJJQJSEUDS-XGISLDBZSA-N,57332917,yes,n.a.,n.a.,n.a.
CyanoMetDB_1200,Microcin SF608,,Aeruginosin,,C32H44N6O6,608.3322332,C1C[C@H](C[C@H]2[C@@H]1C[C@H](N2C(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](CC4=CC=C(C=C4)O)O)C(=O)NCCCCN=C(N)N)O,"InChI=1S/C32H44N6O6/c33-32(34)36-15-5-4-14-35-29(42)27-18-22-10-13-24(40)19-26(22)38(27)31(44)25(16-20-6-2-1-3-7-20)37-30(43)28(41)17-21-8-11-23(39)12-9-21/h1-3,6-9,11-12,22,24-28,39-41H,4-5,10,13-19H2,(H,35,42)(H,37,43)(H4,33,34,36)/t22-,24+,25-,26-,27-,28-/m0/s1",HYPWKJJQJSEUDS-GFZBRZDVSA-N,10793809,yes,n.a.,n.a.,n.a.
CyanoMetDB_1201,Microginin 612,,Microginin,,C32H44N4O8,612.3159144,CCCCC[C@@H](N)[C@H](O)C(N[C@H](C(N([C@H](C(N1CCC[C@H]1C(O)=O)=O)CC2=CC=C(O)C=C2)C)=O)CC3=CC=C(O)C=C3)=O,"InChI=1S/C32H44N4O8/c1-3-4-5-7-24(33)28(39)29(40)34-25(18-20-9-13-22(37)14-10-20)30(41)35(2)27(19-21-11-15-23(38)16-12-21)31(42)36-17-6-8-26(36)32(43)44/h9-16,24-28,37-39H,3-8,17-19,33H2,1-2H3,(H,34,40)(H,43,44)/t24-,25+,26+,27+,28+/m1/s1",DPIAGPAEHFCIAF-ABTFIVDISA-N,132534544,yes,Microcystis,aeruginosa,UTEX LB 2386
CyanoMetDB_1202,Spumigin J,,Spumigin,Aeruginosin,C32H44N4O8,612.3159144,OC1=CC=C(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(N(C)[C@@H](C(O)=O)CCCCN)=O)C[C@H](C)C2)=O)CCC3=CC=C(O)C=C3)=O)C=C1,"InChI=1S/C32H44N4O8/c1-20-17-27(31(42)35(2)26(32(43)44)5-3-4-16-33)36(19-20)30(41)25(15-10-21-6-11-23(37)12-7-21)34-29(40)28(39)18-22-8-13-24(38)14-9-22/h6-9,11-14,20,25-28,37-39H,3-5,10,15-19,33H2,1-2H3,(H,34,40)(H,43,44)/t20-,25+,26?,27-,28+/m0/s1",GYOYQEPTCVDBLP-BGJRLJGQSA-N,,yes,Anabaena ,compacta,NIES 835
CyanoMetDB_1203,Aeruginosin DA642A,,Aeruginosin,,C32H43ClN6O6,642.2932608,O=C([C@@H](NC([C@@H](O)CC1=CC(Cl)=C(O)C=C1)=O)CC2=CC=CC=C2)N3[C@H](C(NCCCCNC(N)=N)=O)C[C@H]4[C@@H]3C[C@H](O)CC4 ,"InChI=1S/C32H43ClN6O6/c33-23-14-20(8-11-27(23)41)16-28(42)30(44)38-24(15-19-6-2-1-3-7-19)31(45)39-25-18-22(40)10-9-21(25)17-26(39)29(43)36-12-4-5-13-37-32(34)35/h1-3,6-8,11,14,21-22,24-26,28,40-42H,4-5,9-10,12-13,15-18H2,(H,36,43)(H,38,44)(H4,34,35,37)/t21-,22+,24-,25-,26-,28-/m0/s1",LNFDGLKYPWLQGX-CFWNRGJUSA-N,73604008,yes,n.a.,n.a.,n.a.
CyanoMetDB_1204,Aeruginosin DA642B,,Aeruginosin,,C32H43ClN6O6,642.2932608,O=C([C@@H](NC([C@H](O)CC1=CC(Cl)=C(O)C=C1)=O)CC2=CC=CC=C2)N3[C@H](C(NCCCCNC(N)=N)=O)C[C@H]4[C@@H]3C[C@H](O)CC4,"InChI=1S/C32H43ClN6O6/c33-23-14-20(8-11-27(23)41)16-28(42)30(44)38-24(15-19-6-2-1-3-7-19)31(45)39-25-18-22(40)10-9-21(25)17-26(39)29(43)36-12-4-5-13-37-32(34)35/h1-3,6-8,11,14,21-22,24-26,28,40-42H,4-5,9-10,12-13,15-18H2,(H,36,43)(H,38,44)(H4,34,35,37)/t21-,22+,24-,25-,26-,28+/m0/s1",LNFDGLKYPWLQGX-UFIMWVCZSA-N,73603912,yes,n.a.,n.a.,n.a.
CyanoMetDB_1205,Microginin 645,,Microginin,,C32H43ClN4O8,646.2769421,CN(C([C@H](NC([C@H](O)[C@@H](N)CCCCCCl)=O)CC1=CC=C(O)C=C1)=O)[C@H](C(N2CCC[C@@H]2C(O)=O)=O)CC3=CC=C(O)C=C3,"InChI=1S/C32H43ClN4O8/c1-36(27(19-21-10-14-23(39)15-11-21)31(43)37-17-5-7-26(37)32(44)45)30(42)25(18-20-8-12-22(38)13-9-20)35-29(41)28(40)24(34)6-3-2-4-16-33/h8-15,24-28,38-40H,2-7,16-19,34H2,1H3,(H,35,41)(H,44,45)/t24-,25+,26+,27-,28+/m0/s1",ZLZNALHCFDVNII-RKJAVHAZSA-N,,yes,Microcystis,aeruginosa,UTEX LB 2386
CyanoMetDB_1206,Spumigin 654,SPU 654,Spumigin,Aeruginosin,C32H42N6O9,654.301327,OC1=CC=C(CC(OC(C)=O)C(NC(CCC2=CC=C(O)C=C2)C(N3C(C(NC(C(O)=O)CCCNC(N)=N)=O)CCC3)=O)=O)C=C1,"InChI=1S/C32H42N6O9/c1-19(39)47-27(18-21-8-13-23(41)14-9-21)29(43)36-24(15-10-20-6-11-22(40)12-7-20)30(44)38-17-3-5-26(38)28(42)37-25(31(45)46)4-2-16-35-32(33)34/h6-9,11-14,24-27,40-41H,2-5,10,15-18H2,1H3,(H,36,43)(H,37,42)(H,45,46)(H4,33,34,35)",PAHUSUOEHURDBG-UHFFFAOYSA-N,146684834,no,Nodularia,spumigena,"CCNP 1401, CCNP 1403, KAC 11"
CyanoMetDB_1207,Spumigin 638,SPU 638,Spumigin,Aeruginosin,C32H42N6O8,638.3064123,OC1=CC=C(CC(OC(C)=O)C(NC(CCC2=CC=C(O)C=C2)C(N3C(C(NC(C=O)CCCNC(N)=N)=O)CCC3)=O)=O)C=C1,"InChI=1S/C32H42N6O8/c1-20(40)46-28(18-22-8-13-25(42)14-9-22)30(44)37-26(15-10-21-6-11-24(41)12-7-21)31(45)38-17-3-5-27(38)29(43)36-23(19-39)4-2-16-35-32(33)34/h6-9,11-14,19,23,26-28,41-42H,2-5,10,15-18H2,1H3,(H,36,43)(H,37,44)(H4,33,34,35)",QBBDUNLTVSKRAQ-UHFFFAOYSA-N,146684835,no,Nodularia,spumigena,n.a.
CyanoMetDB_1208,Microginin 680,,Microginin,,C32H42Cl2N4O8,680.2379697,CN(C([C@@H](NC([C@@H](O)[C@H](N)CCCCC(Cl)Cl)=O)CC1=CC=C(O)C=C1)=O)[C@H](C(N2CCC[C@H]2C(O)=O)=O)CC3=CC=C(O)C=C3,"InChI=1S/C32H42Cl2N4O8/c1-37(26(18-20-10-14-22(40)15-11-20)31(44)38-16-4-6-25(38)32(45)46)30(43)24(17-19-8-12-21(39)13-9-19)36-29(42)28(41)23(35)5-2-3-7-27(33)34/h8-15,23-28,39-41H,2-7,16-18,35H2,1H3,(H,36,42)(H,45,46)/t23-,24+,25+,26+,28+/m1/s1",NGZPFBMYYAIAEL-VETGFMSWSA-N,132534542,yes,Microcystis,aeruginosa,UTEX LB 2386
CyanoMetDB_1209,Tolyporphin F,,other cyclic non-peptide,porphyrins,C32H34N4O7,586.2427495,CC1C(CC(C(O1)C2(C3=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C6C(=CC(=CC(=N3)C2=O)N6)C)(C)O)C)C)OC(=O)C)O,"InChI=1S/C32H34N4O7/c1-14-8-19-10-26-31(5,30-25(43-17(4)37)13-24(38)16(3)42-30)28(39)22(35-26)9-18-7-15(2)21(33-18)12-27-32(6,41)29(40)23(36-27)11-20(14)34-19/h7-12,16,24-25,30,33-34,38,41H,13H2,1-6H3",ZARYZUPFPJSRQD-UHFFFAOYSA-N,85083486,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1210,Malyngamide E,,other linear non-peptide,Malyngamide,C31H55NO6,537.4029385,CCCCCCCC(C)CC(C/C=C/CCC(=O)NC(COC)C(C1=CC(C(C(C1=O)(C)C)O)C)O)OC,"InChI=1S/C31H55NO6/c1-8-9-10-11-13-16-22(2)19-24(38-7)17-14-12-15-18-27(33)32-26(21-37-6)28(34)25-20-23(3)29(35)31(4,5)30(25)36/h12,14,20,22-24,26,28-29,34-35H,8-11,13,15-19,21H2,1-7H3,(H,32,33)/b14-12+",NSVICYIIAALIHO-WYMLVPIESA-N,71459739,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1211,Lyngbouilloside,,other cyclic non-peptide,,C31H52O10,584.3560479,C[C@@H]1CC[C@](C2)([H])O[C@@](CC(O[C@@](CC/C=C/C=C/CC)(C)C[C@@H]1O)=O)(O)C[C@]2([H])O[C@@H]3O[C@@H](C)[C@H](OC)[C@@H](O)[C@H]3OC,"InChI=1S/C31H52O10/c1-7-8-9-10-11-12-15-30(4)18-24(32)20(2)13-14-22-16-23(17-31(35,40-22)19-25(33)41-30)39-29-28(37-6)26(34)27(36-5)21(3)38-29/h8-11,20-24,26-29,32,34-35H,7,12-19H2,1-6H3/b9-8+,11-10+/t20-,21+,22+,23-,24+,26-,27+,28-,29?,30?,31+/m1/s1",YYWHCGARYFKWST-ATGQZWQESA-N,10371085,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1212,Dysinosin B,,Aeruginosin,,C31H52N6O15S,780.3211362,O=C([C@@H]1N([C@]2(C[C@@H]([C@H](C[C@]2(C1)[H])O)O[C@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO)[H])C(C(C(C)C)NC(C(COS(=O)([O-])=O)OC)=O)=O)NCCC(C/4)=CC[N+]4=C(N)\N,"InChI=1S/C31H52N6O15S/c1-14(2)23(35-28(44)22(49-3)13-50-53(46,47)48)29(45)37-17-10-20(51-30-26(42)25(41)24(40)21(12-38)52-30)19(39)9-16(17)8-18(37)27(43)34-6-4-15-5-7-36(11-15)31(32)33/h5,14,16-26,30,38-42H,4,6-13H2,1-3H3,(H6,32,33,34,35,43,44,46,47,48)/t16-,17+,18-,19+,20+,21-,22?,23?,24-,25+,26-,30+/m1/s1",RPYXLWOZBBICPU-DNZYGRGBSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1213,Gallinamide A,,other linear peptide,linear depsipeptide,C31H52N4O7,592.3836,CC[C@H](C)[C@@H](C(=O)O[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)/C=C/C(=O)N1[C@H](C(=CC1=O)OC)C)N(C)C,"InChI=1S/C31H52N4O7/c1-12-20(6)28(34(9)10)31(40)42-25(16-19(4)5)30(39)33-23(15-18(2)3)29(38)32-21(7)13-14-26(36)35-22(8)24(41-11)17-27(35)37/h13-14,17-23,25,28H,12,15-16H2,1-11H3,(H,32,38)(H,33,39)/b14-13+/t20-,21-,22-,23-,25-,28-/m0/s1",ASRBKZHDORPEHO-KYJIWOQOSA-N,25209862,yes,Schizothrix,n.a.,n.a.
CyanoMetDB_1214,Symplostatin 4,,other linear peptide,linear peptide,C31H52N4O7,592.3836,CC[C@@H](C)[C@@H](C(O[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](C)/C=C/C(N1[C@H](C(OC)=CC1=O)C)=O)=O)=O)=O)N(C)C,"InChI=1S/C31H52N4O7/c1-12-20(6)28(34(9)10)31(40)42-25(16-19(4)5)30(39)33-23(15-18(2)3)29(38)32-21(7)13-14-26(36)35-22(8)24(41-11)17-27(35)37/h13-14,17-23,25,28H,12,15-16H2,1-11H3,(H,32,38)(H,33,39)/b14-13+/t20-,21+,22+,23+,25+,28+/m1/s1",ASRBKZHDORPEHO-ZGLCCBNVSA-N,25209862,yes,n.a.,n.a.,n.a.
CyanoMetDB_1215,Microginin 590B,,Microginin,,C31H50N4O7,590.36795,CCCCCCCC(C(C(NC(C(N(C)C(C(N(CCC1)C1C(O)=O)=O)CC(C)C)=O)CC2=CC=C(O)C=C2)=O)O)N,"InChI=1S/C31H50N4O7/c1-5-6-7-8-9-11-23(32)27(37)28(38)33-24(19-21-13-15-22(36)16-14-21)29(39)34(4)26(18-20(2)3)30(40)35-17-10-12-25(35)31(41)42/h13-16,20,23-27,36-37H,5-12,17-19,32H2,1-4H3,(H,33,38)(H,41,42)",KYDXAZLZVXVQPG-UHFFFAOYSA-N,146684946,no,n.a.,n.a.,n.a.
CyanoMetDB_1216,Lyngbyaloside,,other cyclic non-peptide,Lyngbya toxin,C31H49BrO10,660.250911,C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O[C@H]2C[C@H]3C(C(C/C=C\C(CC(OC(=O)C([C@@](C2)(O3)O)C)/C=C/C=C/Br)C)O)C)OC)OC)OC,"InChI=1S/C31H49BrO10/c1-18-11-10-13-24(33)19(2)25-16-23(41-30-28(38-7)27(37-6)26(36-5)21(4)39-30)17-31(35,42-25)20(3)29(34)40-22(15-18)12-8-9-14-32/h8-12,14,18-28,30,33,35H,13,15-17H2,1-7H3/b11-10-,12-8+,14-9+/t18-,19-,20+,21-,22-,23+,24-,25+,26-,27+,28+,30-,31-/m0/s1",RXKHKYLAQKUTIR-OUZPULKLSA-N,49865665,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1217,2-epi-lyngbyaloside,,other cyclic non-peptide,,C31H49BrO10,660.250911,O[C@@H]1[C@H](C)[C@](C2)([H])O[C@@]([C@@]([H])(C)C(O[C@@H](/C=C/C=C/Br)C[C@@H](C)/C=C\C1)=O)(O)C[C@@H]2O[C@@H]3O[C@@H](C)[C@H](OC)[C@@H](OC)[C@H]3OC,"InChI=1S/C31H49BrO10/c1-18-11-10-13-24(33)19(2)25-16-23(41-30-28(38-7)27(37-6)26(36-5)21(4)39-30)17-31(35,42-25)20(3)29(34)40-22(15-18)12-8-9-14-32/h8-12,14,18-28,30,33,35H,13,15-17H2,1-7H3/b11-10-,12-8+,14-9+/t18-,19-,20-,21-,22-,23+,24-,25+,26-,27+,28+,30-,31-/m0/s1",RXKHKYLAQKUTIR-CZNUVGAJSA-N,46939688,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1218,Aeruginosin LH650,Aeruginosin LH650A;  Aeruginosin LH650B,Aeruginosin,,C31H47ClN6O7,650.3194756,OC1=CC=C(C[C@H](C(N[C@@H](C(N2[C@H](C(N[C@@H]3[C@@H](OC)N(C(N)=N)CCC3)=O)C[C@H]4[C@@H]2C[C@H](O)CC4)=O)CC(C)C)=O)O)C=C1Cl,"InChI=1S/C31H47ClN6O7/c1-16(2)11-22(36-28(43)26(41)13-17-6-9-25(40)20(32)12-17)29(44)38-23-15-19(39)8-7-18(23)14-24(38)27(42)35-21-5-4-10-37(31(33)34)30(21)45-3/h6,9,12,16,18-19,21-24,26,30,39-41H,4-5,7-8,10-11,13-15H2,1-3H3,(H3,33,34)(H,35,42)(H,36,43)/t18-,19+,21-,22+,23-,24-,26+,30?/m0/s1",KSOHSUTZQAOLGJ-NRTCUROASA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1219,Oscillatoxin A,,other cyclic non-peptide,,C31H46O10,578.3090977,[H]C(O)[C@@H](C1)OC(C[C@@]2(O)[C@H](C)CC(C)(C)[C@]3(C[C@@H]([C@H](C)[C@H](O3)[C@@H](C)CC[C@H](OC)C4=CC=CC(O)=C4)OC1=O)O2)=O,"InChI=1S/C31H46O10/c1-18(10-11-24(37-6)21-8-7-9-22(33)12-21)28-20(3)25-15-31(40-28)29(4,5)14-19(2)30(36,41-31)16-27(35)38-23(17-32)13-26(34)39-25/h7-9,12,18-20,23-25,28,32-33,36H,10-11,13-17H2,1-6H3/t18-,19+,20-,23+,24?,25-,28+,30-,31-/m0/s1",GKTXURNRIDXUNG-CBESCSLASA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1220,21-Bromooscillatoxin A,,other cyclic non-peptide,,C31H45BrO10,656.219611,C[C@@H]1CC([C@@]23C[C@@H]([C@@H](C(O2)[C@@H](C)CC[C@@H](C4=C(C=CC(=C4)O)Br)OC)C)OC(=O)C[C@@H](OC(=O)C[C@@]1(O3)O)CO)(C)C,"InChI=1S/C31H45BrO10/c1-17(7-10-24(38-6)22-11-20(34)8-9-23(22)32)28-19(3)25-14-31(41-28)29(4,5)13-18(2)30(37,42-31)15-27(36)39-21(16-33)12-26(35)40-25/h8-9,11,17-19,21,24-25,28,33-34,37H,7,10,12-16H2,1-6H3/t17-,18+,19-,21+,24-,25-,28?,30-,31-/m0/s1",YOLKNISQJFUHRH-WNMMYCDTSA-N,139586612,yes,Oscillatoria/Planktothrix,nigro-viridis ,n.a.
CyanoMetDB_1221,Spumigin A,SPU A,Spumigin,Aeruginosin,C31H44N6O7,612.3271478,C[C@H]1C[C@@H](C(NC(CO)CCCNC(N)=N)=O)N(C([C@H](NC([C@H](O)CC2=CC=C(O)C=C2)=O)CCC3=CC=C(O)C=C3)=O)C1,"InChI=1S/C31H44N6O7/c1-19-15-26(28(42)35-22(18-38)3-2-14-34-31(32)33)37(17-19)30(44)25(13-8-20-4-9-23(39)10-5-20)36-29(43)27(41)16-21-6-11-24(40)12-7-21/h4-7,9-12,19,22,25-27,38-41H,2-3,8,13-18H2,1H3,(H,35,42)(H,36,43)(H4,32,33,34)/t19-,22?,25+,26-,27+/m0/s1",LRHLULGPZSFCCN-NBJYBXKZSA-N,10651408,yes,Nodularia,spumigena,AV1
CyanoMetDB_1222,Dihydrospumigin K,,Spumigin,Aeruginosin,C31H44N6O7,612.3271478,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@H](CCCNC(N)=N)CO)=O)CC(C)C3)=O)=O)C=C1,"InChI=1S/C31H44N6O7/c1-19-15-26(28(42)35-22(18-38)3-2-14-34-31(32)33)37(17-19)30(44)25(16-21-6-11-24(40)12-7-21)36-29(43)27(41)13-8-20-4-9-23(39)10-5-20/h4-7,9-12,19,22,25-27,38-41H,2-3,8,13-18H2,1H3,(H,35,42)(H,36,43)(H4,32,33,34)/t19?,22-,25-,26+,27?/m1/s1",OYLLIRIQZZWJCJ-CBJUXADFSA-N,139589787,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1223,Dihydrospumigin L,,Spumigin,Aeruginosin,C31H44N6O7,612.3271478,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@@H](CCCNC(N)=N)CO)=O)CC(C)C3)=O)=O)C=C1,"InChI=1S/C31H44N6O7/c1-19-15-26(28(42)35-22(18-38)3-2-14-34-31(32)33)37(17-19)30(44)25(16-21-6-11-24(40)12-7-21)36-29(43)27(41)13-8-20-4-9-23(39)10-5-20/h4-7,9-12,19,22,25-27,38-41H,2-3,8,13-18H2,1H3,(H,35,42)(H,36,43)(H4,32,33,34)/t19?,22-,25+,26-,27?/m0/s1",OYLLIRIQZZWJCJ-SNPABIAHSA-N,139589788,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1224,"19,21-Dibromooscillatoxin A",,other cyclic non-peptide,,C31H44Br2O10,734.130124,C[C@@H]1CC([C@@]23C[C@@H]([C@@H](C(O2)[C@@H](C)CC[C@@H](C4=CC(=C(C=C4Br)Br)O)OC)C)OC(=O)C[C@@H](OC(=O)C[C@@]1(O3)O)CO)(C)C,"InChI=1S/C31H44Br2O10/c1-16(7-8-24(39-6)20-10-23(35)22(33)11-21(20)32)28-18(3)25-13-31(42-28)29(4,5)12-17(2)30(38,43-31)14-27(37)40-19(15-34)9-26(36)41-25/h10-11,16-19,24-25,28,34-35,38H,7-9,12-15H2,1-6H3/t16-,17+,18-,19+,24-,25-,28?,30-,31-/m0/s1",DDGGYVOCCJLZJL-YJMWZKKWSA-N,139584730,yes,Oscillatoria/Planktothrix,nigro-viridis ,n.a.
CyanoMetDB_1225,Guineamide A,,other cyclic peptide,Obyanamide,C31H43N5O6S,613.2934053,CC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)CC3=CC=CC=C3)C)C(C)C)C)C)C,"InChI=1S/C31H43N5O6S/c1-9-22-18(4)31(41)42-20(6)29(39)36(8)25(17(2)3)30(40)35(7)24(15-21-13-11-10-12-14-21)27(38)32-19(5)28-34-23(16-43-28)26(37)33-22/h10-14,16-20,22,24-25H,9,15H2,1-8H3,(H,32,38)(H,33,37)/t18-,19-,20-,22+,24-,25-/m0/s1",GPTJWGYTFCSLIR-CMDJPLBESA-N,10865023,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1226,Spumigin B1,,Spumigin,Aeruginosin,C31H42N6O8,626.3064123,OC1=CC=C(C[C@H](C(N[C@@H](C(N2[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)C[C@H](C)C2)=O)CCC3=CC=C(O)C=C3)=O)O)C=C1,"InChI=1S/C31H42N6O8/c1-18-15-25(27(41)36-24(30(44)45)3-2-14-34-31(32)33)37(17-18)29(43)23(13-8-19-4-9-21(38)10-5-19)35-28(42)26(40)16-20-6-11-22(39)12-7-20/h4-7,9-12,18,23-26,38-40H,2-3,8,13-17H2,1H3,(H,35,42)(H,36,41)(H,44,45)(H4,32,33,34)/t18-,23+,24-,25-,26+/m0/s1",MNCDUGJJFHDUNT-DXHIOLLYSA-N,11802077,yes,Nodularia,spumigena,AV1
CyanoMetDB_1227,Spumigin B2,,Spumigin,Aeruginosin,C31H42N6O8,626.3064123,OC1=CC=C(C[C@H](C(N[C@@H](C(N2[C@H](C(N[C@@H](C(O)=O)CCCNC(N)=N)=O)C[C@H](C)C2)=O)CCC3=CC=C(O)C=C3)=O)O)C=C1,"InChI=1S/C31H42N6O8/c1-18-15-25(27(41)36-24(30(44)45)3-2-14-34-31(32)33)37(17-18)29(43)23(13-8-19-4-9-21(38)10-5-19)35-28(42)26(40)16-20-6-11-22(39)12-7-20/h4-7,9-12,18,23-26,38-40H,2-3,8,13-17H2,1H3,(H,35,42)(H,36,41)(H,44,45)(H4,32,33,34)/t18-,23+,24+,25-,26+/m0/s1",MNCDUGJJFHDUNT-XAQLEQOKSA-N,15342342,yes,Nodularia,spumigena,AV1
CyanoMetDB_1228,Spumigin E,SPU E,Spumigin,Aeruginosin,C31H42N6O7,610.3114977,C[C@H]1C[C@H](N(C1)C(=O)[C@@H](CCC2=CC=C(C=C2)O)NC(=O)[C@@H](CC3=CC=C(C=C3)O)O)C(=O)NC(CCCN=C(N)N)C=O,"InChI=1S/C31H42N6O7/c1-19-15-26(28(42)35-22(18-38)3-2-14-34-31(32)33)37(17-19)30(44)25(13-8-20-4-9-23(39)10-5-20)36-29(43)27(41)16-21-6-11-24(40)12-7-21/h4-7,9-12,18-19,22,25-27,39-41H,2-3,8,13-17H2,1H3,(H,35,42)(H,36,43)(H4,32,33,34)/t19-,22?,25+,26-,27+/m0/s1",GNEMRCVXTBTWCG-NBJYBXKZSA-N,71449303,no,Nodularia,spumigena,"AV1, CCY9414"
CyanoMetDB_1229,Spumigin K,,Spumigin,Aeruginosin,C31H42N6O7,610.3114977,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@H](CCCN4C(N)=N)C4O)=O)CC(C)C3)=O)=O)C=C1,"InChI=1S/C31H42N6O7/c1-18-15-25(27(41)34-23-3-2-14-36(29(23)43)31(32)33)37(17-18)30(44)24(16-20-6-11-22(39)12-7-20)35-28(42)26(40)13-8-19-4-9-21(38)10-5-19/h4-7,9-12,18,23-26,29,38-40,43H,2-3,8,13-17H2,1H3,(H3,32,33)(H,34,41)(H,35,42)/t18?,23-,24-,25+,26?,29?/m1/s1",CUYCVKFWPTWZJN-XLOUHILKSA-N,146684839,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1230,Spumigin L,,Spumigin,Aeruginosin,C31H42N6O7,610.3114977,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@@H](CCCN4C(N)=N)C4O)=O)CC(C)C3)=O)=O)C=C1,"InChI=1S/C31H42N6O7/c1-18-15-25(27(41)34-23-3-2-14-36(29(23)43)31(32)33)37(17-18)30(44)24(16-20-6-11-22(39)12-7-20)35-28(42)26(40)13-8-19-4-9-21(38)10-5-19/h4-7,9-12,18,23-26,29,38-40,43H,2-3,8,13-17H2,1H3,(H3,32,33)(H,34,41)(H,35,42)/t18?,23-,24+,25-,26?,29?/m0/s1",CUYCVKFWPTWZJN-HPGRWYDASA-N,146684840,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1231,Spumigin G,SPU G,Spumigin,Aeruginosin,C31H42N6O6,594.3165831,C[C@H]1C[C@H](N(C1)C(=O)[C@@H](CCC2=CC=CC=C2)NC(=O)[C@@H](CC3=CC=C(C=C3)O)O)C(=O)NC(CCCN=C(N)N)C=O,"InChI=1S/C31H42N6O6/c1-20-16-26(28(41)35-23(19-38)8-5-15-34-31(32)33)37(18-20)30(43)25(14-11-21-6-3-2-4-7-21)36-29(42)27(40)17-22-9-12-24(39)13-10-22/h2-4,6-7,9-10,12-13,19-20,23,25-27,39-40H,5,8,11,14-18H2,1H3,(H,35,41)(H,36,42)(H4,32,33,34)/t20-,23?,25+,26-,27+/m0/s1",YGAGCUYKOBGAQX-SYCDWYGJSA-N,139588808,no,Nodularia,spumigena,"AV1, CCY9414"
CyanoMetDB_1232,Glucosylsucrose derivative 3,,other cyclic non-peptide,,C30H52O26,828.2746818,C(C1[C@@H]([C@H]([C@](O1)(CO)OC2C(C(C(C(O2)CO)O)O)O[C@@H]3[C@H](C([C@@H](C(O3)CO)O)O)O[C@@H]4C(C([C@@H](C(O4)CO)O)O)O[C@@H]5[C@H](C([C@@H](C(O5)CO)O)O)O)O)O)O,"InChI=1S/C30H52O26/c31-1-7-12(37)17(42)21(46)26(48-7)52-22-18(43)13(38)8(2-32)49-27(22)53-23-19(44)14(39)9(3-33)50-28(23)54-24-20(45)15(40)10(4-34)51-29(24)56-30(6-36)25(47)16(41)11(5-35)55-30/h7-29,31-47H,1-6H2/t7?,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",JFSPEAOTYUCNFS-RZNBSGJJSA-N,139586875,yes,Nostoc,ellipsosporum,n.a.
CyanoMetDB_1233,Microginin 578A,,Microginin,,C30H50N4O7,578.36795,CCCCCCCC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)CC(C)C)=O)C)=O)O)NC,"InChI=1S/C30H50N4O7/c1-7-8-9-10-11-12-23(31-5)26(36)28(38)32-20(4)29(39)34(6)25(17-19(2)3)27(37)33-24(30(40)41)18-21-13-15-22(35)16-14-21/h13-16,19-20,23-26,31,35-36H,7-12,17-18H2,1-6H3,(H,32,38)(H,33,37)(H,40,41)",ASGNRABWPWMWMJ-UHFFFAOYSA-N,146684947,no,n.a.,n.a.,n.a.
CyanoMetDB_1234,Microginin 578C,,Microginin,,C30H50N4O7,578.36795,CCCCCCCC(C(C(NC(C(N(C)C(C(N(C)C(CC(C)C)C(O)=O)=O)CC1=CC=C(O)C=C1)=O)C)=O)O)N,"InChI=1S/C30H50N4O7/c1-7-8-9-10-11-12-23(31)26(36)27(37)32-20(4)28(38)33(5)24(18-21-13-15-22(35)16-14-21)29(39)34(6)25(30(40)41)17-19(2)3/h13-16,19-20,23-26,35-36H,7-12,17-18,31H2,1-6H3,(H,32,37)(H,40,41)",PNNZPCLTHYPTIC-UHFFFAOYSA-N,146684948,no,n.a.,n.a.,n.a.
CyanoMetDB_1235,Nostoginin BN578,,Microginin,,C30H50N4O7,578.36795,OC([C@H](N(C([C@H](N(C([C@H](NC([C@@H]([C@@H](CCCCC)N)O)=O)C(C)C)=O)C)[C@@H](CC)C)=O)C)CC1=CC=C(C=C1)O)=O,"InChI=1S/C30H50N4O7/c1-8-10-11-12-22(31)26(36)27(37)32-24(18(3)4)28(38)34(7)25(19(5)9-2)29(39)33(6)23(30(40)41)17-20-13-15-21(35)16-14-20/h13-16,18-19,22-26,35-36H,8-12,17,31H2,1-7H3,(H,32,37)(H,40,41)/t19-,22-,23-,24-,25-,26-/m1/s1",UDNHSOSLMVFALQ-GDBHKVHBSA-N,146682034,yes,Nostoc,n.a.,TAU IL-235
CyanoMetDB_1236,Ulongamide F,,Cyclamide,Depsipeptide,C30H49N5O6S,607.3403555,CCC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)N[C@H](C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)C(C)C)C)C(C)C)[C@@H](C)CC)C,"InChI=1S/C30H49N5O6S/c1-11-13-20-18(8)30(40)41-24(17(7)12-2)27(38)34-22(15(3)4)29(39)35(10)23(16(5)6)26(37)31-19(9)28-33-21(14-42-28)25(36)32-20/h14-20,22-24H,11-13H2,1-10H3,(H,31,37)(H,32,36)(H,34,38)/t17-,18-,19-,20+,22-,23-,24-/m0/s1",LOMSNBSLWHBACM-LNJFAXJLSA-N,636676,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1237,18E-lyngbyaloside C,,other cyclic non-peptide,,C30H49BrO10,648.250911,C[C@H](O1)[C@H](OC)[C@@H](OC)[C@@H](OC)[C@@H]1O[C@H]2C[C@](CC(O[C@@](CC/C=C/C=C/Br)(C)C[C@@H](O)[C@@H](CC3)C)=O)(O)O[C@]3([H])C2[H],"InChI=1S/C30H49BrO10/c1-19-11-12-21-15-22(39-28-27(37-6)26(36-5)25(35-4)20(2)38-28)16-30(34,40-21)18-24(33)41-29(3,17-23(19)32)13-9-7-8-10-14-31/h7-8,10,14,19-23,25-28,32,34H,9,11-13,15-18H2,1-6H3/b8-7+,14-10+/t19-,20+,21+,22-,23-,25+,26-,27-,28+,29-,30+/m1/s1",CKTXZFBKOQGTIC-XPFUENKGSA-N,46939689,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1238,Lyngbyaloside B,,other cyclic non-peptide,Lyngbya toxin,C30H49BrO10,648.250911,C[C@H]1CC[C@@H]2[C@H]([C@@H](C[C@@](O2)(CC(=O)O[C@@](C[C@@H]1O)(C)CC/C=C/C=C/Br)O)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)C)OC)OC)O)C,"InChI=1S/C30H49BrO10/c1-18-11-12-22-19(2)23(39-28-25(34)27(37-6)26(36-5)20(3)38-28)16-30(35,40-22)17-24(33)41-29(4,15-21(18)32)13-9-7-8-10-14-31/h7-8,10,14,18-23,25-28,32,34-35H,9,11-13,15-17H2,1-6H3/b8-7+,14-10+/t18-,19+,20+,21-,22+,23+,25-,26+,27+,28+,29-,30+/m1/s1",IFLWJWSXKDLJIN-RHAGIDFESA-N,637091,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1239,Aeruginosin 298A,Aeruginosin 298-A,Aeruginosin,,C30H48N6O7,604.3584479,OC1=CC=C(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(N[C@@H](CCCNC(N)=N)CO)=O)C[C@@]3([H])[C@]2([H])C[C@H](O)CC3)=O)CC(C)C)=O)C=C1,"InChI=1S/C30H48N6O7/c1-17(2)12-23(35-28(42)26(40)13-18-5-8-21(38)9-6-18)29(43)36-24-15-22(39)10-7-19(24)14-25(36)27(41)34-20(16-37)4-3-11-33-30(31)32/h5-6,8-9,17,19-20,22-26,37-40H,3-4,7,10-16H2,1-2H3,(H,34,41)(H,35,42)(H4,31,32,33)/t19-,20-,22+,23+,24-,25-,26+/m0/s1",ZRJNSRDWYFDFAT-HASRRMFUSA-N,11238809,yes,Microcystis, aeruginosa ,NIES 298
CyanoMetDB_1240,Aeruginosin NOL3,NOL 3,Aeruginosin,,C30H48N6O6,588.3635333,CCCCCC(N[C@H](C(N([C@H](C(NC(CO)CCCNC(N)=N)=O)C1)[C@@H]2[C@H]1CCC(O)C2)=O)CC3=CC=C(O)C=C3)=O,"InChI=1S/C30H48N6O6/c1-2-3-4-7-27(40)35-24(15-19-8-11-22(38)12-9-19)29(42)36-25-17-23(39)13-10-20(25)16-26(36)28(41)34-21(18-37)6-5-14-33-30(31)32/h8-9,11-12,20-21,23-26,37-39H,2-7,10,13-18H2,1H3,(H,34,41)(H,35,40)(H4,31,32,33)/t20-,21?,23?,24-,25-,26-/m0/s1",KVEGLZCDCVSBQX-ZHYXHTNASA-N,146683747,yes,Nodularia,spumigena,"AV1, CCY9414 and CH307"
CyanoMetDB_1241,Aeruginosamide,,other linear peptide,Cyanobactine,C30H48N4O4S,560.3396272,CC[C@@H]([C@H](N(C/C=C(C)\C)C/C=C(C)\C)C(N[C@H](C(N1CCC[C@H]1C2=NC(C(OC)=O)=CS2)=O)C(C)C)=O)C,"InChI=1S/C30H48N4O4S/c1-10-22(8)26(33(16-13-19(2)3)17-14-20(4)5)27(35)32-25(21(6)7)29(36)34-15-11-12-24(34)28-31-23(18-39-28)30(37)38-9/h13-14,18,21-22,24-26H,10-12,15-17H2,1-9H3,(H,32,35)/t22-,24-,25-,26-/m0/s1",QGQGLBPVZHTZGT-GKXKVECMSA-N,10840603,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1242,Malyngamide R,,other linear non-peptide,,C30H47ClN2O7,582.3071796,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C\Cl)/C/C(=C\C(=O)N1[C@@H](C(=CC1=O)OC)CO)/OC)OC,"InChI=1S/C30H47ClN2O7/c1-6-7-8-9-11-14-24(38-3)15-12-10-13-16-28(35)32(2)21-23(20-31)17-25(39-4)18-29(36)33-26(22-34)27(40-5)19-30(33)37/h10,12,18-20,24,26,34H,6-9,11,13-17,21-22H2,1-5H3/b12-10+,23-20-,25-18+/t24-,26+/m0/s1",NMCDAOMWRMOQIT-NFXWNFFPSA-N,21606577,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1243,Aeruginosin K139,,Aeruginosin,,C30H46N6O7,602.3427978,O=C(NC(CC(C)C)C(N1C(C(NC2CCCN(C(N)=N)C2O)=O)C[C@H]3[C@@H]1CC(O)CC3)=O)C(O)CC4=CC=C(O)C=C4,"InChI=1S/C30H46N6O7/c1-16(2)12-22(34-27(41)25(39)13-17-5-8-19(37)9-6-17)29(43)36-23-15-20(38)10-7-18(23)14-24(36)26(40)33-21-4-3-11-35(28(21)42)30(31)32/h5-6,8-9,16,18,20-25,28,37-39,42H,3-4,7,10-15H2,1-2H3,(H3,31,32)(H,33,40)(H,34,41)/t18-,20?,21?,22?,23-,24?,25?,28?/m0/s1",KEXHNSJRBLHZIN-AAJPRWQTSA-N,146683750,yes,Microcystis,aeruginosa,K-139
CyanoMetDB_1244,Aeruginosin 602,AER 602,Aeruginosin,,C30H46N6O7,602.3427978,OC1=CC=C(C[C@@H](O)C(N[C@@H](C(N2[C@@H](C(NC(C=O)CCCNC(N)=N)=O)C[C@H]3[C@@H]2CC(O)CC3)=O)CC(C)C)=O)C=C1,"InChI=1S/C30H46N6O7/c1-17(2)12-23(35-28(42)26(40)13-18-5-8-21(38)9-6-18)29(43)36-24-15-22(39)10-7-19(24)14-25(36)27(41)34-20(16-37)4-3-11-33-30(31)32/h5-6,8-9,16-17,19-20,22-26,38-40H,3-4,7,10-15H2,1-2H3,(H,34,41)(H,35,42)(H4,31,32,33)/t19-,20?,22?,23+,24-,25+,26+/m0/s1",TWDUPWHWAGIVAS-JZFUDOPHSA-N,146683925,no,Microcystis,aeruginosa,PCC 7820
CyanoMetDB_1245,Aeruginosin NAL2,NAL 2,Aeruginosin,,C30H46N6O6,586.3478832,CCCCCC(N[C@H](C(N([C@H](C(NC(C=O)CCCNC(N)=N)=O)C1)[C@@H]2[C@H]1CCC(O)C2)=O)CC3=CC=C(O)C=C3)=O,"InChI=1S/C30H46N6O6/c1-2-3-4-7-27(40)35-24(15-19-8-11-22(38)12-9-19)29(42)36-25-17-23(39)13-10-20(25)16-26(36)28(41)34-21(18-37)6-5-14-33-30(31)32/h8-9,11-12,18,20-21,23-26,38-39H,2-7,10,13-17H2,1H3,(H,34,41)(H,35,40)(H4,31,32,33)/t20-,21?,23?,24-,25-,26-/m0/s1",NYGVGDLVEMUBNK-ZHYXHTNASA-N,146683748,yes,Nodularia,spumigena,"V1, CCY9414, CH307"
CyanoMetDB_1246,Aeruginosin 89A-SO3,,Aeruginosin,,C30H45ClN6O10S,716.2606405,ClC1=C(OS(=O)(O)=O)C=CC(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(N[C@@H]3C(O)N(C(N)=N)CCC3)=O)C[C@H]4[C@@H]2C[C@H](O)CC4)=O)CC(C)C)=O)=C1,"InChI=1S/C30H45ClN6O10S/c1-15(2)10-21(35-27(41)24(39)12-16-5-8-25(19(31)11-16)47-48(44,45)46)29(43)37-22-14-18(38)7-6-17(22)13-23(37)26(40)34-20-4-3-9-36(28(20)42)30(32)33/h5,8,11,15,17-18,20-24,28,38-39,42H,3-4,6-7,9-10,12-14H2,1-2H3,(H3,32,33)(H,34,40)(H,35,41)(H,44,45,46)/t17-,18+,20-,21+,22-,23-,24+,28?/m0/s1",HGPSINCIELURHW-OGHGMSAWSA-N,10556802,yes,Microcystis,aeruginosa,NIES 89
CyanoMetDB_1247,Aeruginosin 89B-SO3,,Aeruginosin,,C30H45ClN6O10S,716.2606405,ClC1=C(OS(=O)(O)=O)C=CC(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(N[C@H]3[C@H](O)N(C(N)=N)CCC3)=O)C[C@H]4[C@@H]2CC(O)CC4)=O)CC(C)C)=O)=C1,"InChI=1S/C30H45ClN6O10S/c1-15(2)10-21(35-27(41)24(39)12-16-5-8-25(19(31)11-16)47-48(44,45)46)29(43)37-22-14-18(38)7-6-17(22)13-23(37)26(40)34-20-4-3-9-36(28(20)42)30(32)33/h5,8,11,15,17-18,20-24,28,38-39,42H,3-4,6-7,9-10,12-14H2,1-2H3,(H3,32,33)(H,34,40)(H,35,41)(H,44,45,46)/t17-,18?,20+,21+,22-,23-,24+,28-/m0/s1",HGPSINCIELURHW-JNBAKQLUSA-N,,yes,Microcystis,aeruginosa,NIES 90
CyanoMetDB_1248,Aeruginosin 670,,Aeruginosin,,C30H44Cl2N6O7,670.2648532,OC1=C(Cl)C=C(C=C1Cl)CC(C(NC(CC(C)C)C(N2C(CC3C2CC(CC3)O)C(NC4C(O)N(C(N)=N)CCC4)=O)=O)=O)O,"InChI=1S/C30H44Cl2N6O7/c1-14(2)8-21(36-27(43)24(40)11-15-9-18(31)25(41)19(32)10-15)29(45)38-22-13-17(39)6-5-16(22)12-23(38)26(42)35-20-4-3-7-37(28(20)44)30(33)34/h9-10,14,16-17,20-24,28,39-41,44H,3-8,11-13H2,1-2H3,(H3,33,34)(H,35,42)(H,36,43)",BWARWHZEWXIALB-UHFFFAOYSA-N,146684710,no,n.a.,n.a.,n.a.
CyanoMetDB_1249,Homodolastatin 3,,Cyclamide,Microcyclamide,C30H42N8O6S2,674.2668735,CCC(C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C3=NC(=CS3)C(=O)NCC4=NC(=CS4)C(=O)N1)CCC(=O)N)CC(C)C,"InChI=1S/C30H42N8O6S2/c1-5-16(4)24-30(44)38-10-6-7-21(38)28(43)35-18(11-15(2)3)26(41)34-17(8-9-22(31)39)29-36-19(14-46-29)25(40)32-12-23-33-20(13-45-23)27(42)37-24/h13-18,21,24H,5-12H2,1-4H3,(H2,31,39)(H,32,40)(H,34,41)(H,35,43)(H,37,42)/t16?,17-,18-,21-,24-/m0/s1",MQRGSRJNNVRQHQ-UNKLHJSVSA-N,44575197,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1250,Spumigin D,SPU D,Spumigin,Aeruginosin,C30H42N6O7,598.3114977,OC1=CC=C(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(NC(CCCNC(N)=N)CO)=O)CCC2)=O)CCC3=CC=C(O)C=C3)=O)C=C1,"InChI=1S/C30H42N6O7/c31-30(32)33-15-1-3-21(18-37)34-27(41)25-4-2-16-36(25)29(43)24(14-9-19-5-10-22(38)11-6-19)35-28(42)26(40)17-20-7-12-23(39)13-8-20/h5-8,10-13,21,24-26,37-40H,1-4,9,14-18H2,(H,34,41)(H,35,42)(H4,31,32,33)/t21?,24-,25+,26-/m1/s1",KRNLOYZRJLTDBI-TUJAQADMSA-N,146684744,no,Nodularia,spumigena,"AV1, CCY941"
CyanoMetDB_1251,Dihydrospumigin M,,Spumigin,Aeruginosin,C30H42N6O7,598.3114977,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@H](CCCNC(N)=N)CO)=O)CCC3)=O)=O)C=C1,"InChI=1S/C30H42N6O7/c31-30(32)33-15-1-3-21(18-37)34-27(41)25-4-2-16-36(25)29(43)24(17-20-7-12-23(39)13-8-20)35-28(42)26(40)14-9-19-5-10-22(38)11-6-19/h5-8,10-13,21,24-26,37-40H,1-4,9,14-18H2,(H,34,41)(H,35,42)(H4,31,32,33)/t21-,24-,25+,26?/m1/s1",WKADCTRDFMBYPU-LXRNPWNFSA-N,139589789,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1252,Dihydrospumigin N,,Spumigin,Aeruginosin,C30H42N6O7,598.3114977,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@@H](CCCNC(N)=N)CO)=O)CCC3)=O)=O)C=C1,"InChI=1S/C30H42N6O7/c31-30(32)33-15-1-3-21(18-37)34-27(41)25-4-2-16-36(25)29(43)24(17-20-7-12-23(39)13-8-20)35-28(42)26(40)14-9-19-5-10-22(38)11-6-19/h5-8,10-13,21,24-26,37-40H,1-4,9,14-18H2,(H,34,41)(H,35,42)(H4,31,32,33)/t21-,24+,25-,26?/m0/s1",WKADCTRDFMBYPU-FDHYGZKMSA-N,145974544,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1253,Spumigin 582b,SPU 582b,Spumigin,Aeruginosin,C30H42N6O6,582.3165831,OC1=CC=C(C[C@H](C(N[C@H](C(N2C(C(NCCCCNC(N)=N)=O)CC(C)C2)=O)CCC3=CC=C(O)C=C3)=O)O)C=C1,"InChI=1S/C30H42N6O6/c1-19-16-25(27(40)33-14-2-3-15-34-30(31)32)36(18-19)29(42)24(13-8-20-4-9-22(37)10-5-20)35-28(41)26(39)17-21-6-11-23(38)12-7-21/h4-7,9-12,19,24-26,37-39H,2-3,8,13-18H2,1H3,(H,33,40)(H,35,41)(H4,31,32,34)/t19?,24-,25?,26+/m0/s1",NLJRMAAFNUDGBC-LMOYGDGSSA-N,146684836,no,Nodularia,spumigena,AV1
CyanoMetDB_1254,Obyanamide,,Cyclamide,Depsipeptide,C30H41N5O6S,599.2777552,CC[C@H]1CC(=O)O[C@H](C(=O)N([C@H](C(=O)N([C@H](C(=O)N[C@H](C2=NC(=CS2)C(=O)N1)C)CC3=CC=CC=C3)C)C(C)C)C)C,"InChI=1S/C30H41N5O6S/c1-8-21-15-24(36)41-19(5)29(39)35(7)25(17(2)3)30(40)34(6)23(14-20-12-10-9-11-13-20)27(38)31-18(4)28-33-22(16-42-28)26(37)32-21/h9-13,16-19,21,23,25H,8,14-15H2,1-7H3,(H,31,38)(H,32,37)/t18-,19-,21-,23-,25-/m0/s1",HTERYHQTEBIQTA-USLAZGEGSA-N,636989,yes,Lyngbya,confervoides,n.a.
CyanoMetDB_1255,Spumigin C,SPU C,Spumigin,Aeruginosin,C30H40N6O8,612.2907623,OC1=CC=C(C[C@H](C(N[C@@H](C(N2[C@H](C(NC(CCCNC(N)=N)C(O)=O)=O)CCC2)=O)CCC3=CC=C(O)C=C3)=O)O)C=C1,"InChI=1S/C30H40N6O8/c31-30(32)33-15-1-3-23(29(43)44)35-26(40)24-4-2-16-36(24)28(42)22(14-9-18-5-10-20(37)11-6-18)34-27(41)25(39)17-19-7-12-21(38)13-8-19/h5-8,10-13,22-25,37-39H,1-4,9,14-17H2,(H,34,41)(H,35,40)(H,43,44)(H4,31,32,33)/t22-,23?,24+,25-/m1/s1",JCBBIZWYSLCGPJ-ZTRUVXPPSA-N,139586997,yes,Nodularia,spumigena,AV1
CyanoMetDB_1256,Spumigin F,SPU F,Spumigin,Aeruginosin,C30H40N6O7,596.2958477,OC1=CC=C(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(NC(CCCNC(N)=N)C=O)=O)CCC2)=O)CCC3=CC=C(O)C=C3)=O)C=C1,"InChI=1S/C30H40N6O7/c31-30(32)33-15-1-3-21(18-37)34-27(41)25-4-2-16-36(25)29(43)24(14-9-19-5-10-22(38)11-6-19)35-28(42)26(40)17-20-7-12-23(39)13-8-20/h5-8,10-13,18,21,24-26,38-40H,1-4,9,14-17H2,(H,34,41)(H,35,42)(H4,31,32,33)/t21?,24-,25+,26-/m1/s1",ZSNZKFBMFHDMOM-TUJAQADMSA-N,139588807,no,Nodularia,spumigena,"AV1,  CCY941"
CyanoMetDB_1257,Spumigin M,,Spumigin,Aeruginosin,C30H40N6O7,596.2958477,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@@H]4CCCN(C(N)=N)C4O)=O)CCC3)=O)=O)C=C1,"InChI=1S/C30H40N6O7/c31-30(32)36-16-1-3-22(28(36)42)33-26(40)24-4-2-15-35(24)29(43)23(17-19-7-12-21(38)13-8-19)34-27(41)25(39)14-9-18-5-10-20(37)11-6-18/h5-8,10-13,22-25,28,37-39,42H,1-4,9,14-17H2,(H3,31,32)(H,33,40)(H,34,41)/t22-,23-,24+,25?,28?/m1/s1",QXBUDVOMMRXMPC-NESQBPDXSA-N,146684841,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1258,Spumigin N,,Spumigin,Aeruginosin,C30H40N6O7,596.2958477,OC1=CC=C(CCC(O)C(N[C@H](CC2=CC=C(O)C=C2)C(N3[C@H](C(N[C@H]4CCCN(C(N)=N)C4O)=O)CCC3)=O)=O)C=C1,"InChI=1S/C30H40N6O7/c31-30(32)36-16-1-3-22(28(36)42)33-26(40)24-4-2-15-35(24)29(43)23(17-19-7-12-21(38)13-8-19)34-27(41)25(39)14-9-18-5-10-20(37)11-6-18/h5-8,10-13,22-25,28,37-39,42H,1-4,9,14-17H2,(H3,31,32)(H,33,40)(H,34,41)/t22-,23+,24-,25?,28?/m0/s1",QXBUDVOMMRXMPC-TUSVKCCSSA-N,146684842,yes,Sphaerospermopsis,torques-reginae,ITEP-024
CyanoMetDB_1259,Spumigin H,SPU H,Spumigin,Aeruginosin,C30H40N6O6,580.300933,OC1=CC=C(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(NC(CCCNC(N)=N)C=O)=O)CCC2)=O)CCC3=CC=CC=C3)=O)C=C1,"InChI=1S/C30H40N6O6/c31-30(32)33-16-4-8-22(19-37)34-27(40)25-9-5-17-36(25)29(42)24(15-12-20-6-2-1-3-7-20)35-28(41)26(39)18-21-10-13-23(38)14-11-21/h1-3,6-7,10-11,13-14,19,22,24-26,38-39H,4-5,8-9,12,15-18H2,(H,34,40)(H,35,41)(H4,31,32,33)/t22?,24-,25+,26-/m1/s1",VBJAVXUALMEUNC-SLRGTUBMSA-N,139588809,no,Nodularia,spumigena,"AV1,  CCY941"
CyanoMetDB_1260,Cryptophycin 10,Cryptophycin F,Cryptophycin,,C30H39ClN2O8,590.2394939,C[C@@H](C(O)=O)CNC([C@H](NC(/C=C/C[C@H](O)[C@@H]([C@@H](O)[C@@H](OC)C1=CC=CC=C1)C)=O)CC2=CC(Cl)=C(OC)C=C2)=O,"InChI=1S/C30H39ClN2O8/c1-18(30(38)39)17-32-29(37)23(16-20-13-14-25(40-3)22(31)15-20)33-26(35)12-8-11-24(34)19(2)27(36)28(41-4)21-9-6-5-7-10-21/h5-10,12-15,18-19,23-24,27-28,34,36H,11,16-17H2,1-4H3,(H,32,37)(H,33,35)(H,38,39)/b12-8+/t18-,19+,23-,24+,27-,28+/m1/s1",FTJYIKGBCOJBMK-JIQHABPYSA-N,,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1261,Cryptophycin 66,,Cryptophycin,,C30H38ClN3O6,571.2449137,O[C@H](CC=CC(N[C@@H](C(NC[C@@H](C(NC)=O)C)=O)CC1=CC(Cl)=C(C=C1)OC)=O)[C@H]([C@H]2[C@@H](C3=CC=CC=C3)O2)C,"InChI=1S/C30H38ClN3O6/c1-18(29(37)32-3)17-33-30(38)23(16-20-13-14-25(39-4)22(31)15-20)34-26(36)12-8-11-24(35)19(2)27-28(40-27)21-9-6-5-7-10-21/h5-10,12-15,18-19,23-24,27-28,35H,11,16-17H2,1-4H3,(H,32,37)(H,33,38)(H,34,36)/t18-,19+,23+,24+,27-,28+/m0/s1",RFZXLZAUDICPSI-CUMHWKNSSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1262,Cryptophycin F,"Cryptophycin F methyl ester, Cryptophycin 6",Cryptophycin,,C30H37ClN2O7,572.2289292,C[C@H]1C(C/C=C/C(N[C@@H](C(NC[C@@H](C(OC)=O)C)=O)CC2=CC(Cl)=C(OC)C=C2)=O)OC(C3=CC=CC=C3)[C@@H]1O,"InChI=1S/C30H37ClN2O7/c1-18(30(37)39-4)17-32-29(36)23(16-20-13-14-25(38-3)22(31)15-20)33-26(34)12-8-11-24-19(2)27(35)28(40-24)21-9-6-5-7-10-21/h5-10,12-15,18-19,23-24,27-28,35H,11,16-17H2,1-4H3,(H,32,36)(H,33,34)/b12-8+/t18-,19-,23+,24?,27+,28?/m0/s1",UDONTJXRCICYGH-QERZVVJYSA-N,,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1263,Tolyporphin K,,other cyclic non-peptide,porphyrins,C30H32N4O4,512.2423555,CC1C(CC(C(O1)C2(C3=CC4=NC(=CC5=NC(=CC6=NC(=CC(=C2O)N3)C=C6C)C(=C5)C)C(=C4)C)C)O)O,"InChI=1S/C30H32N4O4/c1-14-8-20-11-27-30(5,29-26(36)13-25(35)17(4)38-29)28(37)24(34-27)10-19-7-16(3)23(32-19)12-22-15(2)6-18(31-22)9-21(14)33-20/h6-12,17,25-26,29,34-37H,13H2,1-5H3",QZISHXZCHQREEK-UHFFFAOYSA-N,139585166,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1264,Crossbyanol C,,other linear non-peptide,,C30H15Br7O9S,1103.472044,C1=CC(=C(C=C1OC2=CC(=C(C(=C2)Br)OC3=C(C(=C(C=C3)OS(=O)(=O)O)OC4=C(C=C(C=C4)Br)Br)Br)OC5=C(C=C(C=C5)Br)Br)Br)O,"InChI=1S/C30H15Br7O9S/c31-14-1-5-23(19(34)9-14)43-27-13-17(42-16-3-4-22(38)18(33)11-16)12-21(36)29(27)45-25-7-8-26(46-47(39,40)41)30(28(25)37)44-24-6-2-15(32)10-20(24)35/h1-13,38H,(H,39,40,41)",ZEPFKNVSWFBTOK-UHFFFAOYSA-N,46211030,yes,Leptolyngbya,crossbyana,HI09-1
CyanoMetDB_1265,Crossbyanol D,,other linear non-peptide,,C30H15Br7O9S,1103.472044,C1=CC(=C(C=C1OC2=CC(=C(C(=C2)Br)OC3=C(C(=C(C=C3)O)OC4=C(C=C(C=C4)Br)Br)Br)OC5=C(C=C(C=C5)Br)Br)Br)OS(=O)(=O)O,"InChI=1S/C30H15Br7O9S/c31-14-1-5-23(18(33)9-14)43-27-13-17(42-16-3-7-25(20(35)11-16)46-47(39,40)41)12-21(36)29(27)45-26-8-4-22(38)30(28(26)37)44-24-6-2-15(32)10-19(24)34/h1-13,38H,(H,39,40,41)",FNJCBTVNRSOXTH-UHFFFAOYSA-N,46211031,yes,Leptolyngbya,crossbyana,HI09-1
CyanoMetDB_1266,Crossbyanol A,,other linear non-peptide,,C30H15Br7O6,1023.515229,C1=CC(=C(C=C1OC2=CC(=C(C(=C2)Br)OC3=C(C(=C(C=C3)O)OC4=C(C=C(C=C4)Br)Br)Br)OC5=C(C=C(C=C5)Br)Br)Br)O,"InChI=1S/C30H15Br7O6/c31-14-1-6-24(19(34)9-14)41-27-13-17(40-16-3-4-22(38)18(33)11-16)12-21(36)29(27)43-26-8-5-23(39)30(28(26)37)42-25-7-2-15(32)10-20(25)35/h1-13,38-39H",NBQGOUOMJQLWCZ-UHFFFAOYSA-N,46210880,yes,Leptolyngbya,crossbyana,HI09-1
CyanoMetDB_1267,Crossbyanol B,,other linear non-peptide,,C30H15Br7O12S2,1183.428858,C1=CC(=C(C=C1OC2=CC(=C(C(=C2)Br)OC3=C(C(=C(C=C3)OS(=O)(=O)O)OC4=C(C=C(C=C4)Br)Br)Br)OC5=C(C=C(C=C5)Br)Br)Br)OS(=O)(=O)O,"InChI=1S/C30H15Br7O12S2/c31-14-1-4-22(18(33)9-14)45-27-13-17(44-16-3-6-24(20(35)11-16)48-50(38,39)40)12-21(36)29(27)47-25-7-8-26(49-51(41,42)43)30(28(25)37)46-23-5-2-15(32)10-19(23)34/h1-13H,(H,38,39,40)(H,41,42,43)",PGLDWZUFBSDOEM-UHFFFAOYSA-N,46211029,yes,Leptolyngbya,crossbyana,HI09-1
CyanoMetDB_1268,Calothrixamides B,,other linear non-peptide,,C29H54N2O4,494.4083582,CCCCCC[C@H](C)[C@@H](CCCCCCCC[C@@H](C)/C=C\C=C(/C)\C(=O)N[C@@H](C)CO)OC(=O)N,"InChI=1S/C29H54N2O4/c1-6-7-8-14-19-24(3)27(35-29(30)34)21-15-12-10-9-11-13-17-23(2)18-16-20-25(4)28(33)31-26(5)22-32/h16,18,20,23-24,26-27,32H,6-15,17,19,21-22H2,1-5H3,(H2,30,34)(H,31,33)/b18-16-,25-20+/t23-,24+,26+,27-/m1/s1",WQPQQBBVOYDVPX-VBDFEYIOSA-N,139590145,yes,Calothrix,n.a.,UIC 10520
CyanoMetDB_1269,Calothrixamides A,,other linear non-peptide,,C29H52N2O4,492.3927082,C[C@H](CCCCCCCC[C@H]([C@@H](C)CCCCC=C)OC(=O)N)/C=C\C=C(/C)\C(=O)N[C@@H](C)CO,"InChI=1S/C29H52N2O4/c1-6-7-8-14-19-24(3)27(35-29(30)34)21-15-12-10-9-11-13-17-23(2)18-16-20-25(4)28(33)31-26(5)22-32/h6,16,18,20,23-24,26-27,32H,1,7-15,17,19,21-22H2,2-5H3,(H2,30,34)(H,31,33)/b18-16-,25-20+/t23-,24+,26+,27-/m1/s1",MQZZDNJDULBWLQ-VBDFEYIOSA-N,139590144,yes,Calothrix,n.a.,UIC 10520
CyanoMetDB_1270,methyl tumonoate B,,other linear non-peptide,,C29H49NO8,539.3458175,CCCCCCC/C=C(C)/[C@@H](O)[C@@H](C)C(N1CCC[C@H]1C(O[C@H]([C@H](CC)C)C(O[C@@H](C)C(OC)=O)=O)=O)=O,"InChI=1S/C29H49NO8/c1-8-10-11-12-13-14-16-20(4)24(31)21(5)26(32)30-18-15-17-23(30)28(34)38-25(19(3)9-2)29(35)37-22(6)27(33)36-7/h16,19,21-25,31H,8-15,17-18H2,1-7H3/b20-16+/t19-,21+,22-,23-,24+,25+/m0/s1",RYWKXTITOBZASH-DZOJKPGOSA-N,10840160,yes,Lyngbya/Moorea,majuscula/producens,VP216
CyanoMetDB_1271,1-(2-Hydroxy-phenoxy)-trieicos-1-en-3-one,,other linear non-peptide,,C29H48O3,444.3603454,CCCCCCCCCCCCCCCCCCCCC(=O)/C=C/OC1=CC=CC=C1O,"InChI=1S/C29H48O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-27(30)25-26-32-29-24-21-20-23-28(29)31/h20-21,23-26,31H,2-19,22H2,1H3/b26-25+",OECGJWGQWVWZRT-OCEACIFDSA-N,139585403,Yes,Oscillatoria,late-virens,n.a.
CyanoMetDB_1272,Microginin 580,,Microginin,,C29H48N4O8,580.3472145,CCCCCCCC(C(C(NC(C(N(C)C(C(NC(CC1=CC=C(O)C=C1)C(O)=O)=O)CC(C)C)=O)CO)=O)O)N,"InChI=1S/C29H48N4O8/c1-5-6-7-8-9-10-21(30)25(36)27(38)32-23(17-34)28(39)33(4)24(15-18(2)3)26(37)31-22(29(40)41)16-19-11-13-20(35)14-12-19/h11-14,18,21-25,34-36H,5-10,15-17,30H2,1-4H3,(H,31,37)(H,32,38)(H,40,41)",FRLFHRFBQODDEQ-UHFFFAOYSA-N,146684949,no,n.a.,n.a.,n.a.
CyanoMetDB_1273,Oscillaginin B,,Microginin,Oscillaginin (similar to microginin) ,C29H48N4O8,580.3472145,CCCCCCC[C@H]([C@@H](C(=O)N[C@@H](CO)C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O)O)N,"InChI=1S/C29H48N4O8/c1-5-6-7-8-9-10-21(30)25(36)27(38)32-23(17-34)28(39)33(4)24(18(2)3)26(37)31-22(29(40)41)16-13-19-11-14-20(35)15-12-19/h11-12,14-15,18,21-25,34-36H,5-10,13,16-17,30H2,1-4H3,(H,31,37)(H,32,38)(H,40,41)",FAFNVISAZDFOJC-RYWAYVEBSA-N,44825956,yes,Oscillatoria/Planktothrix,agardhii,NIES 610 = CCAP 1 459/22 = NIVA CYA 18
CyanoMetDB_1274,Microguanidine AL772,,other linear non-peptide,Microguanidine,C29H48N4O14S3,772.2329144,CC(C(C1=CC(COS(=O)([O-])=O)=C(C=C1)OS(=O)(O)=O)OS(=O)([O-])=O)OC(C(CCCN(C/C=C(CC/C=C(C)\C)\C)C(N)=[NH2+])[N+](C)(C)C)=O,"InChI=1S/C29H48N4O14S3/c1-20(2)10-8-11-21(3)15-17-32(29(30)31)16-9-12-25(33(5,6)7)28(34)45-22(4)27(47-50(41,42)43)23-13-14-26(46-49(38,39)40)24(18-23)19-44-48(35,36)37/h10,13-15,18,22,25,27H,8-9,11-12,16-17,19H2,1-7H3,(H5-,30,31,35,36,37,38,39,40,41,42,43)/b21-15+",BHXZESJHQKTKGS-RCCKNPSSSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1275,Oscillaginin A,,Microginin,Oscillaginin (similar to microginin) ,C29H47ClN4O8,614.3082422,CC(C)[C@@H](C(=O)N[C@@H](CCC1=CC=C(C=C1)O)C(=O)O)N(C)C(=O)[C@H](CO)NC(=O)[C@H]([C@@H](CCCCCCCCl)N)O,"InChI=1S/C29H47ClN4O8/c1-18(2)24(26(38)32-22(29(41)42)15-12-19-10-13-20(36)14-11-19)34(3)28(40)23(17-35)33-27(39)25(37)21(31)9-7-5-4-6-8-16-30/h10-11,13-14,18,21-25,35-37H,4-9,12,15-17,31H2,1-3H3,(H,32,38)(H,33,39)(H,41,42)",QYOGCHNVZHLFTR-RYWAYVEBSA-N,46902107,yes,Oscillatoria/Planktothrix,agardhii,NIES 610 = CCAP 1 459/22 = NIVA CYA 18
CyanoMetDB_1276,Trichophycin A,,other linear non-peptide,,C29H47ClO3,478.3213731,[H]/C(Cl)=C(CC(O)CCC(C)CC(C)C(O)CCCCC(C)C(O)CC=C)\CC1=CC=CC=C1,"InChI=1S/C29H47ClO3/c1-5-11-28(32)23(3)12-9-10-15-29(33)24(4)18-22(2)16-17-27(31)20-26(21-30)19-25-13-7-6-8-14-25/h5-8,13-14,21-24,27-29,31-33H,1,9-12,15-20H2,2-4H3",ORENNUJWZUSRAQ-UHFFFAOYSA-N,139590413,yes,Trichodesmium,thiebautii,n.a.
CyanoMetDB_1277,Aeruginosin 98B,Aeruginosin 98-B,Aeruginosin,,C29H46N6O9S,654.3046983,OC1=CC=C(CC(O)C(N[C@H]([C@H](C)CC)C(N2C(C(NCCCCNC(N)=N)=O)CC3C2CC(OS(=O)(O)=O)CC3)=O)=O)C=C1,"InChI=1S/C29H46N6O9S/c1-3-17(2)25(34-27(39)24(37)14-18-6-9-20(36)10-7-18)28(40)35-22-16-21(44-45(41,42)43)11-8-19(22)15-23(35)26(38)32-12-4-5-13-33-29(30)31/h6-7,9-10,17,19,21-25,36-37H,3-5,8,11-16H2,1-2H3,(H,32,38)(H,34,39)(H4,30,31,33)(H,41,42,43)/t17-,19?,21?,22?,23?,24?,25-/m1/s1",WZVRXEOKWMIDDV-APHGSVRASA-N,10055080,yes,Microcystis,aeruginosa,NIES 98
CyanoMetDB_1278,Aeruginosin NAL1,NAL 1,Aeruginosin,,C28H42N6O6,558.3165831,CCCC(N[C@H](C(N1[C@H](C(NC(C=O)CCCNC(N)=N)=O)C[C@H]2[C@@H]1CC(O)CC2)=O)CC3=CC=C(O)C=C3)=O,"InChI=1S/C28H42N6O6/c1-2-4-25(38)33-22(13-17-6-9-20(36)10-7-17)27(40)34-23-15-21(37)11-8-18(23)14-24(34)26(39)32-19(16-35)5-3-12-31-28(29)30/h6-7,9-10,16,18-19,21-24,36-37H,2-5,8,11-15H2,1H3,(H,32,39)(H,33,38)(H4,29,30,31)/t18-,19?,21?,22-,23-,24-/m0/s1",XKKMWSYEKWIZSV-FYNJCVRDSA-N,146683749,no,Nodularia,spumigena,n.a.
CyanoMetDB_1279,Oscillaginin C,,Microginin,,C29H46Cl2N4O8,648.2692699,CC([C@H](N(C([C@@H](NC([C@@H](O)[C@H](N)CCCCCCC(Cl)Cl)=O)CO)=O)C)C(N[C@H](C(O)=O)CCC1=CC=C(O)C=C1)=O)C,"InChI=1S/C29H46Cl2N4O8/c1-17(2)24(26(39)33-21(29(42)43)15-12-18-10-13-19(37)14-11-18)35(3)28(41)22(16-36)34-27(40)25(38)20(32)8-6-4-5-7-9-23(30)31/h10-11,13-14,17,20-25,36-38H,4-9,12,15-16,32H2,1-3H3,(H,33,39)(H,34,40)(H,42,43)/t20-,21+,22+,24+,25+/m1/s1",NDDICYYHCIGFPY-OOXANGRUSA-N,,yes,Oscillatoria/Planktothrix,agardhii,NIES 610 = CCAP 1 459/22 = NIVA CYA 18
CyanoMetDB_1280,Aeruginosin 98C,Aeruginosin GE98C ; Aeruginosin 98-C,Aeruginosin,,C29H45BrN6O9S,732.215211,OC1=CC=C(C[C@@H](O)C(N[C@H]([C@@H](C)CC)C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](OS(=O)(O)=O)CC3)=O)=O)C=C1Br,"InChI=1S/C29H45BrN6O9S/c1-3-16(2)25(35-27(40)24(38)13-17-6-9-23(37)20(30)12-17)28(41)36-21-15-19(45-46(42,43)44)8-7-18(21)14-22(36)26(39)33-10-4-5-11-34-29(31)32/h6,9,12,16,18-19,21-22,24-25,37-38H,3-5,7-8,10-11,13-15H2,1-2H3,(H,33,39)(H,35,40)(H4,31,32,34)(H,42,43,44)/t16-,18-,19?,21-,22-,24+,25+/m0/s1",JDIQMZJCZUMKHX-FNIAKDIGSA-N,,yes,Microcystis,aeruginosa,NIES 98 ; NIES 298
CyanoMetDB_1282,Namalide B,,other cyclic peptide,,C29H45N5O7,575.3318988,CC[C@@H]([C@H]1C(N[C@@H](CCC2=CC=C(O)C=C2)C(NCCCC[C@@H](NC(N[C@@H]([C@@H](CC)C)C(O)=O)=O)C(N1)=O)=O)=O)C,"InChI=1S/C29H45N5O7/c1-5-17(3)23-27(38)31-22(15-12-19-10-13-20(35)14-11-19)25(36)30-16-8-7-9-21(26(37)33-23)32-29(41)34-24(28(39)40)18(4)6-2/h10-11,13-14,17-18,21-24,35H,5-9,12,15-16H2,1-4H3,(H,30,36)(H,31,38)(H,33,37)(H,39,40)(H2,32,34,41)/t17-,18+,21+,22-,23-,24-/m0/s1",BEGARHAEPVBWAE-NSDNVYNZSA-N,,yes,Sphaerospermopsis,torques-reginae,ITEP-24
CyanoMetDB_1283,Isomalyngamide A,,other linear non-peptide,Lyngbya toxin (alkaloid),C29H45ClN2O6,552.2966149,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C\Cl)/C/C(=C\C(=O)N1CC(=CC1=O)OC)/OC)OC,"InChI=1S/C29H45ClN2O6/c1-6-7-8-9-11-14-24(36-3)15-12-10-13-16-27(33)31(2)21-23(20-30)17-25(37-4)18-28(34)32-22-26(38-5)19-29(32)35/h10,12,18-20,24H,6-9,11,13-17,21-22H2,1-5H3/b12-10+,23-20-,25-18+/t24-/m0/s1",MCGPGUSLTPAGCR-DINDZMPHSA-N,10626553,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1284,Aeruginosin 98A,Aeruginosin 98-A,Aeruginosin,,C29H45ClN6O9S,688.2657259,OC1=C(Cl)C=C(CC(O)C(N[C@H]([C@H](C)CC)C(N2C(C(NCCCCNC(N)=N)=O)CC3C2CC(OS(=O)(O)=O)CC3)=O)=O)C=C1,"InChI=1S/C29H45ClN6O9S/c1-3-16(2)25(35-27(40)24(38)13-17-6-9-23(37)20(30)12-17)28(41)36-21-15-19(45-46(42,43)44)8-7-18(21)14-22(36)26(39)33-10-4-5-11-34-29(31)32/h6,9,12,16,18-19,21-22,24-25,37-38H,3-5,7-8,10-11,13-15H2,1-2H3,(H,33,39)(H,35,40)(H4,31,32,34)(H,42,43,44)/t16-,18?,19?,21?,22?,24?,25-/m1/s1",LNRXFFGKAKWQCV-DJKRDFIDSA-N,10327288,yes,Microcystis,aeruginosa,NIES 98
CyanoMetDB_1285,Aeruginosin DA688,,Aeruginosin,,C29H45ClN6O9S,688.2657259,OC1=C(C=C(C=C1Cl)C[C@H](C(N[C@@H](C(N2[C@@H](C[C@H]3[C@@H]2C[C@H](OS(=O)(O)=O)CC3)C(NCCCCNC(N)=N)=O)=O)CC(C)C)=O)O)[H],"InChI=1S/C29H45ClN6O9S/c1-16(2)11-21(35-27(40)25(38)13-17-5-8-24(37)20(30)12-17)28(41)36-22-15-19(45-46(42,43)44)7-6-18(22)14-23(36)26(39)33-9-3-4-10-34-29(31)32/h5,8,12,16,18-19,21-23,25,37-38H,3-4,6-7,9-11,13-15H2,1-2H3,(H,33,39)(H,35,40)(H4,31,32,34)(H,42,43,44)/t18-,19+,21+,22-,23-,25+/m0/s1",QINSXEZKRIOXRD-JDAMQYKPSA-N,73603913,yes,n.a.,n.a.,n.a.
CyanoMetDB_1286,Aeruginosin IN608,,Aeruginosin,,C29H45ClN6O6,608.3089109,ClC1=C(O)C=CC(C[C@@H](O)C(N[C@H](CC(C)C)C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](O)CC3)=O)=O)=C1,"InChI=1S/C29H45ClN6O6/c1-16(2)11-21(35-27(41)25(39)13-17-5-8-24(38)20(30)12-17)28(42)36-22-15-19(37)7-6-18(22)14-23(36)26(40)33-9-3-4-10-34-29(31)32/h5,8,12,16,18-19,21-23,25,37-39H,3-4,6-7,9-11,13-15H2,1-2H3,(H,33,40)(H,35,41)(H4,31,32,34)/t18-,19+,21+,22-,23-,25+/m0/s1",ZJNOSDFPXZTAGG-JDAMQYKPSA-N,71726249,yes,n.a.,n.a.,n.a.
CyanoMetDB_1287,Aeruginosin KY608,,Aeruginosin,,C29H45ClN6O6,608.3089109,ClC1=C(O)C([H])=CC(C[C@H](O)C(N[C@H]([C@@H](C)CC)C(N2[C@@H](C[C@H](O)CC3)[C@@H]3C[C@H]2C(NCCCCNC(N)=N)=O)=O)=O)=C1,"InChI=1S/C29H45ClN6O6/c1-3-16(2)25(35-27(41)24(39)13-17-6-9-23(38)20(30)12-17)28(42)36-21-15-19(37)8-7-18(21)14-22(36)26(40)33-10-4-5-11-34-29(31)32/h6,9,12,16,18-19,21-22,24-25,37-39H,3-5,7-8,10-11,13-15H2,1-2H3,(H,33,40)(H,35,41)(H4,31,32,34)/t16-,18-,19+,21-,22-,24-,25+/m0/s1",SDGIBJVOLGWMJS-XQQHUQLZSA-N,73351990,yes,n.a.,n.a.,n.a.
CyanoMetDB_1288,Malyngamide Q,,other linear non-peptide,Malyngamide,C29H45ClN2O7,568.2915295,CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C\Cl)/C/C(=C\C(=O)N1[C@@H](C(=CC1=O)OC)CO)/OC)OC,"InChI=1S/C29H45ClN2O7/c1-5-6-7-8-10-13-23(37-2)14-11-9-12-15-27(34)31-20-22(19-30)16-24(38-3)17-28(35)32-25(21-33)26(39-4)18-29(32)36/h9,11,17-19,23,25,33H,5-8,10,12-16,20-21H2,1-4H3,(H,31,34)/b11-9+,22-19-,24-17+/t23-,25+/m0/s1",QAVVYSDJFMRAQB-VUIFCYKZSA-N,21606576,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1289,Malyngamide A,,other linear non-peptide,Malyngamide,C29H45ClN2O6,552.2966149,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C/Cl)/C/C(=C\C(=O)N1CC(=CC1=O)OC)/OC)OC,"InChI=1S/C29H45ClN2O6/c1-6-7-8-9-11-14-24(36-3)15-12-10-13-16-27(33)31(2)21-23(20-30)17-25(37-4)18-28(34)32-22-26(38-5)19-29(32)35/h10,12,18-20,24H,6-9,11,13-17,21-22H2,1-5H3/b12-10+,23-20+,25-18+/t24-/m0/s1",MCGPGUSLTPAGCR-RPPVKKOJSA-N,14779548,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1291,Aeruginosin IN652,,Aeruginosin,,C29H45BrN6O6,652.258396,BrC1=C(O)C=CC(C[C@@H](O)C(N[C@H](CC(C)C)C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](O)CC3)=O)=O)=C1,"InChI=1S/C29H45BrN6O6/c1-16(2)11-21(35-27(41)25(39)13-17-5-8-24(38)20(30)12-17)28(42)36-22-15-19(37)7-6-18(22)14-23(36)26(40)33-9-3-4-10-34-29(31)32/h5,8,12,16,18-19,21-23,25,37-39H,3-4,6-7,9-11,13-15H2,1-2H3,(H,33,40)(H,35,41)(H4,31,32,34)/t18-,19+,21+,22-,23-,25+/m0/s1",HVTUJLWYHRJFCH-JDAMQYKPSA-N,71726250,yes,n.a.,n.a.,n.a.
CyanoMetDB_1292,Comnostin D,,other linear non-peptide,Diterpenoid,C29H44O5,472.3188745,C[C@@H]1CC[C@@]2(C3CC[C@@]([C@@]3(CCC2[C@]1(C)CC4=C(C=CC(=C4)C(=O)O)O)C)(C)C(OC)OC)C,"InChI=1S/C29H44O5/c1-18-10-13-26(2)22(27(18,3)17-20-16-19(24(31)32)8-9-21(20)30)11-14-28(4)23(26)12-15-29(28,5)25(33-6)34-7/h8-9,16,18,22-23,25,30H,10-15,17H2,1-7H3,(H,31,32)/t18-,22?,23?,26+,27-,28-,29+/m1/s1",NGZCNRIYOUJSLA-SKPIEEQRSA-N,10390076,yes,Nostoc,commune,EAWAG 122b
CyanoMetDB_1293,Aeruginosin GE686,,Aeruginosin,,C29H44BrClN6O6,686.219424,ClC1=C(O)C(Br)=CC(C[C@@H](O)C(N[C@H]([C@@H](C)CC)C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](O)CC3)=O)=O)=C1,"InChI=1S/C29H44BrClN6O6/c1-3-15(2)24(36-27(42)23(39)12-16-10-19(30)25(40)20(31)11-16)28(43)37-21-14-18(38)7-6-17(21)13-22(37)26(41)34-8-4-5-9-35-29(32)33/h10-11,15,17-18,21-24,38-40H,3-9,12-14H2,1-2H3,(H,34,41)(H,36,42)(H4,32,33,35)/t15-,17-,18+,21-,22-,23+,24+/m0/s1",NONLYEHCSKGAFP-GPSFYHMWSA-N,71452509,yes,n.a.,n.a.,n.a.
CyanoMetDB_1295,Aeruginosin 101,,Aeruginosin,,C29H44Cl2N6O9S,722.2267536,ClC1=C(O)C(Cl)=CC(C[C@@H](O)C(N[C@H]([C@@H](C)CC)C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](OS(=O)(O)=O)CC3)=O)=O)=C1,"InChI=1S/C29H44Cl2N6O9S/c1-3-15(2)24(36-27(41)23(38)12-16-10-19(30)25(39)20(31)11-16)28(42)37-21-14-18(46-47(43,44)45)7-6-17(21)13-22(37)26(40)34-8-4-5-9-35-29(32)33/h10-11,15,17-18,21-24,38-39H,3-9,12-14H2,1-2H3,(H,34,40)(H,36,41)(H4,32,33,35)(H,43,44,45)/t15-,17-,18?,21-,22-,23+,24+/m0/s1",RLHOQMQWBDVOPM-MVPZNAGXSA-N,,yes,Microcystis,aeruginosa,NIES 101
CyanoMetDB_1296,Aeruginosin DA722,,Aeruginosin,,C29H44Cl2N6O9S,722.2267536,ClC1=C(C(Cl)=CC(C[C@H](C(N[C@@H](C(N2[C@@H](C[C@H]3[C@@H]2C[C@@H](CC3)OS(=O)(O)=O)C(NCCCCNC(N)=N)=O)=O)CC(C)C)=O)O)=C1)O,"InChI=1S/C29H44Cl2N6O9S/c1-15(2)9-21(36-27(41)24(38)12-16-10-19(30)25(39)20(31)11-16)28(42)37-22-14-18(46-47(43,44)45)6-5-17(22)13-23(37)26(40)34-7-3-4-8-35-29(32)33/h10-11,15,17-18,21-24,38-39H,3-9,12-14H2,1-2H3,(H,34,40)(H,36,41)(H4,32,33,35)(H,43,44,45)/t17-,18+,21+,22-,23-,24+/m0/s1",UVNFBGACXCESOX-PVPAWSFNSA-N,73603914,yes,n.a.,n.a.,n.a.
CyanoMetDB_1297,Aeruginosin KY642,,Aeruginosin,,C29H44Cl2N6O6,642.2699386,ClC1=C(O)C(Cl)=CC(C[C@H](O)C(N[C@H]([C@H](CC)C)C(N2[C@@H](C[C@H](O)CC3)[C@@H]3C[C@H]2C(NCCCCNC(N)=N)=O)=O)=O)=C1,"InChI=1S/C29H44Cl2N6O6/c1-3-15(2)24(36-27(42)23(39)12-16-10-19(30)25(40)20(31)11-16)28(43)37-21-14-18(38)7-6-17(21)13-22(37)26(41)34-8-4-5-9-35-29(32)33/h10-11,15,17-18,21-24,38-40H,3-9,12-14H2,1-2H3,(H,34,41)(H,36,42)(H4,32,33,35)/t15-,17-,18+,21-,22-,23-,24+/m0/s1",ONDJEXZMKGTDJV-UCASTMKVSA-N,146683926,yes,n.a.,n.a.,IL-323
CyanoMetDB_1298,Aeruginosin GE766,,Aeruginosin,,C29H44BrClN6O9S,766.176239,ClC1=C(O)C(Br)=CC(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](OS(=O)(O)=O)CC3)=O)[C@@H](C)CC)=O)=C1,"InChI=1S/C29H44BrClN6O9S/c1-3-15(2)24(36-27(41)23(38)12-16-10-19(30)25(39)20(31)11-16)28(42)37-21-14-18(46-47(43,44)45)7-6-17(21)13-22(37)26(40)34-8-4-5-9-35-29(32)33/h10-11,15,17-18,21-24,38-39H,3-9,12-14H2,1-2H3,(H,34,40)(H,36,41)(H4,32,33,35)(H,43,44,45)/t15-,17-,18?,21-,22-,23+,24+/m0/s1",WGFZRUTWFMYTPD-GPSFYHMWSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1299,Aeruginosin GE810,,Aeruginosin,,C29H44Br2N6O9S,810.125724,BrC1=C(C(Br)=CC(C[C@H](C(N[C@@H](C(N2[C@@H](C[C@H]3[C@@H]2C[C@@H](CC3)OS(=O)(O)=O)C(NCCCCNC(N)=N)=O)=O)[C@H](CC)C)=O)O)=C1)O,"InChI=1S/C29H44Br2N6O9S/c1-3-15(2)24(36-27(41)23(38)12-16-10-19(30)25(39)20(31)11-16)28(42)37-21-14-18(46-47(43,44)45)7-6-17(21)13-22(37)26(40)34-8-4-5-9-35-29(32)33/h10-11,15,17-18,21-24,38-39H,3-9,12-14H2,1-2H3,(H,34,40)(H,36,41)(H4,32,33,35)(H,43,44,45)/t15-,17-,18+,21-,22-,23+,24+/m0/s1",CZGJMJRVWATCJK-GPSFYHMWSA-N,71463188,yes,n.a.,n.a.,n.a.
CyanoMetDB_1300,Aeruginosin GE730,,Aeruginosin,,C29H44Br2N6O6,730.168909,BrC1=C(O)C(Br)=CC(C[C@@H](O)C(N[C@H]([C@@H](C)CC)C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](O)CC3)=O)=O)=C1,"InChI=1S/C29H44Br2N6O6/c1-3-15(2)24(36-27(42)23(39)12-16-10-19(30)25(40)20(31)11-16)28(43)37-21-14-18(38)7-6-17(21)13-22(37)26(41)34-8-4-5-9-35-29(32)33/h10-11,15,17-18,21-24,38-40H,3-9,12-14H2,1-2H3,(H,34,41)(H,36,42)(H4,32,33,35)",HLHFYIIZYTUCEC-GPSFYHMWSA-N,71452508,yes,n.a.,n.a.,n.a.
CyanoMetDB_1301,Aeruginosin LH606,,Aeruginosin,,C29H43ClN6O6,606.2932608,OC1=CC=C(C[C@@H](O)C(N[C@H](CC(C)C)C(N2[C@H](C(NC3N(C(N)=N)CCC3)=O)C[C@H]4[C@@H]2C[C@H](O)CC4)=O)=O)C=C1Cl,"InChI=1S/C29H43ClN6O6/c1-15(2)10-20(33-27(41)24(39)12-16-5-8-23(38)19(30)11-16)28(42)36-21-14-18(37)7-6-17(21)13-22(36)26(40)34-25-4-3-9-35(25)29(31)32/h5,8,11,15,17-18,20-22,24-25,37-39H,3-4,6-7,9-10,12-14H2,1-2H3,(H3,31,32)(H,33,41)(H,34,40)/t17-,18+,20+,21-,22-,24+,25?/m0/s1InChI=1S/C29H43ClN6O6/c1-15(2)10-20(33-27(41)24(39)12-16-5-8-23(38)19(30)11-16)28(42)36-21-14-18(37)7-6-17(21)13-22(36)26(40)34-25-4-3-9-35(25)29(31)32/h5,8,11,15,17-18,20-22,24-25,37-39H,3-4,6-7,9-10,12-14H2,1-2H3,(H3,31,32)(H,33,41)(H,34,40)/t17-,18+,20+,21-,22-,24+,25?/m0/s1",VTKSRNODZPGCEU-ZNLUQXHSSA-N,101884819,yes,Microcystis,n.a.,TAU IL-376
CyanoMetDB_1302,Pseudoaeruginosin KT554,,other linear peptide,,C29H42N6O5,554.3216685,OC1=CC=C(C[C@H](C(N[C@H](CC(C)C)C(N[C@H](C(NCCCCNC(N)=N)=O)CC2=CC=CC=C2)=O)=O)O)C=C1,"InChI=1S/C29H42N6O5/c1-19(2)16-23(35-28(40)25(37)18-21-10-12-22(36)13-11-21)27(39)34-24(17-20-8-4-3-5-9-20)26(38)32-14-6-7-15-33-29(30)31/h3-5,8-13,19,23-25,36-37H,6-7,14-18H2,1-2H3,(H,32,38)(H,34,39)(H,35,40)(H4,30,31,33)",QSELNASSFIOFMX-DSNGMDLFSA-N,57333042,yes,n.a.,n.a.,n.a.
CyanoMetDB_1303,Largazole,,Cyclamide,,C29H42N4O5S3,622.231734,CCCCCCCC(=O)SCC/C=C/[C@@H]1CC(=O)NCC2=NC(=CS2)C3=N[C@@](CS3)(C(=O)N[C@H](C(=O)O1)C(C)C)C,"InChI=1S/C29H42N4O5S3/c1-5-6-7-8-9-13-24(35)39-14-11-10-12-20-15-22(34)30-16-23-31-21(17-40-23)26-33-29(4,18-41-26)28(37)32-25(19(2)3)27(36)38-20/h10,12,17,19-20,25H,5-9,11,13-16,18H2,1-4H3,(H,30,34)(H,32,37)/b12-10+/t20-,25+,29+/m1/s1",AXESYCSCGBQJBL-SZPBEECKSA-N,24757913,yes,Symploca,n.a.,n.a.
CyanoMetDB_1304,Dolastatin 3,,other linear peptide,Oscillapeptin,C29H40N8O6S2,660.2512234,CC(C[C@@H](C(N[C@H](C1=NC2=CS1)CCC(N)=O)=O)NC([C@@H]3CCCN3C([C@@H](NC(C4=CSC(CNC2=O)=N4)=O)C(C)C)=O)=O)C,"InChI=1S/C29H40N8O6S2/c1-14(2)10-17-25(40)33-16(7-8-21(30)38)28-35-18(13-45-28)24(39)31-11-22-32-19(12-44-22)26(41)36-23(15(3)4)29(43)37-9-5-6-20(37)27(42)34-17/h12-17,20,23H,5-11H2,1-4H3,(H2,30,38)(H,31,39)(H,33,40)(H,34,42)(H,36,41)/t16-,17-,20-,23-/m0/s1",ATCVYMAKQRUVDS-OSAZLGQLSA-N,9852693,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1305,Microcyclamide GL616,,Cyclamide,,C29H40N6O7S,616.2679188,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@H](C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)N1)[C@H](C)O)CC3=CC=CC=C3)[C@H](C)O)C,"InChI=1S/C29H40N6O7S/c1-6-14(2)21-29-32-20(13-43-29)26(40)30-15(3)24(38)34-22(16(4)36)27(41)31-19(12-18-10-8-7-9-11-18)25(39)35-23(17(5)37)28(42)33-21/h7-11,13-17,19,21-23,36-37H,6,12H2,1-5H3,(H,30,40)(H,31,41)(H,33,42)(H,34,38)(H,35,39)/t14-,15-,16-,17-,19-,21-,22+,23+/m0/s1",URKWKYAJQNZSLA-KXNOCRFKSA-N,46197046,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1306,Lyngbyabellin A,,Cyclamide,Peptolide,C29H40Cl2N4O7S2,690.1715474,CCC(C)C1C2=NC(=CS2)C(=O)OC(C(C(=O)OC(C3=NC(=CS3)C(=O)NCC(=O)N1)C(C)(C)O)(C)C)CCCC(C)(Cl)Cl,"InChI=1S/C29H40Cl2N4O7S2/c1-8-15(2)20-23-34-17(14-43-23)25(38)41-18(10-9-11-29(7,30)31)27(3,4)26(39)42-21(28(5,6)40)24-33-16(13-44-24)22(37)32-12-19(36)35-20/h13-15,18,20-21,40H,8-12H2,1-7H3,(H,32,37)(H,35,36)/t15-,18-,20-,21+/m0/s1",VJSNPXXBMRWPEJ-CEDBRAGKSA-N,10032587,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1307,27-deoxylyngbyabellin A,,Cyclamide,,C29H40Cl2N4O6S2,674.1766328,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)O[C@H](C(C(=O)O[C@H](C3=NC(=CS3)C(=O)NCC(=O)N1)C(C)C)(C)C)CCCC(C)(Cl)Cl,"InChI=1S/C29H40Cl2N4O6S2/c1-8-16(4)21-24-34-18(14-42-24)26(38)40-19(10-9-11-29(7,30)31)28(5,6)27(39)41-22(15(2)3)25-33-17(13-43-25)23(37)32-12-20(36)35-21/h13-16,19,21-22H,8-12H2,1-7H3,(H,32,37)(H,35,36)/t16-,19-,21-,22-/m0/s1",MXKVWNSSDRMDBC-PWZKMPOXSA-N,46939691,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1308,Spumigin 582a,SPU 582a,Spumigin,Aeruginosin,C29H38N6O7,582.2801976,OC1=CC=C(C[C@H](C(N[C@H](C(N2C(C(NC(C=O)CCCNC(N)=N)=O)CCC2)=O)CC3=CC=C(O)C=C3)=O)O)C=C1,"InChI=1S/C29H38N6O7/c30-29(31)32-13-1-3-20(17-36)33-26(40)24-4-2-14-35(24)28(42)23(15-18-5-9-21(37)10-6-18)34-27(41)25(39)16-19-7-11-22(38)12-8-19/h5-12,17,20,23-25,37-39H,1-4,13-16H2,(H,33,40)(H,34,41)(H4,30,31,32)/t20?,23-,24?,25+/m0/s1",NUDLACNKYRKLHR-DBMPWETRSA-N,146684837,no,Nodularia,spumigena,"CCNP 1401, CCNP 1403"
CyanoMetDB_1309,Aeruginosin GH553,,Aeruginosin,,C29H35N3O8,553.2424151,CC(=O)O[C@@H]1CC[C@@H]2C[C@@H](N([C@@H]2C1)C(=O)[C@@H](CC3=CC=C(C=C3)O)NC(=O)[C@H](CC4=CC=C(C=C4)O)O)C(=O)N,"InChI=1S/C29H35N3O8/c1-16(33)40-22-11-6-19-14-25(27(30)37)32(24(19)15-22)29(39)23(12-17-2-7-20(34)8-3-17)31-28(38)26(36)13-18-4-9-21(35)10-5-18/h2-5,7-10,19,22-26,34-36H,6,11-15H2,1H3,(H2,30,37)(H,31,38)/t19-,22-,23-,24-,25-,26+/m1/s1",BUDABURPHLLGEK-MKDQKPEESA-N,70687366,yes,n.a.,n.a.,n.a.
CyanoMetDB_1310,Cryptophycin 12,,Cryptophycin,,C29H35ClN2O7,558.2132792,O=C(N[C@H](CC1=CC(Cl)=C(OC)C=C1)C(NC[C@H](C)C(O)=O)=O)/C=C/CC2C(C)C(O)C(C3=CC=CC=C3)O2,"InChI=1S/C29H35ClN2O7/c1-17(29(36)37)16-31-28(35)22(15-19-12-13-24(38-3)21(30)14-19)32-25(33)11-7-10-23-18(2)26(34)27(39-23)20-8-5-4-6-9-20/h4-9,11-14,17-18,22-23,26-27,34H,10,15-16H2,1-3H3,(H,31,35)(H,32,33)(H,36,37)/b11-7+/t17-,18?,22+,23?,26?,27?/m0/s1",OSTVPMZLVSKYIL-XLXNHWAGSA-N,,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1311,Cryptophycin 14,,Cryptophycin,,C29H35ClN2O6,542.2183646,O[C@H]([C@H](/C=C/C1=CC=CC=C1)C)C/C=C/C(N[C@H](CC2=CC(Cl)=C(OC)C=C2)C(NC[C@H](C)C(O)=O)=O)=O,"InChI=1S/C29H35ClN2O6/c1-19(12-13-21-8-5-4-6-9-21)25(33)10-7-11-27(34)32-24(28(35)31-18-20(2)29(36)37)17-22-14-15-26(38-3)23(30)16-22/h4-9,11-16,19-20,24-25,33H,10,17-18H2,1-3H3,(H,31,35)(H,32,34)(H,36,37)/b11-7+,13-12+/t19-,20-,24+,25-/m0/s1",OURPIRNGWYKWOO-JMTZPVHYSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1312,Microginin 576,,Microginin,,C28H53ClN4O6,576.3653631,NC(C(C(NC(C(N(C)C(C(NC(C(C)C)C(O)=O)=O)CC(C)C)=O)CC(C)C)=O)O)CCCCCCCCl,"InChI=1S/C28H53ClN4O6/c1-17(2)15-21(31-26(36)24(34)20(30)13-11-9-8-10-12-14-29)27(37)33(7)22(16-18(3)4)25(35)32-23(19(5)6)28(38)39/h17-24,34H,8-16,30H2,1-7H3,(H,31,36)(H,32,35)(H,38,39)",QHKNHRQADQPRLD-UHFFFAOYSA-N,146684950,no,n.a.,n.a.,n.a.
CyanoMetDB_1313,Microginin 91A,Microginin 91-A,Microginin,,C28H51ClN4O6,574.3497131,CC[C@@H]([C@@H](C(N([C@@H](C(N1CCC[C@@H]1C(O)=O)=O)CC(C)C)C)=O)NC([C@H]([C@H](CCCCCCCCl)N)O)=O)C,"InChI=1S/C28H51ClN4O6/c1-6-19(4)23(31-25(35)24(34)20(30)13-10-8-7-9-11-15-29)27(37)32(5)22(17-18(2)3)26(36)33-16-12-14-21(33)28(38)39/h18-24,34H,6-17,30H2,1-5H3,(H,31,35)(H,38,39)/t19-,20-,21+,22+,23-,24-/m0/s1",MECPYWUIDGLDCB-PQZIIDKGSA-N,,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_1314,Microginin 91B,Microginin 91-B,Microginin,,C28H50Cl2N4O6,608.3107407,N[C@@H](CCCCCCC(Cl)Cl)[C@@H](C(N[C@@H]([C@@H](C)CC)C(N(C)[C@H](CC(C)C)C(N1CCC[C@@H]1C(O)=O)=O)=O)=O)O,"InChI=1S/C28H50Cl2N4O6/c1-6-18(4)23(32-25(36)24(35)19(31)12-9-7-8-10-14-22(29)30)27(38)33(5)21(16-17(2)3)26(37)34-15-11-13-20(34)28(39)40/h17-24,35H,6-16,31H2,1-5H3,(H,32,36)(H,39,40)/t18-,19-,20+,21+,23-,24-/m0/s1",JRCJKKSDWXJOMP-ZLBIGGGMSA-N,,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_1315,Tumonoic acid B,,other linear non-peptide,,C28H47NO8,525.3301675,CCCCCCC/C=C(C)/[C@@H](O)[C@@H](C)C(N1CCC[C@H]1C(O[C@H]([C@H](CC)C)C(O[C@@H](C)C(O)=O)=O)=O)=O,"InChI=1S/C28H47NO8/c1-7-9-10-11-12-13-15-19(4)23(30)20(5)25(31)29-17-14-16-22(29)27(34)37-24(18(3)8-2)28(35)36-21(6)26(32)33/h15,18,20-24,30H,7-14,16-17H2,1-6H3,(H,32,33)/b19-15+/t18-,20+,21-,22-,23+,24+/m0/s1",HYPDCGGBAFGHKA-JILBMGCCSA-N,10554104,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1316,Malyngamide 3,,other linear non-peptide,,C28H47ClN2O7,558.3071796,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C\Cl)/CC(=O)CC(=O)NC[C@@H](CC(=O)OC)O)OC,"InChI=1S/C28H47ClN2O7/c1-5-6-7-8-10-13-25(37-3)14-11-9-12-15-27(35)31(2)21-22(19-29)16-23(32)17-26(34)30-20-24(33)18-28(36)38-4/h9,11,19,24-25,33H,5-8,10,12-18,20-21H2,1-4H3,(H,30,34)/b11-9+,22-19-/t24-,25+/m1/s1",FGRVZQUFZGRBFK-RBZBVOEWSA-N,52952438,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1318,Antillatoxin-A,Antillatoxin,other cyclic peptide,Lyngbya toxin (alkaloid),C28H45N3O5,503.3359216,C[C@@H]1[C@H](/C(C)=C/C(C)=C/C(C)(C)C)OC(CNC([C@H](C(C)C)N(C)C([C@H](C)NC(CC1=C)=O)=O)=O)=O,"InChI=1S/C28H45N3O5/c1-16(2)24-26(34)29-15-23(33)36-25(19(5)12-17(3)14-28(8,9)10)20(6)18(4)13-22(32)30-21(7)27(35)31(24)11/h12,14,16,20-21,24-25H,4,13,15H2,1-3,5-11H3,(H,29,34)(H,30,32)/b17-14+,19-12+/t20-,21-,24-,25-/m0/s1",WNMROEVYEZDXEL-QVOGVHLFSA-N,10029084,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1319,Isomalyngamide B,,other linear non-peptide,Lyngbya toxin (alkaloid),C28H45ClN2O6,540.2966149,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C\Cl)/C/C(=C\C(=O)N1C[C@@H](CC1=O)O)/OC)OC,"InChI=1S/C28H45ClN2O6/c1-5-6-7-8-10-13-24(36-3)14-11-9-12-15-26(33)30(2)20-22(19-29)16-25(37-4)18-28(35)31-21-23(32)17-27(31)34/h9,11,18-19,23-24,32H,5-8,10,12-17,20-21H2,1-4H3/b11-9+,22-19-,25-18-/t23-,24+/m1/s1",LCTQNEJUQPJWPJ-LUNFPOCBSA-N,101087570,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1320,Microginin AL584,,Microginin,,C28H45ClN4O7,584.2976775,C[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)NC(=O)[C@H]([C@H](CCCCCCCCl)N)O,"InChI=1S/C28H45ClN4O7/c1-17(2)23(25(36)32-22(28(39)40)16-19-11-13-20(34)14-12-19)33(4)27(38)18(3)31-26(37)24(35)21(30)10-8-6-5-7-9-15-29/h11-14,17-18,21-24,34-35H,5-10,15-16,30H2,1-4H3,(H,31,37)(H,32,36)(H,39,40)/t18-,21-,22?,23-,24-/m0/s1",IZEUJLTUOBKQOT-NHKCCNDQSA-N,24970708,yes,n.a.,n.a.,n.a.
CyanoMetDB_1321,Malyngamide B,,other linear non-peptide,Malyngamide,C28H45ClN2O6,540.2966149,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C/Cl)/C/C(=C\C(=O)N1CC(CC1=O)O)/OC)OC,"InChI=1S/C28H45ClN2O6/c1-5-6-7-8-10-13-24(36-3)14-11-9-12-15-26(33)30(2)20-22(19-29)16-25(37-4)18-28(35)31-21-23(32)17-27(31)34/h9,11,18-19,23-24,32H,5-8,10,12-17,20-21H2,1-4H3/b11-9+,22-19+,25-18+/t23?,24-/m0/s1",LCTQNEJUQPJWPJ-LQFFYNKWSA-N,70697918,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1322,18Z-lyngbyaloside C,,other cyclic non-peptide,,C30H49BrO10,648.250911,C[C@H](O1)[C@H](OC)[C@@H](OC)[C@@H](OC)[C@@H]1O[C@H]2C[C@](CC(O[C@@](CC/C=C/C=C\Br)(C)C[C@@H](O)[C@@H](CC3)C)=O)(O)O[C@]3([H])C2[H],"InChI=1S/C30H49BrO10/c1-19-11-12-21-15-22(39-28-27(37-6)26(36-5)25(35-4)20(2)38-28)16-30(34,40-21)18-24(33)41-29(3,17-23(19)32)13-9-7-8-10-14-31/h7-8,10,14,19-23,25-28,32,34H,9,11-13,15-18H2,1-6H3/b8-7+,14-10-/t19-,20+,21+,22-,23-,25+,26-,27-,28+,29-,30+/m1/s1",CKTXZFBKOQGTIC-NVXQDTFASA-N,46939690,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1323,Hapalosin,,other cyclic non-peptide,,C28H43NO6,489.3090381,CCCCCCC[C@@H]1[C@@H](C(=O)O[C@H](C(=O)N([C@H]([C@@H](CC(=O)O1)O)CC2=CC=CC=C2)C)C(C)C)C,"InChI=1S/C28H43NO6/c1-6-7-8-9-13-16-24-20(4)28(33)35-26(19(2)3)27(32)29(5)22(23(30)18-25(31)34-24)17-21-14-11-10-12-15-21/h10-12,14-15,19-20,22-24,26,30H,6-9,13,16-18H2,1-5H3/t20-,22-,23+,24+,26-/m0/s1",NJNAHFYVTBZQHU-LFFUDGMSSA-N,133055,yes,Hapalosiphon,welwitschii ,n.a.
CyanoMetDB_1324,Namalide C,,other cyclic peptide,,C28H43N5O7,561.3162487,CC([C@H]1C(N[C@@H](CCC2=CC=C(O)C=C2)C(NCCCC[C@@H](NC(N[C@@H]([C@@H](CC)C)C(O)=O)=O)C(N1)=O)=O)=O)C,"InChI=1S/C28H43N5O7/c1-5-17(4)23(27(38)39)33-28(40)31-20-8-6-7-15-29-24(35)21(14-11-18-9-12-19(34)13-10-18)30-26(37)22(16(2)3)32-25(20)36/h9-10,12-13,16-17,20-23,34H,5-8,11,14-15H2,1-4H3,(H,29,35)(H,30,37)(H,32,36)(H,38,39)(H2,31,33,40)/t17-,20-,21+,22+,23+/m1/s1",VYCMKIJKBUVUBL-KJWUJUMESA-N,139589786,yes,Sphaerospermopsis,torques-reginae,ITEP-24
CyanoMetDB_1325,Microginin 598,,Microginin,,C28H43ClN4O8,598.2769421,NC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)C(C)O)=O)O)CCCCCCCCl,"InChI=1S/C28H43ClN4O8/c1-17(34)23(32-26(38)24(36)20(30)8-5-3-2-4-6-14-29)27(39)33-15-7-9-22(33)25(37)31-21(28(40)41)16-18-10-12-19(35)13-11-18/h10-13,17,20-24,34-36H,2-9,14-16,30H2,1H3,(H,31,37)(H,32,38)(H,40,41)",NXGFQTNWNWRMQX-UHFFFAOYSA-N,146684951,no,n.a.,n.a.,n.a.
CyanoMetDB_1326,Malyngamide 538,,other linear non-peptide,,C28H43ClN2O6,538.2809648,CCCCCCCC(O)C/C=C/CCC(N(C)C/C(C/C(OC)=C\C(N1C(C=C(OC)C1)=O)=O)=C\Cl)=O,"InChI=1S/C28H43ClN2O6/c1-5-6-7-8-10-13-23(32)14-11-9-12-15-26(33)30(2)20-22(19-29)16-24(36-3)17-27(34)31-21-25(37-4)18-28(31)35/h9,11,17-19,23,32H,5-8,10,12-16,20-21H2,1-4H3/b11-9+,22-19-,24-17+",YJGBARQRQUFWTE-XLDHAGBESA-N,146683885,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1327,Malyngamide 4,,other linear non-peptide,Malyngamide,C28H43ClN2O5,522.2860502,CCCCCCC[C@H](OC)C/C=C/CCC(N(C)C/C(C/C(OC)=C\C(N1C(C=CC1)=O)=O)=C/Cl)=O,"InChI=1S/C28H43ClN2O5/c1-5-6-7-8-10-14-24(35-3)15-11-9-12-16-26(32)30(2)22-23(21-29)19-25(36-4)20-28(34)31-18-13-17-27(31)33/h9,11,13,17,20-21,24H,5-8,10,12,14-16,18-19,22H2,1-4H3/b11-9+,23-21+,25-20+/t24-/m0/s1",TZHJOLWRRFAQDY-MEXJTVAISA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1328,Spumigin 574,SPU 574,Spumigin,Aeruginosin,C28H42N6O7,574.3114977,OC1=CC=C(CC(OC(C)=O)C(NC(CC(C)C)C(N2C(C(NC(C=O)CCCNC(N)=N)=O)CCC2)=O)=O)C=C1,"InChI=1S/C28H42N6O7/c1-17(2)14-22(33-26(39)24(41-18(3)36)15-19-8-10-21(37)11-9-19)27(40)34-13-5-7-23(34)25(38)32-20(16-35)6-4-12-31-28(29)30/h8-11,16-17,20,22-24,37H,4-7,12-15H2,1-3H3,(H,32,38)(H,33,39)(H4,29,30,31)",HFULWQRAZWFHBF-UHFFFAOYSA-N,146684838,no,Nodularia,spumigena,"CCNP 1401, CCNP 1403"
CyanoMetDB_1329,Aeruginosin GE642,,Aeruginosin,,C29H44Cl2N6O6,642.2699386,ClC1=C(O)C(Cl)=CC(C[C@@H](O)C(N[C@H](CC(C)C)C(N2[C@H](C(NCCCCNC(N)=N)=O)C[C@H]3[C@@H]2C[C@H](O)CC3)=O)=O)=C1,"InChI=1S/C29H44Cl2N6O6/c1-15(2)9-21(36-27(42)24(39)12-16-10-19(30)25(40)20(31)11-16)28(43)37-22-14-18(38)6-5-17(22)13-23(37)26(41)34-7-3-4-8-35-29(32)33/h10-11,15,17-18,21-24,38-40H,3-9,12-14H2,1-2H3,(H,34,41)(H,36,42)(H4,32,33,35)/t17-,18+,21+,22-,23-,24+/m0/s1",MNXFJDXHLSUJHU-PVPAWSFNSA-N,71461464,yes,n.a.,n.a.,n.a.
CyanoMetDB_1330,Teleocidin B,Teleocidin B1,other linear non-peptide,Lyngbya toxin (alkaloid),C28H41N3O2,451.3198776,CC(C)[C@H]1C(=O)N[C@@H](CC2=CNC3=C4C(=CC(=C23)N1C)[C@](CC[C@]4(C)C=C)(C)C(C)C)CO,"InChI=1S/C28H41N3O2/c1-9-27(6)10-11-28(7,17(4)5)20-13-21-22-18(14-29-24(22)23(20)27)12-19(15-32)30-26(33)25(16(2)3)31(21)8/h9,13-14,16-17,19,25,29,32H,1,10-12,15H2,2-8H3,(H,30,33)/t19-,25-,27-,28-/m0/s1",PEYTUVXFLCCGCC-IVLSQBGHSA-N,133562790,no ,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1331,Tolypodiol,,other linear non-peptide,,C28H40O5,456.2875744,C[C@]12CCC3[C@](C[C@@H](O)C4[C@]3(C)[C@H](O)CCC4(C)C)(C)C1CC5=C(C=CC(C(OC)=O)=C5)O2,"InChI=1S/C28H40O5/c1-25(2)11-10-22(30)28(5)20-9-12-27(4)21(26(20,3)15-18(29)23(25)28)14-17-13-16(24(31)32-6)7-8-19(17)33-27/h7-8,13,18,20-23,29-30H,9-12,14-15H2,1-6H3/t18-,20?,21?,22-,23?,26-,27+,28+/m1/s1",NQNQLGPYASRQND-AGJVNAMPSA-N,10434219,yes,Tolypothrix,nodosa ,HT-58-2
CyanoMetDB_1332,Muscoride A,,other linear non-peptide,,C28H40N4O5,512.2998704,CC1=C(C2=NC(C(OC/C=C(C)\C)=O)=C(C)O2)N=C(C3CCCN3C(C(NC(C)(C=C)C)C(C)C)=O)O1,"InChI=1S/C28H40N4O5/c1-10-28(8,9)31-21(17(4)5)26(33)32-14-11-12-20(32)24-29-22(18(6)36-24)25-30-23(19(7)37-25)27(34)35-15-13-16(2)3/h10,13,17,20-21,31H,1,11-12,14-15H2,2-9H3",PFXJYHPNSWNJBP-UHFFFAOYSA-N,496385,yes,Nostoc,muscorum,IAM M-14
CyanoMetDB_1333,Microcyclamide MZ602,,Cyclamide,,C28H38N6O7S,602.2522688,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)[C@@H](C)O)CC3=CC=CC=C3)[C@@H](C)O,"InChI=1S/C28H38N6O7S/c1-5-14(2)21-28-31-19(13-42-28)24(38)29-12-20(37)32-22(15(3)35)26(40)30-18(11-17-9-7-6-8-10-17)25(39)34-23(16(4)36)27(41)33-21/h6-10,13-16,18,21-23,35-36H,5,11-12H2,1-4H3,(H,29,38)(H,30,40)(H,32,37)(H,33,41)(H,34,39)/t14-,15+,16+,18-,21-,22-,23-/m0/s1",ADBNSJLKNCMLCN-PQACYZQCSA-N,50942792,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1334,Lyngbyabellin B,,Cyclamide,Peptolide,C28H38Cl2N4O7S2,676.1558973,CC(C)[C@H]1C2=NC(=CS2)C(=O)O[C@H](C(C(=O)O[C@H](C3=NC(=CS3)C(=O)NCC(=O)N1)C(C)(C)O)(C)C)CCCC(C)(Cl)Cl,"InChI=1S/C28H38Cl2N4O7S2/c1-14(2)19-22-33-16(13-42-22)24(37)40-17(9-8-10-28(7,29)30)26(3,4)25(38)41-20(27(5,6)39)23-32-15(12-43-23)21(36)31-11-18(35)34-19/h12-14,17,19-20,39H,8-11H2,1-7H3,(H,31,36)(H,34,35)/t17-,19-,20+/m0/s1",AFYNXSMIBRNBEB-YSIASYRMSA-N,12072715,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1335,Balgacyclamide C,,Cyclamide,,C28H36N6O6S,584.2417041,O=C(C1C(C)OC2=N1)NC(C(CC)C)C3=NC(C(NCC(NC(C(NC2CC4=CC=CC=C4)=O)C(O)C)=O)=O)=CS3,"InChI=1S/C28H36N6O6S/c1-5-14(2)21-28-31-19(13-41-28)24(37)29-12-20(36)32-22(15(3)35)25(38)30-18(11-17-9-7-6-8-10-17)27-34-23(16(4)40-27)26(39)33-21/h6-10,13-16,18,21-23,35H,5,11-12H2,1-4H3,(H,29,37)(H,30,38)(H,32,36)(H,33,39)",QKBDCVSHWVPQHK-UHFFFAOYSA-N,146684898,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1336,Tolyporphin I,,other cyclic non-peptide,porphyrins,C28H26N4O6,514.1852346,CC1=CC2=CC3=NC(=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C1N2)(C)OC(=O)C)C)C(C3=O)(C)OC(=O)C,"InChI=1S/C28H26N4O6/c1-13-8-18-10-23-27(5,37-15(3)33)25(35)21(31-23)9-17-7-14(2)20(29-17)12-24-28(6,38-16(4)34)26(36)22(32-24)11-19(13)30-18/h7-12,29-30H,1-6H3",HFZVYGBRGMEKNE-UHFFFAOYSA-N,11756214,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1337,Tumonoic acid I,,other linear non-peptide,,C27H47NO7,497.3352529,CCCC[C@H](C)C[C@H](C)C(N1CCC[C@H]1C(O[C@](C(O[C@]([C@@H](C)CC)([H])C(O)=O)=O)([H])[C@@H](C)CC)=O)=O,"InChI=1S/C27H47NO7/c1-8-11-13-17(4)16-20(7)24(29)28-15-12-14-21(28)26(32)35-23(19(6)10-3)27(33)34-22(25(30)31)18(5)9-2/h17-23H,8-16H2,1-7H3,(H,30,31)/t17-,18-,19-,20-,21-,22-,23+/m0/s1",LWUJNFXMOSWRGO-HXWZHSPTSA-N,25058102,yes,Blennothrix,cantharidosmum,n.a.
CyanoMetDB_1338,Tumonoic acid C,,other linear non-peptide,,C27H45NO8,511.3145174,CCCCCCC/C=C(C)/[C@@H](O)[C@@H](C)C(N1CCC[C@H]1C(O[C@H](C(C)C)C(O[C@@H](C)C(O)=O)=O)=O)=O,"InChI=1S/C27H45NO8/c1-7-8-9-10-11-12-14-18(4)22(29)19(5)24(30)28-16-13-15-21(28)26(33)36-23(17(2)3)27(34)35-20(6)25(31)32/h14,17,19-23,29H,7-13,15-16H2,1-6H3,(H,31,32)/b18-14+/t19-,20+,21+,22-,23-/m1/s1",JMMSUMNUHPWPOM-ITIUQMENSA-N,10577669,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1339,Acutiphycin,,other cyclic non-peptide,,C27H44O7,480.3087038,CCCCC[C@@H](OC(C[C@@](O1)(O)C[C@@H](O)CC1/C(C)=C/[C@@H]2C)=O)C/C=C(C)/[C@@H](O)C(C)(C)C2=O,"InChI=1S/C27H44O7/c1-7-8-9-10-21-12-11-17(2)24(30)26(5,6)25(31)19(4)13-18(3)22-14-20(28)15-27(32,34-22)16-23(29)33-21/h11,13,19-22,24,28,30,32H,7-10,12,14-16H2,1-6H3/b17-11+,18-13+/t19-,20-,21+,22?,24+,27+/m0/s1",GEJXYOJDTGLZJE-DDALQIJOSA-N,10435292,yes,Oscillatoria/Planktothrix,acutissima,n.a.
CyanoMetDB_1340,Oscillatoxin,,Aeruginosin,Pseudoaeruginosin,C27H44N6O5,532.3373185,O=C(N[C@H](C(N1C(C(NC(CO)CCCNC(N)=N)=O)CC(C)C1)=O)CC2=CC=C(O)C=C2)CCCCC,"InChI=1S/C27H44N6O5/c1-3-4-5-8-24(36)32-22(15-19-9-11-21(35)12-10-19)26(38)33-16-18(2)14-23(33)25(37)31-20(17-34)7-6-13-30-27(28)29/h9-12,18,20,22-23,34-35H,3-8,13-17H2,1-2H3,(H,31,37)(H,32,36)(H4,28,29,30)/t18?,20?,22-,23?/m0/s1",FWZWNDYYSSVPMN-UGWHRVMUSA-N,,no ,Nodularia,spumigena,n.a.
CyanoMetDB_1341,"20,21-didehydroacutiphycin",,other cyclic non-peptide,,C27H42O7,478.2930537,C/C=C/CC[C@@H](OC(C[C@@](O1)(O)C[C@@H](O)CC1/C(C)=C/[C@@H]2C)=O)C/C=C(C)/[C@@H](O)C(C)(C)C2=O,"InChI=1S/C27H42O7/c1-7-8-9-10-21-12-11-17(2)24(30)26(5,6)25(31)19(4)13-18(3)22-14-20(28)15-27(32,34-22)16-23(29)33-21/h7-8,11,13,19-22,24,28,30,32H,9-10,12,14-16H2,1-6H3/b8-7+,17-11+,18-13+/t19-,20-,21+,22?,24+,27+/m0/s1",SLWJHRCOUPNNFJ-SOOWIYMQSA-N,23425161,yes,Oscillatoria/Planktothrix,acutissima,n.a.
CyanoMetDB_1342,Westiellamide,cycloxazoline (from ascidian derived Prochloron sp.),Cyclamide,Microcyclamide,C27H42N6O6,546.3165831,C[C@@H]1[C@H]2C(=O)N[C@H](C3=N[C@@H]([C@H](O3)C)C(=O)N[C@H](C4=N[C@@H]([C@H](O4)C)C(=O)N[C@H](C(=N2)O1)C(C)C)C(C)C)C(C)C,"InChI=1S/C27H42N6O6/c1-10(2)16-25-31-20(13(7)37-25)23(35)29-18(12(5)6)27-33-21(15(9)39-27)24(36)30-17(11(3)4)26-32-19(14(8)38-26)22(34)28-16/h10-21H,1-9H3,(H,28,34)(H,29,35)(H,30,36)/t13-,14-,15-,16+,17+,18+,19+,20+,21+/m1/s1",MIDTUAMKJJDHAR-YAWPOEEYSA-N,159587,yes,Westiellopsis,prolifica,n.a.
CyanoMetDB_1343,Pseudoaeruginosin NS1,,Spumigin,Pseudoaeruginosin ; aeruginosin,C27H42N6O5,530.3216685,CCCCCC(N[C@H](C(N1[C@@H](C[C@@H](C1)C)C(NC(CCCNC(N)=N)C([H])=O)=O)=O)CC2=CC=C(C=C2)O)=O,"InChI=1S/C27H42N6O5/c1-3-4-5-8-24(36)32-22(15-19-9-11-21(35)12-10-19)26(38)33-16-18(2)14-23(33)25(37)31-20(17-34)7-6-13-30-27(28)29/h9-12,17-18,20,22-23,35H,3-8,13-16H2,1-2H3,(H,31,37)(H,32,36)(H4,28,29,30)/t18-,20?,22-,23-/m0/s1",ULFMNSXBTYDMFI-JLWWHIBLSA-N,146683670,no ,Nodularia,spumigena,AV1
CyanoMetDB_1344,Microginin 550,,Microginin,,C27H42N4O8,550.3002643,CCCCCCCC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)CO)=O)O)N,"InChI=1S/C27H42N4O8/c1-2-3-4-5-6-8-19(28)23(34)25(36)30-21(16-32)26(37)31-14-7-9-22(31)24(35)29-20(27(38)39)15-17-10-12-18(33)13-11-17/h10-13,19-23,32-34H,2-9,14-16,28H2,1H3,(H,29,35)(H,30,36)(H,38,39)",IHGGTMZLAXZULN-UHFFFAOYSA-N,146684952,no,n.a.,n.a.,n.a.
CyanoMetDB_1345,Microginin 534,,Microginin,,C27H42N4O7,534.3053497,CCCCCCCC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)C)=O)O)N,"InChI=1S/C27H42N4O7/c1-3-4-5-6-7-9-20(28)23(33)25(35)29-17(2)26(36)31-15-8-10-22(31)24(34)30-21(27(37)38)16-18-11-13-19(32)14-12-18/h11-14,17,20-23,32-33H,3-10,15-16,28H2,1-2H3,(H,29,35)(H,30,34)(H,37,38)",VNBMYUGDBFAYON-UHFFFAOYSA-N,146684953,no,n.a.,n.a.,n.a.
CyanoMetDB_1346,Microginin 568,,Microginin,,C27H41ClN4O7,568.2663774,NC(C(C(NC(C(N1C(CCC1)C(NC(CC2=CC=C(O)C=C2)C(O)=O)=O)=O)C)=O)O)CCCCCCCCl,"InChI=1S/C27H41ClN4O7/c1-17(30-25(36)23(34)20(29)8-5-3-2-4-6-14-28)26(37)32-15-7-9-22(32)24(35)31-21(27(38)39)16-18-10-12-19(33)13-11-18/h10-13,17,20-23,33-34H,2-9,14-16,29H2,1H3,(H,30,36)(H,31,35)(H,38,39)",NJDILFPPWHNJRA-UHFFFAOYSA-N,146684954,no,n.a.,n.a.,n.a.
CyanoMetDB_1347,Comnostin A,,other linear non-peptide,,C27H40O4,428.2926598,C[C@@H]1CC[C@@]2(C3CC[C@@]([C@@]3(CCC2[C@]1(C)CC4=C(C=CC(=C4)C(=O)O)O)C)(C)CO)C,"InChI=1S/C27H40O4/c1-17-8-12-25(3)21(10-13-27(5)22(25)9-11-24(27,2)16-28)26(17,4)15-19-14-18(23(30)31)6-7-20(19)29/h6-7,14,17,21-22,28-29H,8-13,15-16H2,1-5H3,(H,30,31)/t17-,21?,22?,24+,25+,26-,27-/m1/s1",GADPAHOVYVZUKK-YIZMITPNSA-N,10365300,yes,Nostoc,commune,EAWAG 122b
CyanoMetDB_1348,Lyngbyatoxin B,,other linear non-peptide,Lyngbya toxin (alkaloid),C27H39N3O3,453.2991421,CC(C)C1C(=O)NC(CC2=CNC3=C(C=CC(=C23)N1C)C(C)(CCC(C(=C)C)O)C=C)CO,"InChI=1S/C27H39N3O3/c1-8-27(6,12-11-22(32)16(2)3)20-9-10-21-23-18(14-28-24(20)23)13-19(15-31)29-26(33)25(17(4)5)30(21)7/h8-10,14,17,19,22,25,28,31-32H,1-2,11-13,15H2,3-7H3,(H,29,33)",RLQWNZUFDRUTMZ-UHFFFAOYSA-N,131589,no ,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1349,Lyngbyatoxin C,,other linear non-peptide,Lyngbya toxin (alkaloid),C27H39N3O3,453.2991421,CC(C)C1C(=O)NC(CC2=CNC3=C(C=CC(=C23)N1C)C(C)(CC=CC(C)(C)O)C=C)CO,"InChI=1S/C27H39N3O3/c1-8-27(6,13-9-12-26(4,5)33)20-10-11-21-22-18(15-28-23(20)22)14-19(16-31)29-25(32)24(17(2)3)30(21)7/h8-12,15,17,19,24,28,31,33H,1,13-14,16H2,2-7H3,(H,29,32)/b12-",VMLLPMJDAXPWAA-PIKNDIPASA-N,6441239,no ,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1350,Lyngbyatoxin A,Teleocidina A1,other linear peptide,Lyngbya toxin (alkaloid),C27H39N3O2,437.3042275,CC([C@@H]1C(N[C@@H](CO)CC2=CNC3=C([C@@](CC/C=C(C)\C)(C=C)C)C=CC(N1C)=C23)=O)C,"InChI=1S/C27H39N3O2/c1-8-27(6,13-9-10-17(2)3)21-11-12-22-23-19(15-28-24(21)23)14-20(16-31)29-26(32)25(18(4)5)30(22)7/h8,10-12,15,18,20,25,28,31H,1,9,13-14,16H2,2-7H3,(H,29,32)/t20-,25-,27-/m0/s1",KISDGNGREAJPQR-OICBGKIFSA-N,91706,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1351,Teleocidin-A2 19(S),,other linear non-peptide,Lyngbya toxin (alkaloid),C27H39N3O2,437.3042275,CC([C@@H](C(N[C@H](CC1=CNC2=C1C3=CC=C2C(C)(C=C)CC/C=C(C)\C)CO)=O)N3C)C,"InChI=1S/C27H39N3O2/c1-8-27(6,13-9-10-17(2)3)21-11-12-22-23-19(15-28-24(21)23)14-20(16-31)29-26(32)25(18(4)5)30(22)7/h8,10-12,15,18,20,25,28,31H,1,9,13-14,16H2,2-7H3,(H,29,32)/t20-,25+,27?/m1/s1",KISDGNGREAJPQR-PAZRZLAHSA-N,,no ,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1352,Jamaicamide C,,other linear non-peptide,Lipopeptide,C27H39ClN2O4,490.2598354,CC1C=CC(=O)N1C(=O)/C=C(\CCNC(=O)CC/C=C/C(C)CC/C(=C/Cl)/CCCC=C)/OC,"InChI=1S/C27H39ClN2O4/c1-5-6-7-11-23(20-28)15-13-21(2)10-8-9-12-25(31)29-18-17-24(34-4)19-27(33)30-22(3)14-16-26(30)32/h5,8,10,14,16,19-22H,1,6-7,9,11-13,15,17-18H2,2-4H3,(H,29,31)/b10-8+,23-20+,24-19+",PRVBXXHHHXSICY-GDKFLGFMSA-N,21589267,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1353,neo-debromoaplysiatoxin B,,other linear non-peptide,Aplysiatoxin,C27H38O6,458.2668389,OC1=C2C3(C(C)(C)CC1C)CC(C(C)C(O3)C(C)CCC(OC)C4=CC(O)=CC=C4)OC2=O,"InChI=1S/C27H38O6/c1-15(10-11-20(31-6)18-8-7-9-19(28)12-18)24-17(3)21-14-27(33-24)22(25(30)32-21)23(29)16(2)13-26(27,4)5/h7-9,12,15-17,20-21,24,28-29H,10-11,13-14H2,1-6H3/t15-,16+,17-,20-,21-,24+,27-/m0/s1",AXOGDPFMSLPSGB-FFHNPLLASA-N,146683881,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1354,Comnostin C,,other linear non-peptide,Diterpenoid,C27H38O5,442.2719243,C[C@@H]1CC[C@@]2(C3CC[C@@]([C@@]3(CCC2[C@]1(C)CC4=C(C=CC(=C4)C(=O)O)O)C)(C)C(=O)O)C,"InChI=1S/C27H38O5/c1-16-8-11-24(2)20(9-12-26(4)21(24)10-13-27(26,5)23(31)32)25(16,3)15-18-14-17(22(29)30)6-7-19(18)28/h6-7,14,16,20-21,28H,8-13,15H2,1-5H3,(H,29,30)(H,31,32)/t16-,20?,21?,24+,25-,26-,27+/m1/s1",VEXFNNZBZUDQNY-DALJTSPUSA-N,9980817,yes,Nostoc,commune,EAWAG 122b
CyanoMetDB_1355,Noscomin,,other linear non-peptide,,C27H38O4,426.2770097,C[C@@H]1CC=C2[C@H]([C@]1(C)CC3=C(C=CC(=C3)C(=O)O)O)CC[C@H]4[C@]2(CC[C@H](C4(C)C)O)C,"InChI=1S/C27H38O4/c1-16-6-8-19-20(9-11-22-25(2,3)23(29)12-13-26(19,22)4)27(16,5)15-18-14-17(24(30)31)7-10-21(18)28/h7-8,10,14,16,20,22-23,28-29H,6,9,11-13,15H2,1-5H3,(H,30,31)/t16-,20-,22-,23-,26+,27-/m1/s1",HWGPBUBDNCZOBN-FVBFRTCBSA-N,10410225,yes,Nostoc,commune,n.a.
CyanoMetDB_1356,Comnostin B,,other linear non-peptide,,C27H38O4,426.2770097,C[C@@H]1CC[C@@]2(C3CC[C@@]([C@@]3(CCC2[C@]1(C)CC4=C(C=CC(=C4)C(=O)O)O)C)(C)C=O)C,"InChI=1S/C27H38O4/c1-17-8-12-25(3)21(10-13-27(5)22(25)9-11-24(27,2)16-28)26(17,4)15-19-14-18(23(30)31)6-7-20(19)29/h6-7,14,16-17,21-22,29H,8-13,15H2,1-5H3,(H,30,31)/t17-,21?,22?,24+,25+,26-,27-/m1/s1",JBBYKAGPJLHVPI-YIZMITPNSA-N,10093982,yes,Nostoc,commune,EAWAG 122b
CyanoMetDB_1357,Comnostin E,,other linear non-peptide,,C27H38O4,426.2770097,C[C@@H]1CC[C@@]2(C3CC[C@H]([C@@]3(CCC2[C@]1(C)CC4=C(C=CC(=C4)C(=O)O)O)C)C(=O)C)C,"InChI=1S/C27H38O4/c1-16-10-12-26(4)22-9-7-20(17(2)28)25(22,3)13-11-23(26)27(16,5)15-19-14-18(24(30)31)6-8-21(19)29/h6,8,14,16,20,22-23,29H,7,9-13,15H2,1-5H3,(H,30,31)/t16-,20+,22?,23?,25+,26-,27-/m1/s1",PCLWWUDFTVTRTJ-ATCNUFKCSA-N,10025501,yes,Nostoc,commune,EAWAG 122b
CyanoMetDB_1358,Jamaicamide B,,other linear non-peptide,Lipopeptide,C27H37ClN2O4,488.2441854,CC1C=CC(=O)N1C(=O)/C=C(\CCNC(=O)CC/C=C/C(C)CC/C(=C/Cl)/CCCC#C)/OC,"InChI=1S/C27H37ClN2O4/c1-5-6-7-11-23(20-28)15-13-21(2)10-8-9-12-25(31)29-18-17-24(34-4)19-27(33)30-22(3)14-16-26(30)32/h1,8,10,14,16,19-22H,6-7,9,11-13,15,17-18H2,2-4H3,(H,29,31)/b10-8+,23-20+,24-19+",KZVHAGNFWJIOMX-GDKFLGFMSA-N,21589266,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1359,"8-[(5-carboxy-2,9-epoxy)benzyl]-2,5-dihydroxy-1,1,4a,7,8-pentamethyl-1,2,3,4,4a,6,7,8,9,10,10a-dodecahydrophenanthrene",,other linear non-peptide,,C27H36O5,440.2562743,C[C@@H]1C[C@@H](C2=C3[C@@]1(CC4=C(C=CC(=C4)C(=O)O)O[C@@H]3C[C@H]5[C@]2(CC[C@H](C5(C)C)O)C)C)O,"InChI=1S/C27H36O5/c1-14-10-17(28)22-23-19(12-20-25(2,3)21(29)8-9-26(20,22)4)32-18-7-6-15(24(30)31)11-16(18)13-27(14,23)5/h6-7,11,14,17,19-21,28-29H,8-10,12-13H2,1-5H3,(H,30,31)/t14-,17+,19-,20-,21-,26-,27-/m1/s1",MJJYRBWVKARFOM-FORJUWHVSA-N,10503263,yes,Nostoc,commune ,EAWAG 122b
CyanoMetDB_1360,Jamaicamide A,,other linear non-peptide,Lipopeptide,C27H36BrClN2O4,566.154698,CC1C=CC(=O)N1C(=O)/C=C(\CCNC(=O)CC/C=C/C(C)CC/C(=C/Cl)/CCCC#CBr)/OC,"InChI=1S/C27H36BrClN2O4/c1-21(12-14-23(20-29)10-5-4-8-17-28)9-6-7-11-25(32)30-18-16-24(35-3)19-27(34)31-22(2)13-15-26(31)33/h6,9,13,15,19-22H,4-5,7,10-12,14,16,18H2,1-3H3,(H,30,32)/b9-6+,23-20+,24-19+",NAIKIJSSBJHCBL-IPUGVWFUSA-N,21589265,no,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1361,Bistratamide A,,Cyclamide,Microcyclamide,C27H34N6O4S2,570.2082959,C[C@@H]1[C@H]2C(=O)N[C@H](C3=NC(CS3)C(=O)N[C@H](C4=NC(CS4)C(=O)N[C@H](C(=N2)O1)C(C)C)CC5=CC=CC=C5)C,"InChI=1S/C27H34N6O4S2/c1-13(2)20-25-33-21(15(4)37-25)24(36)28-14(3)26-30-18(11-38-26)22(34)29-17(10-16-8-6-5-7-9-16)27-31-19(12-39-27)23(35)32-20/h5-9,13-15,17-21H,10-12H2,1-4H3,(H,28,36)(H,29,34)(H,32,35)/t14-,15+,17-,18?,19?,20-,21-/m0/s1",WNSIWZVQPOAVNY-XKYJWWAMSA-N,149084,yes,n.a.,n.a.,n.a.
CyanoMetDB_1362,Hectochlorin,,Cyclamide,,C27H34Cl2N2O9S2,664.1082784,C[C@H]1[C@@H](OC(=O)C2=CSC(=N2)[C@H](C(OC(=O)C3=CSC(=N3)[C@@H](OC1=O)C(C)(C)O)(C)C)OC(=O)C)CCCC(C)(Cl)Cl,"InChI=1S/C27H34Cl2N2O9S2/c1-13-17(9-8-10-27(7,28)29)38-23(34)15-11-42-21(30-15)19(37-14(2)32)26(5,6)40-24(35)16-12-41-20(31-16)18(25(3,4)36)39-22(13)33/h11-13,17-19,36H,8-10H2,1-7H3",USXIYWCPCGVOKF-UHFFFAOYSA-N,22297345,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1363,Aeruginosin DA511,,Aeruginosin,,C27H33N3O7,511.2318504,C1C[C@@H](C[C@H]2[C@@H]1C[C@H](N2C(=O)[C@@H](CC3=CC=C(C=C3)O)NC(=O)[C@@H](CC4=CC=C(C=C4)O)O)C(=O)N)O,"InChI=1S/C27H33N3O7/c28-25(35)23-13-17-5-10-20(33)14-22(17)30(23)27(37)21(11-15-1-6-18(31)7-2-15)29-26(36)24(34)12-16-3-8-19(32)9-4-16/h1-4,6-9,17,20-24,31-34H,5,10-14H2,(H2,28,35)(H,29,36)/t17-,20-,21+,22-,23-,24+/m0/s1",UYAGLGONOYOGBB-QECFBVRUSA-N,76317191,yes,n.a.,n.a.,n.a.
CyanoMetDB_1364,Aeruginosin DA495A,,Aeruginosin,,C27H33N3O6,495.2369,OC1=CC=C(C[C@@H](O)C(N[C@H](CC2=CC=C([H])C=C2)C(N3[C@H](C(N)=O)C[C@H]4[C@@H]3C[C@@H](O)CC4)=O)=O)C=C1,"InChI=1S/C27H33N3O6/c28-25(34)23-14-18-8-11-20(32)15-22(18)30(23)27(36)21(12-16-4-2-1-3-5-16)29-26(35)24(33)13-17-6-9-19(31)10-7-17/h1-7,9-10,18,20-24,31-33H,8,11-15H2,(H2,28,34)(H,29,35)/t18-,20-,21+,22-,23-,24+/m0/s1",NGUWJJZEICUAEZ-YKWUAUMOSA-N,76317192,yes,n.a.,n.a.,n.a.
CyanoMetDB_1365,Microcyclamide GL628,,Cyclamide,,C27H32N8O6S2,628.1886231,CC[C@@H]([C@H]1C2=NC(C(N3[C@H](C4=NC(C(N[C@@H](C)C5=NC(C(N1)=O)=C(C)O5)=O)=CS4)C[C@]6(OC)[C@H]3NC(N6C)=O)=O)=CS2)C,"InChI=1S/C27H32N8O6S2/c1-7-11(2)17-23-30-15(10-43-23)24(38)35-16(8-27(40-6)25(35)33-26(39)34(27)5)22-29-14(9-42-22)19(36)28-12(3)21-32-18(13(4)41-21)20(37)31-17/h9-12,16-17,25H,7-8H2,1-6H3,(H,28,36)(H,31,37)(H,33,39)/t11-,12-,16-,17-,25-,27-/m0/s1",ZMCZEOONQQHJQK-HURATCRKSA-N,46197258,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1367,Raocyclamide B,,Cyclamide,,C27H32N6O6S,568.2104039,CC[C@H](C)C1C2=NC(=CS2)C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@H](C3=NC(=CO3)C(=O)N1)C)CO)CC4=CC=CC=C4,"InChI=1S/C27H32N6O6S/c1-4-14(2)21-27-32-20(13-40-27)25(38)29-17(10-16-8-6-5-7-9-16)22(35)30-18(11-34)23(36)28-15(3)26-31-19(12-39-26)24(37)33-21/h5-9,12-15,17-18,21,34H,4,10-11H2,1-3H3,(H,28,36)(H,29,38)(H,30,35)(H,33,37)",YHWCLQASEOOYBT-UHFFFAOYSA-N,177291,yes,Oscillatoria/Planktothrix,raoi,n.a.
CyanoMetDB_1368,Bistratamide K,,Cyclamide,Microcyclamide,C27H32N6O4S2,568.1926459,O=C(N[C@H](C)C1=NC(C(N[C@H](CC2=CC=CC=C2)C3=N[C@H]4CS3)=O)=CS1)[C@H]5N=C([C@H](C(C)C)NC4=O)O[C@@H]5C,"InChI=1S/C27H32N6O4S2/c1-13(2)20-25-33-21(15(4)37-25)24(36)28-14(3)26-30-18(11-38-26)22(34)29-17(10-16-8-6-5-7-9-16)27-31-19(12-39-27)23(35)32-20/h5-9,11,13-15,17,19-21H,10,12H2,1-4H3,(H,28,36)(H,29,34)(H,32,35)/t14-,15-,17-,19+,20+,21+/m1/s1",WNDVDRLYHYCTLJ-GLSDQQHTSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1369,Bistratamide L,,Cyclamide,Microcyclamide,C27H32N6O4S2,568.1926459,C[C@@H]1[C@@H]2N=C([C@H](C(C)C)NC([C@@H]3CSC([C@H](NC(C4=CSC([C@@H](NC2=O)C)=N4)=O)CC5=CC=CC=C5)=N3)=O)O1,"InChI=1S/C27H32N6O4S2/c1-13(2)20-25-33-21(15(4)37-25)24(36)28-14(3)26-30-18(11-38-26)22(34)29-17(10-16-8-6-5-7-9-16)27-31-19(12-39-27)23(35)32-20/h5-9,11,13-15,17,19-21H,10,12H2,1-4H3,(H,28,36)(H,29,34)(H,32,35)/t14-,15-,17-,19+,20+,21+/m1/s1",WNDVDRLYHYCTLJ-GLSDQQHTSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1370,Bistratamide B,,Cyclamide,Microcyclamide,C27H32N6O4S2,568.192645,C[C@@H]1[C@H]2C(N[C@@H](C)C3=NC(C(N[C@@H](CC4=CC=CC=C4)C5=NC(C(N[C@@H](C(C)C)C(O1)=N2)=O)=CS5)=O)CS3)=O,"InChI=1S/C27H32N6O4S2/c1-13(2)20-25-33-21(15(4)37-25)24(36)28-14(3)26-30-18(11-38-26)22(34)29-17(10-16-8-6-5-7-9-16)27-31-19(12-39-27)23(35)32-20/h5-9,12-15,17-18,20-21H,10-11H2,1-4H3,(H,28,36)(H,29,34)(H,32,35)/t14-,15+,17-,18?,20-,21-/m0/s1",BRLJUCBNCZSZRH-OSZAHGOSSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1371,Raocyclamide A,,Cyclamide,,C27H30N6O5S,550.1998393,CC[C@H](C)C1C2=NC(=CS2)C(=O)N[C@@H](C3=N[C@H](CO3)C(=O)N[C@H](C4=NC(=CO4)C(=O)N1)C)CC5=CC=CC=C5,"InChI=1S/C27H30N6O5S/c1-4-14(2)21-27-32-20(13-39-27)24(36)29-17(10-16-8-6-5-7-9-16)26-31-18(12-38-26)22(34)28-15(3)25-30-19(11-37-25)23(35)33-21/h5-9,11,13-15,17-18,21H,4,10,12H2,1-3H3,(H,28,34)(H,29,36)(H,33,35)",PNCLWRPJCHTJRB-UHFFFAOYSA-N,,yes,Oscillatoria/Planktothrix,raoi,n.a.
CyanoMetDB_1372,Semiplenamide D,,other linear non-peptide,Semiplenamide,C26H49NO3,423.3712444,CCCCCCCCCCCCCCCCC/C=C(\C)/C(=O)N[C@@H](C)COC(=O)C,"InChI=1S/C26H49NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(2)26(29)27-24(3)22-30-25(4)28/h21,24H,5-20,22H2,1-4H3,(H,27,29)/b23-21+/t24-/m0/s1",BWYMSFLJEASKMU-SECBRAMXSA-N,11316191,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_1373,Synechobactin A,,other linear non-peptide,Siderophore,C26H48N4O9,560.3421291,O=C(CC(CC(NCCCN(C(C)=O)O)=O)(C(O)=O)O)NCCCN(C(CCCCCCCCCCC)=O)O,"InChI=1S/C26H48N4O9/c1-3-4-5-6-7-8-9-10-11-14-24(34)30(39)18-13-16-28-23(33)20-26(37,25(35)36)19-22(32)27-15-12-17-29(38)21(2)31/h37-39H,3-20H2,1-2H3,(H,27,32)(H,28,33)(H,35,36)",PBPRFAHEEMSBKU-UHFFFAOYSA-N,21778355,yes,Synechococcus,n.a.,PCC 7002
CyanoMetDB_1374,Tumonoic acid H,,other linear non-peptide,,C26H45NO7,483.3196028,CCCCCCCC[C@@H](C(N1CCC[C@H]1C(O[C@H](C(C)C)C(O[C@H](C(O)=O)C(C)C)=O)=O)=O)C,"InChI=1S/C26H45NO7/c1-7-8-9-10-11-12-14-19(6)23(28)27-16-13-15-20(27)25(31)34-22(18(4)5)26(32)33-21(17(2)3)24(29)30/h17-22H,7-16H2,1-6H3,(H,29,30)/t19-,20-,21-,22+/m0/s1",XZDDLHQSVWZOPD-MYGLTJDJSA-N,25058105,yes,Blennothrix,cantharidosmum,n.a.
CyanoMetDB_1375,Scytoscalarol,,other linear non-peptide,,C26H45N3O,415.3562631,C[C@@]12CC[C@]3([H])[C@@]([C@H](O)CCC3(C)C)(C)[C@@]1([H])CC[C@@]4(C)[C@@]2([H])CCC([C@@H]4CNC(N)=N)=C,"InChI=1S/C26H45N3O/c1-16-7-8-19-24(4,17(16)15-29-22(27)28)13-10-20-25(19,5)14-9-18-23(2,3)12-11-21(30)26(18,20)6/h17-21,30H,1,7-15H2,2-6H3,(H4,27,28,29)/t17-,18-,19+,20-,21+,24+,25-,26-/m1/s1",YFYZOMDKMZGTIY-SDIHUKMBSA-N,44605340,yes,Scytonema,n.a.,UTEX 1163
CyanoMetDB_1376,Dysinosin A,,Aeruginosin,,C26H44N6O10S,632.2839628,O[C@@H]1[C@@H](O)C[C@@](N(C([C@H](NC([C@H](OC)COS(=O)([O-])=O)=O)CC(C)C)=O)[C@H](C(NCCC(C/2)=CC[N+]2=C(N)/N)=O)C3)([H])[C@@]3([H])C1,"InChI=1S/C26H44N6O10S/c1-14(2)8-17(30-24(36)22(41-3)13-42-43(38,39)40)25(37)32-18-11-21(34)20(33)10-16(18)9-19(32)23(35)29-6-4-15-5-7-31(12-15)26(27)28/h5,14,16-22,33-34H,4,6-13H2,1-3H3,(H6,27,28,29,30,35,36,38,39,40)/t16-,17-,18+,19+,20+,21+,22?/m1/s1",FJKGWCOVORXKMM-FDUJWEDISA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1377,Cybastacine A,,other linear non-peptide,,C26H44N4O4,476.3362559,C[C@]12CCCC([C@@H]1CCC3=C2[C@@H](C[C@]4([C@@]3(CC[C@@]5([C@@H]4CN=C(N5)N)C)C)C)O)(C)C.[N+](=O)(O)[O-],"InChI=1S/C26H43N3O.HNO3/c1-22(2)10-7-11-23(3)18(22)9-8-16-20(23)17(30)14-25(5)19-15-28-21(27)29-26(19,6)13-12-24(16,25)4;2-1(3)4/h17-19,30H,7-15H2,1-6H3,(H3,27,28,29);(H,2,3,4)/t17-,18+,19-,23+,24-,25-,26-;/m1./s1",SJKXTCCZAGJOMB-HHVDTDQPSA-N,139589911,yes,Nostoc,n.a.,BEA-0956
CyanoMetDB_1378,Nosperin,,other linear non-peptide,,C26H43N3O9,541.29993,C[C@@H]1[C@H](C)C(C[C@@]([C@H](O)C(N/C=C/C([C@@H](O)C(C)C(N2CCC[C@H]2[C@H](O)CC(N)=O)=O)CO)=O)(OC)O1)=C,"InChI=1S/C26H43N3O9/c1-14-12-26(37-5,38-17(4)15(14)2)23(34)24(35)28-9-8-18(13-30)22(33)16(3)25(36)29-10-6-7-19(29)20(31)11-21(27)32/h8-9,15-20,22-23,30-31,33-34H,1,6-7,10-13H2,2-5H3,(H2,27,32)(H,28,35)/b9-8+/t15-,16?,17-,18?,19+,20-,22+,23-,26-/m1/s1",AYSMYLUVPGMSKV-PLXAKVCMSA-N,,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1379,Microginin 527 methyl ester,,Microginin,,C26H43N3O7S,541.2821715,CCCCCCC[C@H](N)[C@H](O)C(N([C@H](C(N[C@H](C(OC)=O)CC1=CC=C(O)C=C1)=O)CCS(C)=O)C)=O,"InChI=1S/C26H43N3O7S/c1-5-6-7-8-9-10-20(27)23(31)25(33)29(2)22(15-16-37(4)35)24(32)28-21(26(34)36-3)17-18-11-13-19(30)14-12-18/h11-14,20-23,30-31H,5-10,15-17,27H2,1-4H3,(H,28,32)/t20-,21-,22-,23-,37?/m0/s1",LMUKNGXVZWJANM-DHWRZQMWSA-N,146684843,yes,Microcystis,aeruginosa,UTEX LB2385
CyanoMetDB_1380,Smenamide E,,other linear non-peptide,Smenamides,C26H43ClN2O5,498.2860502,CCC(N(CCC/C(CCC(C)C(O)C(C)C(N1C(CC(C)C)C(OC)=CC1=O)=O)=C\Cl)C)=O,"InChI=1S/C26H43ClN2O5/c1-8-23(30)28(6)13-9-10-20(16-27)12-11-18(4)25(32)19(5)26(33)29-21(14-17(2)3)22(34-7)15-24(29)31/h15-19,21,25,32H,8-14H2,1-7H3/b20-16+",IURWMKSBPILHRN-CAPFRKAQSA-N,146683882,yes,Trichodesmium,n.a.,n.a.
CyanoMetDB_1381,Malyngamide I,,other linear non-peptide,Malyngamide,C26H42ClNO5,483.2751512,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C/Cl)/[C@]12[C@H](O1)C[C@@H]([C@@H](C2=O)C)O)OC,"InChI=1S/C26H42ClNO5/c1-5-6-7-8-10-13-21(32-4)14-11-9-12-15-23(29)28(3)18-20(17-27)26-22(33-26)16-19(2)24(30)25(26)31/h9,11,17,19,21-22,24,30H,5-8,10,12-16,18H2,1-4H3/b11-9+,20-17-",PYKFFLZRWLVRMO-JZUNLKODSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1382,Malyngamide L,,other linear non-peptide,Malyngamide,C26H42ClNO4,467.2802365,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C/Cl)/C1=CCC(C(C1=O)C)O)OC,"InChI=1S/C26H42ClNO4/c1-5-6-7-8-10-13-22(32-4)14-11-9-12-15-25(30)28(3)19-21(18-27)23-16-17-24(29)20(2)26(23)31/h9,11,16,18,20,22,24,29H,5-8,10,12-15,17,19H2,1-4H3/b11-9+,21-18-/t20?,22-,24?/m0/s1",GPOZTCNXXQOJHN-JBGKWSIPSA-N,21673411,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1383,Malyngamide H,,other linear non-peptide,Malyngamide,C26H41NO4,431.3035588,CCCCCCC[C@@H](C/C=C/CCC(=O)NCCC(=C)[C@]12[C@H](O1)CC=C(C2=O)C)OC,"InChI=1S/C26H41NO4/c1-5-6-7-8-10-13-22(30-4)14-11-9-12-15-24(28)27-19-18-21(3)26-23(31-26)17-16-20(2)25(26)29/h9,11,16,22-23H,3,5-8,10,12-15,17-19H2,1-2,4H3,(H,27,28)/b11-9+/t22-,23+,26+/m0/s1",MNBBBIJBVPWYSD-AIIVTHQSSA-N,10025771,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1384,8-O-acetyl-8-epi-malyngamide C,,other linear non-peptide,Lyngbya toxin,C26H40ClNO6,497.2544157,CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C/Cl)/[C@@]12[C@@H](O1)[C@@H](CCC2=O)OC(=O)C)OC,"InChI=1S/C26H40ClNO6/c1-4-5-6-7-9-12-21(32-3)13-10-8-11-14-24(31)28-18-20(17-27)26-23(30)16-15-22(25(26)34-26)33-19(2)29/h8,10,17,21-22,25H,4-7,9,11-16,18H2,1-3H3,(H,28,31)/b10-8+,20-17-/t21-,22+,25-,26+/m0/s1",UADSYHULFVDMCJ-HAXZSZBCSA-N,49782891,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1385,Malyngamide N,,other linear non-peptide,Malyngamide,C26H40ClNO4,465.2645865,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C/Cl)/[C@@]12[C@@H](O1)CC=C(C2=O)C)OC,"InChI=1S/C26H40ClNO4/c1-5-6-7-8-10-13-22(31-4)14-11-9-12-15-24(29)28(3)19-21(18-27)26-23(32-26)17-16-20(2)25(26)30/h9,11,16,18,22-23H,5-8,10,12-15,17,19H2,1-4H3/b11-9+,21-18-/t22-,23-,26-/m0/s1",NTWGVTHKTLNPTB-SERKONDUSA-N,10528184,yes,Gracilaria,coronopifolia,n.a.
CyanoMetDB_1386,Malyngamide M,,other linear non-peptide,Malyngamide,C26H40ClNO3,449.2696719,CCCCCCC[C@@H](C/C=C/CCC(=O)N(C)C/C(=C/Cl)/C1=C(C(=CC=C1)C)O)OC,"InChI=1S/C26H40ClNO3/c1-5-6-7-8-10-15-23(31-4)16-11-9-12-18-25(29)28(3)20-22(19-27)24-17-13-14-21(2)26(24)30/h9,11,13-14,17,19,23,30H,5-8,10,12,15-16,18,20H2,1-4H3/b11-9+,22-19-/t23-/m0/s1",ONLRPLDTZJYMBK-MHZFXPHZSA-N,10623415,yes,Gracilaria,coronopifolia,n.a.
CyanoMetDB_1387,Ypaoamide A,Ypaoamide,other linear non-peptide,Lyngbya toxin (alkaloid),C26H36N2O5,456.2624223,CC(C)(C)CCCCC(=O)NCC/C(=C\C(=O)N1[C@H](C=CC1=O)CC2=CC=C(C=C2)O)/OC,"InChI=1S/C26H36N2O5/c1-26(2,3)15-6-5-7-23(30)27-16-14-22(33-4)18-25(32)28-20(10-13-24(28)31)17-19-8-11-21(29)12-9-19/h8-13,18,20,29H,5-7,14-17H2,1-4H3,(H,27,30)/b22-18+/t20-/m1/s1",ATTMLQCPKPSEGH-FCKILEINSA-N,44471103,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1389,Fischerellin A,,other linear non-peptide,,C26H36N2O2,408.2776784,CCCCCC#CC#C/C=C/CC(C)C[C@H]1C[C@H](C(=N1)C2=C(C(N(C2=O)C)C)O)C,"InChI=1S/C26H36N2O2/c1-6-7-8-9-10-11-12-13-14-15-16-19(2)17-22-18-20(3)24(27-22)23-25(29)21(4)28(5)26(23)30/h14-15,19-22,27H,6-9,16-18H2,1-5H3/b15-14+,24-23+",UJRQFLBBBCLATN-ITNOJFFJSA-N,,yes,Fischerella,muscicola,n.a.
CyanoMetDB_1390,Ambiguine N isonitrile,,other linear non-peptide,,C26H32N2O2,404.2463783,C[C@@]1(CC[C@H]2[C@@]3([C@@]1(C[C@H](C(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)O)[N+]#[C-])O)C=C,"InChI=1S/C26H32N2O2/c1-8-24(6)13-12-17-22(2,3)15-10-9-11-16-19(15)20-21(28-16)23(4,5)18(29)14-25(24,27-7)26(17,20)30/h8-11,17-18,28-30H,1,12-14H2,2-6H3/t17-,18-,24+,25+,26-/m1/s1",KAXIDSYNDHUROH-OWINPNOJSA-N,44139370,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_1391,Ambiguine H isonitrile,,other linear non-peptide,,C26H32N2,372.256549,C[C@]1(CC[C@@H]2[C@@H]([C@@H]1[N+]#[C-])C3=C(NC4=CC=CC(=C43)C2(C)C)C(C)(C)C=C)C=C,"InChI=1S/C26H32N2/c1-9-24(3,4)22-21-19-16(12-11-13-18(19)28-22)25(5,6)17-14-15-26(7,10-2)23(27-8)20(17)21/h9-13,17,20,23,28H,1-2,14-15H2,3-7H3/t17-,20-,23+,26-/m1/s1",DBOXZAYTFKDLHJ-KPQBMEGNSA-N,139588184,yes,Fischerella,n.a.,IL-199-3-1
CyanoMetDB_1392,Ambiguine M isonitrile,,other linear non-peptide,,C26H31ClN2O2,438.2074059,C[C@@]1([C@@H](C[C@H]2[C@@]3([C@@]1(C[C@H](C(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)O)[N+]#[C-])O)Cl)C=C,"InChI=1S/C26H31ClN2O2/c1-8-24(6)17(27)12-16-22(2,3)14-10-9-11-15-19(14)20-21(29-15)23(4,5)18(30)13-25(24,28-7)26(16,20)31/h8-11,16-18,29-31H,1,12-13H2,2-6H3/t16-,17-,18-,24+,25+,26-/m1/s1",JUZKIODJYIMVBI-INSWYDPJSA-N,44139369,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_1393,Microcyclamide GL614A,,Cyclamide,,C26H30N8O6S2,614.1729731,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=C(O4)C)C(=O)N1)C)CC5C(=O)NC(=O)N5C,"InChI=1S/C26H30N8O6S2/c1-6-10(2)17-25-30-15(9-42-25)20(36)28-13(7-16-21(37)33-26(39)34(16)5)24-29-14(8-41-24)19(35)27-11(3)23-32-18(12(4)40-23)22(38)31-17/h8-11,13,16-17H,6-7H2,1-5H3,(H,27,35)(H,28,36)(H,31,38)(H,33,37,39)/t10-,11-,13-,16?,17-/m0/s1",YMVUMOCTCMIYEH-YQNZXUTESA-N,46197154,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1394,Microcyclamide GL614B,,Cyclamide,,C26H30N8O6S2,614.1729731,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=C(O4)C)C(=O)N1)C)CC5C(=O)NC(=O)N5C,"InChI=1S/C26H30N8O6S2/c1-6-10(2)17-25-30-15(9-42-25)20(36)28-13(7-16-21(37)33-26(39)34(16)5)24-29-14(8-41-24)19(35)27-11(3)23-32-18(12(4)40-23)22(38)31-17/h8-11,13,16-17H,6-7H2,1-5H3,(H,27,35)(H,28,36)(H,31,38)(H,33,37,39)/t10-,11-,13+,16?,17-/m0/s1",YMVUMOCTCMIYEH-ZXCUNYDDSA-N,46197155,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1395,Microcyclamide GL614C,,Cyclamide,,C26H30N8O6S2,614.1729731,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N3[C@@H](C[C@@]4([C@H]3NC(=O)N4C)O)C5=NC(=CS5)C(=O)N[C@H](C6=NC(=C(O6)C)C(=O)N1)C,"InChI=1S/C26H30N8O6S2/c1-6-10(2)16-22-29-14(9-42-22)23(37)34-15(7-26(39)24(34)32-25(38)33(26)5)21-28-13(8-41-21)18(35)27-11(3)20-31-17(12(4)40-20)19(36)30-16/h8-11,15-16,24,39H,6-7H2,1-5H3,(H,27,35)(H,30,36)(H,32,38)/t10-,11-,15-,16-,24-,26-/m0/s1",ILKKLNFJSSYIIX-KBCIWZPCSA-N,46197259,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1398,Microcyclamide GL582,Microcyclamide,Cyclamide,,C26H30N8O4S2,582.1831438,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=C(O4)C)C(=O)N1)C)CC5=CN=CN5C,"InChI=1S/C26H30N8O4S2/c1-6-12(2)19-26-31-18(10-40-26)22(36)29-16(7-15-8-27-11-34(15)5)25-30-17(9-39-25)21(35)28-13(3)24-33-20(14(4)38-24)23(37)32-19/h8-13,16,19H,6-7H2,1-5H3,(H,28,35)(H,29,36)(H,32,37)/t12-,13-,16+,19-/m0/s1",VJNFZONNMHDIHW-MCBIMKKHSA-N,16717178,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1399,Microcyclamide A,Microcyclamide ;; Microcyclamide 1,Cyclamide,,C26H30N8O4S2,582.1831438,CCC(C)C1C2=NC(=CS2)C(=O)NC(C3=NC(=CS3)C(=O)NC(C4=NC(=C(O4)C)C(=O)N1)C)CC5=CN=CN5C,"InChI=1S/C26H30N8O4S2/c1-6-12(2)19-26-31-18(10-40-26)22(36)29-16(7-15-8-27-11-34(15)5)25-30-17(9-39-25)21(35)28-13(3)24-33-20(14(4)38-24)23(37)32-19/h8-13,16,19H,6-7H2,1-5H3,(H,28,35)(H,29,36)(H,32,37)/t12-,13-,16-,19-/m0/s1",VJNFZONNMHDIHW-DYIBVVGTSA-N,10555282,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1401,Aerucyclamide DSO2,,Cyclamide,,C26H30N6O6S3,618.1388962,CC1C2C(NCC3=NC(C(NC(CCS(C)(=O)=O)C4=NC(C(NC(CC5=CC=CC=C5)C(O1)=N2)=O)CS4)=O)=CS3)=O,"InChI=1S/C26H30N6O6S3/c1-14-21-24(35)27-11-20-28-18(12-39-20)22(33)29-16(8-9-41(2,36)37)26-31-19(13-40-26)23(34)30-17(25(32-21)38-14)10-15-6-4-3-5-7-15/h3-7,12,14,16-17,19,21H,8-11,13H2,1-2H3,(H,27,35)(H,29,33)(H,30,34)",ORVAOHBOGFNWLU-UHFFFAOYSA-N,146684969,no,n.a.,n.a.,n.a.
CyanoMetDB_1402,Aerucyclamide D,,Cyclamide,,C26H30N6O4S3,586.149067,C[C@@H]1[C@H]2C(=O)NCC3=NC(=CS3)C(=O)N[C@H](C4=N[C@@H](CS4)C(=O)N[C@H](C(=N2)O1)CC5=CC=CC=C5)CCSC,"InChI=1S/C26H30N6O4S3/c1-14-21-24(35)27-11-20-28-18(12-38-20)22(33)29-16(8-9-37-2)26-31-19(13-39-26)23(34)30-17(25(32-21)36-14)10-15-6-4-3-5-7-15/h3-7,12,14,16-17,19,21H,8-11,13H2,1-2H3,(H,27,35)(H,29,33)(H,30,34)/t14-,16+,17+,19+,21+/m1/s1",MLBROOJXUZKDHY-PKPICYNOSA-N,25156432,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_1403,Ambiguine J isonitrile,,other linear non-peptide,,C26H30N2O3,418.2256428,C[C@]1(CC[C@@H]2[C@]3([C@]1([C@H]4[C@H](O4)C(C5=NC6=CC=CC(=C6[C@]53O)C2(C)C)(C)C)[N+]#[C-])O)C=C,"InChI=1S/C26H30N2O3/c1-8-23(6)13-12-16-21(2,3)14-10-9-11-15-17(14)24(29)20(28-15)22(4,5)18-19(31-18)25(23,27-7)26(16,24)30/h8-11,16,18-19,29-30H,1,12-13H2,2-6H3/t16-,18-,19+,23+,24-,25+,26-/m0/s1",GTBYKMVNBWUXSM-XIFLMVLWSA-N,139583760,yes,Fischerella,n.a.,IL-199-3-1
CyanoMetDB_1404,Ambiguine I isonitrile,,other linear non-peptide,,C26H30N2O2,402.2307282,C[C@]1(CC[C@@H]2[C@]3([C@]1([C@H]4[C@H](O4)C(C5=C3C6=C(C2(C)C)C=CC=C6N5)(C)C)[N+]#[C-])O)C=C,"InChI=1S/C26H30N2O2/c1-8-24(6)13-12-16-22(2,3)14-10-9-11-15-17(14)18-19(28-15)23(4,5)20-21(30-20)26(24,27-7)25(16,18)29/h8-11,16,20-21,28-29H,1,12-13H2,2-6H3/t16-,20-,21+,24+,25-,26+/m0/s1",RVIIZRJMWFSNER-BDOGLJFWSA-N,139583343,yes,Fischerella,n.a.,IL-199-3-1
CyanoMetDB_1405,Ambiguine L isonitrile,,other linear non-peptide,,C26H30N2O,386.2358136,C[C@@]1(CC[C@H]2[C@@]3([C@@]1(C=CC(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)[N+]#[C-])O)C=C,"InChI=1S/C26H30N2O/c1-8-24(6)13-12-18-23(4,5)16-10-9-11-17-19(16)20-21(28-17)22(2,3)14-15-25(24,27-7)26(18,20)29/h8-11,14-15,18,28-29H,1,12-13H2,2-6H3/t18-,24+,25+,26-/m1/s1",GCEYOMBDTZKZAO-PKNULQPYSA-N,44139241,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_1406,Fischambiguine A,,other linear non-peptide,,C26H30N2O,386.2358136,C[C@@]1(CC[C@H]2[C@@]3([C@@]1(C(=C)C(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)[N+]#[C-])O)C=C,"InChI=1S/C26H30N2O/c1-9-24(7)14-13-18-23(5,6)16-11-10-12-17-19(16)20-21(28-17)22(3,4)15(2)26(24,27-8)25(18,20)29/h9-12,18,28-29H,1-2,13-14H2,3-7H3/t18-,24+,25-,26+/m1/s1",VARACNJZOYFAJE-JBSJPJJHSA-N,50908501,yes,Fischerella,ambigua ,UTEX 1903
CyanoMetDB_1407,Ambiguine O isonitrile,,other linear non-peptide,,C26H29ClN2O3,452.1866705,C[C@@]1([C@@H](C[C@H]2[C@@]3([C@@]1([C@@H](C(=O)C(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)O)[N+]#[C-])O)Cl)C=C,"InChI=1S/C26H29ClN2O3/c1-8-24(6)16(27)12-15-22(2,3)13-10-9-11-14-17(13)18-19(29-14)23(4,5)20(30)21(31)26(24,28-7)25(15,18)32/h8-11,15-16,21,29,31-32H,1,12H2,2-6H3/t15-,16-,21-,24+,25-,26+/m1/s1",CQNFEWJQEPWSEN-SNUJMJNFSA-N,44139367,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_1408,Fischambiguine B,,other linear non-peptide,,C26H29ClN2O2,436.1917559,C[C@@]1([C@@H](C[C@H]2[C@@]3([C@@]1([C@@]4(CO4)C(C5=C3C6=C(C2(C)C)C=CC=C6N5)(C)C)[N+]#[C-])O)Cl)C=C,"InChI=1S/C26H29ClN2O2/c1-8-23(6)17(27)12-16-21(2,3)14-10-9-11-15-18(14)19-20(29-15)22(4,5)24(13-31-24)26(23,28-7)25(16,19)30/h8-11,16-17,29-30H,1,12-13H2,2-6H3/t16-,17-,23+,24-,25-,26-/m1/s1",KJUYAVAQJZRMGD-BNGQEVPLSA-N,50905031,yes,Fischerella,ambigua ,UTEX 1903
CyanoMetDB_1409,Ambiguine K isonitrile,,other linear non-peptide,,C26H29ClN2O,420.1968413,C[C@@]1([C@@H](C[C@H]2[C@@]3([C@@]1(C=CC(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)[N+]#[C-])O)Cl)C=C,"InChI=1S/C26H29ClN2O/c1-8-24(6)18(27)14-17-23(4,5)15-10-9-11-16-19(15)20-21(29-16)22(2,3)12-13-25(24,28-7)26(17,20)30/h8-13,17-18,29-30H,1,14H2,2-6H3/t17-,18-,24+,25+,26-/m1/s1",RSUTYZFOFIAHFY-OWINPNOJSA-N,44139368,yes,Fischerella,ambigua,UTEX 1903
CyanoMetDB_1410,Ambiguine Q nitrile,,other linear non-peptide,,C26H28N2,368.2252489,C[C@@]1(CC[C@H]2C3=C1C=C(C(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)C#N)C=C,"InChI=1S/C26H28N2/c1-7-26(6)12-11-17-20-18(26)13-15(14-27)24(2,3)23-22(20)21-16(25(17,4)5)9-8-10-19(21)28-23/h7-10,13,17,28H,1,11-12H2,2-6H3/t17-,26-/m0/s1",WBJRBYKJNBYZBT-QLXKLKPCSA-N,102263593,yes,Fischerella,ambigua ,UTEX 1903
CyanoMetDB_1411,Ambiguine G nitrile,,other linear non-peptide,,C26H27ClN2,402.1862766,C[C@@]1([C@@H](C[C@H]2C3=C1C=C(C(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)C#N)Cl)C=C,"InChI=1S/C26H27ClN2/c1-7-26(6)17-11-14(13-28)24(2,3)23-22-20(17)16(12-19(26)27)25(4,5)15-9-8-10-18(29-23)21(15)22/h7-11,16,19,29H,1,12H2,2-6H3/t16-,19+,26+/m0/s1",HFHQOKOLRORURO-KGVVXCLESA-N,10834980,yes,Hapalosiphon,delicatulus,UH strain IC-13-1
CyanoMetDB_1412,Tolyporphin G,,other cyclic non-peptide,porphyrins,C26H24N4O5,472.1746699,CC1=CC2=CC3=NC(=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C1N2)(C)OC(=O)C)C)C(C3=O)(C)O,"InChI=1S/C26H24N4O5/c1-12-7-16-9-21-25(4,34)23(32)19(29-21)8-15-6-13(2)18(27-15)11-22-26(5,35-14(3)31)24(33)20(30-22)10-17(12)28-16/h6-11,27-28,34H,1-5H3",OOIVFTQIDBCWSW-UHFFFAOYSA-N,10344738,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1413,Tolyporphin H,,other cyclic non-peptide,porphyrins,C26H24N4O5,472.1746699,CC1=CC2=CC3=NC(=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C1N2)(C)O)C)C(C3=O)(C)OC(=O)C,"InChI=1S/C26H24N4O5/c1-12-7-16-9-22-26(5,35-14(3)31)24(33)19(30-22)8-15-6-13(2)18(27-15)11-21-25(4,34)23(32)20(29-21)10-17(12)28-16/h6-11,27-28,34H,1-5H3",ACEUAOKAOJEZQZ-UHFFFAOYSA-N,10254212,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1414,(2S)-1-O-Palmitoyl-3-O-?-D-galactopyranosylglycerol,,other linear non-peptide,,C25H48O9,492.3298331,CCCCCCCCCCCCCCCC(OC[C@@H](O)CO[C@H]1C(O)[C@@H](O)[C@@H](O)[C@@H](CO)O1)=O,"InChI=1S/C25H48O9/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(28)32-17-19(27)18-33-25-24(31)23(30)22(29)20(16-26)34-25/h19-20,22-27,29-31H,2-18H2,1H3/t19-,20-,22+,23+,24?,25-/m1/s1",DWKQIHQQZYILDB-KIQYXBSXSA-N,,yes,Oscillatoria/Planktothrix,rosea,n.a.
CyanoMetDB_1415,Guamamide,,other linear non-peptide,,C25H45NO8,487.3145174,CCCCCCCCCCCC(=O)OC(C)C(C(C)C(=O)NC[C@@H](CC(=O)OC)O)OC(=O)C,"InChI=1S/C25H45NO8/c1-6-7-8-9-10-11-12-13-14-15-22(29)33-19(3)24(34-20(4)27)18(2)25(31)26-17-21(28)16-23(30)32-5/h18-19,21,24,28H,6-17H2,1-5H3,(H,26,31)/t18?,19?,21-,24?/m1/s1",NKCAMZIYBHRHKW-IYGBNXAISA-N,11283187,yes,Symploca,n.a.,n.a.
CyanoMetDB_1416,Semiplenamide B,,other linear non-peptide,Semiplenamide,C25H45NO3,407.3399443,CCCCCCCCCCCCC/C=C/CC/C=C(\C)/C(=O)NCCOC(=O)C,"InChI=1S/C25H45NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2)25(28)26-21-22-29-24(3)27/h16-17,20H,4-15,18-19,21-22H2,1-3H3,(H,26,28)/b17-16+,23-20+",QXKJTHBWYQHGEY-UEAIFQQQSA-N,10454085,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_1417,Carmaphycin B,,other linear peptide,,C25H45N3O7S,531.297822,CCCCCC(N[C@H](C(N[C@H](C(N[C@H](C([C@]1(C)OC1)=O)CC(C)C)=O)CCS(=O)(C)=O)=O)C(C)C)=O,"InChI=1S/C25H45N3O7S/c1-8-9-10-11-20(29)28-21(17(4)5)24(32)26-18(12-13-36(7,33)34)23(31)27-19(14-16(2)3)22(30)25(6)15-35-25/h16-19,21H,8-15H2,1-7H3,(H,26,32)(H,27,31)(H,28,29)/t18-,19-,21-,25+/m0/s1",ODAZGDXFSFEAAA-SHNDDRJUSA-N,71543331,yes,Symploca,n.a.,n.a.
CyanoMetDB_1418,Carmaphycin A,,other linear peptide,,C25H45N3O6S,515.3029074,CCCCCC(N[C@H](C(N[C@H](C(N[C@H](C([C@]1(C)OC1)=O)CC(C)C)=O)CCS(C)=O)=O)C(C)C)=O,"InChI=1S/C25H45N3O6S/c1-8-9-10-11-20(29)28-21(17(4)5)24(32)26-18(12-13-35(7)33)23(31)27-19(14-16(2)3)22(30)25(6)15-34-25/h16-19,21H,8-15H2,1-7H3,(H,26,32)(H,27,31)(H,28,29)/t18-,19-,21-,25+,35?/m0/s1",KLYPRXGLYCCNGZ-PFIKXURKSA-N,71499515,yes,Symploca,n.a.,n.a.
CyanoMetDB_1419,Tumonoic acid G,,other linear non-peptide,,C25H43NO7,469.3039527,CCCCCCCC[C@@H](C(N1CCC[C@H]1C(O[C@]([H])([C@H](CC)C)C(O[C@H](C(O)=O)C)=O)=O)=O)C,"InChI=1S/C25H43NO7/c1-6-8-9-10-11-12-14-18(4)22(27)26-16-13-15-20(26)24(30)33-21(17(3)7-2)25(31)32-19(5)23(28)29/h17-21H,6-16H2,1-5H3,(H,28,29)/t17-,18-,19-,20-,21+/m0/s1",NHPBYMFQSUHYPK-UQVNRYHBSA-N,25058104,yes,Blennothrix,cantharidosmum,n.a.
CyanoMetDB_1420,Tricholide B,,other cyclic non-peptide,Tricholide,C25H43NO4,421.3192089,O=C1/C(C)=C/C(C)CCC(OC)CCC[C@@H]([C@H](C)CCCC)OC([C@H]2N1CCC2)=O,"InChI=1S/C25H43NO4/c1-6-7-10-19(3)23-13-8-11-21(29-5)15-14-18(2)17-20(4)24(27)26-16-9-12-22(26)25(28)30-23/h17-19,21-23H,6-16H2,1-5H3/b20-17+/t18?,19-,21?,22+,23+/m1/s1",XWYPACJKLTZIII-OXDMWNTHSA-N,139590495,yes,Trichodesmium,thiebautii,n.a.
CyanoMetDB_1421,Dysinosin D,,Aeruginosin,,C25H43N6O7,539.3193228,O[C@@H]1[C@@H](O)C[C@@](N(C(C(NC(C(OC)CO)=O)C(C)C)=O)[C@H](C(NCCC(C/2)=CC[N+]2=C(N)/N)=O)C3)([H])[C@@]3([H])C1,"InChI=1S/C25H42N6O7/c1-13(2)21(29-23(36)20(12-32)38-3)24(37)31-16-10-19(34)18(33)9-15(16)8-17(31)22(35)28-6-4-14-5-7-30(11-14)25(26)27/h5,13,15-21,32-34H,4,6-12H2,1-3H3,(H5,26,27,28,29,35,36)/p+1/t15-,16+,17+,18+,19+,20?,21?/m1/s1",YUWYJLZMNVWJKP-GEBGTVLDSA-O,11330154,yes,n.a.,n.a.,n.a.
CyanoMetDB_1422,Malyngamide 2,,other linear non-peptide,,C25H42ClNO6,487.2700658,CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C/Cl)/[C@@H]1C(=O)[C@@H](C[C@H]([C@]1(C)O)O)O)OC,"InChI=1S/C25H42ClNO6/c1-4-5-6-7-9-12-19(33-3)13-10-8-11-14-22(30)27-17-18(16-26)23-24(31)20(28)15-21(29)25(23,2)32/h8,10,16,19-21,23,28-29,32H,4-7,9,11-15,17H2,1-3H3,(H,27,30)/b10-8+,18-16-/t19-,20+,21+,23+,25-/m0/s1",OEGLIHPBLJQCGW-DRBFKITJSA-N,51354252,yes,Lyngbya,sordida,n.a.
CyanoMetDB_1423,Malyngamide O,,other linear non-peptide,Malyngamide,C25H42ClNO5,471.2751512,CCCCCCCC(CC=CCCC(=O)N(C)CC(=CCl)CC(=CC(=O)OC)OC)OC,"InChI=1S/C25H42ClNO5/c1-6-7-8-9-11-14-22(30-3)15-12-10-13-16-24(28)27(2)20-21(19-26)17-23(31-4)18-25(29)32-5/h10,12,18-19,22H,6-9,11,13-17,20H2,1-5H3/b12-10+,21-19-,23-18+/t22-/m0/s1",APYMXRPHYRRJTM-ZWUHNMOSSA-N,10027764,yes,n.a.,n.a.,n.a.
CyanoMetDB_1424,Dysinosin C,,Aeruginosin,,C25H42N6O10S,618.2683128,O[C@@H]1[C@@H](O)C[C@@](N(C(C(NC(C(OC)COS(=O)([O-])=O)=O)C(C)C)=O)[C@H](C(NCCC(C/2)=CC[N+]2=C(N)/N)=O)C3)([H])[C@@]3([H])C1,"InChI=1S/C25H42N6O10S/c1-13(2)21(29-23(35)20(40-3)12-41-42(37,38)39)24(36)31-16-10-19(33)18(32)9-15(16)8-17(31)22(34)28-6-4-14-5-7-30(11-14)25(26)27/h5,13,15-21,32-33H,4,6-12H2,1-3H3,(H6,26,27,28,29,34,35,37,38,39)/t15-,16+,17+,18+,19+,20?,21?/m1/s1",IDIGNXIFMDXCKQ-GEBGTVLDSA-N,11377063,yes,n.a.,n.a.,n.a.
CyanoMetDB_1425,Microginin 527,,Microginin,,C25H41N3O7S,527.2665218,CCCCCCC[C@@H]([C@@H](C(=O)N(C)[C@@H](CCS(=O)C)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)O)N,"InChI=1S/C25H41N3O7S/c1-4-5-6-7-8-9-19(26)22(30)24(32)28(2)21(14-15-36(3)35)23(31)27-20(25(33)34)16-17-10-12-18(29)13-11-17/h10-13,19-22,29-30H,4-9,14-16,26H2,1-3H3,(H,27,31)(H,33,34)/t19-,20-,21-,22-,36?/m0/s1",VUIHOFONJHXOQE-ZPPOLDLBSA-N,25108825,yes,Microcystis,aeruginosa,UTEX LB2385
CyanoMetDB_1426,Microginin 511,,Microginin,,C25H41N3O6S,511.2716072,CCCCCCC[C@@H]([C@@H](C(=O)N(C)[C@@H](CCSC)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)O)O)N,"InChI=1S/C25H41N3O6S/c1-4-5-6-7-8-9-19(26)22(30)24(32)28(2)21(14-15-35-3)23(31)27-20(25(33)34)16-17-10-12-18(29)13-11-17/h10-13,19-22,29-30H,4-9,14-16,26H2,1-3H3,(H,27,31)(H,33,34)",XYXASPCRONZBJP-UHFFFAOYSA-N,,yes,Microcystis,aeruginosa,UTEX LB2385
CyanoMetDB_1427,Microcyclamide MZ568,,Cyclamide,,C25H40N6O7S,568.2679188,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)[C@@H](C)O)C(C)C)[C@@H](C)O)C,"InChI=1S/C25H40N6O7S/c1-8-11(4)17-25-27-15(9-39-25)21(35)26-12(5)20(34)30-18(13(6)32)23(37)28-16(10(2)3)22(36)31-19(14(7)33)24(38)29-17/h9-14,16-19,32-33H,8H2,1-7H3,(H,26,35)(H,28,37)(H,29,38)(H,30,34)(H,31,36)/t11-,12-,13+,14+,16-,17-,18-,19-/m0/s1",SVGNQHFSKCBLNV-FENUFEPCSA-N,50941350,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1428,Smenamide D,,other linear non-peptide,Smenamides,C25H39ClN2O4,466.2598354,CC(C[C@@](N1C(/C(C)=C([H])/[C@](CC/C(CCCN(C(C)=O)C)=C([H])\Cl)([H])C)=O)([H])C(OC)=CC1=O)C,"InChI=1S/C25H39ClN2O4/c1-17(2)13-22-23(32-7)15-24(30)28(22)25(31)19(4)14-18(3)10-11-21(16-26)9-8-12-27(6)20(5)29/h14-18,22H,8-13H2,1-7H3/b19-14+,21-16-/t18-,22+/m1/s1",VZXRJCLKLPORSH-JBQLJMNMSA-N,,yes,Trichodesmium,n.a.,n.a.
CyanoMetDB_1429,Smenamide C,,other linear non-peptide,Smenamides,C25H39ClN2O4,466.2598354,Cl/C=C(CCCN(C(C)=O)C)/CC[C@H](/C=C(C)/C(N1[C@@H](CC(C)C)C(OC)=CC1=O)=O)C,"InChI=1S/C25H39ClN2O4/c1-17(2)13-22-23(32-7)15-24(30)28(22)25(31)19(4)14-18(3)10-11-21(16-26)9-8-12-27(6)20(5)29/h14-18,22H,8-13H2,1-7H3/b19-14+,21-16+/t18-,22+/m1/s1",VZXRJCLKLPORSH-MZNYJUHOSA-N,146683884,yes,Trichodesmium,n.a.,n.a.
CyanoMetDB_1430,Malyngamide T,,other linear non-peptide,,C25H38ClNO5,467.243851,CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C/Cl)/CC1=CC(=CC(=O)O1)OC)OC,"InChI=1S/C25H38ClNO5/c1-4-5-6-7-9-12-21(30-2)13-10-8-11-14-24(28)27-19-20(18-26)15-23-16-22(31-3)17-25(29)32-23/h8,10,16-18,21H,4-7,9,11-15,19H2,1-3H3,(H,27,28)/b10-8+,20-18+/t21-/m0/s1",ABBPFXQJIWUCKF-CXRCMLCDSA-N,643677,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1431,Balgacyclamide B,,Cyclamide,,C25H38N6O6S,550.2573541,CC[C@H](C)[C@@H]1C2=NC(=CS2)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N[C@H](C3=N[C@@H]([C@H](O3)C)C(=O)N1)C(C)C)[C@@H](C)O)C,"InChI=1S/C25H38N6O6S/c1-8-11(4)17-25-27-15(9-38-25)21(34)26-12(5)20(33)30-18(13(6)32)22(35)28-16(10(2)3)24-31-19(14(7)37-24)23(36)29-17/h9-14,16-19,32H,8H2,1-7H3,(H,26,34)(H,28,35)(H,29,36)(H,30,33)",XRULOHJFZLNAKT-UHFFFAOYSA-N,,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1432,Hermitamide B,,other linear non-peptide,Lyngbya toxin,C25H38N2O2,398.2933285,CCCCCCC[C@@H](C/C=C/CCC(=O)NCCC1=CNC2=CC=CC=C21)OC,"InChI=1S/C25H38N2O2/c1-3-4-5-6-8-13-22(29-2)14-9-7-10-17-25(28)26-19-18-21-20-27-24-16-12-11-15-23(21)24/h7,9,11-12,15-16,20,22,27H,3-6,8,10,13-14,17-19H2,1-2H3,(H,26,28)/b9-7+/t22-/m0/s1",OHYDYQKPXIXRBQ-GLJAUCNMSA-N,10386173,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1433,Bistratamide I,,Cyclamide,Microcyclamide,C25H36N6O6S,548.2417041,C[C@H]([C@H]1C(=O)N[C@H](C2=NC(=CO2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C(=O)N1)C(C)C)C(C)C)C(C)C)O,"InChI=1S/C25H36N6O6S/c1-10(2)16-22(35)31-19(13(7)32)23(36)29-17(11(3)4)24-26-14(8-37-24)20(33)30-18(12(5)6)25-27-15(9-38-25)21(34)28-16/h8-13,16-19,32H,1-7H3,(H,28,34)(H,29,36)(H,30,33)(H,31,35)/t13-,16+,17+,18+,19+/m1/s1",LDXCESZYUWPDOR-RUZYHRDJSA-N,11092841,yes,n.a.,n.a.,n.a.
CyanoMetDB_1434,Bistratamide J,,Cyclamide,Microcyclamide,C25H36N6O5S2,564.2188606,C[C@H]([C@H]1C(=O)N[C@H](C2=NC(=CS2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C(=O)N1)C(C)C)C(C)C)C(C)C)O,"InChI=1S/C25H36N6O5S2/c1-10(2)16-22(35)31-19(13(7)32)23(36)30-18(12(5)6)25-27-15(9-38-25)21(34)29-17(11(3)4)24-26-14(8-37-24)20(33)28-16/h8-13,16-19,32H,1-7H3,(H,28,33)(H,29,34)(H,30,36)(H,31,35)/t13-,16+,17+,18+,19+/m1/s1",QYWGBWCDPYJCGC-RUZYHRDJSA-N,10951899,yes,n.a.,n.a.,n.a.
CyanoMetDB_1435,Balgacyclamide A,,Cyclamide,,C25H36N6O5S,532.2467895,CC[C@H](C)[C@@H]1C2=NC(=CS2)C(=O)N[C@@H](C3=N[C@@H]([C@H](O3)C)C(=O)N[C@H](C4=N[C@@H]([C@H](O4)C)C(=O)N1)C(C)C)C,"InChI=1S/C25H36N6O5S/c1-8-11(4)17-25-27-15(9-37-25)20(32)26-12(5)23-30-18(13(6)35-23)21(33)28-16(10(2)3)24-31-19(14(7)36-24)22(34)29-17/h9-14,16-19H,8H2,1-7H3,(H,26,32)(H,28,33)(H,29,34)",HEBALIVNNXPKNZ-UHFFFAOYSA-N,,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1436,Bistratamide F,,Cyclamide,Microcyclamide,C25H36N6O5S,532.2467895,C[C@@H]1[C@H]2C(=O)N[C@H](C3=N[C@@H](CO3)C(=O)N[C@H](C4=NC(=CS4)C(=O)N[C@H](C(=N2)O1)C(C)C)C(C)C)C(C)C,"InChI=1S/C25H36N6O5S/c1-10(2)16-23-26-14(8-35-23)20(32)30-18(12(5)6)25-27-15(9-37-25)21(33)28-17(11(3)4)24-31-19(13(7)36-24)22(34)29-16/h9-14,16-19H,8H2,1-7H3,(H,28,33)(H,29,34)(H,30,32)/t13-,14+,16+,17+,18+,19+/m1/s1",PVKWKGXPRJQDIZ-XZHCTYTHSA-N,11060498,yes,n.a.,n.a.,n.a.
CyanoMetDB_1437,Palau’imide,,other cyclic peptide,Palau'imide,C25H36N2O4,428.2675077,CCCCC(C)C(N[C@@H](C(C)C)C(N1[C@@H](CC2=CC=CC=C2)C(OC)=C(C)C1=O)=O)=O,"InChI=1S/C25H36N2O4/c1-7-8-12-17(4)23(28)26-21(16(2)3)25(30)27-20(15-19-13-10-9-11-14-19)22(31-6)18(5)24(27)29/h9-11,13-14,16-17,20-21H,7-8,12,15H2,1-6H3,(H,26,28)/t17?,20-,21-/m0/s1",HMXDFLALTRZBII-FUKGKQRISA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1438,Aranazole C,,other linear non-peptide,,C25H35Cl6NO5S,671.0367106,CCC(CC(/C=C\C(C(C(C(C(C[C@@H]1[C@H]([C@@H](OCO1)C(c2nc(cs2)C(=O)C)OC)C)Cl)Cl)Cl)O)Cl)Cl)Cl,"InChI=1S/C25H35Cl6NO5S/c1-5-14(26)8-15(27)6-7-16(28)22(34)21(31)20(30)17(29)9-19-12(2)23(37-11-36-19)24(35-4)25-32-18(10-38-25)13(3)33/h6-7,10,12,14-17,19-24,34H,5,8-9,11H2,1-4H3/b7-6-/t12-,14?,15?,16?,17?,19-,20?,21?,22?,23-,24?/m1/s1",KVAGQEMNZHLCBY-WLOZKBIXSA-N,,yes,Fischerella,n.a.,PCC 9339
CyanoMetDB_1439,Aranazole D,,other linear non-peptide,,C25H35Cl4NO6S,617.0939198,CCC(C/C=C/C([C@@H]1[C@H](O1)C(C(C(C[C@@H]2[C@H]([C@@H](OCO2)C(c3nc(cs3)C(=O)C)OC)C)Cl)Cl)Cl)O)Cl,"InChI=1S/C25H35Cl4NO6S/c1-5-14(26)7-6-8-17(32)22-23(36-22)20(29)19(28)15(27)9-18-12(2)21(35-11-34-18)24(33-4)25-30-16(10-37-25)13(3)31/h6,8,10,12,14-15,17-24,32H,5,7,9,11H2,1-4H3/b8-6+/t12-,14?,15?,17?,18-,19?,20?,21-,22-,23-,24?/m1/s1",AUXCARRWWRCVMM-ZZFZSVSRSA-N,,yes,Fischerella,n.a.,PCC 9339
CyanoMetDB_1440,Bistratamide D,,Cyclamide,Microcyclamide,C25H34N6O5S,530.2311394,C[C@@H]1[C@H]2C(=O)N[C@H](C3=NC(=CO3)C(=O)N[C@H](C4=NC(=CS4)C(=O)N[C@H](C(=N2)O1)C(C)C)C(C)C)C(C)C,"InChI=1S/C25H34N6O5S/c1-10(2)16-23-26-14(8-35-23)20(32)30-18(12(5)6)25-27-15(9-37-25)21(33)28-17(11(3)4)24-31-19(13(7)36-24)22(34)29-16/h8-13,16-19H,1-7H3,(H,28,33)(H,29,34)(H,30,32)/t13-,16+,17+,18+,19+/m1/s1",FARIBTJPCDNMIZ-RUZYHRDJSA-N,10098515,yes,n.a.,n.a.,n.a.
CyanoMetDB_1441,Bistratamide E,,Cyclamide,Microcyclamide,C25H34N6O4S2,546.2082959,C[C@@H]1[C@H]2C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=CS4)C(=O)N[C@H](C(=N2)O1)C(C)C)C(C)C)C(C)C,"InChI=1S/C25H34N6O4S2/c1-10(2)16-23-31-19(13(7)35-23)22(34)30-18(12(5)6)25-27-15(9-37-25)21(33)29-17(11(3)4)24-26-14(8-36-24)20(32)28-16/h8-13,16-19H,1-7H3,(H,28,32)(H,29,33)(H,30,34)/t13-,16+,17+,18+,19+/m1/s1",USFFWHGVKNECEY-RUZYHRDJSA-N,637220,yes,n.a.,n.a.,n.a.
CyanoMetDB_1442,Lyngbyabellin M,,other linear non-peptide,Peptolide,C25H34Cl2N2O8S2,624.1133638,CCOC(C1=CSC([C@@H](O)COC(C2=CSC([C@H](OC([C@H]([C@@H](O)CCCC(Cl)(Cl)C)C)=O)C(C)C)=N2)=O)=N1)=O,"InChI=1S/C25H34Cl2N2O8S2/c1-6-35-23(33)15-11-38-20(28-15)18(31)10-36-24(34)16-12-39-21(29-16)19(13(2)3)37-22(32)14(4)17(30)8-7-9-25(5,26)27/h11-14,17-19,30-31H,6-10H2,1-5H3/t14-,17-,18-,19+/m0/s1",BHRUFZXHQAOGJV-UDTPNQRGSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1443,Bistratamide G,,Cyclamide,Microcyclamide,C25H32N6O5S,528.2154893,CC1=C2C(=O)N[C@H](C3=NC(=CO3)C(=O)N[C@H](C4=NC(=CS4)C(=O)N[C@H](C(=N2)O1)C(C)C)C(C)C)C(C)C,"InChI=1S/C25H32N6O5S/c1-10(2)16-23-26-14(8-35-23)20(32)30-18(12(5)6)25-27-15(9-37-25)21(33)28-17(11(3)4)24-31-19(13(7)36-24)22(34)29-16/h8-12,16-18H,1-7H3,(H,28,33)(H,29,34)(H,30,32)/t16-,17-,18-/m0/s1",YDONFAWPMVOOTI-BZSNNMDCSA-N,10256384,yes,n.a.,n.a.,n.a.
CyanoMetDB_1444,Bistratamide H,,Cyclamide,Microcyclamide,C25H32N6O4S2,544.1926459,CC1=C2C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=CS4)C(=O)N[C@H](C(=N2)O1)C(C)C)C(C)C)C(C)C,"InChI=1S/C25H32N6O4S2/c1-10(2)16-23-31-19(13(7)35-23)22(34)30-18(12(5)6)25-27-15(9-37-25)21(33)29-17(11(3)4)24-26-14(8-36-24)20(32)28-16/h8-12,16-18H,1-7H3,(H,28,32)(H,29,33)(H,30,34)/t16-,17-,18-/m0/s1",YGMRMAIELLDBHQ-BZSNNMDCSA-N,10347376,yes,n.a.,n.a.,n.a.
CyanoMetDB_1445,Cryptophycin G,,Cryptophycin,,C25H30ClNO7,491.17108,C[C@@H]([C@H](C/C=C/C(=O)N[C@@H](CC1=CC(=C(C=C1)OC)Cl)C(=O)O)O)[C@H]([C@H](C2=CC=CC=C2)O)O,"InChI=1S/C25H30ClNO7/c1-15(23(30)24(31)17-7-4-3-5-8-17)20(28)9-6-10-22(29)27-19(25(32)33)14-16-11-12-21(34-2)18(26)13-16/h3-8,10-13,15,19-20,23-24,28,30-31H,9,14H2,1-2H3,(H,27,29)(H,32,33)/b10-6+/t15-,19-,20-,23+,24-/m0/s1",JCCRURJDQIVIFI-URPFFZMFSA-N,9983101,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_1446,Ambiguine P,,other linear non-peptide,,C25H29NO,359.2249146,C[C@@]1(CC[C@]2(C3=C1C=CC(C4=C3C5=C(C2(C)C)C=CC=C5N4)(C)C)O)C=C,"InChI=1S/C25H29NO/c1-7-24(6)13-14-25(27)20-16(24)11-12-22(2,3)21-19(20)18-15(23(25,4)5)9-8-10-17(18)26-21/h7-12,26-27H,1,13-14H2,2-6H3/t24-,25+/m0/s1",YIXMOSKWKGHGSQ-LOSJGSFVSA-N,50905032,yes,Fischerella,ambigua ,UTEX 1903
CyanoMetDB_1447,Banyascyclamide C,,Cyclamide,,C25H28N6O5S2,556.1562604,O=C1C2=CSC(C(NC([C@H](C(C)O)NC([C@@H](NC(C3=CSC(C(N1)C)=N3)=O)CC4=CC=CC=C4)=O)=O)C)=N2,"InChI=1S/C25H28N6O5S2/c1-12-24-30-18(11-38-24)22(35)28-16(9-15-7-5-4-6-8-15)20(33)31-19(14(3)32)23(36)27-13(2)25-29-17(10-37-25)21(34)26-12/h4-8,10-14,16,19,32H,9H2,1-3H3,(H,26,34)(H,27,36)(H,28,35)(H,31,33)/t12?,13?,14?,16-,19-/m0/s1",ARCFFCLBNNIVPM-FHUOVTFRSA-N,21776921,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1449,Hapalocyclamide,,Cyclamide,,C25H26N6O4S2,538.1456957,C[C@@H]1C2=NC(=C(O2)C)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@@H](C4=N[C@H](CS4)C(=O)N1)CC5=CC=CC=C5)C,"InChI=1S/C25H26N6O4S2/c1-12-23-31-19(14(3)35-23)22(34)27-13(2)24-29-18(10-36-24)21(33)28-16(9-15-7-5-4-6-8-15)25-30-17(11-37-25)20(32)26-12/h4-8,10,12-13,16-17H,9,11H2,1-3H3,(H,26,32)(H,27,34)(H,28,33)",CFWGJXVIHMKTMC-UHFFFAOYSA-N,,yes,Hapalosiphon,n.a.,n.a.
CyanoMetDB_1450,Banyascyclamide A,,Cyclamide,,C25H26N6O4S2,538.1456957,O=C1C2=CSC(C(NC([C@H]3N=C([C@@H](NC(C4=CSC(C(N1)C)=N4)=O)CC5=CC=CC=C5)O[C@@H]3C)=O)C)=N2,"InChI=1S/C25H26N6O4S2/c1-12-24-30-18(11-37-24)21(33)28-16(9-15-7-5-4-6-8-15)23-31-19(14(3)35-23)22(34)27-13(2)25-29-17(10-36-25)20(32)26-12/h4-8,10-14,16,19H,9H2,1-3H3,(H,26,32)(H,27,34)(H,28,33)/t12?,13?,14-,16+,19+/m1/s1",QCYRITGWCJOIEV-FFMCJANTSA-N,101220585,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1451,Semiplenamide G,,other linear non-peptide,Semiplenamide,C24H45NO4,411.3348589,CCCCCCCCCCCCCCC[C@@H]1[C@@](O1)(C)C(=O)NC(C)COC(=O)C,"InChI=1S/C24H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-24(4,29-22)23(27)25-20(2)19-28-21(3)26/h20,22H,5-19H2,1-4H3,(H,25,27)/t20?,22-,24+/m1/s1",MILXVDLKZSMGBO-ZUBLCLOHSA-N,21589501,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_1452,Semiplenamide E,,other linear non-peptide,Semiplenamide,C24H45NO3,395.3399443,CCCCCCCCCCCCCCC/C=C(\C)/C(=O)N[C@@H](C)COC(=O)C,"InChI=1S/C24H45NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(2)24(27)25-22(3)20-28-23(4)26/h19,22H,5-18,20H2,1-4H3,(H,25,27)/b21-19+/t22-/m0/s1",HMEVPMUFHLUBFU-KGAYOUTBSA-N,11463588,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_1453,Synechobactin B,,other linear non-peptide,Siderophore,C24H44N4O9,532.310829,O=C(CC(CC(NCCCN(C(C)=O)O)=O)(C(O)=O)O)NCCCN(C(CCCCCCCCC)=O)O,"InChI=1S/C24H44N4O9/c1-3-4-5-6-7-8-9-12-22(32)28(37)16-11-14-26-21(31)18-24(35,23(33)34)17-20(30)25-13-10-15-27(36)19(2)29/h35-37H,3-18H2,1-2H3,(H,25,30)(H,26,31)(H,33,34)",DCRDXSPHBGCFJE-UHFFFAOYSA-N,21778356,yes,Synechococcus,n.a.,PCC 7002
CyanoMetDB_1454,Propenediester,,other linear non-peptide,lipid,C24H42O4,394.3083098,CCCCCCCCCCCCCC(=C)CCCC(=O)O/C=C\COC(=O)C,"InChI=1S/C24H42O4/c1-4-5-6-7-8-9-10-11-12-13-14-17-22(2)18-15-19-24(26)28-21-16-20-27-23(3)25/h16,21H,2,4-15,17-20H2,1,3H3/b21-16-",DNMGXMJBUOJKLE-PGMHBOJBSA-N,56599474,yes,Oscillatoria/Planktothrix,,"field sample: Isla Canales de Afuera, Panamá"
CyanoMetDB_1455,Glucosylsucrose derivative 2,,other cyclic non-peptide,,C24H42O21,666.2218584,C(C1[C@@H]([C@H]([C@](O1)(CO)OC2C(C(C(C(O2)CO)O)O)O[C@@H]3[C@H](C([C@@H](C(O3)CO)O)O)O[C@@H]4C(C([C@@H](C(O4)CO)O)O)O)O)O)O,"InChI=1S/C24H42O21/c25-1-6-10(30)14(34)17(37)21(39-6)42-18-15(35)11(31)7(2-26)40-22(18)43-19-16(36)12(32)8(3-27)41-23(19)45-24(5-29)20(38)13(33)9(4-28)44-24/h6-23,25-38H,1-5H2/t6?,7?,8?,9?,10-,11-,12?,13+,14?,15?,16?,17?,18+,19?,20-,21-,22-,23?,24+/m1/s1",RHXCTYFNNJCGHX-UUICYSAOSA-N,139587977,yes,Nostoc,ellipsosporum,n.a.
CyanoMetDB_1456,Sanctolide A,,other cyclic non-peptide,,C24H41NO6,439.293388,CCCCC[C@@H](C[C@@H]1CCC(C(=O)N(/C=C/CC(=O)O[C@H](C(=O)O1)C(C)C)C)C)OC,"InChI=1S/C24H41NO6/c1-7-8-9-11-19(29-6)16-20-14-13-18(4)23(27)25(5)15-10-12-21(26)31-22(17(2)3)24(28)30-20/h10,15,17-20,22H,7-9,11-14,16H2,1-6H3/b15-10+",AOZCVYYAEZOYGW-XNTDXEJSSA-N,,yes,Oscillatoria/Planktothrix,sancta,SAG 74.79
CyanoMetDB_1457,Tricholide A,,other cyclic non-peptide,Tricholide,C24H41NO4,407.3035588,O=C1/C([H])=C/C(C)CCC(OC)CCC[C@@H]([C@H](C)CCCC)OC([C@H]2N1CCC2)=O,"InChI=1S/C24H41NO4/c1-5-6-9-19(3)22-12-7-10-20(28-4)15-13-18(2)14-16-23(26)25-17-8-11-21(25)24(27)29-22/h14,16,18-22H,5-13,15,17H2,1-4H3/b16-14+/t18?,19-,20?,21+,22+/m1/s1",BWNYFNVEJYUZSV-RCKKMSNXSA-N,139590494,yes,Trichodesmium,thiebautii,n.a.
CyanoMetDB_1458,Malyngamide P,,other linear non-peptide,Malyngamide,C24H40ClNO5,457.2595011,CCCCCCCC(CC=CCCC(=O)N(C)CC(=CCl)CC(=O)CC(=O)OC)OC,"InChI=1S/C24H40ClNO5/c1-5-6-7-8-10-13-22(30-3)14-11-9-12-15-23(28)26(2)19-20(18-25)16-21(27)17-24(29)31-4/h9,11,18,22H,5-8,10,12-17,19H2,1-4H3/b11-9+,20-18-",YLHIQMKJWXSOGP-HDGFBHKQSA-N,10813740,yes,n.a.,n.a.,n.a.
CyanoMetDB_1459,Glycosylated Palythine-threonine,(612-Da MAA),other linear non-peptide,Mycosporine?like amino acids,C24H40N2O16,612.2377832,O[C@](CC(NC(C(O)=O)C(C)OC1OC(C(C(C1O)O)O)CO)=C2OC)(COC3OC(C(C(C3O)O)O)CO)CC2=N,"InChI=1S/C24H40N2O16/c1-8(40-23-19(34)17(32)15(30)12(6-28)42-23)13(21(35)36)26-10-4-24(37,3-9(25)20(10)38-2)7-39-22-18(33)16(31)14(29)11(5-27)41-22/h8,11-19,22-23,25-34,37H,3-7H2,1-2H3,(H,35,36)/t8?,11?,12?,13?,14?,15?,16?,17?,18?,19?,22?,23?,24-/m1/s1",GTUKEDLUJDXMBH-TZTIUKEMSA-N,,yes,Nostoc,[Nostoc]commune,n.a.
CyanoMetDB_1460,8-epi-malyngamide C,,other linear non-peptide,Lyngbya toxin,C24H38ClNO5,455.243851,CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C/Cl)/[C@@]12[C@@H](O1)[C@@H](CCC2=O)O)OC,"InChI=1S/C24H38ClNO5/c1-3-4-5-6-8-11-19(30-2)12-9-7-10-13-22(29)26-17-18(16-25)24-21(28)15-14-20(27)23(24)31-24/h7,9,16,19-20,23,27H,3-6,8,10-15,17H2,1-2H3,(H,26,29)/b9-7+,18-16-/t19-,20+,23-,24+/m0/s1",WXDBUBIFYCCNLE-FTWIAXFRSA-N,45379966,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1461,Malyngamide C,,other linear non-peptide,Malyngamide,C24H38ClNO5,455.243851,CCCCCCC[C@@H](C/C=C/CCC(=O)NC/C(=C/Cl)/[C@@]12[C@@H](O1)[C@H](CCC2=O)O)OC,"InChI=1S/C24H38ClNO5/c1-3-4-5-6-8-11-19(30-2)12-9-7-10-13-22(29)26-17-18(16-25)24-21(28)15-14-20(27)23(24)31-24/h7,9,16,19-20,23,27H,3-6,8,10-15,17H2,1-2H3,(H,26,29)/b9-7+,18-16-/t19-,20-,23-,24+/m0/s1",WXDBUBIFYCCNLE-NSCMQRKRSA-N,20847479,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1462,Malyngamide K,,Cyclamide,Malyngamide,C24H38ClNO3,423.2540218,CCCCCCCC(OC)C/C=C/CCC(NCC(C1=CCCCC1=O)=CCl)=O,"InChI=1S/C24H38ClNO3/c1-3-4-5-6-8-13-21(29-2)14-9-7-10-17-24(28)26-19-20(18-25)22-15-11-12-16-23(22)27/h7,9,15,18,21H,3-6,8,10-14,16-17,19H2,1-2H3,(H,26,28)/b9-7+,20-18?",MFDHYPQDDSVRFS-BYCVVBSQSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1463,Aeruginosin EI461,,Aeruginosin,,C24H35N3O6,461.2525859,CC(C)C[C@H](C(=O)N1[C@@H]2C[C@@H](CC[C@@H]2C[C@@H]1C(=O)N)O)NC(=O)[C@H](CC3=CC=C(C=C3)O)O,"InChI=1S/C24H35N3O6/c1-13(2)9-18(26-23(32)21(30)10-14-3-6-16(28)7-4-14)24(33)27-19-12-17(29)8-5-15(19)11-20(27)22(25)31/h3-4,6-7,13,15,17-21,28-30H,5,8-12H2,1-2H3,(H2,25,31)(H,26,32)/t15-,17-,18-,19-,20-,21+/m1/s1",FEBDAAYWFMTVBF-KAUTUKSKSA-N,11762312,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1464,Aeruginosin 298B,Aeruginosin 298-B,Aeruginosin,,C24H35N3O6,461.2525859,OC1=CC=C(C[C@@H](O)C(N[C@@H](C(N2[C@H](C(N)=O)C[C@H]3[C@@H]2C[C@H](O)CC3)=O)CC(C)C)=O)C=C1,"InChI=1S/C24H35N3O6/c1-13(2)9-18(26-23(32)21(30)10-14-3-6-16(28)7-4-14)24(33)27-19-12-17(29)8-5-15(19)11-20(27)22(25)31/h3-4,6-7,13,15,17-21,28-30H,5,8-12H2,1-2H3,(H2,25,31)(H,26,32)/t15-,17+,18+,19-,20-,21+/m0/s1",FEBDAAYWFMTVBF-XDUBPDLBSA-N,102376881,yes,Microcystis,n.a.,NIES 298
CyanoMetDB_1465,Microcyclamide 7806B,,Cyclamide,,C24H34N6O6S,534.226054,CC[C@H](C)[C@@H]1C2=NC(=CS2)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C3=NC(=CO3)C(=O)N1)C(C)C)[C@@H](C)O)C,"InChI=1S/C24H34N6O6S/c1-7-11(4)17-24-27-15(9-37-24)21(34)25-12(5)19(32)30-18(13(6)31)22(35)28-16(10(2)3)23-26-14(8-36-23)20(33)29-17/h8-13,16-18,31H,7H2,1-6H3,(H,25,34)(H,28,35)(H,29,33)(H,30,32)/t11-,12-,13+,16-,17+,18-/m0/s1",QZBXXIUSHVFCNF-ZIYJYRAWSA-N,139585806,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_1466,Aerucyclamide A,,Cyclamide,,C24H34N6O4S2,534.2082959,CC[C@H](C)[C@H]1C2=N[C@@H]([C@H](O2)C)C(=O)NCC3=NC(=CS3)C(=O)N[C@@H](C4=N[C@H](CS4)C(=O)N1)[C@@H](C)CC,"InChI=1S/C24H34N6O4S2/c1-6-11(3)17-23-30-19(13(5)34-23)22(33)25-8-16-26-14(9-35-16)20(31)29-18(12(4)7-2)24-27-15(10-36-24)21(32)28-17/h9,11-13,15,17-19H,6-8,10H2,1-5H3,(H,25,33)(H,28,32)(H,29,31)/t11-,12-,13+,15+,17-,18+,19-/m0/s1",VJFRQMMMXJJUSM-VZGZUROSSA-N,24970830,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_1467,Aeruginosin DA495B,,Aeruginosin,,C24H34ClN3O6,495.2136135,CC(C)C[C@H](C(=O)N1[C@H]2C[C@@H](CC[C@H]2C[C@H]1C(=O)N)O)NC(=O)[C@@H](CC3=CC(=C(C=C3)O)Cl)O,"InChI=1S/C24H34ClN3O6/c1-12(2)7-17(27-23(33)21(31)9-13-3-6-20(30)16(25)8-13)24(34)28-18-11-15(29)5-4-14(18)10-19(28)22(26)32/h3,6,8,12,14-15,17-19,21,29-31H,4-5,7,9-11H2,1-2H3,(H2,26,32)(H,27,33)/t14-,15+,17+,18-,19-,21+/m0/s1",JEQFQALMOOSYPM-ICVGXQTJSA-N,139584554,yes,n.a.,n.a.,n.a.
CyanoMetDB_1468,Aranazole B,,other linear non-peptide,,C24H33Cl6NO5S,657.0210605,CCC(CC(/C=C\C(C(C(C(C(C[C@@H]1[C@H]([C@@H](OCO1)C(c2nc(cs2)C(=O)C)O)C)Cl)Cl)Cl)O)Cl)Cl)Cl,"InChI=1S/C24H33Cl6NO5S/c1-4-13(25)7-14(26)5-6-15(27)21(33)20(30)19(29)16(28)8-18-11(2)23(36-10-35-18)22(34)24-31-17(9-37-24)12(3)32/h5-6,9,11,13-16,18-23,33-34H,4,7-8,10H2,1-3H3/b6-5-/t11-,13?,14?,15?,16?,18-,19?,20?,21?,22?,23-/m1/s1",RYSXYKPCSNNWNU-JTBFONRGSA-N,,yes,Fischerella,n.a.,PCC 9339
CyanoMetDB_1469,Aerucyclamide C,,Cyclamide,,C24H32N6O5S,516.2154893,CC[C@H](C)[C@@H]1C2=NC(=CS2)C(=O)N[C@H](C3=N[C@@H]([C@H](O3)C)C(=O)N[C@H](C4=NC(=CO4)C(=O)N1)C(C)C)C,"InChI=1S/C24H32N6O5S/c1-7-11(4)17-24-27-15(9-36-24)20(32)25-12(5)22-30-18(13(6)35-22)21(33)28-16(10(2)3)23-26-14(8-34-23)19(31)29-17/h8-13,16-18H,7H2,1-6H3,(H,25,32)(H,28,33)(H,29,31)/t11-,12-,13+,16-,17+,18-/m0/s1",MQIAICAGVFTAAN-ZIYJYRAWSA-N,25156431,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_1470,Dolastatin I,,Cyclamide,Oscillapeptin,C24H32N6O5S,516.2154893,CC(NC(C1COC(C(C(C)C)NC(C2=C(C)OC(C(C(C)CC)NC3=O)=N2)=O)=N1)=O)C4=NC3=CS4,"InChI=1S/C24H32N6O5S/c1-7-11(4)17-23-30-18(13(6)35-23)21(33)28-16(10(2)3)22-26-14(8-34-22)19(31)25-12(5)24-27-15(9-36-24)20(32)29-17/h9-12,14,16-17H,7-8H2,1-6H3,(H,25,31)(H,28,33)(H,29,32)",RENDPYCTOXQSHL-UHFFFAOYSA-N,73207733,yes,Dolabella ,auricularia,n.a.
CyanoMetDB_1471,Microcyclamide 7806A,,Cyclamide,,C24H32N6O5S,516.2154893,O=C(N[C@H]([C@@H](C)CC)C1=NC(C(N[C@H]2C)=O)=CS1)C3=COC(C(C(C)C)NC([C@H]4N=C2O[C@@H]4C)=O)=N3,"InChI=1S/C24H32N6O5S/c1-7-11(4)17-24-27-15(9-36-24)20(32)25-12(5)22-30-18(13(6)35-22)21(33)28-16(10(2)3)23-26-14(8-34-23)19(31)29-17/h8-13,16-18H,7H2,1-6H3,(H,25,32)(H,28,33)(H,29,31)/t11-,12-,13+,16?,17+,18-/m0/s1",MQIAICAGVFTAAN-NIWZQQEZSA-N,146683733,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1472,Aerucyclamide B,,Cyclamide,,C24H32N6O4S2,532.1926459,CC[C@H](C)[C@H]1C2=N[C@@H]([C@H](O2)C)C(=O)NCC3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)[C@@H](C)CC,"InChI=1S/C24H32N6O4S2/c1-6-11(3)17-23-30-19(13(5)34-23)22(33)25-8-16-26-14(9-35-16)20(31)29-18(12(4)7-2)24-27-15(10-36-24)21(32)28-17/h9-13,17-19H,6-8H2,1-5H3,(H,25,33)(H,28,32)(H,29,31)/t11-,12-,13+,17-,18+,19-/m0/s1",JFWABYMXSVHLEW-ZUDVWZRRSA-N,24970831,yes,Microcystis,aeruginosa,PCC 7806
CyanoMetDB_1473,Tantazole I,,other linear non-peptide,,C24H32N6O2S4,564.146959,CC1=C(N=C(O1)[C@@]2(CSC(=N2)[C@@]3(CSC(=N3)[C@H]4CSC(=N4)[C@@]5(CSC(=N5)C(C)C)C)C)C)C(=O)NC,"InChI=1S/C24H32N6O2S4/c1-12(2)17-28-23(5,10-34-17)20-26-14(8-33-20)18-29-24(6,11-35-18)21-30-22(4,9-36-21)19-27-15(13(3)32-19)16(31)25-7/h12,14H,8-11H2,1-7H3,(H,25,31)/t14-,22+,23+,24+/m1/s1",DQTRTKWROSDCPR-SELBWQTGSA-N,139583807,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_1474,Aranazole A,,other linear non-peptide,,C24H32Cl5NO5S,621.0443828,CCC(CC(/C=C\[C@@H]1[C@H](O1)C(C(C(C[C@@H]2[C@H]([C@@H](OCO2)C(c3nc(cs3)C(=O)C)O)C)Cl)Cl)Cl)Cl)Cl,"InChI=1S/C24H32Cl5NO5S/c1-4-13(25)7-14(26)5-6-17-23(35-17)20(29)19(28)15(27)8-18-11(2)22(34-10-33-18)21(32)24-30-16(9-36-24)12(3)31/h5-6,9,11,13-15,17-23,32H,4,7-8,10H2,1-3H3/b6-5-/t11-,13?,14?,15?,17-,18-,19?,20?,21?,22-,23+/m1/s1",RGMRJERYAWLGFL-DIOVLAQMSA-N,,yes,Fischerella,n.a.,PCC 9339
CyanoMetDB_1475,Dolabellin,,other linear non-peptide,,C24H32Cl2N2O8S2,610.0977137,CC([C@H](OC([C@H]([C@H](OC(C1=CSC([C@@H](O)CO)=N1)=O)CCCC(Cl)(Cl)C)C)=O)C2=NC(C(OC)=O)=CS2)C,"InChI=1S/C24H32Cl2N2O8S2/c1-12(2)18(20-28-14(10-38-20)22(32)34-5)36-21(31)13(3)17(7-6-8-24(4,25)26)35-23(33)15-11-37-19(27-15)16(30)9-29/h10-13,16-18,29-30H,6-9H2,1-5H3/t13-,16-,17+,18-/m0/s1",JHKFWJUVTLNOJZ-RUGDWHBFSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1476,Lyngbyabellin C,,Cyclamide,Macrolide,C24H30Cl2N2O8S2,608.0820637,CCC(C)(C1C2=NC(=CS2)C(=O)OCC(C3=NC(=CS3)C(=O)OC(C(C(=O)O1)C)CCCC(C)(Cl)Cl)O)O,"InChI=1S/C24H30Cl2N2O8S2/c1-5-23(3,33)17-19-28-13(10-38-19)21(31)34-9-15(29)18-27-14(11-37-18)22(32)35-16(12(2)20(30)36-17)7-6-8-24(4,25)26/h10-12,15-17,29,33H,5-9H2,1-4H3",OVRPLXYGNATYDY-UHFFFAOYSA-N,11082611,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1477,Tolyporphin J,,other cyclic non-peptide,porphyrins,C24H22N4O4,430.1641052,CC1=CC2=CC3=NC(=CC4=CC(=C(N4)C=C5C(=O)C(C(=N5)C=C1N2)(C)O)C)C(C3=O)(C)O,"InChI=1S/C24H22N4O4/c1-11-6-14-8-19-23(3,31)21(29)17(27-19)7-13-5-12(2)16(25-13)10-20-24(4,32)22(30)18(28-20)9-15(11)26-14/h5-10,25-26,31-32H,1-4H3",KDTTYUOOJRPMSG-UHFFFAOYSA-N,154165,yes,Tolypothrix,nodosa,n.a.
CyanoMetDB_1478,Serinolamide A,,other linear non-peptide,lipid,C23H45NO3,383.3399443,CCCCCCCCCCCCC/C=C/CCC(=O)N(C)[C@H](CO)COC,"InChI=1S/C23H45NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(26)24(2)22(20-25)21-27-3/h16-17,22,25H,4-15,18-21H2,1-3H3/b17-16+/t22-/m1/s1",CJAVPRNATZCNLN-NBRGKURFSA-N,56597771,yes,Lyngbya/Moorea,majuscula/producens,field sample New Ireland in Papua New Guinea
CyanoMetDB_1479,Besarhanamide A,,other linear non-peptide,Semiplenamide,C23H43NO3,381.3242942,CCCCCCCCCCCCC/C=C/CCC1C(O1)C(=O)N[C@H](C)CO,"InChI=1S/C23H43NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-22(27-21)23(26)24-20(2)19-25/h15-16,20-22,25H,3-14,17-19H2,1-2H3,(H,24,26)/b16-15+/t20-,21?,22?/m1/s1",WFDZAQUSOQZZAS-HFXYZWCVSA-N,102519656,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1480,Semiplenamide A,,other linear non-peptide,Semiplenamide,C23H43NO2,365.3293796,CCCCCCCCCCCCC/C=C/CC/C=C(\C)/C(=O)NCCO,"InChI=1S/C23H43NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22(2)23(26)24-20-21-25/h15-16,19,25H,3-14,17-18,20-21H2,1-2H3,(H,24,26)/b16-15+,22-19+",SJZSLZDOZDKKND-JWGQYYPISA-N,10384247,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_1481,Hierridin B,,other linear non-peptide,,C23H40O3,364.2977451,CCCCCCCCCCCCCCCC1=CC(=CC(=C1O)OC)OC,"InChI=1S/C23H40O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-18-21(25-2)19-22(26-3)23(20)24/h18-19,24H,4-17H2,1-3H3",VNEAIGHVYDWTTQ-UHFFFAOYSA-N,10021709,yes,Phormidium,ectocarpi,n.a.
CyanoMetDB_1482,Malyngamide W,,other linear non-peptide,,C23H39NO5,409.2828234,CCCCC[C@@H](C/C=C/CCC(=O)NCC(C1=CC[C@H]([C@H](C1=O)C)O)OC)OC,"InChI=1S/C23H39NO5/c1-5-6-8-11-18(28-3)12-9-7-10-13-22(26)24-16-21(29-4)19-14-15-20(25)17(2)23(19)27/h7,9,14,17-18,20-21,25H,5-6,8,10-13,15-16H2,1-4H3,(H,24,26)/b9-7+/t17-,18+,20-,21?/m1/s1",ZECLKHBQXKMZMZ-JEBUHTPESA-N,11015086,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1483,Malyngamide U,,other linear non-peptide,,C23H39NO5,409.2828234,CCCCC[C@@H](C/C=C/CCC(=O)NC[C@H]([C@@H]1[C@H](CC=C(C1=O)C)O)OC)OC,"InChI=1S/C23H39NO5/c1-5-6-8-11-18(28-3)12-9-7-10-13-21(26)24-16-20(29-4)22-19(25)15-14-17(2)23(22)27/h7,9,14,18-20,22,25H,5-6,8,10-13,15-16H2,1-4H3,(H,24,26)/b9-7+/t18-,19-,20+,22-/m0/s1",CERISUFCIISKED-GHCVQRJKSA-N,637170,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1484,Malyngamide V,,other linear non-peptide,,C23H39NO5,409.2828234,O=C1\C(=C/C[C@@H](O)C1[C@H](OC)CNC(=O)CC/C=C/C[C@@H](OC)CCCCC)C,"InChI=1S/C23H39NO5/c1-5-6-8-11-18(28-3)12-9-7-10-13-21(26)24-16-20(29-4)22-19(25)15-14-17(2)23(22)27/h7,9,14,18-20,22,25H,5-6,8,10-13,15-16H2,1-4H3,(H,24,26)/b9-7+/t18-,19+,20+,22?/m0/s1",CERISUFCIISKED-PSTDSULQSA-N,11761376,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1485,Madangolide,,other cyclic non-peptide,Macrolide,C23H39NO3,377.2929941,O=C(N(C)/C=C\C=C/CCC(C)C(OC(C(C)(C)C)C1)=O)C(C)CCC1C,"InChI=1S/C23H39NO3/c1-17-13-14-18(2)21(25)24(7)15-11-9-8-10-12-19(3)22(26)27-20(16-17)23(4,5)6/h8-9,11,15,17-20H,10,12-14,16H2,1-7H3/b9-8-,15-11-",PZISRZRLNYYESW-SCLISBBUSA-N,10547620,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1486,Ypaoamide B,,other linear non-peptide,,C23H38N2O4,406.2831577,CC(C)C[C@H]1C=CC(=O)N1C(=O)/C=C(\CCNC(=O)CCCCC(C)(C)C)/OC,"InChI=1S/C23H38N2O4/c1-17(2)15-18-10-11-21(27)25(18)22(28)16-19(29-6)12-14-24-20(26)9-7-8-13-23(3,4)5/h10-11,16-18H,7-9,12-15H2,1-6H3,(H,24,26)/b19-16+/t18-/m1/s1",VKIGEMQNRQJTHS-KNTRCKAVSA-N,,yes,Okeania,n.a.,n.a.
CyanoMetDB_1487,Hermitamide A,,other linear non-peptide,Lyngbya toxin,C23H37NO2,359.2824294,CCCCCCC[C@@H](C/C=C/CCC(=O)NCCC1=CC=CC=C1)OC,"InChI=1S/C23H37NO2/c1-3-4-5-6-11-16-22(26-2)17-12-8-13-18-23(25)24-20-19-21-14-9-7-10-15-21/h7-10,12,14-15,22H,3-6,11,13,16-20H2,1-2H3,(H,24,25)/b12-8+/t22-/m0/s1",VPNLGLXHRKAYHD-UBQCRTFRSA-N,10473646,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1488,Curacin A,,other linear non-peptide,,C23H35NOS,373.2439359,C[C@H]1C[C@H]1C2=N[C@@H](CS2)/C=C\CC/C=C/C=C(\C)/CC[C@H](CC=C)OC,"InChI=1S/C23H35NOS/c1-5-11-21(25-4)15-14-18(2)12-9-7-6-8-10-13-20-17-26-23(24-20)22-16-19(22)3/h5,7,9-10,12-13,19-22H,1,6,8,11,14-17H2,2-4H3/b9-7+,13-10-,18-12+/t19-,20+,21-,22+/m0/s1",LUEYTMPPCOCKBX-KWYHTCOPSA-N,5281967,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1489,Curacin B,,other linear non-peptide,,C23H35NOS,373.2439359,C[C@H]1C[C@H]1C2=N[C@@H](CS2)/C=C\CC/C=C\C=C(/C)\CC[C@H](CC=C)OC,"InChI=1S/C23H35NOS/c1-5-11-21(25-4)15-14-18(2)12-9-7-6-8-10-13-20-17-26-23(24-20)22-16-19(22)3/h5,7,9-10,12-13,19-22H,1,6,8,11,14-17H2,2-4H3/b9-7-,13-10-,18-12+/t19-,20+,21-,22+/m0/s1",LUEYTMPPCOCKBX-ROLIPQDHSA-N,10022252,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1490,Curacin C,,other linear non-peptide,,C23H35NOS,373.2439359,C[C@H]1C[C@H]1C2=N[C@@H](CS2)/C=C\CC/C=C/C=C(/C)\CC[C@H](CC=C)OC,"InChI=1S/C23H35NOS/c1-5-11-21(25-4)15-14-18(2)12-9-7-6-8-10-13-20-17-26-23(24-20)22-16-19(22)3/h5,7,9-10,12-13,19-22H,1,6,8,11,14-17H2,2-4H3/b9-7+,13-10-,18-12-/t19-,20+,21-,22+/m0/s1",LUEYTMPPCOCKBX-GMZZFSLLSA-N,10339335,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1492,Nostocyclyne A,,other cyclic non-peptide,Cyclophane,C23H34O2,342.2558803,CCCC1CCCCCCCCCCCC#CC2=CC(=C1C(=C2)O)O,"InChI=1S/C23H34O2/c1-2-14-20-16-13-11-9-7-5-3-4-6-8-10-12-15-19-17-21(24)23(20)22(25)18-19/h17-18,20,24-25H,2-11,13-14,16H2,1H3",HHFZKMAGUORSAM-UHFFFAOYSA-N,10088786,yes,Nostoc,n.a.,TAU IL-220
CyanoMetDB_1493,Radiosumin B,,other linear peptide,,C23H32N4O5,444.2372701,CC(=O)N[C@@H]1CC/C(=C\[C@@H](C(=O)O)NC(=O)[C@H](/C=C/2\CC[C@H](C=C2)NC)NC(=O)C)/C=C1,"InChI=1S/C23H32N4O5/c1-14(28)25-19-10-6-17(7-11-19)13-21(23(31)32)27-22(30)20(26-15(2)29)12-16-4-8-18(24-3)9-5-16/h4,6,8,10,12-13,18-21,24H,5,7,9,11H2,1-3H3,(H,25,28)(H,26,29)(H,27,30)(H,31,32)/b16-12+,17-13-",DXOBDIZQMJWEAT-OHCYLCFFSA-N,,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1494,Lyngbyabellin G,,Cyclamide,Peptolide,C23H28Cl2N2O8S2,594.0664136,C[C@H]1[C@@H](OC(=O)C2=CSC(=N2)[C@@H](COC(=O)C3=CSC(=N3)[C@@H](OC1=O)C(C)(C)O)O)CCCC(C)(Cl)Cl,"InChI=1S/C23H28Cl2N2O8S2/c1-11-15(6-5-7-23(4,24)25)34-21(31)13-10-36-17(26-13)14(28)8-33-20(30)12-9-37-18(27-12)16(22(2,3)32)35-19(11)29/h9-11,14-16,28,32H,5-8H2,1-4H3/t11-,14+,15-,16+/m0/s1",HPCFVGQULNKVOH-BJKJVOPESA-N,11699930,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1495,Lyngbyabellin K,,Cyclamide,Peptolide,C23H28Cl2N2O7S2,578.071499,CC1C(OC(=O)C2=CSC(=N2)C(COC(=O)C3=CSC(=N3)C(OC1=O)C(C)C)O)CCCC(C)(Cl)Cl,"InChI=1S/C23H28Cl2N2O7S2/c1-11(2)17-19-27-13(9-36-19)21(30)32-8-15(28)18-26-14(10-35-18)22(31)33-16(12(3)20(29)34-17)6-5-7-23(4,24)25/h9-12,15-17,28H,5-8H2,1-4H3/t12-,15+,16-,17-/m0/s1",ZBAMSLOMNLECFR-IEAZIUSSSA-N,70677296,yes,n.a.,n.a.,n.a.
CyanoMetDB_1496,Microcyclamide GL546A,,Cyclamide,,C23H26N6O6S2,546.1355249,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=C(O4)C)C(=O)N1)C)CC(=O)O,"InChI=1S/C23H26N6O6S2/c1-5-9(2)16-23-27-14(8-37-23)19(33)25-12(6-15(30)31)22-26-13(7-36-22)18(32)24-10(3)21-29-17(11(4)35-21)20(34)28-16/h7-10,12,16H,5-6H2,1-4H3,(H,24,32)(H,25,33)(H,28,34)(H,30,31)/t9-,10-,12+,16-/m0/s1",SWMDBTHOKJGFQB-XQDRIVNHSA-N,46197156,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1497,Microcyclamide GL546B,,Cyclamide,,C23H26N6O6S2,546.1355249,CC[C@H](C)[C@H]1C2=NC(=CS2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=C(O4)C)C(=O)N1)C)CC(=O)O,"InChI=1S/C23H26N6O6S2/c1-5-9(2)16-23-27-14(8-37-23)19(33)25-12(6-15(30)31)22-26-13(7-36-22)18(32)24-10(3)21-29-17(11(4)35-21)20(34)28-16/h7-10,12,16H,5-6H2,1-4H3,(H,24,32)(H,25,33)(H,28,34)(H,30,31)/t9-,10-,12-,16-/m0/s1",SWMDBTHOKJGFQB-ZZTKVPBPSA-N,46197157,yes,Microcystis,n.a.,n.a.
CyanoMetDB_1500,Cyanobacterin,,other linear non-peptide,,C23H23ClO6,430.1183162,CC(C)[C@]\1([C@H](C(=O)O/C1=C\C2=CC=C(C=C2)OC)CC3=CC4=C(C(=C3)Cl)OCO4)O,"InChI=1S/C23H23ClO6/c1-13(2)23(26)17(8-15-9-18(24)21-19(10-15)28-12-29-21)22(25)30-20(23)11-14-4-6-16(27-3)7-5-14/h4-7,9-11,13,17,26H,8,12H2,1-3H3/b20-11-/t17-,23+/m0/s1",YYPUQBCQRSMSKU-YLBRSAIOSA-N,6437843,yes,Scytonema,hofmannii,n.a.
CyanoMetDB_1501,Semiplenamide F,,other linear non-peptide,Semiplenamide,C22H43NO3,369.3242942,CCCCCCCCCCCCCCC[C@@H]1[C@@](O1)(C)C(=O)NC(C)CO,"InChI=1S/C22H43NO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-22(3,26-20)21(25)23-19(2)18-24/h19-20,24H,4-18H2,1-3H3,(H,23,25)/t19?,20-,22+/m1/s1",WTOKUHHGBBPESF-VRAFCGOGSA-N,10022023,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_1502,Synechobactin C,,other linear non-peptide,Siderophore,C22H40N4O9,504.2795289,O=C(CC(CC(NCCCN(C(C)=O)O)=O)(C(O)=O)O)NCCCN(C(CCCCCCC)=O)O,"InChI=1S/C22H40N4O9/c1-3-4-5-6-7-10-20(30)26(35)14-9-12-24-19(29)16-22(33,21(31)32)15-18(28)23-11-8-13-25(34)17(2)27/h33-35H,3-16H2,1-2H3,(H,23,28)(H,24,29)(H,31,32)",LPWDCGVTZOZWBF-UHFFFAOYSA-N,21778357,yes,Synechococcus,n.a.,PCC 7002
CyanoMetDB_1503,Nostosin B,,other linear peptide,,C22H37N5O5,451.2794693,OC1=CC=C(C=C1)CCC(C(N[C@H](C(N[C@@H](CCCNC(N)=N)CO)=O)[C@@H](C)CC)=O)O,"InChI=1S/C22H37N5O5/c1-3-14(2)19(21(32)26-16(13-28)5-4-12-25-22(23)24)27-20(31)18(30)11-8-15-6-9-17(29)10-7-15/h6-7,9-10,14,16,18-19,28-30H,3-5,8,11-13H2,1-2H3,(H,26,32)(H,27,31)(H4,23,24,25)/t14-,16-,18?,19-/m0/s1",NFEXMBMBZZNYQK-JEWWICQWSA-N,118711063,yes,Nostoc,n.a.,FSN
CyanoMetDB_1504,Nostosin A,,other linear peptide,Nostosin,C22H35N5O5,449.2638192,OC1=CC=C(CCC(O)C(N[C@@H]([C@H](CC)C)C(N[C@H](C2O)CCCN2C(N)=N)=O)=O)C=C1,"InChI=1S/C22H35N5O5/c1-3-13(2)18(20(31)25-16-5-4-12-27(21(16)32)22(23)24)26-19(30)17(29)11-8-14-6-9-15(28)10-7-14/h6-7,9-10,13,16-18,21,28-29,32H,3-5,8,11-12H2,1-2H3,(H3,23,24)(H,25,31)(H,26,30)/t13-,16-,17?,18-,21?/m0/s1",MKNWXPPWASGIJB-MBFYVNQYSA-N,,yes,Nostoc,n.a.,FSN
CyanoMetDB_1505,Curacin D,,other linear non-peptide,,C22H33NOS,359.2282859,C[C@H]1C[C@H]1C2=NC(CS2)/C=C\CC/C=C/C=C/CCC(CC=C)OC,"InChI=1S/C22H33NOS/c1-4-13-20(24-3)15-12-10-8-6-5-7-9-11-14-19-17-25-22(23-19)21-16-18(21)2/h4-6,8,10-11,14,18-21H,1,7,9,12-13,15-17H2,2-3H3/b6-5+,10-8+,14-11-/t18-,19?,20?,21+/m0/s1",SSJXRCYFOOLEKV-RDTKOLQBSA-N,10546404,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1506,Ypaoamide C,,other linear non-peptide,,C22H33ClN2O4,424.2128853,C[C@H]1C=CC(=O)N1C(=O)/C=C(\C/C(=C/Cl)/CNC(=O)CCCCC(C)(C)C)/OC,"InChI=1S/C22H33ClN2O4/c1-16-9-10-20(27)25(16)21(28)13-18(29-5)12-17(14-23)15-24-19(26)8-6-7-11-22(2,3)4/h9-10,13-14,16H,6-8,11-12,15H2,1-5H3,(H,24,26)/b17-14-,18-13+/t16-/m0/s1",XXFDGELVIZKSQK-CNUNMIECSA-N,,yes,Okeania,n.a.,n.a.
CyanoMetDB_1507,Radiosumin,Radiosumin A,other linear peptide,linear depsipeptide,C22H32N4O5,432.2372701,CC(=O)NC1CCC(=C[C@@H](C(=O)O)NC(=O)[C@H](/C=C/2\CC[C@H](C=C2)N)NC(=O)C)CC1,"InChI=1S/C22H32N4O5/c1-13(27)24-18-9-5-16(6-10-18)12-20(22(30)31)26-21(29)19(25-14(2)28)11-15-3-7-17(23)8-4-15/h3,7,11-12,17-20H,4-6,8-10,23H2,1-2H3,(H,24,27)(H,25,28)(H,26,29)(H,30,31)/b15-11-,16-12?/t17-,18?,19-,20-/m0/s1",BZYYTAOQKTUZST-NRZWWCDRSA-N,10812638,yes,Plectonema,radiosum,NIES-515
CyanoMetDB_1508,Banyascyclamide B,,Cyclamide,,C22H30N6O5S2,522.1719104,O=C1C2=CSC(C(NC([C@H](C(C)O)NC([C@@H](NC(C3=CSC(C(N1)C)=N3)=O)CC(C)C)=O)=O)C)=N2,"InChI=1S/C22H30N6O5S2/c1-9(2)6-13-17(30)28-16(12(5)29)20(33)24-11(4)22-26-14(7-34-22)18(31)23-10(3)21-27-15(8-35-21)19(32)25-13/h7-13,16,29H,6H2,1-5H3,(H,23,31)(H,24,33)(H,25,32)(H,28,30)/t10?,11?,12?,13-,16-/m0/s1",NPBPDQUTCNAUEW-XHPPBCIXSA-N,21776920,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1509,Dehydroradiosumin,,other linear peptide,,C22H30N4O5,430.2216201,CC(N[C@H]1CC/C(C=C1)=C/[C@H](NC([C@@H](NC(C)=O)/C=C2CC[C@@H](N)C=C\2)=O)C(O)=O)=O,"InChI=1S/C22H30N4O5/c1-13(27)24-18-9-5-16(6-10-18)12-20(22(30)31)26-21(29)19(25-14(2)28)11-15-3-7-17(23)8-4-15/h3,5,7,9,11-12,17-20H,4,6,8,10,23H2,1-2H3,(H,24,27)(H,25,28)(H,26,29)(H,30,31)/b15-11-,16-12+/t17-,18+,19-,20-/m0/s1",ZKDJPRDXYUPPEK-KUGPAYIISA-N,,yes,Anabaena,cylindrica,NIES 19
CyanoMetDB_1510,Venturamide B,,Cyclamide,Microcyclamide,C22H26N6O5S2,518.1406095,CC([C@@H](NC(C1=CSC(C(NC2=O)[C@H](O)C)=N1)=O)C3=NC(C(N[C@H](C)C(O4)=NC2=C4C)=O)=CS3)C,"InChI=1S/C22H26N6O5S2/c1-8(2)14-21-24-12(6-34-21)17(30)23-9(3)20-28-16(11(5)33-20)19(32)27-15(10(4)29)22-25-13(7-35-22)18(31)26-14/h6-10,14-15,29H,1-5H3,(H,23,30)(H,26,31)(H,27,32)/t9-,10-,14-,15?/m1/s1",BJJVHBJYOXGRRO-IMXBXKRKSA-N,,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_1511,Bistratamide C,,Cyclamide,Microcyclamide,C22H26N6O4S2,502.1456957,C[C@H]1C2=NC(=CS2)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C4=NC(=CO4)C(=O)N1)C(C)C)C(C)C,"InChI=1S/C22H26N6O4S2/c1-9(2)15-20-24-12(6-32-20)17(29)23-11(5)21-25-13(7-33-21)19(31)28-16(10(3)4)22-26-14(8-34-22)18(30)27-15/h6-11,15-16H,1-5H3,(H,23,29)(H,27,30)(H,28,31)/t11-,15-,16-/m0/s1",MGQOLXUQYDFTKZ-UVBJJODRSA-N,10391365,yes,n.a.,n.a.,n.a.
CyanoMetDB_1512,Hydroxycyanobacterin,,other linear non-peptide,,C22H23ClO5,402.1234015,CC(C)[C@]\1([C@H](C(=O)O/C1=C\C2=CC=C(C=C2)OC)CC3=CC(=C(C=C3)O)Cl)O,"InChI=1S/C22H23ClO5/c1-13(2)22(26)17(10-15-6-9-19(24)18(23)11-15)21(25)28-20(22)12-14-4-7-16(27-3)8-5-14/h4-9,11-13,17,24,26H,10H2,1-3H3/b20-12-/t17-,22+/m0/s1",RSVNZCJGMZWPMU-ITMNURAISA-N,139584169,yes,Scytonema,hofmannii,UTEX 2349
CyanoMetDB_1513,3-epi-welwitindolinone B isothiocyanate,N-Methylwelwitindolinone B isothiocyanate,other linear non-peptide,,C22H23ClN2O2S,414.1168769,C[C@]1([C@@H](C[C@H]2C(=O)[C@@]1(C3=C4[C@H](C2(C)C)C(=O)N(C4=CC=C3)C)N=C=S)Cl)C=C,"InChI=1S/C22H23ClN2O2S/c1-6-21(4)15(23)10-13-18(26)22(21,24-11-28)12-8-7-9-14-16(12)17(20(13,2)3)19(27)25(14)5/h6-9,13,15,17H,1,10H2,2-5H3/t13-,15+,17-,21+,22+/m0/s1",RBPIZRWOMRMEOB-ADDAZVEVSA-N,139588580,yes,Hapalosiphon,welwitschii,W. & G.S. West UHIC-52-3
CyanoMetDB_1514,3-hydroxy-N-methylwelwitindolinone C isothiocyanate,,other linear non-peptide,,C22H21ClN2O3S,428.0961414,C[C@]1(C(=C[C@H]2C(=O)[C@@]1(C3=C4C(=CC=C3)N(C(=O)[C@@]4(C2(C)C)O)C)N=C=S)Cl)C=C,"InChI=1S/C22H21ClN2O3S/c1-6-20(4)15(23)10-13-17(26)21(20,24-11-29)12-8-7-9-14-16(12)22(28,19(13,2)3)18(27)25(14)5/h6-10,13,28H,1H2,2-5H3/t13-,20+,21+,22-/m0/s1",VDNAFECSPBXWIH-WOHBTAIZSA-N,10812488,yes,Fischerella,n.a.,n.a.
CyanoMetDB_1515,3-hydroxy-N-methylwelwitindolinone C isonitrile,,other linear non-peptide,,C22H21ClN2O3,396.1240702,C[C@]1(C(=C[C@H]2C(=O)[C@@]1(C3=C4C(=CC=C3)N(C(=O)[C@@]4(C2(C)C)O)C)[N+]#[C-])Cl)C=C,"InChI=1S/C22H21ClN2O3/c1-7-20(4)15(23)11-13-17(26)21(20,24-5)12-9-8-10-14-16(12)22(28,19(13,2)3)18(27)25(14)6/h7-11,13,28H,1H2,2-4,6H3/t13-,20+,21+,22-/m0/s1",GFNPBZSGZFQTJA-WOHBTAIZSA-N,10786957,yes,Fischerella,n.a.,n.a.
CyanoMetDB_1516,N-methylwelwitindolinone C isothiocyanate,,other linear non-peptide,,C22H21ClN2O2S,412.1012268,C[C@]1(C(=C[C@H]2C(=O)[C@@]1(C3=C4[C@@H](C2(C)C)C(=O)N(C4=CC=C3)C)N=C=S)Cl)C=C,"InChI=1S/C22H21ClN2O2S/c1-6-21(4)15(23)10-13-18(26)22(21,24-11-28)12-8-7-9-14-16(12)17(20(13,2)3)19(27)25(14)5/h6-10,13,17H,1H2,2-5H3/t13-,17+,21+,22+/m0/s1",ULCGNHFUBLOLRR-YLBNWIERSA-N,10476807,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1517,N-methylwelwitinsolinone C isonitrile,,other linear non-peptide,,C22H21ClN2O2,380.1291556,C[C@]1(C(=C[C@H]2C(=O)[C@@]1(C3=C4[C@@H](C2(C)C)C(=O)N(C4=CC=C3)C)[N+]#[C-])Cl)C=C,"InChI=1S/C22H21ClN2O2/c1-7-21(4)15(23)11-13-18(26)22(21,24-5)12-9-8-10-14-16(12)17(20(13,2)3)19(27)25(14)6/h7-11,13,17H,1H2,2-4,6H3/t13-,17+,21+,22+/m0/s1",XIXVXXYJRITWPP-YLBNWIERSA-N,10317676,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1518,N-methylwelwitindolinone D isonitrile,,other linear non-peptide,,C22H20N2O4,376.1423071,C[C@]1(C(=O)[C@H]2[C@H]3C(=O)[C@@]1(C4=C5C(=CC=C4)N(C(=O)[C@@]5(C3(C)C)O2)C)[N+]#[C-])C=C,"InChI=1S/C22H20N2O4/c1-7-20(4)17(26)15-14-16(25)21(20,23-5)11-9-8-10-12-13(11)22(28-15,19(14,2)3)18(27)24(12)6/h7-10,14-15H,1H2,2-4,6H3/t14-,15+,20+,21+,22-/m0/s1",UIYNCSYDIUPTBP-VQKSPFJLSA-N,53261448,yes,Fischerella,n.a.,n.a.
CyanoMetDB_1519,Besarhanamide B,,other linear non-peptide,Semiplenamide,C21H39NO4,369.2879087,O=C(C)OCC(CC(C)=O)NC(CCCCCCCCCCCCC)=O,"InChI=1S/C21H39NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-21(25)22-20(16-18(2)23)17-26-19(3)24/h20H,4-17H2,1-3H3,(H,22,25)",ASMQMRMTPQTLFC-UHFFFAOYSA-N,102519657,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1520,Kalkitoxin,,other linear non-peptide,Lyngbya toxin (alkaloid),C21H38N2OS,366.270485,CC[C@@H](C)C(=O)N(C)CC[C@@H](C)C[C@H](C)[C@H](C)CC1=N[C@@H](CS1)C=C,"InChI=1S/C21H38N2OS/c1-8-16(4)21(24)23(7)11-10-15(3)12-17(5)18(6)13-20-22-19(9-2)14-25-20/h9,15-19H,2,8,10-14H2,1,3-7H3/t15-,16-,17+,18-,19-/m1/s1",PHYRFZDJEDWWKT-UJWQCDCRSA-N,11176051,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1521,Tumonoic acid F,,other linear non-peptide,,C21H37NO5,383.2671733,CCCCCCCCC([C@H](OC(C)=O)[C@@H](C(N1CCC[C@H]1C(O)=O)=O)C)C,"InChI=1S/C21H37NO5/c1-5-6-7-8-9-10-12-15(2)19(27-17(4)23)16(3)20(24)22-14-11-13-18(22)21(25)26/h15-16,18-19H,5-14H2,1-4H3,(H,25,26)/t15?,16-,18-,19-/m0/s1",PFYSYVJVRRSPAP-PVRLSMEHSA-N,25058103,yes,Blennothrix,cantharidosmum,n.a.
CyanoMetDB_1522,ethyl tumonoate A,,other linear non-peptide,,C21H37NO4,367.2722587,CCCCCCC/C=C(\C)/[C@H]([C@@H](C)C(=O)N1CCC[C@H]1C(=O)OCC)O,"InChI=1S/C21H37NO4/c1-5-7-8-9-10-11-13-16(3)19(23)17(4)20(24)22-15-12-14-18(22)21(25)26-6-2/h13,17-19,23H,5-12,14-15H2,1-4H3/b16-13+/t17-,18+,19-/m1/s1",ATSNGULFDLCUIL-BFJJTLHJSA-N,53493313,yes,Oscillatoria/Planktothrix,margaritifera,n.a.
CyanoMetDB_1523,Laingolide,,other cyclic non-peptide,,C21H37NO3,351.2773441,CC1CC(C)CCC(CC(C(C)(C)C)OC(C/C=C\N(C)C1=O)=O)C,"InChI=1S/C21H37NO3/c1-15-10-11-16(2)14-18(21(4,5)6)25-19(23)9-8-12-22(7)20(24)17(3)13-15/h8,12,15-18H,9-11,13-14H2,1-7H3/b12-8-",MUPORQMYFNQMDE-WQLSENKSSA-N,,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1524,Grenadamide B,,other linear non-peptide,,C21H36ClNO2,369.2434571,CCC/C(=C\Cl)/CCCC(=O)NC(C)CC(C)C(=O)C(C)CCC=C,"InChI=1S/C21H36ClNO2/c1-6-8-11-16(3)21(25)17(4)14-18(5)23-20(24)13-9-12-19(15-22)10-7-2/h6,15-18H,1,7-14H2,2-5H3,(H,23,24)/b19-15+",MTSIKQYOKFAJKC-XDJHFCHBSA-N,44479217,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1525,Grenadamide C,,other linear non-peptide,,C21H35Cl2NO2,403.2044848,CCC/C(=C\Cl)/CCCC(=O)NC(C)CC(C)C(=O)C(C)CC/C=C/Cl,"InChI=1S/C21H35Cl2NO2/c1-5-9-19(15-23)11-8-12-20(25)24-18(4)14-17(3)21(26)16(2)10-6-7-13-22/h7,13,15-18H,5-6,8-12,14H2,1-4H3,(H,24,25)/b13-7+,19-15+",OEEXJHFQVSGEBK-KFPQZNHNSA-N,44479218,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1526,Laingolide B,,other cyclic non-peptide,,C20H32ClNO3,369.2071,CC1CCCC/C(CC(C(C)(C)C)OC(C/C=C\N(C)C1=O)=O)=C\Cl,"InChI=1S/C20H32ClNO3/c1-15-9-6-7-10-16(14-21)13-17(20(2,3)4)25-18(23)11-8-12-22(5)19(15)24/h8,12,14-15,17H,6-7,9-11,13H2,1-5H3/b12-8-,16-14+",TXSKGOYJIQLKGC-DXYNANAWSA-N,,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1527,Grenadamide,(+)-grenadamide,other linear non-peptide,,C21H33NO,315.2562147,CCCCCCC[C@H]1C[C@@H]1CCC(=O)NCCC2=CC=CC=C2,"InChI=1S/C21H33NO/c1-2-3-4-5-9-12-19-17-20(19)13-14-21(23)22-16-15-18-10-7-6-8-11-18/h6-8,10-11,19-20H,2-5,9,12-17H2,1H3,(H,22,23)/t19-,20-/m1/s1",DBLLDTYDBSMYBP-WOJBJXKFSA-N,10313633,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1528,Nhatrangin A,,other linear non-peptide,Lyngbya toxin (alkaloid),C21H32O8,412.209718,OC1=CC=CC([C@@H](OC)CC[C@H](C)[C@@H](OC(C[C@@H](O)[C-](O)C)=O)[C@@H](C)C(O)=O)=C1,"InChI=1S/C21H31O8/c1-12(8-9-18(28-4)15-6-5-7-16(23)10-15)20(13(2)21(26)27)29-19(25)11-17(24)14(3)22/h5-7,10,12-13,17-18,20,22-24H,8-9,11H2,1-4H3,(H,26,27)/q-1/t12-,13+,17+,18-,20+/m0/s1",SDQFZZGLPYJDFO-IKZAZAHWSA-N,46211050,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1529,Yoshinone B1,,other linear non-peptide,Yoshinone,C21H32O6,380.2198888,CC1=C(OC)OC(/C=C/C(C)(O)CCC(OC)/C(C)=C/C(O)C)=C(C)C1=O,"InChI=1S/C21H32O6/c1-13(12-14(2)22)17(25-6)8-10-21(5,24)11-9-18-15(3)19(23)16(4)20(26-7)27-18/h9,11-12,14,17,22,24H,8,10H2,1-7H3/b11-9+,13-12+",LVQGAOXDSKNQRU-GNDASISDSA-N,101883475,yes,Leptolyngbya,sp.,n.a.
CyanoMetDB_1530,Yoshinone B2,,other linear non-peptide,Yoshinone,C21H32O6,380.2198888,CC1=C(OC)OC(/C=C/C(C)(O)CCC(OC)/C(C)=C/C(O)C)=C(C)C1=O,"InChI=1S/C21H32O6/c1-13(12-14(2)22)17(25-6)8-10-21(5,24)11-9-18-15(3)19(23)16(4)20(26-7)27-18/h9,11-12,14,17,22,24H,8,10H2,1-7H3/b11-9+,13-12+",LVQGAOXDSKNQRU-GNDASISDSA-N,101883475,yes,Leptolyngbya,sp.,n.a.
CyanoMetDB_1531,Yoshinone A,,other linear non-peptide,Yoshinone,C21H32O5,364.2249741,CC1=C(OC(C/C=C(CC[C@@H](/C(C)=C/[C@H](O)C)OC)\C)=C(C1=O)C)OC,"InChI=1S/C21H32O5/c1-13(8-10-18(24-6)14(2)12-15(3)22)9-11-19-16(4)20(23)17(5)21(25-7)26-19/h9,12,15,18,22H,8,10-11H2,1-7H3/b13-9+,14-12+/t15-,18+/m1/s1",JRYSFTQQWLHNHH-SWRHGPNJSA-N,132965780,yes,Leptolyngbya,sp.,n.a.
CyanoMetDB_1532,Nhatrangin B,,other linear non-peptide,Lyngbya toxin (alkaloid),C21H31BrO8,490.120231,OC1=CC=C(Br)C([C@@H](OC)CC[C@H](C)[C@@H](OC(C[C@@H](O)[C@H](O)C)=O)[C@@H](C)C(O)=O)=C1,"InChI=1S/C21H31BrO8/c1-11(5-8-18(29-4)15-9-14(24)6-7-16(15)22)20(12(2)21(27)28)30-19(26)10-17(25)13(3)23/h6-7,9,11-13,17-18,20,23-25H,5,8,10H2,1-4H3,(H,27,28)/t11-,12+,13+,17+,18-,20+/m0/s1",ZMDNPAXGEYVRDA-WVQPDWTRSA-N,46211051,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1533,"20-Nor-3?-acetoxy-12-hydroxy-abieta-5,7,9,11,13-pentaene",,other linear non-peptide,,C21H26O3,326.1881947,CC(C)C1=C(C=C2C3=C(C=CC2=C1)C([C@@H](CC3)OC(=O)C)(C)C)O,"InChI=1S/C21H26O3/c1-12(2)16-10-14-6-8-18-15(17(14)11-19(16)23)7-9-20(21(18,4)5)24-13(3)22/h6,8,10-12,20,23H,7,9H2,1-5H3/t20-/m1/s1",VAOOUXRVYRUSNC-HXUWFJFHSA-N,102393971,yes,Microcoleus,lacustris,n.a.
CyanoMetDB_1534,"20-Nor-3?-acetoxyabieta-5,7,9,11,13-pentaene",,other linear non-peptide,,C21H26O2,310.1932801,CC(C)C1=CC2=C(C=C1)C3=C(C=C2)C([C@@H](CC3)OC(=O)C)(C)C,"InChI=1S/C21H26O2/c1-13(2)15-6-8-17-16(12-15)7-10-19-18(17)9-11-20(21(19,4)5)23-14(3)22/h6-8,10,12-13,20H,9,11H2,1-5H3/t20-/m1/s1",JWXNHJCJMZWIQI-HXUWFJFHSA-N,102393970,yes,Microcoleus,lacustris,n.a.
CyanoMetDB_1535,Dolastatin E,,Cyclamide,Oscillapeptin,C21H26N6O4S2,490.1456957,CC(CC)C(NC(C1CSC(C(C)NC(C2=COC(C(C)NC3=O)=N2)=O)=N1)=O)C4=NC3=CS4,"InChI=1S/C21H26N6O4S2/c1-5-9(2)15-21-26-13(8-33-21)17(29)22-10(3)19-24-12(6-31-19)16(28)23-11(4)20-25-14(7-32-20)18(30)27-15/h6,8-11,14-15H,5,7H2,1-4H3,(H,22,29)(H,23,28)(H,27,30)",VSGYUYYHFCZFRA-UHFFFAOYSA-N,9983048,yes,n.a.,n.a.,n.a.
CyanoMetDB_1536,Dendroamide C,,Cyclamide,Microcyclamide,C21H24N6O5S3,536.0970314,C[C@@H]1C2=NC(=C(O2)C)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)CCS(=O)C)C,"InChI=1S/C21H24N6O5S3/c1-9-19-27-15(11(3)32-19)18(30)23-10(2)20-25-14(7-33-20)17(29)24-12(5-6-35(4)31)21-26-13(8-34-21)16(28)22-9/h7-10,12H,5-6H2,1-4H3,(H,22,28)(H,23,30)(H,24,29)/t9-,10-,12-,35?/m1/s1",VBKOUAVWXRGGDI-AFCAKOPLSA-N,10768697,yes,Stigonema,dendroideum,n.a.
CyanoMetDB_1537,Dendroamide B,,Cyclamide,Microcyclamide,C21H24N6O4S3,520.1021168,C[C@@H]1C2=NC(=C(O2)C)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)CCSC)C,"InChI=1S/C21H24N6O4S3/c1-9-19-27-15(11(3)31-19)18(30)23-10(2)20-25-14(7-33-20)17(29)24-12(5-6-32-4)21-26-13(8-34-21)16(28)22-9/h7-10,12H,5-6H2,1-4H3,(H,22,28)(H,23,30)(H,24,29)/t9-,10-,12-/m1/s1",AERWTVOXUHXGAE-CKYFFXLPSA-N,10673550,yes,Stigonema,dendroideum,n.a.
CyanoMetDB_1538,Bistratamide M,,Cyclamide,Microcyclamide,C21H24N6O4S2,488.1300456,O=C(N[C@@H](C)C1=NC(C(N[C@@H]([C@@H](CC)C)C2=NC3=CS2)=O)=CS1)C4=COC([C@H](C)NC3=O)=N4,"InChI=1S/C21H24N6O4S2/c1-5-9(2)15-21-26-13(8-33-21)17(29)22-10(3)19-24-12(6-31-19)16(28)23-11(4)20-25-14(7-32-20)18(30)27-15/h6-11,15H,5H2,1-4H3,(H,22,29)(H,23,28)(H,27,30)/t9-,10+,11+,15+/m1/s1",SRBVEPMXRCSCCU-LMCGPQHNSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1539,Bistratamide N,,Cyclamide,Microcyclamide,C21H24N6O4S2,488.1300456,O=C(N[C@H](C)C1=NC(C(N[C@@H]([C@@H](CC)C)C2=NC3=CS2)=O)=CS1)C4=COC([C@H](C)NC3=O)=N4,"InChI=1S/C21H24N6O4S2/c1-5-9(2)15-21-26-13(8-33-21)17(29)22-10(3)19-24-12(6-31-19)16(28)23-11(4)20-25-14(7-32-20)18(30)27-15/h6-11,15H,5H2,1-4H3,(H,22,29)(H,23,28)(H,27,30)/t9-,10+,11-,15+/m1/s1",SRBVEPMXRCSCCU-RSQPEXBXSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1540,Dendroamide A,,Cyclamide,Microcyclamide,C21H24N6O4S2,488.1300456,C[C@@H]1C2=NC(=C(O2)C)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)C)C(C)C,"InChI=1S/C21H24N6O4S2/c1-8(2)14-21-25-13(7-33-21)17(29)23-10(4)20-24-12(6-32-20)16(28)22-9(3)19-27-15(11(5)31-19)18(30)26-14/h6-10,14H,1-5H3,(H,22,28)(H,23,29)(H,26,30)/t9-,10-,14-/m1/s1",MDIRDFOZMJDCMK-GPCCPHFNSA-N,177307,yes,Stigonema,dendroideum,n.a.
CyanoMetDB_1541,Venturamide A,,Cyclamide,Microcyclamide,C21H24N6O4S2,488.1300456,C[C@@H]1C2=NC(=C(O2)C)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)C(C)C)C,"InChI=1S/C21H24N6O4S2/c1-8(2)14-21-25-12(7-33-21)16(28)22-9(3)19-27-15(11(5)31-19)18(30)23-10(4)20-24-13(6-32-20)17(29)26-14/h6-10,14H,1-5H3,(H,22,28)(H,23,30)(H,26,29)/t9-,10-,14-/m1/s1",OJMSNONHTSXZKM-GPCCPHFNSA-N,11225555,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_1542,Hapalindole D,,other linear non-peptide,,C21H24N2S,336.16602,CC(=C)[C@H]1CC[C@]([C@@H]([C@@H]1C2=CNC3=CC=CC=C32)N=C=S)(C)C=C,"InChI=1S/C21H24N2S/c1-5-21(4)11-10-15(14(2)3)19(20(21)23-13-24)17-12-22-18-9-7-6-8-16(17)18/h5-9,12,15,19-20,22H,1-2,10-11H2,3-4H3/t15-,19+,20-,21+/m1/s1",PPHWDUZMWNUINO-QAJUQPOASA-N,14157132,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_1543,Hapalindole M,,other linear non-peptide,,C21H24N2S,336.16602,C[C@@]1(CC[C@H]2[C@@H]([C@H]1N=C=S)C3=CNC4=CC=CC(=C43)C2(C)C)C=C,"InChI=1S/C21H24N2S/c1-5-21(4)10-9-15-18(19(21)23-12-24)13-11-22-16-8-6-7-14(17(13)16)20(15,2)3/h5-8,11,15,18-19,22H,1,9-10H2,2-4H3/t15-,18-,19+,21-/m0/s1",IFJQNMZCVDODPB-RMYQPGKMSA-N,10404773,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_1544,Hapalindole Q,,other linear non-peptide,,C21H24N2S,336.16602,CC(=C)[C@@H]1CC[C@]([C@@H]([C@H]1C2=CNC3=CC=CC=C32)N=C=S)(C)C=C,"InChI=1S/C21H24N2S/c1-5-21(4)11-10-15(14(2)3)19(20(21)23-13-24)17-12-22-18-9-7-6-8-16(17)18/h5-9,12,15,19-20,22H,1-2,10-11H2,3-4H3/t15-,19+,20+,21-/m0/s1",PPHWDUZMWNUINO-NOOVBMIQSA-N,10246418,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_1545,12-epi-fisherindole U isothiocyanate,,other linear non-peptide,,C21H24N2S,336.16602,C[C@]1(CC[C@H]2[C@H]([C@H]1N=C=S)C3=C(C2(C)C)NC4=CC=CC=C43)C=C,"InChI=1S/C21H24N2S/c1-5-21(4)11-10-14-17(19(21)22-12-24)16-13-8-6-7-9-15(13)23-18(16)20(14,2)3/h5-9,14,17,19,23H,1,10-11H2,2-4H3/t14-,17-,19+,21+/m0/s1",SKPZPLQBYCKOGH-QBGRRASTSA-N,101677548,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1546,Hapalindole O,,other linear non-peptide,,C21H24N2OS,352.1609346,C[C@@]1([C@@H](C[C@H]2[C@@H]([C@H]1N=C=S)C3=CNC4=CC=CC(=C43)C2(C)C)O)C=C,"InChI=1S/C21H24N2OS/c1-5-21(4)16(24)9-14-18(19(21)23-11-25)12-10-22-15-8-6-7-13(17(12)15)20(14,2)3/h5-8,10,14,16,18-19,22,24H,1,9H2,2-4H3/t14-,16+,18-,19+,21-/m0/s1",NUQRVLVXINMDRL-DJNKVENRSA-N,10383388,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_1547,12-epi-Hapalindole C isonitrile,,other linear non-peptide,Hapalindole,C21H24N2,304.1939488,C=C[C@@](CC1)(C)[C@H]([N+]#[C-])[C@@H]([C@H]1C(C)=C)C2=CNC3=C2C=CC=C3,"InChI=1S/C21H24N2/c1-6-21(4)12-11-15(14(2)3)19(20(21)22-5)17-13-23-18-10-8-7-9-16(17)18/h6-10,13,15,19-20,23H,1-2,11-12H2,3-4H3/t15-,19+,20?,21-/m1/s1",KGWATBYKCMCFLC-FBTBGZJPSA-N,,yes,Hapalosiphon; Fischerella,[Hapalosiphon]welwitschii; [Fischerella]sp.,[Fischerella sp.]ATCC 43239 (Stigonematales)
CyanoMetDB_1548,12-epi-Hapalindole J isonitrile,,other linear non-peptide,Hapalindole,C21H24N2,304.1939488,C=C[C@@](CC1)(C)[C@H]([N+]#[C-])[C@@]([C@@]1([H])C2(C)C)([H])C3=CNC4=C3C2=CC=C4,"InChI=1S/C21H24N2/c1-6-21(4)11-10-15-18(19(21)22-5)13-12-23-16-9-7-8-14(17(13)16)20(15,2)3/h6-9,12,15,18-19,23H,1,10-11H2,2-4H3/t15-,18-,19?,21+/m0/s1",SLUFHMQYBPOTFZ-LUTZYKOESA-N,,yes,Fischerella,sp.,ATCC 43239 (Stigonematales)
CyanoMetDB_1549,12-epi-fischerindole U isonitrile,,other linear non-peptide,,C21H24N2,304.1939488,C[C@]1(CC[C@H]2[C@H]([C@H]1[N+]#[C-])C3=C(C2(C)C)NC4=CC=CC=C43)C=C,"InChI=1S/C21H24N2/c1-6-21(4)12-11-14-17(19(21)22-5)16-13-9-7-8-10-15(13)23-18(16)20(14,2)3/h6-10,14,17,19,23H,1,11-12H2,2-4H3/t14-,17-,19+,21+/m0/s1",NEYJIGPAQAKWSI-QBGRRASTSA-N,101677547,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1550,Hapalindole F,12-epi-hapalindole F isothiocyanate ,other linear non-peptide,,C21H23ClN2S,370.1270476,CC([C@H]1C[C@@H](Cl)[C@](C)(C=C)[C@H](N=C=S)[C@@H]1C2=CNC3=CC=CC=C32)=C,"InChI=1S/C21H23ClN2S/c1-5-21(4)18(22)10-15(13(2)3)19(20(21)24-12-25)16-11-23-17-9-7-6-8-14(16)17/h5-9,11,15,18-20,23H,1-2,10H2,3-4H3/t15-,18-,19+,20-,21+/m1/s1",GRQUFNAGGOBDNI-GRARQNNCSA-N,14157135,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_1551,Hapalindole T,,other linear non-peptide,,C21H23ClN2OS,386.1219622,C[C@@]1([C@@H](C[C@H]2[C@@]3([C@H]1NC(=O)S3)C4=CNC5=CC=CC(=C54)C2(C)C)Cl)C=C,"InChI=1S/C21H23ClN2OS/c1-5-20(4)15(22)9-14-19(2,3)11-7-6-8-13-16(11)12(10-23-13)21(14)17(20)24-18(25)26-21/h5-8,10,14-15,17,23H,1,9H2,2-4H3,(H,24,25)/t14-,15-,17+,20+,21-/m1/s1",HQHRKXNDJILQCX-NFWXSOHESA-N,21671523,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_1552,Hapalonamide A,,other linear non-peptide,,C21H23ClN2O2,370.1448057,C[C@]1(C=C)[C@H](Cl)C[C@@]2([H])[C@@](C(C3=C(C=CC=C3NC=O)C2(C)C)=O)([H])[C@H]1[N+]#[C-],"InChI=1S/C21H23ClN2O2/c1-6-21(4)15(22)10-13-17(19(21)23-5)18(26)16-12(20(13,2)3)8-7-9-14(16)24-11-25/h6-9,11,13,15,17,19H,1,10H2,2-4H3,(H,24,25)/t13-,15+,17+,19+,21-/m0/s1",FXUGCACUUONQJC-ANFZLHQHSA-N,,yes,Hapalosiphon,fontinalis,V-3-1
CyanoMetDB_1553,12-epi-Hapalindole E isonitrile,,other linear non-peptide,Hapalindole,C21H23ClN2,338.1549764,C=C[C@@]([C@H](Cl)C1)(C)[C@H]([N+]#[C-])[C@@H]([C@H]1C(C)=C)C2=CNC3=C2C=CC=C3,"InChI=1S/C21H23ClN2/c1-6-21(4)18(22)11-15(13(2)3)19(20(21)23-5)16-12-24-17-10-8-7-9-14(16)17/h6-10,12,15,18-20,24H,1-2,11H2,3-4H3/t15-,18-,19+,20?,21-/m1/s1",IJEJDCXOVNHHAX-MUUICVMPSA-N,101719783,yes,Hapalosiphon; Fischerella,[Hapalosiphon]welwitschii; [Fischerella]sp.,[Fischerella sp.]ATCC 43239 (Stigonematales)
CyanoMetDB_1554,Hapalindole L,,other linear non-peptide,Hapalindole,C21H23ClN2,338.1549764,C=C[C@@]([C@H](Cl)C1)(C)[C@H]([N+]#[C-])[C@@]([C@@]1([H])C2(C)C)([H])C3=CNC4=C3C2=CC=C4,"InChI=1S/C21H23ClN2/c1-6-21(4)16(22)10-14-18(19(21)23-5)12-11-24-15-9-7-8-13(17(12)15)20(14,2)3/h6-9,11,14,16,18-19,24H,1,10H2,2-4H3/t14-,16+,18-,19?,21+/m0/s1",UGBGKUYYYCTXAK-ZIXHNVMWSA-N,,yes,Hapalosiphon; Fischerella,[Hapalosiphon]welwitschii; [Fischerella]sp.,[Fischerella sp.]ATCC 43239 (Stigonematales)
CyanoMetDB_1555,12-epi-Hapalindole G,,other linear non-peptide,,C21H23ClN2,338.1549764,CC1(C2CC(C(C(C2C3=CNC4=CC=CC1=C43)[N+]#[C-])(C)C=C)Cl)C,"InChI=1S/C21H23ClN2/c1-6-21(4)16(22)10-14-18(19(21)23-5)12-11-24-15-9-7-8-13(17(12)15)20(14,2)3/h6-9,11,14,16,18-19,24H,1,10H2,2-4H3",UGBGKUYYYCTXAK-UHFFFAOYSA-N,23425648,yes,Hapalosiphon,laingii,n.a.
CyanoMetDB_1556,12-epi-fischerindole G isonitrile,,other linear non-peptide,,C21H23ClN2,338.1549764,C[C@]1([C@@H](C[C@H]2[C@H]([C@H]1[N+]#[C-])C3=C(C2(C)C)NC4=CC=CC=C43)Cl)C=C,"InChI=1S/C21H23ClN2/c1-6-21(4)15(22)11-13-17(19(21)23-5)16-12-9-7-8-10-14(12)24-18(16)20(13,2)3/h6-10,13,15,17,19,24H,1,11H2,2-4H3/t13-,15+,17-,19+,21+/m0/s1",ADPQVXWEVQETCB-AGPIPWNKSA-N,16069591,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1557,Fischerindole L,,other linear non-peptide,Fischerindole,C21H23ClN2,338.1549765,CC1(C)[C@@H](C[C@@H](Cl)[C@@](C)(C=C)[C@@H]2[N+]#[C-])[C@@H]2C3=C1NC4=CC=CC=C43,"InChI=1S/C21H23ClN2/c1-6-21(4)15(22)11-13-17(19(21)23-5)16-12-9-7-8-10-14(12)24-18(16)20(13,2)3/h6-10,13,15,17,19,24H,1,11H2,2-4H3/t13-,15+,17+,19?,21+/m0/s1",ADPQVXWEVQETCB-CMLHOTGTSA-N,,yes,Fischerella,muscicola,UTEX 1829
CyanoMetDB_1558,Hapalindolinone B,,other linear non-peptide,,C21H22N2O,318.1732133,CC(=C)[C@@H]1CC[C@@]([C@@]2([C@H]1[C@@]23C4=CC=CC=C4NC3=O)C#N)(C)C=C,"InChI=1S/C21H22N2O/c1-5-19(4)11-10-14(13(2)3)17-20(19,12-22)21(17)15-8-6-7-9-16(15)23-18(21)24/h5-9,14,17H,1-2,10-11H2,3-4H3,(H,23,24)/t14-,17-,19+,20-,21+/m0/s1",OIBWFYOBXWQXKY-UBFQGWSASA-N,139588041,yes,Fischerella,n.a.,ATCC 53558
CyanoMetDB_1559,Deschloro 12-epi-fischerindole I nitrile,,other linear non-peptide,,C21H22N2,302.1782987,C[C@]1(CC[C@H]2C(=C1C#N)C3=C(C2(C)C)NC4=CC=CC=C43)C=C,"InChI=1S/C21H22N2/c1-5-21(4)11-10-14-18(15(21)12-22)17-13-8-6-7-9-16(13)23-19(17)20(14,2)3/h5-9,14,23H,1,10-11H2,2-4H3/t14-,21+/m0/s1",KTONQTZUWGFNIE-LHSJRXKWSA-N,57407825,yes,Fischerella,n.a.,n.a.
CyanoMetDB_1560,Welwitindolinone B isothiocyanate,,other linear non-peptide,,C21H21ClN2O2S,400.1012268,C[C@]1([C@@H](C[C@H]2C(=O)[C@@]1(C3=C4[C@@H](C2(C)C)C(=O)NC4=CC=C3)N=C=S)Cl)C=C,"InChI=1S/C21H21ClN2O2S/c1-5-20(4)14(22)9-12-17(25)21(20,23-10-27)11-7-6-8-13-15(11)16(18(26)24-13)19(12,2)3/h5-8,12,14,16H,1,9H2,2-4H3,(H,24,26)/t12-,14+,16+,20+,21?/m0/s1",VLJMTNLRJHJRGI-HQEDDRCNSA-N,,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1561,Hapalindolinone A,,other linear non-peptide,,C21H21ClN2O,352.134241,CC(=C)[C@@H]1C[C@@H]([C@@]([C@@]2([C@H]1[C@@]23C4=CC=CC=C4NC3=O)C#N)(C)C=C)Cl,"InChI=1S/C21H21ClN2O/c1-5-19(4)16(22)10-13(12(2)3)17-20(19,11-23)21(17)14-8-6-7-9-15(14)24-18(21)25/h5-9,13,16-17H,1-2,10H2,3-4H3,(H,24,25)/t13-,16-,17-,19+,20-,21+/m0/s1",CLXKBATYSCEAQF-ZEHUYGQASA-N,135026998,yes,Fischerella,n.a.,ATCC 53558
CyanoMetDB_1562,Anhydrohapaloxindole A,,other linear non-peptide,,C21H21ClN2O,352.134241,C[C@@]1([C@@H](C[C@H]2C(=C3C4=C(C2(C)C)C=CC=C4NC3=O)[C@@H]1[N+]#[C-])Cl)C=C,"InChI=1S/C21H21ClN2O/c1-6-21(4)14(22)10-12-16(18(21)23-5)17-15-11(20(12,2)3)8-7-9-13(15)24-19(17)25/h6-9,12,14,18H,1,10H2,2-4H3,(H,24,25)/t12-,14+,18-,21-/m0/s1",ZHHYANZIARLNFJ-KEWKWHHGSA-N,139586554,yes,Hapalosiphon,welwitschii,V-3-1
CyanoMetDB_1563,Welwitindolinone A isonitrile,,other linear non-peptide,,C21H21ClN2O,352.134241,C[C@]1([C@@H](C[C@H]2C(=C1[N+]#[C-])[C@]3(C2(C)C)C4=CC=CC=C4NC3=O)Cl)C=C,"InChI=1S/C21H21ClN2O/c1-6-20(4)15(22)11-13-16(17(20)23-5)21(19(13,2)3)12-9-7-8-10-14(12)24-18(21)25/h6-10,13,15H,1,11H2,2-4H3,(H,24,25)/t13-,15+,20+,21+/m0/s1",XLRFBPJWPHKLJV-OKKVMHGVSA-N,11501239,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1564,12-epi-fischerindole I nitrile,,other linear non-peptide,,C21H21ClN2,336.1393264,C[C@]1([C@@H](C[C@H]2C(=C1C#N)C3=C(C2(C)C)NC4=CC=CC=C43)Cl)C=C,"InChI=1S/C21H21ClN2/c1-5-21(4)14(11-23)18-13(10-16(21)22)20(2,3)19-17(18)12-8-6-7-9-15(12)24-19/h5-9,13,16,24H,1,10H2,2-4H3/t13-,16+,21-/m0/s1",QBZITGWHJDUKFN-QSZISKGPSA-N,57407824,yes,Fischerella,n.a.,n.a.
CyanoMetDB_1565,12-epi-Fischerindole I isonitrile,,other linear non-peptide,,C21H21ClN2,336.1393264,C[C@]1([C@@H](C[C@H]2C(=C1[N+]#[C-])C3=C(C2(C)C)NC4=CC=CC=C43)Cl)C=C,"InChI=1S/C21H21ClN2/c1-6-21(4)15(22)11-13-17(19(21)23-5)16-12-9-7-8-10-14(12)24-18(16)20(13,2)3/h6-10,13,15,24H,1,11H2,2-4H3/t13-,15+,21+/m0/s1",ZVBCZYGMKQOJFW-QDUSTFBWSA-N,11624200,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1566,Deschloro 12-epi-fischerindole W nitrile,,other linear non-peptide,,C21H20N2,300.1626487,CC1=C2C(=C3[C@@H]([C@](CCC3=C1)(C)C=C)C#N)C4=CC=CC=C4N2,"InChI=1S/C21H20N2/c1-4-21(3)10-9-14-11-13(2)20-19(18(14)16(21)12-22)15-7-5-6-8-17(15)23-20/h4-8,11,16,23H,1,9-10H2,2-3H3/t16-,21+/m0/s1",XJIAYNBCTIRYJS-HRAATJIYSA-N,57407827,yes,Fischerella,n.a.,n.a.
CyanoMetDB_1567,Nostoclide II,Nostoclide 2,other linear non-peptide,,C21H19ClO3,354.1022722,CC(C)C\1=C(C(=O)O/C1=C\C2=CC(=C(C=C2)O)Cl)CC3=CC=CC=C3,"InChI=1S/C21H19ClO3/c1-13(2)20-16(10-14-6-4-3-5-7-14)21(24)25-19(20)12-15-8-9-18(23)17(22)11-15/h3-9,11-13,23H,10H2,1-2H3/b19-12-",FJCMKDBQNWQPBT-UNOMPAQXSA-N,5468143,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1568,Welwitindolinone C isothiocyanate,,other linear non-peptide,,C21H19ClN2O2S,398.0855767,C[C@]1(C(=C[C@H]2C(=O)[C@@]1(C3=C4[C@@H](C2(C)C)C(=O)NC4=CC=C3)N=C=S)Cl)C=C,"InChI=1S/C21H19ClN2O2S/c1-5-20(4)14(22)9-12-17(25)21(20,23-10-27)11-7-6-8-13-15(11)16(18(26)24-13)19(12,2)3/h5-9,12,16H,1H2,2-4H3,(H,24,26)/t12-,16+,20+,21?/m0/s1",AVHUCHOOGRXBJM-JBTFYACOSA-N,,yes,Hapalosiphon,welwitschii,n.a.
CyanoMetDB_1569,12-epi-fischerindole W nitrile,,other linear non-peptide,,C21H19ClN2,334.1236763,CC1=C2C(=C3[C@@H]([C@]([C@@H](CC3=C1)Cl)(C)C=C)C#N)C4=CC=CC=C4N2,"InChI=1S/C21H19ClN2/c1-4-21(3)15(11-23)18-13(10-17(21)22)9-12(2)20-19(18)14-7-5-6-8-16(14)24-20/h4-9,15,17,24H,1,10H2,2-3H3/t15-,17+,21-/m0/s1",IJADLSDSEAXAAQ-XPIZARPCSA-N,57407826,yes,Fischerella,n.a.,n.a.
CyanoMetDB_1570,Nostoclide I,Nostoclide 1,other linear non-peptide,,C21H18Cl2O3,388.0632998,CC(C)C\1=C(C(=O)O/C1=C\C2=CC(=C(C(=C2)Cl)O)Cl)CC3=CC=CC=C3,"InChI=1S/C21H18Cl2O3/c1-12(2)19-15(8-13-6-4-3-5-7-13)21(25)26-18(19)11-14-9-16(22)20(24)17(23)10-14/h3-7,9-12,24H,8H2,1-2H3/b18-11-",OLAZDNWZIHSQMW-WQRHYEAKSA-N,5468142,yes,Nostoc,n.a.,n.a.
CyanoMetDB_1571,Eucapsitrione,,other linear non-peptide,,C21H10O6,358.047738,C1=CC2=C(C(=C1)O)C(=O)C3=CC4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5O,"InChI=1S/C21H10O6/c22-12-5-1-3-8-14-10(19(25)15(8)12)7-11-17(20(14)26)21(27)16-9(18(11)24)4-2-6-13(16)23/h1-7,22-23,26H",SQYXINNIHPQYPE-UHFFFAOYSA-N,46919489,yes,Eucapsis,n.a.,UTEX 1519
CyanoMetDB_1572,Semiplenamide C,,other linear non-peptide,Semiplenamide,C20H39NO2,325.2980795,CCCCCCCCCCCCC/C=C(\C)/C(=O)N[C@@H](C)CO,"InChI=1S/C20H39NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18(2)20(23)21-19(3)17-22/h16,19,22H,4-15,17H2,1-3H3,(H,21,23)/b18-16+/t19-/m0/s1",YATFRALIAPYFQO-YMIFCHIISA-N,11347939,yes,Lyngbya,semiplena,n.a.
CyanoMetDB_1573,methyl tumonoate A,,other linear non-peptide,,C20H35NO4,353.2566086,CCCCCCC/C=C(C)/[C@@H](O)[C@H](C(N1[C@@H](CCC1)C(OC)=O)=O)C,"InChI=1S/C20H35NO4/c1-5-6-7-8-9-10-12-15(2)18(22)16(3)19(23)21-14-11-13-17(21)20(24)25-4/h12,16-18,22H,5-11,13-14H2,1-4H3/b15-12+/t16-,17+,18?/m1/s1",SZDORSKCYIOHRW-AHAKCJHSSA-N,21775358,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1574,Laingolide A,,other cyclic non-peptide,Macrolide,C20H35NO3,337.261694,CC1CCCCC(CC(C(C)(C)C)OC(C/C=C\N(C)C1=O)=O)C,"InChI=1S/C20H35NO3/c1-15-10-7-8-11-16(2)19(23)21(6)13-9-12-18(22)24-17(14-15)20(3,4)5/h9,13,15-17H,7-8,10-12,14H2,1-6H3/b13-9-",WJVLPAKNVBCNQF-LCYFTJDESA-N,,yes,Lyngbya,bouillonii,n.a.
CyanoMetDB_1575,Palmyrolide A,,other cyclic non-peptide,,C20H35NO3,337.261694,CN(/C=C/CC[C@H]1C)C(CCC[C@@H](C)C[C@H](C(C)(C)C)OC1=O)=O,"InChI=1S/C20H35NO3/c1-15-10-9-12-18(22)21(6)13-8-7-11-16(2)19(23)24-17(14-15)20(3,4)5/h8,13,15-17H,7,9-12,14H2,1-6H3/b13-8+/t15-,16-,17-/m1/s1",WRIPSIKIDAUKBP-CJRSWYJFSA-N,60201959,yes,n.a.,n.a.,n.a.
CyanoMetDB_1576,Debromogrenadadiene,,other linear non-peptide,,C20H32O4,336.2300595,CCCCCCC[C@H]1C[C@@H]1CCC(=O)O/C=C\C=C\COC(=O)C,"InChI=1S/C20H32O4/c1-3-4-5-6-8-11-18-16-19(18)12-13-20(22)24-15-10-7-9-14-23-17(2)21/h7,9-10,15,18-19H,3-6,8,11-14,16H2,1-2H3/b9-7+,15-10-/t18-,19-/m0/s1",SCUPHZKUVOJZFO-VECWKQJSSA-N,10544861,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1577,Hexose-bound porphyra-334,(508-Da MAA),other linear non-peptide,Mycosporine?like amino acids,C20H32N2O13,508.1904391,OC[C@](O)(CC1=NCC(O)=O)CC(N[C@H](C(O)=O)[C@H](OCC2OC(C(C(C2O)O)O)O)C)=C1OC,"InChI=1S/C20H32N2O13/c1-8(34-6-11-14(26)15(27)16(28)19(31)35-11)13(18(29)30)22-10-4-20(32,7-23)3-9(17(10)33-2)21-5-12(24)25/h8,11,13-16,19,22-23,26-28,31-32H,3-7H2,1-2H3,(H,24,25)(H,29,30)/t8-,11?,13+,14?,15?,16?,19?,20+/m1/s1",FSXFHOSBFSYGAX-HUXHAMOPSA-N,,yes,Nostoc,commune,n.a.
CyanoMetDB_1578,13-O-(?-galactosyl)-porphyra-334,,other linear non-peptide,Mycosporine?like amino acids,C20H32N2O13,508.1904391,COC1=C(C[C@](O)(CC1=N[C@@H]([C@@H](C)O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2O)O)O)CO)C(O)=O)CO)NCC(O)=O,"InChI=1S/C20H32N2O13/c1-8(34-19-16(29)15(28)14(27)11(6-23)35-19)13(18(30)31)22-10-4-20(32,7-24)3-9(17(10)33-2)21-5-12(25)26/h8,11,13-16,19,21,23-24,27-29,32H,3-7H2,1-2H3,(H,25,26)(H,30,31)/t8-,11-,13+,14+,15+,16-,19-,20+/m1/s1",SBJSFGCXPZQBOG-CQRDSGTRSA-N,,yes,Nostoc,sphaericum,n.a.
CyanoMetDB_1579,Cylindrofridin A,,other linear non-peptide,Cylindrofridin,C20H31ClO4,370.1910872,CCCCC(CCCC[C@H](C)[C@H](C1=CC(=CC(=C1)O)O)OC(=O)C)Cl,"InChI=1S/C20H31ClO4/c1-4-5-9-17(21)10-7-6-8-14(2)20(25-15(3)22)16-11-18(23)13-19(24)12-16/h11-14,17,20,23-24H,4-10H2,1-3H3/t14-,17?,20+/m0/s1",MONOMZXDURAAAV-BKCMZVEJSA-N,127031267,yes,Cylindrospermum,stagnale,PCC 7417
CyanoMetDB_1580,Trichotoxin B,,other linear non-peptide,Trichotoxin,C20H31ClO,322.2063433,C[C@@H](CC/C(=C\Cl)/CCCCCC#C)/C=C(\C)/[C@@H](CC=C)O,"InChI=1S/C20H31ClO/c1-5-7-8-9-10-12-19(16-21)14-13-17(3)15-18(4)20(22)11-6-2/h1,6,15-17,20,22H,2,7-14H2,3-4H3/b18-15+,19-16-/t17-,20+/m0/s1",WKRSVZWXGDTWNJ-IFUIVXKFSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1581,Grenadadiene,,other linear non-peptide,,C20H31BrO4,414.140572,CCCCCCC[C@H]1C[C@@H]1CCC(=O)O/C=C\C=C(\COC(=O)C)/Br,"InChI=1S/C20H31BrO4/c1-3-4-5-6-7-9-17-14-18(17)11-12-20(23)24-13-8-10-19(21)15-25-16(2)22/h8,10,13,17-18H,3-7,9,11-12,14-15H2,1-2H3/b13-8-,19-10-/t17-,18-/m0/s1",IGWLQLNRNKKQCR-QMGMKAADSA-N,10835643,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1582,Kalkipyrone B,,other linear non-peptide,,C20H30O4,334.2144094,CC1=C(OC(=C(C1=O)C)OC)C/C=C(\C)/CCC/C(=C/[C@@H](C)O)/C,"InChI=1S/C20H30O4/c1-13(8-7-9-14(2)12-15(3)21)10-11-18-16(4)19(22)17(5)20(23-6)24-18/h10,12,15,21H,7-9,11H2,1-6H3/b13-10+,14-12+/t15-/m1/s1",POWDQNOFNJBGFS-FEFCGZSXSA-N,132578764,yes,Leptolyngbya,n.a.,n.a.
CyanoMetDB_1583,Fischerellin B,,other linear non-peptide,,C20H29NO,299.2249146,CCCCCC#CC#C/C=C/CCCC[C@H]1C[C@H](C(=O)N1)C,"InChI=1S/C20H29NO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-18(2)20(22)21-19/h11-12,18-19H,3-6,13-17H2,1-2H3,(H,21,22)/b12-11+/t18-,19+/m1/s1",WZFPWAGQPCLSQP-VVZAMHAXSA-N,70684692,yes,Fischerella,[Fischerella]muscicola; [Fischerella]ambigua,n.a.
CyanoMetDB_1584,Dysideaproline B,,other linear peptide,,C20H29Cl4N3O2S,515.0734592,CC1CC(N(C1)C(=O)C(CC(C)C(Cl)Cl)N(C)C(=O)CC(C)C(Cl)Cl)C2=NC=CS2,"InChI=1S/C20H29Cl4N3O2S/c1-11-7-14(19-25-5-6-30-19)27(10-11)20(29)15(8-12(2)17(21)22)26(4)16(28)9-13(3)18(23)24/h5-6,11-15,17-18H,7-10H2,1-4H3",HDSPSTLDRVPLIV-UHFFFAOYSA-N,10874983,yes,n.a.,n.a.,n.a.
CyanoMetDB_1585,Kalkipyrone A,,other linear non-peptide,Pyrone,C20H28O4,332.1987594,CC1=C(OC(=C(C1=O)C)OC)C/C=C(\C)/C/C=C/C(=C/[C@@H](C)O)/C,"InChI=1S/C20H28O4/c1-13(8-7-9-14(2)12-15(3)21)10-11-18-16(4)19(22)17(5)20(23-6)24-18/h7,9-10,12,15,21H,8,11H2,1-6H3/b9-7+,13-10+,14-12+/t15-/m1/s1",ZMSSBNLNFAIVPK-MTGFRBBYSA-N,10592699,yes,Lyngbya/Moorea; Tolypothrix,[Lyngbya/Moorea]majuscula/producens; [Tolypothrix]sp.,n.a.
CyanoMetDB_1586,Trichotoxin A,,other linear non-peptide,Trichotoxin,C20H27ClO,318.1750432,Cl/C=C(CC[C@@H](/C=C([C@@H](CC=C)O)\C)C)/CC1=CC=CC=C1,"InChI=1S/C20H27ClO/c1-4-8-20(22)17(3)13-16(2)11-12-19(15-21)14-18-9-6-5-7-10-18/h4-7,9-10,13,15-16,20,22H,1,8,11-12,14H2,2-3H3/b17-13+,19-15+/t16-,20+/m0/s1",ANQYSAMBWZMXEL-RFMFNWNASA-N,132851224,yes,n.a.,n.a.,n.a.
CyanoMetDB_1587,Dechlorobarbamide,,other linear non-peptide,,C20H24Cl2N2O2S,426.0935546,CN(C(/C=C(CC(C)C(Cl)Cl)/OC)=O)C(C1=NC=CS1)CC2=CC=CC=C2,"InChI=1S/C20H24Cl2N2O2S/c1-14(19(21)22)11-16(26-3)13-18(25)24(2)17(20-23-9-10-27-20)12-15-7-5-4-6-8-15/h4-10,13-14,17,19H,11-12H2,1-3H3/b16-13+/t14?,17-/m0/s1",AOEGCPSVMLZAOC-JGQNNITGSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1588,13-hydroxy dechlorofontonamide,,other linear non-peptide,,C20H23NO3,325.1677936,C[C@]1(C=C2[C@H](C[C@H]1O)C(C3=C(C2=O)C(=CC=C3)NC=O)(C)C)C=C,"InChI=1S/C20H23NO3/c1-5-20(4)10-12-14(9-16(20)23)19(2,3)13-7-6-8-15(21-11-22)17(13)18(12)24/h5-8,10-11,14,16,23H,1,9H2,2-4H3,(H,21,22)/t14-,16+,20+/m0/s1",YNEOQMQDVSEXCP-YYFZDKIDSA-N,66553681,yes,Fischerella,muscicola,n.a.
CyanoMetDB_1590,Tenuecyclamide D,,Cyclamide,,C20H22N6O5S3,522.0813814,C[C@H]1C2=NC(=C(O2)C)C(=O)NCC3=NC(=CS3)C(=O)N[C@H](C4=NC(=CS4)C(=O)N1)CCS(=O)C,"InChI=1S/C20H22N6O5S3/c1-9-19-26-15(10(2)31-19)18(29)21-6-14-23-12(7-32-14)17(28)24-11(4-5-34(3)30)20-25-13(8-33-20)16(27)22-9/h7-9,11H,4-6H2,1-3H3,(H,21,29)(H,22,27)(H,24,28)/t9-,11-,34?/m0/s1",ILKYNUWKOMIMLZ-KMLOPCPQSA-N,10602098,yes,Nostoc,spongiaeforme,TAU IL-184-6
CyanoMetDB_1591,Nostocyclamide M,,Cyclamide,Microcyclamide,C20H22N6O4S3,506.0864667,C[C@H]1C2=NC(=C(O2)C)C(=O)NCC3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)CCSC,"InChI=1S/C20H22N6O4S3/c1-9-19-26-15(10(2)30-19)18(29)21-6-14-23-12(7-32-14)17(28)24-11(4-5-31-3)20-25-13(8-33-20)16(27)22-9/h7-9,11H,4-6H2,1-3H3,(H,21,29)(H,22,27)(H,24,28)/t9-,11+/m0/s1",DMFUPHMBLSJHNR-GXSJLCMTSA-N,636967,yes,Nostoc,n.a.,31
CyanoMetDB_1592,Tenuecyclamide C,,Cyclamide,,C20H22N6O4S3,506.0864667,C[C@H]1C2=NC(=C(O2)C)C(=O)NCC3=NC(=CS3)C(=O)N[C@H](C4=NC(=CS4)C(=O)N1)CCSC,"InChI=1S/C20H22N6O4S3/c1-9-19-26-15(10(2)30-19)18(29)21-6-14-23-12(7-32-14)17(28)24-11(4-5-31-3)20-25-13(8-33-20)16(27)22-9/h7-9,11H,4-6H2,1-3H3,(H,21,29)(H,22,27)(H,24,28)/t9-,11-/m0/s1",DMFUPHMBLSJHNR-ONGXEEELSA-N,10720367,yes,Nostoc,spongiaeforme,TAU IL-184-6
CyanoMetDB_1593,Nostocyclamide,,Cyclamide,Microcyclamide,C20H22N6O4S2,474.1143956,C[C@H]1C2=NC(=C(O2)C)C(=O)NCC3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)C(C)C,"InChI=1S/C20H22N6O4S2/c1-8(2)14-20-24-12(7-32-20)16(27)22-9(3)19-26-15(10(4)30-19)18(29)21-5-13-23-11(6-31-13)17(28)25-14/h6-9,14H,5H2,1-4H3,(H,21,29)(H,22,27)(H,25,28)/t9-,14+/m0/s1",CRISVSOALHAQCE-LKFCYVNXSA-N,393060,yes,Nostoc,n.a.,31
CyanoMetDB_1594,Fontonamide,,other linear non-peptide,,C20H22ClNO2,343.1339067,C[C@]1(C=C2[C@H](C[C@H]1Cl)C(C3=C(C2=O)C(=CC=C3)NC=O)(C)C)C=C,"InChI=1S/C20H22ClNO2/c1-5-20(4)10-12-14(9-16(20)21)19(2,3)13-7-6-8-15(22-11-23)17(13)18(12)24/h5-8,10-11,14,16H,1,9H2,2-4H3,(H,22,23)/t14-,16+,20+/m0/s1",NYBCSTOXOBMCIZ-YYFZDKIDSA-N,13820026,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_1595,Barbamide,,other linear non-peptide,,C20H23Cl3N2O2S,460.0545819,CN([C@@H](CC1=CC=CC=C1)C2=NC=CS2)C(/C=C(OC)\C[C@@]([H])(C(Cl)(Cl)Cl)C)=O,"InChI=1S/C20H23Cl3N2O2S/c1-14(20(21,22)23)11-16(27-3)13-18(26)25(2)17(19-24-9-10-28-19)12-15-7-5-4-6-8-15/h4-10,13-14,17H,11-12H2,1-3H3/b16-13+/t14?,17-/m0/s1",UGNRFJOMRFTXSQ-JGQNNITGSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1596,Chlorohyellazole,6-Chlorohyellazol,other linear non-peptide,,C20H16ClNO,321.0920418,CC1=C(C=C2C3=C(C=CC(=C3)Cl)NC2=C1C4=CC=CC=C4)OC,"InChI=1S/C20H16ClNO/c1-12-18(23-2)11-16-15-10-14(21)8-9-17(15)22-20(16)19(12)13-6-4-3-5-7-13/h3-11,22H,1-2H3",ZIOOMUSPLCJTQR-UHFFFAOYSA-N,10947217,yes,Hyella,caespitosa,n.a.
CyanoMetDB_1597,Microguanidine DA368,,other linear non-peptide,Microguanidine,C19H37N4O3,369.2865661,C[N+](C)(C(CCCN(C(N)=N)C/C=C(CCC(C(C)=C)O)\C)C(O)=O)C,"InChI=1S/C19H36N4O3/c1-14(2)17(24)10-9-15(3)11-13-22(19(20)21)12-7-8-16(18(25)26)23(4,5)6/h11,16-17,24H,1,7-10,12-13H2,2-6H3,(H3-,20,21,25,26)/p+1/b15-11+",AKACXVQTFMNJJA-RVDMUPIBSA-O,76324566,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1598,Tumonic acid A,,other linear non-peptide,,C19H33NO4,339.2409585,CCCCCCC/C=C([C@@H](O)[C@H](C(N1CCC[C@H]1C(O)=O)=O)C)\C,"InChI=1S/C19H33NO4/c1-4-5-6-7-8-9-11-14(2)17(21)15(3)18(22)20-13-10-12-16(20)19(23)24/h11,15-17,21H,4-10,12-13H2,1-3H3,(H,23,24)/b14-11+/t15-,16+,17-/m1/s1",JFFANXXIOVCBBG-PYIPWEHNSA-N,10854587,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1599,Micropeptin KT636,Microguanidine KT636,other linear non-peptide,Microguanidine,C19H33N4O14S3,637.11554,CC(C(C1=CC=C(C(COS(=O)(O)=O)=C1)OS(=O)(O)=O)OS(=O)(O)=O)OC(C(CCCNC(N)=N)[N+](C)(C)C)=O,"InChI=1S/C19H32N4O14S3/c1-12(35-18(24)15(23(2,3)4)6-5-9-22-19(20)21)17(37-40(31,32)33)13-7-8-16(36-39(28,29)30)14(10-13)11-34-38(25,26)27/h7-8,10,12,15,17H,5-6,9,11H2,1-4H3,(H6-,20,21,22,25,26,27,28,29,30,31,32,33)/p+1",XIQDCHGBWAVHIQ-UHFFFAOYSA-O,57332916,yes,n.a.,n.a.,n.a.
CyanoMetDB_1600,Caldorin,,other linear non-peptide,,C19H31NO2,305.2354792,CCC[C@@]1(C=C[C@@H]2CC=CC[C@@H]2[C@H]1C(=O)NCCC(C)C)O,"InChI=1S/C19H31NO2/c1-4-11-19(22)12-9-15-7-5-6-8-16(15)17(19)18(21)20-13-10-14(2)3/h5-6,9,12,14-17,22H,4,7-8,10-11,13H2,1-3H3,(H,20,21)/t15-,16-,17-,19-/m0/s1",PLVLPRNEONNYSF-DWRORGKVSA-N,139591244,yes,Caldora,penicillata,n.a.
CyanoMetDB_1601,Makalika ester,,other linear non-peptide,,C19H30ClNO2,339.1965069,CC(C)(C)C(OC([C@@]1([H])N(C)CCC1)=O)CC(C/C=C/C=C/Cl)=C,"InChI=1S/C19H30ClNO2/c1-15(10-7-6-8-12-20)14-17(19(2,3)4)23-18(22)16-11-9-13-21(16)5/h6-8,12,16-17H,1,9-11,13-14H2,2-5H3/b7-6+,12-8+/t16-,17?/m0/s1",ACHIHHQMGVRBRM-GXDSLTBTSA-N,9997346,yes,n.a.,n.a.,n.a.
CyanoMetDB_1602,Hexose-shinorine,,other linear non-peptide,Mycosporine?like amino acids,C19H30N2O13,494.174789,OC[C@]1(O)CC(NCC(OC2C(OC(C(C2O)O)O)CO)=O)=C(C(C1)=NC(CO)C(O)=O)OC,"InChI=1S/C19H30N2O13/c1-32-15-8(2-19(31,7-24)3-9(15)21-10(5-22)17(28)29)20-4-12(25)34-16-11(6-23)33-18(30)14(27)13(16)26/h10-11,13-14,16,18,20,22-24,26-27,30-31H,2-7H2,1H3,(H,28,29)/t10?,11?,13?,14?,16?,18?,19-/m0/s1",CTLCCIQRVCMBEJ-CBTCKCDPSA-N,,no,Scytonema,crispum,UCFS10; UCFS15
CyanoMetDB_1603,478-Da MAA,7-O-(?-arabinopyranosyl)-porphyra-334; Arabinose-bound porphyra-334,other linear non-peptide,Mycosporine?like amino acids,C19H30N2O12,478.1798744,COC1=C(C[C@](O)(CC1=N[C@@H]([C@H](O)C)C(O)=O)CO[C@H]2OC[C@@H]([C@@H]([C@H]2O)O)O)NCC(O)=O,"InChI=1S/C19H30N2O12/c1-8(22)13(17(28)29)21-10-4-19(30,3-9(16(10)31-2)20-5-12(24)25)7-33-18-15(27)14(26)11(23)6-32-18/h8,11,13-15,18,20,22-23,26-27,30H,3-7H2,1-2H3,(H,24,25)(H,28,29)/t8-,11+,13+,14+,15-,18-,19+/m1/s1",MVVWHIALZCCYQH-BMQLVWRBSA-N,,yes,Nostoc,commune,KU002
CyanoMetDB_1604,Dysideaproline D,,other linear peptide,,C19H29Cl2N3O2S,433.1357538,CC(C)CC(=O)N(C)C(CC(C)C(Cl)Cl)C(=O)N1CCCC1C2=NC=CS2,"InChI=1S/C19H29Cl2N3O2S/c1-12(2)10-16(25)23(4)15(11-13(3)17(20)21)19(26)24-8-5-6-14(24)18-22-7-9-27-18/h7,9,12-15,17H,5-6,8,10-11H2,1-4H3",DCNQGUXDRFBFHN-UHFFFAOYSA-N,11091361,yes,n.a.,n.a.,n.a.
CyanoMetDB_1605,Dysideaproline E,,other linear peptide,,C19H29Cl2N3O2S,433.1357538,CC(C)CC(C(=O)N1CCCC1C2=NC=CS2)N(C)C(=O)CC(C)C(Cl)Cl,"InChI=1S/C19H29Cl2N3O2S/c1-12(2)10-15(23(4)16(25)11-13(3)17(20)21)19(26)24-8-5-6-14(24)18-22-7-9-27-18/h7,9,12-15,17H,5-6,8,10-11H2,1-4H3",ANUFTPMAINMTEZ-UHFFFAOYSA-N,11015585,yes,n.a.,n.a.,n.a.
CyanoMetDB_1606,Makalikone ester,,other linear non-peptide,,C19H28ClNO3,353.1757715,CC(C)(C)C(OC([C@@](CC1)([H])N(C)C1=O)=O)CC(C/C=C/C=C/Cl)=C,"InChI=1S/C19H28ClNO3/c1-14(9-7-6-8-12-20)13-16(19(2,3)4)24-18(23)15-10-11-17(22)21(15)5/h6-8,12,15-16H,1,9-11,13H2,2-5H3/b7-6+,12-8+/t15-,16?/m0/s1",PBUCOVRNOZGUGN-OPPOLKRCSA-N,10043668,yes,n.a.,n.a.,n.a.
CyanoMetDB_1607,Taveuniamide A,,other linear non-peptide,Lyngbya toxin (alkaloid),C19H28Cl3NO3,423.1134769,CC(=O)NC(CCCC#C/C=C/Cl)C(CCCCCC(Cl)Cl)C(=O)OC,"InChI=1S/C19H28Cl3NO3/c1-15(24)23-17(12-8-4-3-5-10-14-20)16(19(25)26-2)11-7-6-9-13-18(21)22/h10,14,16-18H,4,6-9,11-13H2,1-2H3,(H,23,24)/b14-10+",GRLUPGAXRLOURI-GXDHUFHOSA-N,11373634,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1608,Dysideaproline F,,other linear peptide,,C19H28Cl3N3O2S,467.0967814,CC(CC(C(=O)N1CCCC1C2=NC=CS2)N(C)C(=O)CC(C)C(Cl)Cl)CCl,"InChI=1S/C19H28Cl3N3O2S/c1-12(11-20)9-15(24(3)16(26)10-13(2)17(21)22)19(27)25-7-4-5-14(25)18-23-6-8-28-18/h6,8,12-15,17H,4-5,7,9-11H2,1-3H3",TXDKKEWSLZFYHQ-UHFFFAOYSA-N,10994307,yes,n.a.,n.a.,n.a.
CyanoMetDB_1609,Phormidinine B,,other linear non-peptide,,C19H27NO2,301.2041791,C[C@H](CCC/C=C/C=C/CCCC1=CC=CC=N1)OC(=O)C,"InChI=1S/C19H27NO2/c1-17(22-18(2)21)13-9-7-5-3-4-6-8-10-14-19-15-11-12-16-20-19/h3-6,11-12,15-17H,7-10,13-14H2,1-2H3/b5-3+,6-4+",LUBYMHPXSXFTJR-GGWOSOGESA-N,,yes,Phormidium,n.a.,n.a.
CyanoMetDB_1610,Taveuniamide B,,other linear non-peptide,Lyngbya toxin (alkaloid),C19H27Cl4NO3,457.0745045,CC(=O)NC(CCCC#CC=C(Cl)Cl)C(CCCCCC(Cl)Cl)C(=O)OC,"InChI=1S/C19H27Cl4NO3/c1-14(25)24-16(11-7-3-4-8-12-17(20)21)15(19(26)27-2)10-6-5-9-13-18(22)23/h12,15-16,18H,3,5-7,9-11,13H2,1-2H3,(H,24,25)",CBOOGDUIMZVPJV-UHFFFAOYSA-N,11224933,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1611,Dysideaproline A,,other linear peptide,,C19H27Cl4N3O2S,501.0578091,CC(CC(C(=O)N1CCCC1C2=NC=CS2)N(C)C(=O)CC(C)C(Cl)Cl)C(Cl)Cl,"InChI=1S/C19H27Cl4N3O2S/c1-11(16(20)21)9-14(25(3)15(27)10-12(2)17(22)23)19(28)26-7-4-5-13(26)18-24-6-8-29-18/h6,8,11-14,16-17H,4-5,7,9-10H2,1-3H3",SYGJZULBETXLGR-UHFFFAOYSA-N,10940079,yes,n.a.,n.a.,n.a.
CyanoMetDB_1612,Mirabazole B,,other linear non-peptide,Mirabazole,C19H26N4S4,438.1040315,CC1=CSC([C@]2(C)CSC([C@]3(C)CSC([C@@]4(C)CSC(C(C)C)=N4)=N3)=N2)=N1,"InChI=1S/C19H26N4S4/c1-11(2)13-21-18(5,8-25-13)15-23-19(6,10-27-15)16-22-17(4,9-26-16)14-20-12(3)7-24-14/h7,11H,8-10H2,1-6H3/t17-,18+,19-/m0/s1",GNDQYOUFXKOCAJ-OTWHNJEPSA-N,10873857,yes,Scytonema,mirabile,BY-8-1
CyanoMetDB_1613,Taveuniamide C,,other linear non-peptide,,C19H25Cl4NO3,455.0588545,CC(=O)NC(CCC/C=C/CC(Cl)Cl)C(CCC#CC=C(Cl)Cl)C(=O)OC,"InChI=1S/C19H25Cl4NO3/c1-14(25)24-16(11-7-3-4-8-12-17(20)21)15(19(26)27-2)10-6-5-9-13-18(22)23/h4,8,13,15-17H,3,6-7,10-12H2,1-2H3,(H,24,25)/b8-4+",FRBZGQKWERYAML-XBXARRHUSA-N,11363084,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1614,Coibacin A,,other linear non-peptide,Lactone,C19H24O2,284.17763,C[C@H]1C[C@@H]1/C=C/C=C/CC/C=C/C=C/[C@@H]2CC=CC(=O)O2,"InChI=1S/C19H24O2/c1-16-15-17(16)11-8-6-4-2-3-5-7-9-12-18-13-10-14-19(20)21-18/h4-12,14,16-18H,2-3,13,15H2,1H3/b6-4+,7-5+,11-8+,12-9+/t16-,17-,18+/m0/s1",DUZRSWWIBKKPQI-TXOHDOJXSA-N,60203968,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_1615,Taveuniamide D,,other linear non-peptide,,C19H23Cl4NO3,453.0432044,CC(=O)NC(CCCC#CCC(Cl)Cl)C(CCC#CC=C(Cl)Cl)C(=O)OC,"InChI=1S/C19H23Cl4NO3/c1-14(25)24-16(11-7-3-4-8-12-17(20)21)15(19(26)27-2)10-6-5-9-13-18(22)23/h13,15-17H,3,6-7,10-12H2,1-2H3,(H,24,25)",PDKKGHRWYLPGPS-UHFFFAOYSA-N,11270993,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1616,Taveuniamide E,,other linear non-peptide,,C19H22Cl3NO3,417.0665267,CC(=O)N[C@H](CCCC#C/C=C/Cl)[C@@H](CCC#CC=C(Cl)Cl)C(=O)OC,"InChI=1S/C19H22Cl3NO3/c1-15(24)23-17(12-8-4-3-5-10-14-20)16(19(25)26-2)11-7-6-9-13-18(21)22/h10,13-14,16-17H,4,7-8,11-12H2,1-2H3,(H,23,24)/b14-10+/t16-,17-/m1/s1",VRCCZDSYIXKCQV-PNUWANSTSA-N,11154328,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1617,Tenuecyclamide A,,Cyclamide,,C19H20N6O4S2,460.0987455,C[C@H]1C2=NC(=C(O2)C)C(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)N1)C)C,"InChI=1S/C19H20N6O4S2/c1-7-17-25-13(10(4)29-17)16(28)22-9(3)19-24-12(6-31-19)15(27)21-8(2)18-23-11(5-30-18)14(26)20-7/h5-9H,1-4H3,(H,20,26)(H,21,27)(H,22,28)/t7-,8+,9-/m0/s1",VSHFFGIAFGCZHA-YIZRAAEISA-N,10837661,yes,Nostoc,spongiaeforme,TAU IL-184-6
CyanoMetDB_1618,Tenuecyclamide B,,Cyclamide,,C19H20N6O4S2,460.0987455,C[C@@H](NC1=O)C2=NC(C(N[C@@H](C3=NC(C(N[C@@H](C)C(O4)=NC1=C4C)=O)=CS3)C)=O)=CS2,"InChI=1S/C19H20N6O4S2/c1-7-17-25-13(10(4)29-17)16(28)22-9(3)19-24-12(6-31-19)15(27)21-8(2)18-23-11(5-30-18)14(26)20-7/h5-9H,1-4H3,(H,20,26)(H,21,27)(H,22,28)/t7-,8?,9?/m0/s1",VSHFFGIAFGCZHA-UEJVZZJDSA-N,24762151,yes,Nostoc,spongiaeforme,TAU IL-184-6
CyanoMetDB_1619,Prenostodione,,other linear non-peptide,,C19H15NO5,337.0950226,COC(=O)/C(=C/C1=CC=C(C=C1)O)/C2=C(C3=CC=CC=C3N2)C(=O)O,"InChI=1S/C19H15NO5/c1-25-19(24)14(10-11-6-8-12(21)9-7-11)17-16(18(22)23)13-4-2-3-5-15(13)20-17/h2-10,20-21H,1H3,(H,22,23)/b14-10+",QYJQBWBZFOEMII-GXDHUFHOSA-N,10735662,yes,n.a.,n.a.,n.a.
CyanoMetDB_1620,Calothrixin A,,other linear non-peptide,Calothrixin,C19H10N2O3,314.0691422,C1=CC=C2C(=C1)C3=C(N2)C(=O)C4=C(C3=O)C=[N+](C5=CC=CC=C54)[O-],"InChI=1S/C19H10N2O3/c22-18-12-9-21(24)14-8-4-2-6-11(14)15(12)19(23)17-16(18)10-5-1-3-7-13(10)20-17/h1-9,20H",CMDAFIAGTOCRGL-UHFFFAOYSA-N,9926867,yes,Calothrix,n.a.,n.a.
CyanoMetDB_1621,Calothrixin B,,other linear non-peptide,,C19H10N2O2,298.0742276,C1=CC=C2C(=C1)C3=C(N2)C(=O)C4=C(C3=O)C=NC5=CC=CC=C54,"InChI=1S/C19H10N2O2/c22-18-12-9-20-13-7-3-1-5-10(13)15(12)19(23)17-16(18)11-6-2-4-8-14(11)21-17/h1-9,21H",CCPDIHKLISWESE-UHFFFAOYSA-N,9817721,yes,Calothrix,n.a.,n.a.
CyanoMetDB_1622,Ambigol B,,other linear non-peptide,,C18H8Cl6O3,481.8604603,C1=CC(=C(C=C1Cl)Cl)OC2=C(C(=C(C=C2Cl)Cl)OC3=C(C=C(C=C3)Cl)Cl)O,"InChI=1S/C18H8Cl6O3/c19-8-1-3-14(10(21)5-8)26-17-12(23)7-13(24)18(16(17)25)27-15-4-2-9(20)6-11(15)22/h1-7,25H",GRQNRKQXLLLWGN-UHFFFAOYSA-N,475342,yes,Fischerella,ambigua,No 108b
CyanoMetDB_1623,Ambigol A,,other linear non-peptide,,C18H8Cl6O3,481.8604603,C1=CC(=C(C=C1Cl)Cl)OC2=C(C=C(C(=C2O)C3=CC(=CC(=C3O)Cl)Cl)Cl)Cl,"InChI=1S/C18H8Cl6O3/c19-7-1-2-14(10(21)4-7)27-18-13(24)6-11(22)15(17(18)26)9-3-8(20)5-12(23)16(9)25/h1-6,25-26H",AHLSIYMTIQLHAO-UHFFFAOYSA-N,475341,yes,Fischerella,ambigua,No 108b
CyanoMetDB_1624,Ambigol C,,other linear non-peptide,,C18H8Cl6O3,481.8604603,C1=CC(=C(C=C1Cl)Cl)OC2=CC(=C(C(=C2Cl)O)Cl)OC3=C(C=C(C=C3)Cl)Cl,"InChI=1S/C18H8Cl6O3/c19-8-1-3-12(10(21)5-8)26-14-7-15(17(24)18(25)16(14)23)27-13-4-2-9(20)6-11(13)22/h1-7,25H",WVDKKFQPVUPWQK-UHFFFAOYSA-N,5276614,yes,Fischerella,ambigua,No 108b
CyanoMetDB_1625,2-acyloxyethylphosphonate,2-acyloxyethylphosphonate analogue 1,other linear non-peptide,,C18H37O5P,364.2378613,CCCCCCCCCCCCCCCC(=O)OCCP(=O)(O)O,"InChI=1S/C18H37O5P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(19)23-16-17-24(20,21)22/h2-17H2,1H3,(H2,20,21,22)",DBJIDTSPKCDNHE-UHFFFAOYSA-N,21162963,yes,Aphanizomenon,flos aquae,n.a.
CyanoMetDB_1626,Circinamide,,other linear peptide,,C18H34N4O5,386.2529202,CC(C[C@H](NC([C@@H]1[C@@H](C(O)=O)O1)=O)C(N(CCCCN)CCCCN)=O)C,"InChI=1S/C18H34N4O5/c1-12(2)11-13(21-16(23)14-15(27-14)18(25)26)17(24)22(9-5-3-7-19)10-6-4-8-20/h12-15H,3-11,19-20H2,1-2H3,(H,21,23)(H,25,26)/t13-,14-,15-/m0/s1",QQVXQLBKFHMJOV-KKUMJFAQSA-N,21601944,yes,Anabaena,circinalis,NIES 41
CyanoMetDB_1627,Malyngic acid,,other linear non-peptide,,C18H32O5,328.2249741,CC/C=C\C[C@@H]([C@@H](/C=C/[C@H](CCCCCCCC(=O)O)O)O)O,"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)/b7-3-,14-13+/t15-,16-,17+/m0/s1",MKYUCBXUUSZMQB-OADLNGDBSA-N,9949348,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1628,Puna’auic acid,,other linear non-peptide,,C18H32O4,312.2300595,OC(CCCCCCCC([H])=[C@]=C([H])[C@@H](O)[C@@H](O)CCCCC)=O,"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/h8,14,16-17,19-20H,2-7,9-10,12-13,15H2,1H3,(H,21,22)/t11-,16-,17+/m0/s1",FIFLDFYODFCEFA-MZPVMMEZSA-N,,yes,Pseudanabaena,n.a.,n.a.
CyanoMetDB_1629,7-methoxy-9-methylhexadecadienoic acid,,other linear non-peptide,,C18H32O3,296.2351449,CCCCCCC/C(=C/C(C/C=C/CCC(=O)O)OC)/C,"InChI=1S/C18H32O3/c1-4-5-6-7-9-12-16(2)15-17(21-3)13-10-8-11-14-18(19)20/h8,10,15,17H,4-7,9,11-14H2,1-3H3,(H,19,20)/b10-8+,16-15+",RDADKZPYWXITRK-ZNNSQMGQSA-N,21773182,yes,Lyngbya,aestuarii,n.a.
CyanoMetDB_1630,Glucosylsucrose,,other linear non-peptide,,C18H32O16,504.169035,C(C1[C@@H]([C@H]([C@](O1)(CO)OC2C(C(C(C(O2)CO)O)O)O[C@@H]3[C@H](C([C@@H](C(O3)CO)O)O)O)O)O)O,"InChI=1S/C18H32O16/c19-1-5-8(23)11(26)13(28)16(30-5)32-14-12(27)9(24)6(2-20)31-17(14)34-18(4-22)15(29)10(25)7(3-21)33-18/h5-17,19-29H,1-4H2/t5?,6?,7?,8-,9?,10+,11?,12?,13+,14?,15-,16-,17?,18+/m1/s1",LNRUEZIDUKQGRH-QZYKWMSJSA-N,139587107,yes,Nostoc,ellipsosporum,n.a.
CyanoMetDB_1631,Tumonoic acid E,,other linear non-peptide,,C18H31NO4,325.2253085,CCCCC(/C=C([C@H](O)[C@@H](C(N1CCC[C@H]1C(O)=O)=O)C)\C)C,"InChI=1S/C18H31NO4/c1-5-6-8-12(2)11-13(3)16(20)14(4)17(21)19-10-7-9-15(19)18(22)23/h11-12,14-16,20H,5-10H2,1-4H3,(H,22,23)/b13-11+/t12?,14-,15-,16-/m0/s1",UUFOMZNZQYHUJH-UKUODDPASA-N,25058107,yes,Blennothrix,cantharidosmum,n.a.
CyanoMetDB_1632,"15,16-dihydrosacrolide A",,other cyclic non-peptide,,C18H30O4,310.2144094,CCCCC[C@@H]1C(=O)/C=C/[C@@H](CCCCCCCC(=O)O1)O,"InChI=1S/C18H30O4/c1-2-3-7-11-17-16(20)14-13-15(19)10-8-5-4-6-9-12-18(21)22-17/h13-15,17,19H,2-12H2,1H3/b14-13+/t15-,17-/m1/s1",JJQOCZNUTZIGAX-RCKIBTJTSA-N,132571558,yes,Aphanothece,sacrum,n.a.
CyanoMetDB_1633,Hexose-bound palythine-treonine,(450-Da MAA),other linear non-peptide,Mycosporine?like amino acids,C18H30N2O11,450.1849598,OC(C(NC(C[C@]1(COC2OC(C(C(C2O)O)O)CO)O)=C(OC)C(C1)=N)C(O)C)=O,"InChI=1S/C18H30N2O11/c1-7(22)11(16(26)27)20-9-4-18(28,3-8(19)15(9)29-2)6-30-17-14(25)13(24)12(23)10(5-21)31-17/h7,10-14,17,19-25,28H,3-6H2,1-2H3,(H,26,27)/t7?,10?,11?,12?,13?,14?,17?,18-/m1/s1",FVSNIBKIWCAOSC-SQSQOOCZSA-N,,yes,Nostoc,commune,n.a.
CyanoMetDB_1634,Hoshinolactam,,other linear non-peptide,,C18H29NO3,307.2147438,CCC[C@H]1C[C@@H]1/C=C/C(=O)O[C@@H]2[C@H](C(=O)N[C@H]2CC(C)C)C,"InChI=1S/C18H29NO3/c1-5-6-13-10-14(13)7-8-16(20)22-17-12(4)18(21)19-15(17)9-11(2)3/h7-8,11-15,17H,5-6,9-10H2,1-4H3,(H,19,21)/b8-7+/t12-,13+,14+,15+,17-/m1/s1",BBMBCHAXOBFQPC-IBGZMIKNSA-N,132506172,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_1635,Sacrolide A,,other cyclic non-peptide,,C18H28O4,308.1987594,CC/C=C\C[C@@H]1C(/C=C/[C@@H](CCCCCCCC(O1)=O)O)=O,"InChI=1S/C18H28O4/c1-2-3-7-11-17-16(20)14-13-15(19)10-8-5-4-6-9-12-18(21)22-17/h3,7,13-15,17,19H,2,4-6,8-12H2,1H3/b7-3-,14-13+/t15-,17-/m1/s1",UYLKXNMQPMQPNW-USYDTVFMSA-N,101883941,yes,Aphanothece,sacrum,n.a.
CyanoMetDB_1636,9-epi-sacrolide A,J3.642.033B,other cyclic non-peptide,,C18H28O4,308.1987594,O=C(O[C@@H]1C/C=C\CC)CCCCCCC[C@]([H])(O)/C=C/C1=O,"InChI=1S/C18H28O4/c1-2-3-7-11-17-16(20)14-13-15(19)10-8-5-4-6-9-12-18(21)22-17/h3,7,13-15,17,19H,2,4-6,8-12H2,1H3/b7-3-,14-13+/t15-,17+/m0/s1",UYLKXNMQPMQPNW-JAYJKSFCSA-N,132571557,yes,Aphanothece,sacrum,n.a.
CyanoMetDB_1638,Gloeolactone,,other linear non-peptide,,C18H28O3,292.2038448,CC/C=C\C[C@@H]1[C@H](O1)/C=C/C2CCCCCCCC(=O)O2,"InChI=1S/C18H28O3/c1-2-3-7-11-16-17(21-16)14-13-15-10-8-5-4-6-9-12-18(19)20-15/h3,7,13-17H,2,4-6,8-12H2,1H3/b7-3-,14-13+/t15?,16-,17-/m1/s1",NQKZDMRQSOUOJH-OULGUUDZSA-N,10589748,yes,Gloeotrichia,n.a.,n.a.
CyanoMetDB_1639,Mueggelone,,other linear non-peptide,,C18H28O3,292.20384,CC/C=C\C[C@H]1[C@@H](O1)/C=C/C2CCCCCCCC(=O)O2,"InChI=1S/C18H28O3/c1-2-3-7-11-16-17(21-16)14-13-15-10-8-5-4-6-9-12-18(19)20-15/h3,7,13-17H,2,4-6,8-12H2,1H3/b7-3-,14-13+/t15?,16-,17-/m0/s1",NQKZDMRQSOUOJH-RMOHKNCISA-N,10266359,yes,Aphanizomenon,flos aquae,n.a.
CyanoMetDB_1640,Pentose-bound shinorine,(464-Da MAA),other linear non-peptide,Mycosporine?like amino acids,C18H28N2O12,464.1642244,COC1=C(NCC(O)=O)C[C@@](CC1=NC(CO)C(O)=O)(O)COC2OC(C(C2O)O)CO,"InChI=1S/C18H28N2O12/c1-30-15-8(19-4-12(23)24)2-18(29,3-9(15)20-10(5-21)16(27)28)7-31-17-14(26)13(25)11(6-22)32-17/h10-11,13-14,17,19,21-22,25-26,29H,2-7H2,1H3,(H,23,24)(H,27,28)/t10?,11?,13?,14?,17?,18-/m0/s1",VCXSIVOHNFBHSM-LOHAKXRJSA-N,,yes,Nostoc,commune,KU002
CyanoMetDB_1641,Microcystbiopterin A,,other linear non-peptide,,C18H27N5O8,441.1859628,C[C@@H]([C@@H](C1=CN=C2C(=N1)C(=O)NC(=N2)N)O)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO)OC)OC)OC,"InChI=1S/C18H27N5O8/c1-7(11(25)8-5-20-15-10(21-8)16(26)23-18(19)22-15)30-17-14(29-4)13(28-3)12(27-2)9(6-24)31-17/h5,7,9,11-14,17,24-25H,6H2,1-4H3,(H3,19,20,22,23,26)/t7-,9+,11-,12+,13-,14-,17-/m0/s1",DGKUISNXCLDEPS-PJPSGOJHSA-N,139588178,yes,Microcystis,n.a.,IL-337
CyanoMetDB_1642,Mirabimide E,,other linear non-peptide,Microcolin/Mirabimide,C18H26Cl4N2O5,490.0595827,C[C@H]1C(=CC(=O)N1C(=O)[C@H](C)[C@@H](CCCCC(C(C)(Cl)Cl)(Cl)Cl)OC(=O)N)OC,"InChI=1S/C18H26Cl4N2O5/c1-10(15(26)24-11(2)13(28-4)9-14(24)25)12(29-16(23)27)7-5-6-8-18(21,22)17(3,19)20/h9-12H,5-8H2,1-4H3,(H2,23,27)/t10-,11+,12-/m1/s1",RYDJXLMYSWZJPD-GRYCIOLGSA-N,10458357,yes,Scytonema,mirabilis   , UH  BY-8-1
CyanoMetDB_1643,Dysideaproline C,,other linear peptide,,C18H25Cl4N3O2S,487.0421586,CC(C(Cl)Cl)CC(NC(C(N1CCCC1C2=NC=CS2)=O)CC(C)C(Cl)Cl)=O,"InChI=1S/C18H25Cl4N3O2S/c1-10(15(19)20)8-12(24-14(26)9-11(2)16(21)22)18(27)25-6-3-4-13(25)17-23-5-7-28-17/h5,7,10-13,15-16H,3-4,6,8-9H2,1-2H3,(H,24,26)",XBWIEMGIJNHGIK-UHFFFAOYSA-N,10972995,yes,n.a.,n.a.,n.a.
CyanoMetDB_1644,Mirabazole C,,other linear non-peptide,Mirabazole,C18H24N4S4,424.0883815,CC(C1=N[C@](C2=N[C@@](C3=N[C@@](C4=NC=CS4)(C)CS3)(C)CS2)(C)CS1)C,"InChI=1S/C18H24N4S4/c1-11(2)12-20-17(4,8-24-12)14-22-18(5,10-26-14)15-21-16(3,9-25-15)13-19-6-7-23-13/h6-7,11H,8-10H2,1-5H3/t16-,17+,18-/m0/s1",AAZNLXXTBVTBKQ-KSZLIROESA-N,10895165,yes,Scytonema,mirabile,BY-8-1
CyanoMetDB_1645,Not named CyanoMetDB_1645,,other linear non-peptide,,C18H24ClNO5,369.1343006,CC1=C2C(=CC(=C1)O[C@H]3[C@@H]([C@H]([C@@H](CO3)OC)O)OC)/C(=C/Cl)/CCN2,"InChI=1S/C18H24ClNO5/c1-10-6-12(7-13-11(8-19)4-5-20-15(10)13)25-18-17(23-3)16(21)14(22-2)9-24-18/h6-8,14,16-18,20-21H,4-5,9H2,1-3H3/b11-8+/t14-,16+,17-,18+/m1/s1",YDKCHRURWAZULR-KECAABKUSA-N,11036033,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1646,"4,8-dimethyl-6-O-(2’,4’-di-O-methyl-?-D-xylopyranosyl)hydroxyquinoline",,other linear non-peptide,,C18H23NO5,333.1576228,CC1=C2C=C(C=C(C2=NC=C1)C)O[C@H]3[C@@H]([C@H]([C@@H](CO3)OC)O)OC,"InChI=1S/C18H23NO5/c1-10-5-6-19-15-11(2)7-12(8-13(10)15)24-18-17(22-4)16(20)14(21-3)9-23-18/h5-8,14,16-18,20H,9H2,1-4H3/t14-,16+,17-,18+/m1/s1",HZFIBZVPZZVOBC-SPUZQDLCSA-N,21601949,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1648,Didehydromirabazole A,,other linear non-peptide,Mirabazole,C18H22N4S4,422.0727314,CC1=CSC(=N1)C2(CSC(=N2)C3=CSC(=N3)C4(CSC(=N4)C(C)C)C)C,"InChI=1S/C18H22N4S4/c1-10(2)13-21-18(5,8-25-13)16-20-12(7-24-16)14-22-17(4,9-26-14)15-19-11(3)6-23-15/h6-7,10H,8-9H2,1-5H3",BDZRADRTDBWWNO-UHFFFAOYSA-N,14863198,yes,Scytonema,mirabile,BY-8-1
CyanoMetDB_1649,Takinolide seco-acid,,other linear non-peptide,,C17H34O4,302.2457096,OC[C@@](CCCCCCCCCCC)(CCCC(O)=O)O,"InChI=1S/C17H34O4/c1-2-3-4-5-6-7-8-9-10-13-17(21,15-18)14-11-12-16(19)20/h18,21H,2-15H2,1H3,(H,19,20)/t17-/m1/s1",JUQSZYLSJUZCDT-QGZVFWFLSA-N,24770830,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1650,Tanikolide,,other linear non-peptide,,C17H32O3,284.2351449,CCCCCCCCCCC[C@@]1(CCCC(=O)O1)CO,"InChI=1S/C17H32O3/c1-2-3-4-5-6-7-8-9-10-13-17(15-18)14-11-12-16(19)20-17/h18H,2-15H2,1H3/t17-/m1/s1",NLAYXWYCDWDTBF-QGZVFWFLSA-N,5276592,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1651,Hexose-palythine-serine,,other linear non-peptide,Mycosporine?like amino acids,C17H28N2O11,436.1693097,OC1C(OC(C(C1O)OC[C@]2(O)CC(NC(CO)C(O)=O)=C(C(C2)=N)OC)CO)O,"InChI=1S/C17H28N2O11/c1-28-13-7(18)2-17(27,3-8(13)19-9(4-20)15(24)25)6-29-14-10(5-21)30-16(26)12(23)11(14)22/h9-12,14,16,18-23,26-27H,2-6H2,1H3,(H,24,25)/t9?,10?,11?,12?,14?,16?,17-/m1/s1",FCWJVJDRWPHMRT-QLYLPIRJSA-N,,no,Scytonema,crispum,UCFS10; UCFS15
CyanoMetDB_1653,"8-Acetamido-1,1,15,15-tetrachloropentadeca-3-yne",,other linear non-peptide,,C17H27Cl4NO,401.0846753,CC(=O)NC(CCCCCCC(Cl)Cl)CCCC#CCC(Cl)Cl,"InChI=1S/C17H27Cl4NO/c1-14(23)22-15(10-6-2-4-8-12-16(18)19)11-7-3-5-9-13-17(20)21/h15-17H,2-4,6-8,10-13H2,1H3,(H,22,23)",XXUGBSMDILTLJG-UHFFFAOYSA-N,10982307,yes,Microcoleus,lyngbyaceus,n.a.
CyanoMetDB_1654,Koshikalide,,other linear non-peptide,,C17H26O4,294.1831093,C/C/1=C/C/C(=C\C(=O)O[C@H](C[C@@H](C=CCC1)OC)CO)/C,"InChI=1S/C17H26O4/c1-13-6-4-5-7-15(20-3)11-16(12-18)21-17(19)10-14(2)9-8-13/h5,7-8,10,15-16,18H,4,6,9,11-12H2,1-3H3/b7-5?,13-8-,14-10-/t15-,16-/m1/s1",QFQKOFIKPPGGPV-NKXUIWCXSA-N,139585071,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_1656,"8-Acetamido-1,1,15,15,15-pentachloropentadeca-3-yne",,other linear non-peptide,,C17H26Cl5NO,435.045703,CC(=O)NC(CCCCCCC(Cl)(Cl)Cl)CCCC#CCC(Cl)Cl,"InChI=1S/C17H26Cl5NO/c1-14(24)23-15(10-6-2-3-8-12-16(18)19)11-7-4-5-9-13-17(20,21)22/h15-16H,2,4-7,9-13H2,1H3,(H,23,24)",VCFLVBCNLOSBCN-UHFFFAOYSA-N,10873828,yes,Microcoleus,lyngbyaceus,n.a.
CyanoMetDB_1657,Taveuniamide F,,other linear non-peptide,,C17H26Cl3NO,365.1079976,CC(=O)NC(CCCCCCC(Cl)Cl)CCCC#C/C=C/Cl,"InChI=1S/C17H26Cl3NO/c1-15(22)21-16(11-7-3-2-6-10-14-18)12-8-4-5-9-13-17(19)20/h10,14,16-17H,3-5,7-9,11-13H2,1H3,(H,21,22)/b14-10+",ARWYVRRMHQNULF-GXDHUFHOSA-N,11233931,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1658,Phormidinine A,,other linear non-peptide,,C17H25NO,259.1936144,C[C@H](CCC/C=C/C=C/CCCC1=CC=CC=N1)O,"InChI=1S/C17H25NO/c1-16(19)12-8-6-4-2-3-5-7-9-13-17-14-10-11-15-18-17/h2-5,10-11,14-16,19H,6-9,12-13H2,1H3/b4-2+,5-3+",KUXJKPYGNYWXQB-ZUVMSYQZSA-N,117846449,yes,Phormidium,n.a.,n.a.
CyanoMetDB_1659,Microcystbiopterin D,,other linear non-peptide,,C17H25N5O9,443.1652274,C[C@@H]([C@@H](C1=CN=C2C(=N1)C(=O)NC(=N2)N)O)O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)C(CO)O)O)OC)O,"InChI=1S/C17H25N5O9/c1-5(9(25)6-3-19-14-8(20-6)15(28)22-17(18)21-14)30-16-11(27)13(29-2)10(26)12(31-16)7(24)4-23/h3,5,7,9-13,16,23-27H,4H2,1-2H3,(H3,18,19,21,22,28)/t5-,7?,9-,10+,11-,12+,13-,16-/m0/s1",GZGGCZMRCDEKCK-NEWBKQJXSA-N,139586872,yes,Microcystis,n.a.,IL-337
CyanoMetDB_1660,7-Deoxy-desulfo-12-acetylcylindrospermopsin,,other linear non-peptide,Cylindrospermopsin,C17H23N5O4,361.1750043,CC(O[C@@H]1[C@H](C)[C@]2([H])N(C(N[C@](CC(NC(N3)=O)=CC3=O)([H])C4)=NC2)[C@]4([H])C1)=O,"InChI=1S/C17H23N5O4/c1-8-13-7-18-16-19-10(3-11-5-15(24)21-17(25)20-11)4-12(22(13)16)6-14(8)26-9(2)23/h5,8,10,12-14H,3-4,6-7H2,1-2H3,(H,18,19)(H2,20,21,24,25)/t8-,10+,12+,13-,14+/m1/s1",MYFWFGYYCFRRTK-VMOOEMLUSA-N,146683901,yes,Cylindrospermopsis,raciborskii,n.a.
CyanoMetDB_1661,Pseudodysidenin,,other linear peptide,,C17H23Cl6N3O2S,542.9642144,C[C@@H](C[C@@H](C(=O)N(C)[C@@H](C)C1=NC=CS1)NC(=O)C[C@H](C)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,"InChI=1S/C17H23Cl6N3O2S/c1-9(16(18,19)20)7-12(25-13(27)8-10(2)17(21,22)23)15(28)26(4)11(3)14-24-5-6-29-14/h5-6,9-12H,7-8H2,1-4H3,(H,25,27)/t9-,10-,11-,12-/m0/s1",MBVQTLXBQHZLRO-BJDJZHNGSA-N,10745152,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1663,Herbamide B,,other linear non-peptide,,C17H23Cl3N2OS,408.0596676,CC(C)[C@@H](C1=NC=CS1)NC(/C(C)=C/C=C/C[C@H](C)C(Cl)(Cl)Cl)=O,"InChI=1S/C17H23Cl3N2OS/c1-11(2)14(16-21-9-10-24-16)22-15(23)12(3)7-5-6-8-13(4)17(18,19)20/h5-7,9-11,13-14H,8H2,1-4H3,(H,22,23)/b6-5+,12-7+/t13-,14-/m0/s1",SASMNYHOQIJNIJ-CBZHAUGTSA-N,44627702,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1664,Anaephene B,,other linear non-peptide,Alkylphenol,C17H22O,242.1670653,OC1=CC=CC(CCCC/C=C/CCCC#C)=C1,"InChI=1S/C17H22O/c1-2-3-4-5-6-7-8-9-10-12-16-13-11-14-17(18)15-16/h1,6-7,11,13-15,18H,3-5,8-10,12H2/b7-6+",ONAACYBLFDMUOW-VOTSOKGWSA-N,146683877,yes,Hormoscilla,n.a.,n.a.
CyanoMetDB_1666,"8-Acetamido-1,1,1,15,15-pentachloropentadeca-3,12-diyne",,other linear non-peptide,,C17H22Cl5NO,431.0144028,CC(=O)NC(CCCC#CCC(Cl)Cl)CCCC#CCC(Cl)(Cl)Cl,"InChI=1S/C17H22Cl5NO/c1-14(24)23-15(10-6-2-3-8-12-16(18)19)11-7-4-5-9-13-17(20,21)22/h15-16H,2,4,6-7,10-13H2,1H3,(H,23,24)",PHCUUSBWIFRVFM-UHFFFAOYSA-N,11080564,yes,Microcoleus,lyngbyaceus,n.a.
CyanoMetDB_1667,Taveuniamide K,,other linear non-peptide,,C17H22Cl3NO,361.0766974,CC(=O)NC(CCC/C=C\C=C(Cl)Cl)CCCC#C/C=C\Cl,"InChI=1S/C17H22Cl3NO/c1-15(22)21-16(11-7-3-2-6-10-14-18)12-8-4-5-9-13-17(19)20/h5,9-10,13-14,16H,3-4,7-8,11-12H2,1H3,(H,21,22)/b9-5-,14-10-",KHCZTRMIJAMOLW-WIIOUWJKSA-N,11739976,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1669,"8-Acetamido-1,1,1,15,15,15-hexachloropentadeca-3,12-diyne",Acetamino-hexachloropentadecadiyne,other linear non-peptide,Zacetamide,C17H21Cl6NO,464.9754305,ClC(CC#CCCCC(NC(C)=O)CCCC#CCC(Cl)(Cl)Cl)(Cl)Cl,"InChI=1S/C17H21Cl6NO/c1-14(25)24-15(10-6-2-4-8-12-16(18,19)20)11-7-3-5-9-13-17(21,22)23/h15H,2-3,6-7,10-13H2,1H3,(H,24,25)",LRVUEDNFXURUBM-UHFFFAOYSA-N,11005154,yes,Microcoleus,lyngbyaceus,n.a.
CyanoMetDB_1670,Taveuniamide G,,other linear non-peptide,,C17H21Cl4NO,395.0377251,CC(=O)NC(CCCC#CCC(Cl)Cl)CCCC#CC=C(Cl)Cl,"InChI=1S/C17H21Cl4NO/c1-14(23)22-15(10-6-2-4-8-12-16(18)19)11-7-3-5-9-13-17(20)21/h12,15,17H,2-3,6-7,10-11,13H2,1H3,(H,22,23)",UJHURGUGOWAGMH-UHFFFAOYSA-N,21777622,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1671,Trichothiazole A,,other linear non-peptide,,C17H21Cl2NS,341.0771763,Cl/C=C(C/C=C/Cl)\CCC1=CSC(CCCCCC#C)=N1,"InChI=1S/C17H21Cl2NS/c1-2-3-4-5-6-9-17-20-16(14-21-17)11-10-15(13-19)8-7-12-18/h1,7,12-14H,3-6,8-11H2/b12-7+,15-13-",RRELOQVRCVAZDA-HMHGSNSKSA-N,139591222,yes,n.a.,n.a.,n.a.
CyanoMetDB_1672,Taveuniamide H,,other linear non-peptide,,C17H21Cl2NO,325.1000197,CC(=O)NC(CCCC#C/C=C/Cl)CCCC#C/C=C/Cl,"InChI=1S/C17H21Cl2NO/c1-16(21)20-17(12-8-4-2-6-10-14-18)13-9-5-3-7-11-15-19/h10-11,14-15,17H,4-5,8-9,12-13H2,1H3,(H,20,21)/b14-10+,15-11+",BKSORQIXSBADRL-WFYKWJGLSA-N,11151529,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1673,Taveuniamide I,,other linear non-peptide,,C17H20Cl3NO,359.0610474,CC(=O)NC(CCCC#C/C=C/Cl)CCCC#CC=C(Cl)Cl,"InChI=1S/C17H20Cl3NO/c1-15(22)21-16(11-7-3-2-6-10-14-18)12-8-4-5-9-13-17(19)20/h10,13-14,16H,3-4,7-8,11-12H2,1H3,(H,21,22)/b14-10+",NBTAVNCNFWJBLH-GXDHUFHOSA-N,11360404,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1674,Taveuniamide J,,other linear non-peptide,,C17H19Cl4NO,393.022075,CC(=O)NC(CCCC#CC=C(Cl)Cl)CCCC#CC=C(Cl)Cl,"InChI=1S/C17H19Cl4NO/c1-14(23)22-15(10-6-2-4-8-12-16(18)19)11-7-3-5-9-13-17(20)21/h12-13,15H,2-3,6-7,10-11H2,1H3,(H,22,23)",QCMCIUCOCAPEJI-UHFFFAOYSA-N,11463564,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1675,Malyngolide,,other linear non-peptide,,C16H30O3,270.2194948,CCCCCCCCCC1(CCC(C(=O)O1)C)CO,"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",OEXPVULGTKWKEH-UHFFFAOYSA-N,10423283,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1676,Tumonoic acid D,,other linear non-peptide,,C16H29NO3,283.2147438,CCCCCCCC[C@H](C)C(=O)N1CCC[C@H]1C(=O)O,"InChI=1S/C16H29NO3/c1-3-4-5-6-7-8-10-13(2)15(18)17-12-9-11-14(17)16(19)20/h13-14H,3-12H2,1-2H3,(H,19,20)/t13-,14-/m0/s1",HSLFSTFEVGMTFF-KBPBESRZSA-N,25111481,yes,Blennothrix,cantharidosmum,n.a.
CyanoMetDB_1677,epi-tumonoic acid D,,other linear non-peptide,,C16H29NO3,283.2147438,CCCCCCCC[C@@H](C(N1CCC[C@@H]1C(O)=O)=O)C,"InChI=1S/C16H29NO3/c1-3-4-5-6-7-8-10-13(2)15(18)17-12-9-11-14(17)16(19)20/h13-14H,3-12H2,1-2H3,(H,19,20)/t13-,14?/m1/s1",HSLFSTFEVGMTFF-KWCCSABGSA-N,,yes,Blennothrix,cantharidosmum,n.a.
CyanoMetDB_1678,Schizokinen,,other linear non-peptide,Siderophore,C16H28N4O9,420.1856285,O=C(CC(CC(NCCCN(C(C)=O)O)=O)(C(O)=O)O)NCCCN(C(C)=O)O,"InChI=1S/C16H28N4O9/c1-11(21)19(28)7-3-5-17-13(23)9-16(27,15(25)26)10-14(24)18-6-4-8-20(29)12(2)22/h27-29H,3-10H2,1-2H3,(H,17,23)(H,18,24)(H,25,26)",YILWWVUXGMGOAM-UHFFFAOYSA-N,3082425,no,Anabaena,                                                                                                                                                                                                                                                                                                                          ,ATCC 27898; PCC 7120         
CyanoMetDB_1679,Microcystbiopterin B,,other linear non-peptide,,C16H23N5O8,413.1546627,C[C@@H]([C@@H](C1=CN=C2C(=N1)C(=O)NC(=N2)N)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)OC)O,"InChI=1S/C16H23N5O8/c1-5(28-15-11(25)12(27-2)10(24)7(4-22)29-15)9(23)6-3-18-13-8(19-6)14(26)21-16(17)20-13/h3,5,7,9-12,15,22-25H,4H2,1-2H3,(H3,17,18,20,21,26)/t5-,7+,9-,10+,11+,12-,15-/m0/s1",ZQLTUOZZFIPZMO-DZFNSMJESA-N,139584151,yes,Microcystis,n.a.,IL-337
CyanoMetDB_1680,Microcystbiopterin E,,other linear non-peptide,,C16H23N5O8,413.1546627,C[C@@H]([C@@H](C1=CN=C2C(=N1)C(=O)NC(=N2)N)O)O[C@@H]3[C@@H]([C@H]([C@@H]([C@H](O3)COC)O)O)O,"InChI=1S/C16H23N5O8/c1-5(28-15-12(25)11(24)10(23)7(29-15)4-27-2)9(22)6-3-18-13-8(19-6)14(26)21-16(17)20-13/h3,5,7,9-12,15,22-25H,4H2,1-2H3,(H3,17,18,20,21,26)/t5-,7+,9-,10+,11-,12+,15-/m0/s1",CARGJJGBCUDXAL-WOUHNLLESA-N,139584565,yes,Microcystis,n.a.,IL-337
CyanoMetDB_1681,Microcystbiopterin C,,other linear non-peptide,,C16H23N5O7,397.1597481,C[C@@H]1[C@H]([C@@H]([C@@H]([C@H](O1)O[C@@H](C)[C@@H](C2=CN=C3C(=N2)C(=O)NC(=N3)N)O)O)OC)O,"InChI=1S/C16H23N5O7/c1-5(27-15-11(24)12(26-3)10(23)6(2)28-15)9(22)7-4-18-13-8(19-7)14(25)21-16(17)20-13/h4-6,9-12,15,22-24H,1-3H3,(H3,17,18,20,21,25)/t5-,6+,9-,10+,11-,12-,15-/m0/s1",BPYVAMUCYHHHRM-GGOUXBKLSA-N,139583914,yes,Microcystis,n.a.,IL-337
CyanoMetDB_1682,Nordysidenin,,other linear peptide,,C16H21Cl6N3O2S,528.9485643,C[C@@H](C[C@@H](C(=O)N[C@@H](C)C1=NC=CS1)NC(=O)C[C@H](C)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,"InChI=1S/C16H21Cl6N3O2S/c1-8(15(17,18)19)6-11(25-12(26)7-9(2)16(20,21)22)13(27)24-10(3)14-23-4-5-28-14/h4-5,8-11H,6-7H2,1-3H3,(H,24,27)(H,25,26)/t8-,9-,10-,11-/m0/s1",JXAGQUPIAAXRDS-NAKRPEOUSA-N,10721006,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1683,Barbaleucamide A,,other linear non-peptide,,C16H20Cl6N2O2S,513.9376653,CC(CC(OC)=CC(NC(CC(C)C(Cl)(Cl)Cl)C1=NC=CS1)=O)C(Cl)(Cl)Cl,"InChI=1S/C16H20Cl6N2O2S/c1-9(15(17,18)19)6-11(26-3)8-13(25)24-12(14-23-4-5-27-14)7-10(2)16(20,21)22/h4-5,8-10,12H,6-7H2,1-3H3,(H,24,25)/b11-8+",ZQNZRXUXPBMKEO-DHZHZOJOSA-N,11038600,yes,n.a.,n.a.,n.a.
CyanoMetDB_1684,Tetrahydroindol 5,,other linear non-peptide,,C16H17N5O3,327.1331394,CN(C=C1C=O)C2=C1C(N3C=NC4=C3NC=NC4=O)CC(O)C2C,"InChI=1S/C16H17N5O3/c1-8-11(23)3-10(12-9(5-22)4-20(2)14(8)12)21-7-19-13-15(21)17-6-18-16(13)24/h4-8,10-11,23H,3H2,1-2H3,(H,17,18,24)",HIODDSQIKRMOBZ-UHFFFAOYSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1685,6-Acetamidotridecane,Acetamino-tridecane,other linear non-peptide,Zacetamide,C15H31NO,241.2405646,CCCCCCCC(CCCCC)NC(=O)C,"InChI=1S/C15H31NO/c1-4-6-8-9-11-13-15(16-14(3)17)12-10-7-5-2/h15H,4-13H2,1-3H3,(H,16,17)",RMTOFKWPCZJSGD-UHFFFAOYSA-N,11770595,yes,Microcoleus,lyngbyaceus,n.a.
CyanoMetDB_1686,Lyngbic acid,(-)-trans-7(S)-methoxytetradec-4-enoic acid,other linear non-peptide,Lyngbya toxin,C15H28O3,256.2038448,CCCCCCCC(OC)C/C=C/CCC(O)=O,"InChI=1S/C15H28O3/c1-3-4-5-6-8-11-14(18-2)12-9-7-10-13-15(16)17/h7,9,14H,3-6,8,10-13H2,1-2H3,(H,16,17)/b9-7+/t14-/m0/s1",DHIPOEWPWSLXNL-KGXGESDWSA-N,11065049,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1687,Mycosporine-glycine-valine,,other linear non-peptide,Mycosporine?like amino acids,C15H24N2O7,344.1583511,O[C@@](CO)(CC(NCC(O)=O)=C1OC)CC1=NC(C(C)C)C(O)=O,"InChI=1S/C15H24N2O7/c1-8(2)12(14(21)22)17-10-5-15(23,7-18)4-9(13(10)24-3)16-6-11(19)20/h8,12,16,18,23H,4-7H2,1-3H3,(H,19,20)(H,21,22)/t12?,15-/m0/s1",UHMGBNQDCNYVOQ-CVRLYYSRSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1688,Dysidenamide,,other linear peptide,,C15H23Cl6N3O3,502.9870578,C[C@@H](C[C@@H](C(=O)N(C)[C@@H](C)C(=O)N)NC(=O)C[C@H](C)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl,"InChI=1S/C15H23Cl6N3O3/c1-7(14(16,17)18)5-10(13(27)24(4)9(3)12(22)26)23-11(25)6-8(2)15(19,20)21/h7-10H,5-6H2,1-4H3,(H2,22,26)(H,23,25)/t7-,8-,9-,10-/m0/s1",MNDIWUDRDZWGIK-XKNYDFJKSA-N,10505744,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1689,Anaephene A,,other linear non-peptide,Alkylphenol,C15H22O,218.1670653,OC1=CC=CC(CCCC/C=C/CCC)=C1,"InChI=1S/C15H22O/c1-2-3-4-5-6-7-8-10-14-11-9-12-15(16)13-14/h4-5,9,11-13,16H,2-3,6-8,10H2,1H3/b5-4+",ACGPFWZDANXQSU-SNAWJCMRSA-N,146683878,yes,Hormoscilla,n.a.,n.a.
CyanoMetDB_1690,Mycosporine-glutamic acid-glycine,,other linear non-peptide,Mycosporine?like amino acids,C15H22N2O9,374.1325303,O[C@@](CC(NCC(O)=O)=C1OC)(CC1=NC(C(O)=O)CCC(O)=O)CO,"InChI=1S/C15H22N2O9/c1-26-13-9(16-6-12(21)22)4-15(25,7-18)5-10(13)17-8(14(23)24)2-3-11(19)20/h8,16,18,25H,2-7H2,1H3,(H,19,20)(H,21,22)(H,23,24)/t8?,15-/m0/s1",VIQCONDNYYHNRC-UOTNVTSPSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1691,Biopterin-a-glucoside,,other linear non-peptide,,C15H21N5O8,399.1390127,C[C@H]([C@@H](C1=CN=C2C(=N1)C(=O)NC(=N2)N)O)OC3C(C(C(C(O3)CO)O)O)O,"InChI=1S/C15H21N5O8/c1-4(27-14-11(25)10(24)9(23)6(3-21)28-14)8(22)5-2-17-12-7(18-5)13(26)20-15(16)19-12/h2,4,6,8-11,14,21-25H,3H2,1H3,(H3,16,17,19,20,26)/t4-,6?,8+,9?,10?,11?,14?/m1/s1",UBSQWCUHJNTZFU-STDHHERASA-N,139583825,yes,Spirulina/Arthrospira,platensis,n.a.
CyanoMetDB_1692,7-Epicylindrospermopsin,epiCYN,other linear non-peptide,Cylindrospermopsin,C15H21N5O7S,415.1161692,C[C@H]1[C@@H](OS(=O)(O)=O)C[C@]2([H])C[C@@](NC3=NC[C@H]1N23)([C@@H](O)C4=CC(NC(N4)=O)=O)[H],"InChI=1S/C15H21N5O7S/c1-6-10-5-16-14-17-8(13(22)9-4-12(21)19-15(23)18-9)2-7(20(10)14)3-11(6)27-28(24,25)26/h4,6-8,10-11,13,22H,2-3,5H2,1H3,(H,16,17)(H,24,25,26)(H2,18,19,21,23)/t6-,7+,8-,10-,11+,13-/m1/s1",LHJPHMKIGRLKDR-VDPNAHCISA-N,42628600,yes,Aphanizomenon,ovalisporum,n.a.
CyanoMetDB_1693,Cylindrospermopsin,CYN,other linear non-peptide,Cylindrospermopsin,C15H21N5O7S,415.1161692,C[C@H]1[C@@H](OS(=O)(O)=O)C[C@]2([H])C[C@@](NC3=NC[C@H]1N23)([C@H](O)C4=CC(NC(N4)=O)=O)[H],"InChI=1S/C15H21N5O7S/c1-6-10-5-16-14-17-8(13(22)9-4-12(21)19-15(23)18-9)2-7(20(10)14)3-11(6)27-28(24,25)26/h4,6-8,10-11,13,22H,2-3,5H2,1H3,(H,16,17)(H,24,25,26)(H2,18,19,21,23)/t6-,7+,8-,10-,11+,13+/m1/s1",LHJPHMKIGRLKDR-YUQKHPEDSA-N,115005,yes,Cylindrospermopsis,raciborskii,n.a.
CyanoMetDB_1694,7-Deoxy-Cylindrospermopsin,,other linear non-peptide,Cylindrospermopsin,C15H21N5O6S,399.1212546,C[C@H]1[C@H](C[C@@]2(C[C@@]([H])(NC3=NC[C@]1(N23)[H])CC4=CC(NC(N4)=O)=O)[H])OS(=O)(O)=O,"InChI=1S/C15H21N5O6S/c1-7-11-6-16-14-17-8(2-9-4-13(21)19-15(22)18-9)3-10(20(11)14)5-12(7)26-27(23,24)25/h4,7-8,10-12H,2-3,5-6H2,1H3,(H,16,17)(H,23,24,25)(H2,18,19,21,22)/t7-,8+,10+,11-,12+/m1/s1",UQRKOHUZCZBNCN-GATYQTQLSA-N,11280999,yes,Cylindrospermopsis,raciborskii,n.a.
CyanoMetDB_1696,7-Deoxy-desulfo-cylindrospermopsin,,other linear non-peptide,Cylindrospermopsin,C15H21N5O3,319.1644396,O[C@@H]1[C@H](C)[C@]2([H])N(C(N[C@](CC(NC(N3)=O)=CC3=O)([H])C4)=NC2)[C@]4([H])C1,"InChI=1S/C15H21N5O3/c1-7-11-6-16-14-17-8(3-10(20(11)14)5-12(7)21)2-9-4-13(22)19-15(23)18-9/h4,7-8,10-12,21H,2-3,5-6H2,1H3,(H,16,17)(H2,18,19,22,23)/t7-,8+,10+,11-,12+/m1/s1",HKUZFYRVEQYWCO-GATYQTQLSA-N,11247498,yes,Cylindrospermopsis,raciborskii,n.a.
CyanoMetDB_1697,Anaephene C,,other linear non-peptide,Alkylphenol,C15H20O,216.1514153,OC1=CC=CC(CC/C=C/C=C/CCC)=C1,"InChI=1S/C15H20O/c1-2-3-4-5-6-7-8-10-14-11-9-12-15(16)13-14/h4-7,9,11-13,16H,2-3,8,10H2,1H3/b5-4+,7-6+",WQIFRGNDJXGCFI-YTXTXJHMSA-N,146683879,yes,Hormoscilla,n.a.,n.a.
CyanoMetDB_1698,Coibacin C,,other linear non-peptide,Lactone,C15H19ClO2,266.1073576,C/C(=C\Cl)/C/C=C/C=C/CC[C@@H]1CC=CC(=O)O1,"InChI=1S/C15H19ClO2/c1-13(12-16)8-5-3-2-4-6-9-14-10-7-11-15(17)18-14/h2-5,7,11-12,14H,6,8-10H2,1H3/b4-2+,5-3+,13-12+/t14-/m1/s1",CEOONFMQXSOFRK-DTSYYBRBSA-N,102452153,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_1699,"4,5-dihydroxy-1-methyl-anthraquinone",,other linear non-peptide,,C15H10O4,254.0579088,CC1=C2C(=C(C=C1)O)C(=O)C3=C(C2=O)C=CC=C3O,"InChI=1S/C15H10O4/c1-7-5-6-10(17)13-11(7)14(18)8-3-2-4-9(16)12(8)15(13)19/h2-6,16-17H,1H3",SRVOZHBUHVINKL-UHFFFAOYSA-N,10244017,yes,Nostoc,commune ,EAWAG 122b
CyanoMetDB_1700,"2,5-dimethyldodecanoic acid",,other linear non-peptide,,C14H28O2,228.2089301,CCCCCCCC(C)CC[C@@H](C)C(=O)O,"InChI=1S/C14H28O2/c1-4-5-6-7-8-9-12(2)10-11-13(3)14(15)16/h12-13H,4-11H2,1-3H3,(H,15,16)/t12?,13-/m1/s1",ABQDDNHUZOOWMZ-ZGTCLIOFSA-N,22832858,yes,Lyngbya,aestuarii,n.a.
CyanoMetDB_1701,Mycosporine-lysine,,other linear non-peptide,Mycosporine?like amino acids,C14H24N2O6,316.1634365,OC(C(CCCCNC1=C(C(C[C@](CO)(C1)O)=O)OC)N)=O,"InChI=1S/C14H24N2O6/c1-22-12-10(6-14(21,8-17)7-11(12)18)16-5-3-2-4-9(15)13(19)20/h9,16-17,21H,2-8,15H2,1H3,(H,19,20)/t9?,14-/m0/s1",LFXJZRGVICKOLP-RJSPSEDBSA-N,,yes,Gloeocapsa; Calothrix; Nostocal,[Gloeocapsa]sp.; [Calothrix]sp.; [Nostocal]sp.,n.a.
CyanoMetDB_1702,Porphyra-334,P-334,other linear non-peptide,Mycosporine?like amino acids,C14H22N2O8,346.1376157,COC1=C(NCC(O)=O)C[C@](CO)(O)CC1=N[C@H](C(O)=O)[C@@H](C)O,"InChI=1S/C14H22N2O8/c1-7(18)11(13(21)22)16-9-4-14(23,6-17)3-8(12(9)24-2)15-5-10(19)20/h7,11,15,17-18,23H,3-6H2,1-2H3,(H,19,20)(H,21,22)/t7-,11+,14+/m1/s1",VIZAVBQHHMQOQF-HFHAVAFHSA-N,137225557,yes,Nostoc; Anabaena; Nodularia; Trichodesmium,[Anabaena]doliolum; [Nodularia]baltica;  [Nodularia]harveyana;  [Nodularia]spumigene,n.a.
CyanoMetDB_1703,Euhalothece-362,,other linear non-peptide,Mycosporine?like amino acids,C14H22N2O7,330.1427011,COC1=C(NC(C)C(O)=O)C[C@@](CC1=NC=C(O)CO)(O)CO,"InChI=1S/C14H22N2O7/c1-8(13(20)21)16-11-4-14(22,7-18)3-10(12(11)23-2)15-5-9(19)6-17/h5,8,16-19,22H,3-4,6-7H2,1-2H3,(H,20,21)/t8?,14-/m1/s1",PLLDPXPIDSAHDH-NVDIHYKVSA-N,,no,Euhalothece,sp.,LK-1
CyanoMetDB_1704,Pukeleimide G,,other linear non-peptide,Pukeleimide,C14H16N2O5,292.1059216,CN1/C(C=C(COC)C1=O)=C/C(N2CC(OC)=CC2=O)=O,"InChI=1S/C14H16N2O5/c1-15-10(4-9(8-20-2)14(15)19)5-12(17)16-7-11(21-3)6-13(16)18/h4-6H,7-8H2,1-3H3/b10-5+",WIKPEERQBVZRIY-BJMVGYQFSA-N,23247773,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1705,(-)-7-methoxydodec-4(E)-enoic acid,,other linear non-peptide,,C13H24O3,228.1725446,CCCCC[C@@H](C/C=C/CCC(=O)O)OC,"InChI=1S/C13H24O3/c1-3-4-6-9-12(16-2)10-7-5-8-11-13(14)15/h5,7,12H,3-4,6,8-11H2,1-2H3,(H,14,15)/b7-5+/t12-/m0/s1",KBMNVOKQUUZFOO-PZBABLGHSA-N,6479924,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1706,Lyngbioic acid,,other linear non-peptide,,C13H24O2,212.17763,CCCCCCC[C@@H]1C[C@H]1CCC(=O)O,"InChI=1S/C13H24O2/c1-2-3-4-5-6-7-11-10-12(11)8-9-13(14)15/h11-12H,2-10H2,1H3,(H,14,15)/t11-,12-/m1/s1",RLZULRFRISISCU-VXGBXAGGSA-N,70698462,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1707,"5-Acetamido-1,1,1-trichloroundecane",Acetamino-trichlorodecane,other linear non-peptide,Zacetamide,C13H24Cl3NO,315.0923475,CCCCCCC(CCCC(Cl)(Cl)Cl)NC(=O)C,"InChI=1S/C13H24Cl3NO/c1-3-4-5-6-8-12(17-11(2)18)9-7-10-13(14,15)16/h12H,3-10H2,1-2H3,(H,17,18)",PMBAZTIKQVXAJA-UHFFFAOYSA-N,11120674,yes,Microcoleus,lyngbyaceus,n.a.
CyanoMetDB_1708,Mycosporine-ornithine,,other linear non-peptide,Mycosporine?like amino acids,C13H22N2O6,302.1477864,O=C1C(OC)=C(C[C@@](CO)(C1)O)NCCCC(C(O)=O)N,"InChI=1S/C13H22N2O6/c1-21-11-9(5-13(20,7-16)6-10(11)17)15-4-2-3-8(14)12(18)19/h8,15-16,20H,2-7,14H2,1H3,(H,18,19)/t8?,13-/m0/s1",AERJYLRVJRRKIZ-RLROJCQXSA-N,,yes,Nostoc; Leptolyngbya,[Nostoc]sp.; [Leptolyngbya]sp.,[Nostoc sp.]CCIBt 3329; [Leptolyngbya sp.]LTPNA DBG 07
CyanoMetDB_1709,Palythinol,,other linear non-peptide,Mycosporine?like amino acids,C13H22N2O6,302.1477864,O[C@](CO)(CC1=NC(CO)C)CC(NCC(O)=O)=C1OC,"InChI=1S/C13H22N2O6/c1-8(6-16)15-10-4-13(20,7-17)3-9(12(10)21-2)14-5-11(18)19/h8,14,16-17,20H,3-7H2,1-2H3,(H,18,19)/t8?,13-/m0/s1",NKJVQFFOGWSVTJ-RLROJCQXSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1710,Shinorine,,other linear non-peptide,Mycosporine?like amino acids,C13H20N2O8,332.1219656,COC1=C(NCC(O)=O)C[C@](CO)(O)CC1=NC(C(O)=O)CO,"InChI=1S/C13H20N2O8/c1-23-11-7(14-4-10(18)19)2-13(22,6-17)3-8(11)15-9(5-16)12(20)21/h9,14,16-17,22H,2-6H2,1H3,(H,18,19)(H,20,21)/t9?,13-/m0/s1",WXEQFJUHQIGKNG-NCWAPJAISA-N,,yes,Komarekiella;Nodularia,[Komarekiella]atlantica;[Nodularia]spumigena,[Komarekiella atlantica]CCIBt 3307;[Nodularia spumigena]CENA 596
CyanoMetDB_1711,Palythene,,other linear non-peptide,Mycosporine?like amino acids,C13H20N2O5,284.1372218,OC[C@@](O)(CC1=N/C=C/C)CC(NCC(O)=O)=C1OC,"InChI=1S/C13H20N2O5/c1-3-4-14-9-5-13(19,8-16)6-10(12(9)20-2)15-7-11(17)18/h3-4,15-16,19H,5-8H2,1-2H3,(H,17,18)/b4-3+,14-9?/t13-/m1/s1",OMPMQQQHTAPTHR-VGBOJRIASA-N,,yes,Aphanothece,halophytica,n.a.
CyanoMetDB_1712,Aphanorphine,,other linear non-peptide,,C13H17NO,203.1310142,OC1=CC=C2C([C@@](C)(C3)CN(C)[C@@H]3C2)=C1,"InChI=1S/C13H17NO/c1-13-7-10(14(2)8-13)5-9-3-4-11(15)6-12(9)13/h3-4,6,10,15H,5,7-8H2,1-2H3/t10-,13+/m1/s1",FVVVZSVINPVAIU-MFKMUULPSA-N,10330518,yes,Aphanizomenon,flos-aquae,n.a.
CyanoMetDB_1713,Pukeleimide D,,other linear non-peptide,Pukeleimide,C13H16N2O6,296.1008362,CN1/C(=C/C(=O)N2CC(=CC2=O)OC)/CC(C1=O)(CO)O,"InChI=1S/C13H16N2O6/c1-14-8(5-13(20,7-16)12(14)19)3-10(17)15-6-9(21-2)4-11(15)18/h3-4,16,20H,5-7H2,1-2H3/b8-3+",FNRFWNOUJULTBT-FPYGCLRLSA-N,23247770,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1714,Pukeleimide A,,other linear non-peptide,Pukeleimide,C13H14N2O5,278.0902716,CN1/C(C=C(CO)C1=O)=C/C(N2CC(OC)=CC2=O)=O,"InChI=1S/C13H14N2O5/c1-14-9(3-8(7-16)13(14)19)4-11(17)15-6-10(20-2)5-12(15)18/h3-5,16H,6-7H2,1-2H3/b9-4+",ZNJVDXPVBMPLNR-RUDMXATFSA-N,6506028,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1715,Pukeleimide B,,other linear non-peptide,Pukeleimide,C13H14N2O5,278.0902716,CN1/C(C=C(CO)C1=O)=C\C(N2CC(OC)=CC2=O)=O,"InChI=1S/C13H14N2O5/c1-14-9(3-8(7-16)13(14)19)4-11(17)15-6-10(20-2)5-12(15)18/h3-5,16H,6-7H2,1-2H3/b9-4-",ZNJVDXPVBMPLNR-WTKPLQERSA-N,6440466,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1716,Pukeleimide E,,other linear non-peptide,Pukeleimide,C13H14N2O4,262.0953569,CN1/C(CC(C1=O)=C)=C/C(N2CC(OC)=CC2=O)=O,"InChI=1S/C13H14N2O4/c1-8-4-9(14(2)13(8)18)5-11(16)15-7-10(19-3)6-12(15)17/h5-6H,1,4,7H2,2-3H3/b9-5+",PKYAOXMLUVFBOB-WEVVVXLNSA-N,23247771,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1717,Bauerine A,,other linear non-peptide,,C12H9ClN2,216.045426,CN1C2=C(C=CC(=C2)Cl)C3=C1C=NC=C3,"InChI=1S/C12H9ClN2/c1-15-11-6-8(13)2-3-9(11)10-4-5-14-7-12(10)15/h2-7H,1H3",CRAMILMCKLDURA-UHFFFAOYSA-N,189885,yes,Dichothrix,baueriana ,GO- 25-2
CyanoMetDB_1718,Bauerine C,,other linear non-peptide,,C12H8Cl2N2O,266.0013683,CN1C2=C(C=CC(=C2Cl)Cl)C3=C1C(=O)NC=C3,"InChI=1S/C12H8Cl2N2O/c1-16-10-6(2-3-8(13)9(10)14)7-4-5-15-12(17)11(7)16/h2-5H,1H3,(H,15,17)",JFESWTBLTSUPGK-UHFFFAOYSA-N,189883,yes,Dichothrix,baueriana ,GO- 25-2
CyanoMetDB_1719,Bauerine B,,other linear non-peptide,,C12H8Cl2N2,250.0064537,CN1C2=C(C=CN=C2)C3=C1C(=C(C=C3)Cl)Cl,"InChI=1S/C12H8Cl2N2/c1-16-10-6-15-5-4-7(10)8-2-3-9(13)11(14)12(8)16/h2-6H,1H3",XGTYSLIGRKUXED-UHFFFAOYSA-N,189884,yes,Dichothrix,baueriana ,GO- 25-2
CyanoMetDB_1720,Aulosirazole,,other linear non-peptide,,C12H7NO4S,261.0095789,COC1=NSC2=C1C(=O)C3=C(C2=O)C=CC=C3O,"InChI=1S/C12H7NO4S/c1-17-12-8-10(16)7-5(3-2-4-6(7)14)9(15)11(8)18-13-12/h2-4,14H,1H3",SYNUZZXUSLTSQM-UHFFFAOYSA-N,10332864,yes,Aulosira,fertilissima Ghose ,UH DO-8-1
CyanoMetDB_1721,N-octanoyl-homoserine lactone,,other linear non-peptide,AHLs,C12H21NO3,227.1521435,O=C1OCCC1NC(CCCCCCC)=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,3474204,no,Gloeothece,n.a.,n.a.
CyanoMetDB_1722,Gonyautoxin-1,"GTX1, GonyautoxinI",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O9S,411.0808,OC([C@@]([H])(CN1C2=N)OS(=O)(O)=O)([C@@]13NC(N[C@]3([C@@H](N2O)COC(N)=O)[H])=N)O,"InChI=1S/C10H17N7O9S/c11-6-14-5-3(2-25-8(13)18)17(21)7(12)16-1-4(26-27(22,23)24)10(19,20)9(5,16)15-6/h3-5,12,19-21H,1-2H2,(H2,13,18)(H3,11,14,15)(H,22,23,24)/t3-,4+,5-,9-/m0/s1",CETRDCWBMBILAL-XXKOCQOQSA-N,90694465,yes,Aphanizomenon,n.a.,n.a.
CyanoMetDB_1723,Palythine–threonine,,other linear non-peptide,Mycosporine?like amino acids,C12H20N2O6,288.1321364,N=C1C[C@](CO)(CC(NC(C(O)C)C(O)=O)=C1OC)O,"InChI=1S/C12H20N2O6/c1-6(16)9(11(17)18)14-8-4-12(19,5-15)3-7(13)10(8)20-2/h6,9,13-16,19H,3-5H2,1-2H3,(H,17,18)/t6?,9?,12-/m1/s1",GULWXNQSNFZLOO-ALRJZHFGSA-N,,no,Oscillatoria; Tolypothrix; Calothrix; Nostoc,[Oscillatoria]sp.; [Tolypothrix]sp.; [Calothrix]sp.; [Nostoc]sp.,[Oscillatoria sp.]CMAA 1600; [Tolypothrix sp.]CMAA 1668; [Tolypothrix sp.]LTPNA DBG 44; [Calothrix sp.]CMAA 1670; [Nostoc sp.]LTPNA DBG 94
CyanoMetDB_1724,Asterina-330,,other linear non-peptide,Mycosporine?like amino acids,C12H20N2O6,288.1321364,OC[C@@](O)(CC1=NCCO)CC(NCC(O)=O)=C1OC,"InChI=1S/C12H20N2O6/c1-20-11-8(13-2-3-15)4-12(19,7-16)5-9(11)14-6-10(17)18/h14-16,19H,2-7H2,1H3,(H,17,18)/t12-/m1/s1",OTZURLUZDRIZEM-GFCCVEGCSA-N,,yes,Lyngbya,n.a.,CU 2555
CyanoMetDB_1725,Mycosporine-GABA,(273-Da MAA),other linear non-peptide,Mycosporine?like amino acids,C12H19NO6,273.1212373,O=C1C[C@](CO)(CC(NCCCC(O)=O)=C1OC)O,"InChI=1S/C12H19NO6/c1-19-11-8(13-4-2-3-10(16)17)5-12(18,7-14)6-9(11)15/h13-14,18H,2-7H2,1H3,(H,16,17)/t12-/m0/s1",PHMFQSVGWKFYII-LBPRGKRZSA-N,,yes,Nostoc,commune,KU006
CyanoMetDB_1726,Mycosporine-2-glycine,,other linear non-peptide,Mycosporine?like amino acids,C12H18N2O7,302.1114009,OCC(O)(CC1=NCC(O)=O)CC(NCC(O)=O)=C1OC,"InChI=1S/C12H18N2O7/c1-21-11-7(13-4-9(16)17)2-12(20,6-15)3-8(11)14-5-10(18)19/h13,15,20H,2-6H2,1H3,(H,16,17)(H,18,19)",NCZZDMCBYGVEGP-UHFFFAOYSA-N,23427657,yes,Euhalothece,n.a.,n.a.
CyanoMetDB_1727,Tetrahydroindol 3,,other linear non-peptide,,C12H17NO3,223.1208434,CN(C=C1C=O)C2=C1C(OC)CC(O)C2C,"InChI=1S/C12H17NO3/c1-7-9(15)4-10(16-3)11-8(6-14)5-13(2)12(7)11/h5-7,9-10,15H,4H2,1-3H3",TUIXQUPRFTWIPR-UHFFFAOYSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1728,7-formyl-3-methoxy-5-methylindanone,,other linear non-peptide,,C12H12O3,204.0786442,CC1=CC2=C(C(=O)CC2OC)C(=C1)C=O,"InChI=1S/C12H12O3/c1-7-3-8(6-13)12-9(4-7)11(15-2)5-10(12)14/h3-4,6,11H,5H2,1-2H3",VNNRAAJVRAAXSH-UHFFFAOYSA-N,11820228,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1729,Nostocarboline,,other linear non-peptide,,C12H10ClN2,217.05325,C[N+]1=CC2=C(C=C1)C3=C(N2)C=CC(=C3)Cl,"InChI=1S/C12H9ClN2/c1-15-5-4-9-10-6-8(13)2-3-11(10)14-12(9)7-15/h2-7H,1H3/p+1",RGQUDRQSJYJYAQ-UHFFFAOYSA-O,5326150,yes,Nostoc,n.a.,78-12A
CyanoMetDB_1730,cis-Dihydrohomoanatoxin-a,"2,3-Dihydrohomoanatoxin-a, H2-hATX",Anatoxin-a,,C11H19NO,181.1467,O=C(CC)[C@@H]1[C@H]2CC[C@H](N2)CCC1,"InChI=1S/C11H19NO/c1-2-11(13)9-5-3-4-8-6-7-10(9)12-8/h8-10,12H,2-7H2,1H3/t8-,9+,10-/m1/s1",MVXJVRNMGNXROR-KXUCPTDWSA-N,101942170,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_1731,Gonyautoxin-4,"GTX4, GonyautoxinIV",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O9S,411.0808,OC([C@]([H])(CN1C2=N)OS(=O)(O)=O)([C@@]13NC(N[C@]3([C@@H](N2O)COC(N)=O)[H])=N)O,"InChI=1S/C10H17N7O9S/c11-6-14-5-3(2-25-8(13)18)17(21)7(12)16-1-4(26-27(22,23)24)10(19,20)9(5,16)15-6/h3-5,12,19-21H,1-2H2,(H2,13,18)(H3,11,14,15)(H,22,23,24)/t3-,4-,5-,9-/m0/s1",CETRDCWBMBILAL-LJRZAWCWSA-N,93136976,yes,Aphanizomenon,n.a.,n.a.
CyanoMetDB_1732,Gonyautoxin-6,"GTX6, B2",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O8S,395.0859,OC([C@@]12NC(N[C@@]2([H])[C@H](COC(NS(=O)(O)=O)=O)N3O)=N)(O)CCN1C3=N,"InChI=1S/C10H17N7O8S/c11-6-13-5-4(3-25-8(18)15-26(22,23)24)17(21)7(12)16-2-1-9(19,20)10(5,16)14-6/h4-5,12,19-21H,1-3H2,(H,15,18)(H3,11,13,14)(H,22,23,24)/t4-,5-,10-/m0/s1",ALRRPAKWGUBPBK-HGRQIUPRSA-N,101650370,yes,Cylindrospermopsis ,n.a.,n.a.
CyanoMetDB_1733,N-Sulfocarbamoylgonyautoxin-3,"C3, C3a Anaphylatoxin; Toxin PX3; Toxin C3; PROTOGONYAUTOXIN 3",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O12S2,491.0377,OC([C@](OS(=O)(O)=O)(CN1C2=N)[H])([C@@]13NC(N[C@]3([C@@H](N2O)COC(NS(=O)(O)=O)=O)[H])=N)O,"InChI=1S/C10H17N7O12S2/c11-6-13-5-3(2-28-8(18)15-30(22,23)24)17(21)7(12)16-1-4(29-31(25,26)27)10(19,20)9(5,16)14-6/h3-5,12,19-21H,1-2H2,(H,15,18)(H3,11,13,14)(H,22,23,24)(H,25,26,27)/t3-,4+,5-,9-/m0/s1",HUDHMIUZDXZZRC-XXKOCQOQSA-N,,yes,Aphanizomenon,n.a.,n.a.
CyanoMetDB_1734,N-Sulfocarbamoylgonyautoxin-4,C4,Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O12S2,491.0377,OC([C@@](OS(=O)(O)=O)(CN1C2=N)[H])([C@@]13NC(N[C@]3([C@@H](N2O)COC(NS(=O)(O)=O)=O)[H])=N)O,"InChI=1S/C10H17N7O12S2/c11-6-13-5-3(2-28-8(18)15-30(22,23)24)17(21)7(12)16-1-4(29-31(25,26)27)10(19,20)9(5,16)14-6/h3-5,12,19-21H,1-2H2,(H,15,18)(H3,11,13,14)(H,22,23,24)(H,25,26,27)/t3-,4-,5-,9-/m0/s1",HUDHMIUZDXZZRC-LJRZAWCWSA-N,49789096,yes,Aphanizomenon,n.a.,n.a.
CyanoMetDB_1735,Palythine-serine,,other linear non-peptide,Mycosporine?like amino acids,C11H18N2O6,274.1164863,N=C1C[C@](CO)(CC(NC(CO)C(O)=O)=C1OC)O,"InChI=1S/C11H18N2O6/c1-19-9-6(12)2-11(18,5-15)3-7(9)13-8(4-14)10(16)17/h8,12-15,18H,2-5H2,1H3,(H,16,17)/t8?,11-/m1/s1",DQCGSCJFICXWFZ-QHDYGNBISA-N,,yes,Scytonema,crispum,UCFS10; UCFS15
CyanoMetDB_1736,N-methylpalythine,Aplysiapalythine C,other linear non-peptide,Mycosporine?like amino acids,C11H18N2O5,258.1215717,COC1=C(C[C@](CO)(O)CC1=NC)NCC(O)=O,"InChI=1S/C11H18N2O5/c1-12-7-3-11(17,6-14)4-8(10(7)18-2)13-5-9(15)16/h13-14,17H,3-6H2,1-2H3,(H,15,16)/t11-/m1/s1",SUHDWLVRBMFGPX-LLVKDONJSA-N,,yes,Calothrix; Scytonema; Brasilonema; Leptolyngbya; Tolypothrix,[Calothrix]sp.; [Scytonema]sp.; [Brasilonema]octagenarum; [Leptolyngbya]sp.; [Tolypothrix]sp.,[Calothrix sp.]CCIBt 3289; [Scytonema sp.]CCIBt 3464; [Brasilonema octagenarum]CCIBt 3551; [Leptolyngbya sp.]CCIBt 3626; [Tolypothrix sp.]LTPNA DBG 92 
CyanoMetDB_1737,4R-Hydroxyhomoanatoxin-a,,Anatoxin-a,,C11H17NO2,195.1259,O=C(C1=C[C@@H](C[C@@H]2CC[C@H]1N2)O)CC,"InChI=1S/C11H17NO2/c1-2-11(14)9-6-8(13)5-7-3-4-10(9)12-7/h6-8,10,12-13H,2-5H2,1H3/t7-,8+,10+/m0/s1",GUFZEUUNFPNBSR-QXFUBDJGSA-N,146684707,yes,Raphidiopsis ,mediterranea,LBRI 48
CyanoMetDB_1738,4S-Hydroxyhomoanatoxin-a,,Anatoxin-a,,C11H17NO2,195.1259,O=C(CC)C1=C[C@@H](O)C[C@@H]2CC[C@H]1N2,"InChI=1S/C11H17NO2/c1-2-11(14)9-6-8(13)5-7-3-4-10(9)12-7/h6-8,10,12-13H,2-5H2,1H3/t7-,8-,10+/m0/s1",GUFZEUUNFPNBSR-OYNCUSHFSA-N,23248676,yes,Raphidiopsis ,mediterranea,LBRI 48
CyanoMetDB_1739,"2,3-Epoxyhomoanatoxin-a",,Anatoxin-a,,C11H17NO2,195.1259,O=C(CC)C12[C@H]3CC[C@H](N3)CCC1O2,"InChI=1S/C11H17NO2/c1-2-9(13)11-8-5-3-7(12-8)4-6-10(11)14-11/h7-8,10,12H,2-6H2,1H3/t7-,8+,10?,11?/m0/s1",VIEJSDSSFCHXNP-IIPFWGKHSA-N,,no ,n.a.,n.a.,n.a.
CyanoMetDB_1740,Homoanatoxin-a,,Anatoxin-a,,C11H17NO,179.131,CCC(C1=CCC[C@@H]2CC[C@H]1N2)=O,"InChI=1S/C11H17NO/c1-2-11(13)9-5-3-4-8-6-7-10(9)12-8/h5,8,10,12H,2-4,6-7H2,1H3/t8-,10-/m1/s1",VVMQRZZXKNDPOT-PSASIEDQSA-N,126727,yes,Oscillatoria/Planktothrix,formosa,n.a.
CyanoMetDB_1741,Tetrahydroindol 2,,other linear non-peptide,,C11H15NO4,225.100108,CN(C=C1C=O)C2=C1C(O)CC(O)C2(O)C,"InChI=1S/C11H15NO4/c1-11(16)8(15)3-7(14)9-6(5-13)4-12(2)10(9)11/h4-5,7-8,14-16H,3H2,1-2H3",OGCFDZMKLHDQHP-UHFFFAOYSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1742,11-Carboxyanatoxin-a,,Anatoxin-a,,C11H15NO3,209.1052,O=C(C1=CCC[C@@H]2CC[C@H]1N2)CC(O)=O,"InChI=1S/C11H15NO3/c13-10(6-11(14)15)8-3-1-2-7-4-5-9(8)12-7/h3,7,9,12H,1-2,4-6H2,(H,14,15)/t7-,9-/m1/s1",JKKXAUZJANMQHE-VXNVDRBHSA-N,,no,Aphanizomenon,issatschenkoi ,n.a.
CyanoMetDB_1743,Tetrahydroindol 1,,other linear non-peptide,,C11H15NO3,209.1051933,CN(C=C1C=O)C2=C1C(O)CC(O)C2C,"InChI=1S/C11H15NO3/c1-6-8(14)3-9(15)10-7(5-13)4-12(2)11(6)10/h4-6,8-9,14-15H,3H2,1-2H3",UOUNAWWCBHCAFG-UHFFFAOYSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1744,Tetrahydroindol 4,,other linear non-peptide,,C11H15NO3,209.1051933,CN(C=C1C=O)C2=C1C(O)CC(O)C2C,"InChI=1S/C11H15NO3/c1-6-8(14)3-9(15)10-7(5-13)4-12(2)11(6)10/h4-6,8-9,14-15H,3H2,1-2H3",UOUNAWWCBHCAFG-UHFFFAOYSA-N,,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1745,4-Oxohomoanatoxin-a,,Anatoxin-a,,C11H15NO2,193.1103,O=C(CC)C([C@H]1CC[C@H](N1)C2)=CC2=O,"InChI=1S/C11H15NO2/c1-2-11(14)9-6-8(13)5-7-3-4-10(9)12-7/h6-7,10,12H,2-5H2,1H3/t7-,10+/m0/s1",OQSWFCINTWWZIB-OIBJUYFYSA-N,71419096,yes,Raphidiopsis ,mediterranea,LBRI 48
CyanoMetDB_1746,Nakienone A,,other linear non-peptide,,C11H14O3,194.0942943,C=C/C=C(/CO)\C1=C(CCC1=O)CO,"InChI=1S/C11H14O3/c1-2-3-8(6-12)11-9(7-13)4-5-10(11)14/h2-3,12-13H,1,4-7H2/b8-3-",FLIOPQJLDGGJFK-BAQGIRSFSA-N,10012855,yes,Synechocystis,n.a.,n.a.
CyanoMetDB_1747,Nakienone C,,other linear non-peptide,,C11H14O3,194.0942943,CC/C=C1COC(O)C2=C\1C(CC2)=O,"InChI=1S/C11H14O3/c1-2-3-7-6-14-11(13)8-4-5-9(12)10(7)8/h3,11,13H,2,4-6H2,1H3/b7-3+",QUOUWQGLKHXESX-XVNBXDOJSA-N,,yes,Synechocystis,n.a.,n.a.
CyanoMetDB_1748,Nakienone B,,other linear non-peptide,,C11H14O3,194.0942943,C=CC=C(CO)C1=CC(CCC1=O)O,"InChI=1S/C11H14O3/c1-2-3-8(7-12)10-6-9(13)4-5-11(10)14/h2-3,6,9,12-13H,1,4-5,7H2",NULAGQBHFUHTPE-UHFFFAOYSA-N,85348811,yes,Synechocystis,n.a.,n.a.
CyanoMetDB_1749,Not named CyanoMetDB_1749,,other linear non-peptide,,C11H13NO4,223.0844579,CC(=O)O[C@H]1CCC2=C([C@@H]1O)C(=CN2)C=O,"InChI=1S/C11H13NO4/c1-6(14)16-9-3-2-8-10(11(9)15)7(5-13)4-12-8/h4-5,9,11-12,15H,2-3H2,1H3/t9-,11+/m0/s1",VCLOZMYOWPWXOV-GXSJLCMTSA-N,11746236,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1750,Nakitriol,,other linear non-peptide,,C11H12O3,192.0786442,C=C/C=C(/CO)\C1=C(C=CC(=C1)O)O,"InChI=1S/C11H12O3/c1-2-3-8(7-12)10-6-9(13)4-5-11(10)14/h2-6,12-14H,1,7H2/b8-3-",ZUPUPHLFVHTOID-BAQGIRSFSA-N,10420098,yes,Synechocystis,n.a.,n.a.
CyanoMetDB_1751,"4,8-dimethyl-6-hydroxyquinoline",,other linear non-peptide,,C11H11NO,173.084064,CC1=C2C=C(C=C(C2=NC=C1)C)O,"InChI=1S/C11H11NO/c1-7-3-4-12-11-8(2)5-9(13)6-10(7)11/h3-6,13H,1-2H3",OJTRAADRYJYHPV-UHFFFAOYSA-N,21601950,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1752,"N,7-Dimethylindole-3-carbaldehyde",,other linear non-peptide,,C11H11NO,173.084064,CC1=CC=CC2=C1N(C=C2C=O)C,"InChI=1S/C11H11NO/c1-8-4-3-5-10-9(7-13)6-12(2)11(8)10/h3-7H,1-2H3",FWIFXCARKJCTGL-UHFFFAOYSA-N,21674241,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_1753,Mycosporine-tau,,other linear non-peptide,Mycosporine?like amino acids,C10H17NO7S,295.0725731,OC[C@@](O)(CC1=O)CC(NCCS(=O)(O)=O)=C1OC,"InChI=1S/C10H17NO7S/c1-18-9-7(11-2-3-19(15,16)17)4-10(14,6-12)5-8(9)13/h11-12,14H,2-6H2,1H3,(H,15,16,17)/t10-/m0/s1",OXQJFBVEKRZTDE-JTQLQIEISA-N,,no,Synechocystis,sp.,PCC 6803
CyanoMetDB_1754,cis-Dihydroanatoxin-a,"2,3-Dihydroanatoxin-a, H2-ATX",Anatoxin-a,,C10H17NO,167.131,CC([C@@H]1[C@H]2CC[C@H](N2)CCC1)=O,"InChI=1S/C10H17NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h8-11H,2-6H2,1H3/t8-,9-,10-/m1/s1",MBXOLPUMNTXLOV-OPRDCNLKSA-N,93498894,yes,Cuspidothrix,issatschenkoi ,n.a.
CyanoMetDB_1755,12?-Deoxydecarbamoyloxysaxitoxin,12?do-doSTX,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O,224.1386,C[C@H]1[C@@]2([H])[C@]3(NC(N2)=N)N(CC[C@](O)3[H])C(N1)=N,"InChI=1S/C9H16N6O/c1-4-6-9(14-7(10)13-6)5(16)2-3-15(9)8(11)12-4/h4-6,16H,2-3H2,1H3,(H2,11,12)(H3,10,13,14)/t4-,5-,6-,9+/m0/s1",QREWPEMPVQOBAA-WWSLTDMBSA-N,146683903,no,Cylindrospermopsis ,raciborskii,n.a.
CyanoMetDB_1756,12?-Deoxydecarbamoyloxysaxitoxin,12?do-doSTX,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O,224.1386,C[C@H]1[C@@]2([H])[C@]3(NC(N2)=N)N(CC[C@]([H])3O)C(N1)=N,"InChI=1S/C9H16N6O/c1-4-6-9(14-7(10)13-6)5(16)2-3-15(9)8(11)12-4/h4-6,16H,2-3H2,1H3,(H2,11,12)(H3,10,13,14)/t4-,5+,6-,9+/m0/s1",QREWPEMPVQOBAA-SOVPELCUSA-N,146683904,no,Cylindrospermopsis ,raciborskii,n.a.
CyanoMetDB_1757,13-O-acetyl-12?-deoxydecarbamoylsaxitoxin-11?-O-sulfate,"LWTX1, Lyngbyawolleitoxin-1",Saxitoxin,Lyngbyawolleitoxin,C11H18N6O7S,378.0958,N=C1N[C@@H](COC(C)=O)[C@@]2([H])[C@]3(NC(N2)=N)N1C[C@@H]([C@H]3O)OS(=O)(O)=O,"InChI=1S/C11H18N6O7S/c1-4(18)23-3-5-7-11(16-9(12)15-7)8(19)6(24-25(20,21)22)2-17(11)10(13)14-5/h5-8,19H,2-3H2,1H3,(H2,13,14)(H3,12,15,16)(H,20,21,22)/t5-,6-,7-,8+,11-/m0/s1",DYKMREANXMYZCE-GBSPZJCNSA-N,101554257,yes,Lyngbya,wollei,n.a.
CyanoMetDB_1758,"13-O-acetyldecarbamoylsaxitoxin-11?-
O-sulfate","Lyngbyawolleitoxin-2, LWTX2",Saxitoxin,Lyngbyawolleitoxin,C11H18N6O8S,394.0907,O=C(C)OC[C@@H]([C@@]1(NC(N[C@@]12C(O)(O)[C@@H](OS(=O)(O)=O)CN23)=N)[H])NC3=N,"InChI=1S/C11H18N6O8S/c1-4(18)24-3-5-7-10(16-8(12)15-7)11(19,20)6(25-26(21,22)23)2-17(10)9(13)14-5/h5-7,19-20H,2-3H2,1H3,(H2,13,14)(H3,12,15,16)(H,21,22,23)/t5-,6-,7-,10-/m0/s1",MVYNBQGQIIORAE-QFNGTQGLSA-N,146683621,yes,Lyngbya,wollei,n.a.
CyanoMetDB_1759,13-O-acetyldecarbamoylsaxitoxin-11?-O-sulfate,"Lyngbyawolleitoxin-3, LWTX3",Saxitoxin,Lyngbyawolleitoxin,C11H18N6O8S,394.0907,O=C(C)OC[C@@H]([C@@]1(NC(N[C@@]12C(O)(O)[C@H](OS(=O)(O)=O)CN23)=N)[H])NC3=N,"InChI=1S/C11H18N6O8S/c1-4(18)24-3-5-7-10(16-8(12)15-7)11(19,20)6(25-26(21,22)23)2-17(10)9(13)14-5/h5-7,19-20H,2-3H2,1H3,(H2,13,14)(H3,12,15,16)(H,21,22,23)/t5-,6+,7-,10-/m0/s1",MVYNBQGQIIORAE-XIVUIJJLSA-N,146683622,yes,Lyngbya,wollei,n.a.
CyanoMetDB_1760,12?-Deoxydecarbamoylsaxitoxin,"Lyngbyawolleitoxin-4, LWTX4, 12?do-dcSTX",Saxitoxin,Lyngbyawolleitoxin,C9H16N6O2,240.1335,N=C1N[C@H]([C@]2([C@@]3(N1CC[C@H]3O)NC(N2)=N)[H])CO,"InChI=1S/C9H16N6O2/c10-7-13-6-4(3-16)12-8(11)15-2-1-5(17)9(6,15)14-7/h4-6,16-17H,1-3H2,(H2,11,12)(H3,10,13,14)/t4-,5+,6-,9+/m0/s1",AIOWIOMRQZYDEM-SOVPELCUSA-N,54597714,yes,Lyngbya,wollei,n.a.
CyanoMetDB_1761,13-O-Acetyldecarbamoylsaxitoxin,"LWTX5, Lyngbyawolleitoxin-5",Saxitoxin,Lyngbyawolleitoxin,C11H18N6O4,298.139,N=C1N[C@H]([C@]2([C@@]3(N1CCC3(O)O)NC(N2)=N)[H])COC(C)=O,"InChI=1S/C11H18N6O4/c1-5(18)21-4-6-7-11(16-8(12)15-7)10(19,20)2-3-17(11)9(13)14-6/h6-7,19-20H,2-4H2,1H3,(H2,13,14)(H3,12,15,16)/t6-,7-,11-/m0/s1",FYMGGEYPNDYSSU-HFJPGXAFSA-N,146683623,yes,Lyngbya,wollei,n.a.
CyanoMetDB_1762,13-O-Acetyl-12?-deoxydecarbamoylsaxitoxin,"Lyngbyawolleitoxin-6, LWTX6",Saxitoxin,Lyngbyawolleitoxin,C11H18N6O3,282.144,N=C1N[C@H]([C@]2([C@@]3(N1CC[C@@]3([H])O)NC(N2)=N)[H])COC(C)=O,"InChI=1S/C11H18N6O3/c1-5(18)20-4-6-8-11(16-9(12)15-8)7(19)2-3-17(11)10(13)14-6/h6-8,19H,2-4H2,1H3,(H2,13,14)(H3,12,15,16)/t6-,7+,8-,11+/m0/s1",KCWXJSKCJDCDBC-MCHASIABSA-N,101554258,yes,Lyngbya,wollei,n.a.
CyanoMetDB_1763,Decarbamoylsaxitoxin,dcSTX,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O3,256.1284,OC([C@@]12NC(N[C@@]2([H])[C@H](CO)N3)=N)(O)CCN1C3=N,"InChI=1S/C9H16N6O3/c10-6-13-5-4(3-16)12-7(11)15-2-1-8(17,18)9(5,15)14-6/h4-5,16-18H,1-3H2,(H2,11,12)(H3,10,13,14)/t4-,5-,9-/m0/s1",VRRIYZJUSNMZMP-PJPYAQQDSA-N,21117969,yes,Anabaena; Aphanizomenon; Cylindrospermopsis; Lyngbya,Anabaena]circinalis,n.a.
CyanoMetDB_1764,N-Sulfocarbamoylgonyautoxin-1,"C1, Protogonyautoxin I; Toxin PX1; Toxin C1",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O11S2,475.0427,OC([C@](OS(=O)(O)=O)(CN1C2=N)[H])([C@@]13NC(N[C@]3([C@@H](N2)COC(NS(=O)(O)=O)=O)[H])=N)O,"InChI=1S/C10H17N7O11S2/c11-6-14-5-3(2-27-8(18)16-29(21,22)23)13-7(12)17-1-4(28-30(24,25)26)10(19,20)9(5,17)15-6/h3-5,19-20H,1-2H2,(H2,12,13)(H,16,18)(H3,11,14,15)(H,21,22,23)(H,24,25,26)/t3-,4+,5-,9-/m0/s1",OKSSKVHGKYJNLL-XXKOCQOQSA-N,92855134,yes,Anabaena; Cylindrospermopsis ,[Anabaena]circinalis ,n.a.
CyanoMetDB_1765,N-Sulfocarbamoylgonyautoxin-2,"C2, Gonyautoxin Viii; Toxin C2; Gonyautoxin 8; Protogonyautoxin 2; Protogonyautoxin II; Toxin PX2; GTX VIII; GTX8",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O11S2,475.0427,OC([C@@](OS(=O)(O)=O)(CN1C2=N)[H])([C@@]13NC(N[C@]3([C@@H](N2)COC(NS(=O)(O)=O)=O)[H])=N)O,"InChI=1S/C10H17N7O11S2/c11-6-14-5-3(2-27-8(18)16-29(21,22)23)13-7(12)17-1-4(28-30(24,25)26)10(19,20)9(5,17)15-6/h3-5,19-20H,1-2H2,(H2,12,13)(H,16,18)(H3,11,14,15)(H,21,22,23)(H,24,25,26)/t3-,4-,5-,9-/m0/s1",OKSSKVHGKYJNLL-LJRZAWCWSA-N,49789086,yes,Anabaena; Cylindrospermopsis ,[Anabaena]circinalis ,n.a.
CyanoMetDB_1767,Gonyautoxin-5,"GTX5, B1",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O7S,379.091,OC([C@@]12NC(N[C@@]2([H])[C@H](COC(NS(=O)(O)=O)=O)N3)=N)(O)CCN1C3=N,"InChI=1S/C10H17N7O7S/c11-6-14-5-4(3-24-8(18)16-25(21,22)23)13-7(12)17-2-1-9(19,20)10(5,17)15-6/h4-5,19-20H,1-3H2,(H2,12,13)(H,16,18)(H3,11,14,15)(H,21,22,23)/t4-,5-,10-/m0/s13H2,(H2,12,13)(H,16,18)(H3,11,14,15)(H,21,22,23)/t4-,5-,10-/m0/s1",JKKCSFJSULZNDN-HGRQIUPRSA-N,49789073,yes,Cylindrospermopsis ,[Cylindrospermopsis]raciborskii,[Cylindrospermopsis raciborskii]T3
CyanoMetDB_1768,Decarbamoyloxygonyautoxin-3,doGTX3,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O6S,336.0852,C[C@H]1[C@@]2([H])[C@]3(NC(N2)=N)N(C[C@H](OS(=O)(O)=O)C3(O)O)C(N1)=N,"InChI=1S/C9H16N6O6S/c1-3-5-8(14-6(10)13-5)9(16,17)4(21-22(18,19)20)2-15(8)7(11)12-3/h3-5,16-17H,2H2,1H3,(H2,11,12)(H3,10,13,14)(H,18,19,20)/t3-,4?,5-,8-/m0/s1",MOUJHDRSWLPUSR-LIIKNNTCSA-N,,no,Anabaena ,circinalis ,n.a.
CyanoMetDB_1769,Palythine,,other linear non-peptide,Mycosporine?like amino acids,C10H16N2O5,244.1059216,COC1=C(N)C[C@](CO)(O)CC1=NCC(O)=O,"InChI=1S/C10H16N2O5/c1-17-9-6(11)2-10(16,5-13)3-7(9)12-4-8(14)15/h13,16H,2-5,11H2,1H3,(H,14,15)/t10-/m0/s1",KYCBIRYKYQCBFO-JTQLQIEISA-N,76764108,no (X-ray crystallography),Nostoc,sp.,R76DM
CyanoMetDB_1770,"Mycosporine glycine 
",,other linear non-peptide,Mycosporine?like amino acids,C10H15NO6,245.0899372,COC1=C(NCC(O)=O)C[C@](CO)(O)CC1=O,"InChI=1S/C10H15NO6/c1-17-9-6(11-4-8(14)15)2-10(16,5-12)3-7(9)13/h11-12,16H,2-5H2,1H3,(H,14,15)/t10-/m0/s1",XZQILKYKJYHEHD-JTQLQIEISA-N,14444486,yes,Chlorogloeopsis,sp.,[Chlorogloeopsis sp.]PCC 6912       
CyanoMetDB_1771,"2,3-Epoxyanatoxin-a",,Anatoxin-a,,C10H15NO2,181.1103,CC(C12[C@H]3CC[C@H](N3)CCC1O2)=O,"InChI=1S/C10H15NO2/c1-6(12)10-8-4-2-7(11-8)3-5-9(10)13-10/h7-9,11H,2-5H2,1H3/t7-,8+,9?,10?/m0/s1",MCXUIUWDGATBOF-AFWXGSBKSA-N,146684698,no,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_1772,Anatoxin-a,,Anatoxin-a,,C10H15NO,165.1154,CC(C1=CCC[C@@H]2CC[C@H]1N2)=O,"InChI=1S/C10H15NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h4,8,10-11H,2-3,5-6H2,1H3/t8-,10-/m1/s1",SGNXVBOIDPPRJJ-PSASIEDQSA-N,3034748,yes,Anabaena ,flos aquae,NRC-44h1
CyanoMetDB_1773,4-Hydroxy-7-methylindan-1-one,,other linear non-peptide,,C10H10O2,162.0680796,CC1=C2C(=C(C=C1)O)CCC2=O,"InChI=1S/C10H10O2/c1-6-2-4-8(11)7-3-5-9(12)10(6)7/h2,4,11H,3,5H2,1H3",LQCJCAYSGRFFCU-UHFFFAOYSA-N,5005111,yes,Nostoc,commune ,EAWAG 122b
CyanoMetDB_1774,Gonyautoxin-2,"GTX2, GonyautoxinII",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O8S,395.0859,OC([C@@]([H])(CN1C2=N)OS(=O)(O)=O)([C@@]13NC(N[C@]3([C@@H](N2)COC(N)=O)[H])=N)O,"InChI=1S/C10H17N7O8S/c11-6-15-5-3(2-24-8(13)18)14-7(12)17-1-4(25-26(21,22)23)10(19,20)9(5,17)16-6/h3-5,19-20H,1-2H2,(H2,12,14)(H2,13,18)(H3,11,15,16)(H,21,22,23)/t3-,4+,5-,9-/m0/s1",ARSXTTJGWGCRRR-XXKOCQOQSA-N,101650338,yes,Cylindrospermopsis,n.a.,n.a.
CyanoMetDB_1775,Gonyautoxin-3,"GTX3, GonyautoxinIII",Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O8S,395.0859,NC1=N[C@@H](COC(N)=O)[C@@]2([H])[C@]3(NC(N)=N2)N1C[C@]([H])(OS(O)(=O)=O)C3(O)O,"InChI=1S/C10H17N7O8S/c11-6-15-5-3(2-24-8(13)18)14-7(12)17-1-4(25-26(21,22)23)10(19,20)9(5,17)16-6/h3-5,19-20H,1-2H2,(H2,12,14)(H2,13,18)(H3,11,15,16)(H,21,22,23)/t3-,4-,5-,9-/m0/s1",ARSXTTJGWGCRRR-LJRZAWCWSA-N,46217347,yes,Lyngbya,[Lyngbya]wollei,n.a.
CyanoMetDB_1776,?-amino-N-methylalanine,BAMA,other linear non-peptide,BMAA,C4H10N2O2,118.0742276,CNC(CN)C(O)=O,"InChI=1S/C4H10N2O2/c1-6-3(2-5)4(7)8/h3,6H,2,5H2,1H3,(H,7,8)",LYESEIVAYITDEH-UHFFFAOYSA-N,21727858,no,n.a.,n.a.,n.a.
CyanoMetDB_1779,11?-hydroxy-N21-sulfocarbamoylsaxitoxin,M1? ; M1,Saxitoxin,other linear non-peptide,C10H17N7O8S,395.0859317,OC1([C@@](O)(CN2C(N)=N[C@@H](COC(NS(O)(=O)=O)=O)[C@]3([H])N=C(N[C@]123)N)[H])O,"InChI=1S/C10H17N7O8S/c11-6-14-5-3(2-25-8(19)16-26(22,23)24)13-7(12)17-1-4(18)10(20,21)9(5,17)15-6/h3-5,18,20-21H,1-2H2,(H2,12,13)(H,16,19)(H3,11,14,15)(H,22,23,24)/t3-,4-,5-,9-/m0/s1",OWPNZRSEHXXIHR-LJRZAWCWSA-N,136045808,Yes,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_1782,"[D?Asp³,DMAdda5]MC-LA",,Microcystin,,C44H63N7O12,881.4534708,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)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]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C44H63N7O12/c1-23(2)19-33-42(59)50-34(44(62)63)22-36(53)45-27(6)39(56)47-31(16-15-24(3)20-25(4)35(52)21-30-13-11-10-12-14-30)26(5)38(55)48-32(43(60)61)17-18-37(54)51(9)29(8)41(58)46-28(7)40(57)49-33/h10-16,20,23,25-28,31-35,52H,8,17-19,21-22H2,1-7,9H3,(H,45,53)(H,46,58)(H,47,56)(H,48,55)(H,49,57)(H,50,59)(H,60,61)(H,62,63)/b16-15+,24-20+/t25-,26-,27-,28+,31-,32+,33-,34+,35-/m0/s1",YEECPBMSOJOCFK-BSBXEUFZSA-N,146684713,no,Hapalosiphon,hibernicus,[Hapalosiphon hibernicus]BZ-3-1
CyanoMetDB_1783,[D?Asp³]MC-VA,,Microcystin,,C44H63N7O12,881.4534708,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C44H63N7O12/c1-23(2)37-42(58)49-33(44(61)62)22-35(52)45-27(6)39(55)47-31(17-16-24(3)20-25(4)34(63-10)21-30-14-12-11-13-15-30)26(5)38(54)48-32(43(59)60)18-19-36(53)51(9)29(8)41(57)46-28(7)40(56)50-37/h11-17,20,23,25-28,31-34,37H,8,18-19,21-22H2,1-7,9-10H3,(H,45,52)(H,46,57)(H,47,55)(H,48,54)(H,49,58)(H,50,56)(H,59,60)(H,61,62)/b17-16+,24-20+/t25-,26-,27-,28+,31-,32+,33+,34-,37-/m0/s1",RBZCKDFHDZZPOQ-FTJZKGJUSA-N,146684714,no,Hapalosiphon,hibernicus,[Hapalosiphon hibernicus]BZ-3-1
CyanoMetDB_1784,MC-VA,,Microcystin,,C45H65N7O12,895.4691208,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C45H65N7O12/c1-23(2)36-43(59)51-37(45(62)63)27(6)39(55)46-28(7)40(56)48-32(18-17-24(3)21-25(4)34(64-11)22-31-15-13-12-14-16-31)26(5)38(54)49-33(44(60)61)19-20-35(53)52(10)30(9)42(58)47-29(8)41(57)50-36/h12-18,21,23,25-29,32-34,36-37H,9,19-20,22H2,1-8,10-11H3,(H,46,55)(H,47,58)(H,48,56)(H,49,54)(H,50,57)(H,51,59)(H,60,61)(H,62,63)/b18-17+,24-21+/t25-,26-,27-,28-,29+,32-,33+,34-,36-,37+/m0/s1",IFVHFRYOHFIXJA-JDFQIOQSSA-N,146684715,no,Hapalosiphon,hibernicus,[Hapalosiphon hibernicus]BZ-3-1
CyanoMetDB_1785,[D-Asp3]MC-LA,,Microcystin,,C45H65N7O12,895.4691208,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C45H65N7O12/c1-24(2)20-34-43(59)51-35(45(62)63)23-37(53)46-28(6)40(56)48-32(17-16-25(3)21-26(4)36(64-10)22-31-14-12-11-13-15-31)27(5)39(55)49-33(44(60)61)18-19-38(54)52(9)30(8)42(58)47-29(7)41(57)50-34/h11-17,21,24,26-29,32-36H,8,18-20,22-23H2,1-7,9-10H3,(H,46,53)(H,47,58)(H,48,56)(H,49,55)(H,50,57)(H,51,59)(H,60,61)(H,62,63)/b17-16+,25-21+/t26-,27-,28-,29+,32-,33+,34-,35+,36-/m0/s1",IEIRNZAKAQISQH-KEGFNAPLSA-N,146683852,no,Microcystis,aeruginosa,[Microcystis aeruginosa]B2666
CyanoMetDB_1786,[Dha7]MC-LA,,Microcystin,,C45H65N7O12,895.4691208,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C45H65N7O12/c1-23(2)20-34-43(59)52-37(45(62)63)27(6)39(55)47-29(8)41(57)49-32(17-16-24(3)21-25(4)35(64-10)22-31-14-12-11-13-15-31)26(5)38(54)50-33(44(60)61)18-19-36(53)46-28(7)40(56)48-30(9)42(58)51-34/h11-17,21,23,25-27,29-30,32-35,37H,7,18-20,22H2,1-6,8-10H3,(H,46,53)(H,47,55)(H,48,56)(H,49,57)(H,50,54)(H,51,58)(H,52,59)(H,60,61)(H,62,63)/b17-16+,24-21+/t25-,26-,27-,29-,30+,32-,33+,34-,35-,37+/m0/s1",RMWLEIURXQBESL-OOMCYYCHSA-N,146684716,no,Hapalosiphon,hibernicus,[Hapalosiphon hibernicus]BZ-3-1
CyanoMetDB_1787,[DMAdda5]MC?LA,,Microcystin,,C45H65N7O12,895.4691208,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C45H65N7O12/c1-23(2)20-34-43(60)51-37(45(63)64)27(6)39(56)46-28(7)40(57)48-32(17-16-24(3)21-25(4)35(53)22-31-14-12-11-13-15-31)26(5)38(55)49-33(44(61)62)18-19-36(54)52(10)30(9)42(59)47-29(8)41(58)50-34/h11-17,21,23,25-29,32-35,37,53H,9,18-20,22H2,1-8,10H3,(H,46,56)(H,47,59)(H,48,57)(H,49,55)(H,50,58)(H,51,60)(H,61,62)(H,63,64)/b17-16+,24-21+/t25-,26-,27-,28-,29+,32-,33+,34-,35-,37+/m0/s1",SPMKPKQNTFKRRN-NLLIVGSUSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1788,[DMAdda5]MC-LR,O?demethyl?MC?LR,Microcystin,,C48H72N10O12,980.5331181,C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)CCCN=C(N)N)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)O)/C,"InChI=1S/C48H72N10O12/c1-25(2)22-36-45(66)57-39(47(69)70)29(6)41(62)54-34(16-13-21-51-48(49)50)44(65)53-33(18-17-26(3)23-27(4)37(59)24-32-14-11-10-12-15-32)28(5)40(61)55-35(46(67)68)19-20-38(60)58(9)31(8)43(64)52-30(7)42(63)56-36/h10-12,14-15,17-18,23,25,27-30,33-37,39,59H,8,13,16,19-22,24H2,1-7,9H3,(H,52,64)(H,53,65)(H,54,62)(H,55,61)(H,56,63)(H,57,66)(H,67,68)(H,69,70)(H4,49,50,51)/b18-17+,26-23+/t27-,28-,29-,30+,33-,34-,35+,36-,37-,39+/m0/s1",IYDKWWDUBYWQGF-ZVCLVCPPSA-N,101641983,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1789,[D?Asp³]MC?LV,,Microcystin,,C47H69N7O12,923.500421,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)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]1C)C(=O)O)C(=O)O)C(C)C)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H69N7O12/c1-25(2)21-35-44(60)52-36(47(64)65)24-38(55)53-40(26(3)4)45(61)49-33(18-17-27(5)22-28(6)37(66-11)23-32-15-13-12-14-16-32)29(7)41(57)50-34(46(62)63)19-20-39(56)54(10)31(9)43(59)48-30(8)42(58)51-35/h12-18,22,25-26,28-30,33-37,40H,9,19-21,23-24H2,1-8,10-11H3,(H,48,59)(H,49,61)(H,50,57)(H,51,58)(H,52,60)(H,53,55)(H,62,63)(H,64,65)/b18-17+,27-22+/t28-,29-,30+,33-,34+,35-,36+,37-,40-/m0/s1",OFWRHWYXGMTEEE-CTLQKDTCSA-N,146684717,no,Hapalosiphon,hibernicus,[Hapalosiphon hibernicus]BZ-3-1
CyanoMetDB_1790,MC-LAba,"MC-LAbu, MC?LAib",Microcystin,,C47H69N7O12,923.500421,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H69N7O12/c1-12-33-44(60)50-34(19-18-26(4)23-27(5)37(66-11)24-32-16-14-13-15-17-32)28(6)40(56)51-35(46(62)63)20-21-38(55)54(10)31(9)43(59)48-30(8)42(58)52-36(22-25(2)3)45(61)53-39(47(64)65)29(7)41(57)49-33/h13-19,23,25,27-30,33-37,39H,9,12,20-22,24H2,1-8,10-11H3,(H,48,59)(H,49,57)(H,50,60)(H,51,56)(H,52,58)(H,53,61)(H,62,63)(H,64,65)/b19-18+,26-23+/t27-,28-,29-,30+,33-,34-,35+,36-,37-,39+/m0/s1",XPANWVSGPFXZCM-GZGPOYOASA-N,146683898,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1791,"[D?Asp3,D?MeO-Glu6]MC?LAba","[D-Asp3,D-Glu(OMe)6]MC-Labu, [D?Asp3,D?Glu(OMe)6]MC?LAba ",Microcystin,,C47H69N7O12,923.500421,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)NC(=O)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]1C)C(=O)OC)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H69N7O12/c1-12-33-44(60)50-34(19-18-27(4)23-28(5)38(65-10)24-32-16-14-13-15-17-32)29(6)41(57)51-35(47(64)66-11)20-21-40(56)54(9)31(8)43(59)48-30(7)42(58)52-36(22-26(2)3)45(61)53-37(46(62)63)25-39(55)49-33/h13-19,23,26,28-30,33-38H,8,12,20-22,24-25H2,1-7,9-11H3,(H,48,59)(H,49,55)(H,50,60)(H,51,57)(H,52,58)(H,53,61)(H,62,63)/b19-18+,27-23+/t28-,29-,30+,33-,34-,35+,36-,37+,38-/m0/s1",MBMJHNCKPVQQHC-DLKNYIFCSA-N,146683863,no,Microcystis,aeruginosa,[Microcystis aeruginosa]UTEX-2666
CyanoMetDB_1792,"[D-Asp³,Dha7]MC?YA",,Microcystin,,C47H61N7O13,931.4327353,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)C[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H61N7O13/c1-25(21-26(2)38(67-7)23-31-11-9-8-10-12-31)13-18-34-27(3)41(58)52-35(46(63)64)19-20-39(56)48-28(4)42(59)50-30(6)44(61)53-36(22-32-14-16-33(55)17-15-32)45(62)54-37(47(65)66)24-40(57)49-29(5)43(60)51-34/h8-18,21,26-27,29-30,34-38,55H,4,19-20,22-24H2,1-3,5-7H3,(H,48,56)(H,49,57)(H,50,59)(H,51,60)(H,52,58)(H,53,61)(H,54,62)(H,63,64)(H,65,66)/b18-13+,25-21+/t26-,27-,29-,30+,34-,35+,36-,37+,38-/m0/s1",MGAZKNAKSAZXDT-QKQRECLSSA-N,146683860,no,Microcystis,aeruginosa,[Microcystis aeruginosa]BGSD 243
CyanoMetDB_1793,[D-Asp3]MC-LL,,Microcystin,,C48H71N7O12,937.516071,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H71N7O12/c1-26(2)21-36-45(61)51-34(18-17-28(5)23-29(6)39(67-11)24-33-15-13-12-14-16-33)30(7)42(58)52-35(47(63)64)19-20-41(57)55(10)32(9)44(60)49-31(8)43(59)53-37(22-27(3)4)46(62)54-38(48(65)66)25-40(56)50-36/h12-18,23,26-27,29-31,34-39H,9,19-22,24-25H2,1-8,10-11H3,(H,49,60)(H,50,56)(H,51,61)(H,52,58)(H,53,59)(H,54,62)(H,63,64)(H,65,66)/b18-17+,28-23+/t29-,30-,31+,34-,35+,36-,37-,38+,39-/m0/s1",XJIZHUWILPFIOA-IHYVCQHASA-N,146683853,no,Microcystis,aeruginosa,[Microcystis aeruginosa]B2666
CyanoMetDB_1794,[NMe-Ser7]MC-LR,[Mser7]MC-LR,Microcystin,,C49H76N10O13,1012.559333,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC\N=C(/N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CO)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)CC(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H76N10O13/c1-26(2)22-36-45(66)58-40(48(70)71)30(6)42(63)55-34(16-13-21-52-49(50)51)44(65)54-33(18-17-27(3)23-28(4)38(72-9)24-32-14-11-10-12-15-32)29(5)41(62)56-35(47(68)69)19-20-39(61)59(8)37(25-60)46(67)53-31(7)43(64)57-36/h10-12,14-15,17-18,23,26,28-31,33-38,40,60H,13,16,19-22,24-25H2,1-9H3,(H,53,67)(H,54,65)(H,55,63)(H,56,62)(H,57,64)(H,58,66)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,27-23+/t28-,29-,30-,31+,33-,34-,35+,36-,37-,38-,40+/m0/s1",OXWGDZCZZKVNKF-AEBVJMRDSA-N,10418538,yes,n.a.,n.a.,n.a.
CyanoMetDB_1795,[seco?4/5]MC?LR,Acyclo?LR: Adda?D?Glu(?)?Mdha?D?Ala?L?Leu?D?MeAsp(?)?L?Arg?OH,Microcystin,linear microcystin,C49H76N10O13,1012.559333,O=C(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](C)[C@@H](N)/C=C/C(/C)=C/[C@H](C)[C@@H](OC)Cc1ccccc1)C(=O)O)C(=O)O,"InChI=1S/C49H76N10O13/c1-26(2)23-37(45(65)58-40(48(70)71)30(6)42(62)55-35(46(66)67)17-14-22-53-49(51)52)57-43(63)31(7)54-44(64)32(8)59(9)39(60)21-20-36(47(68)69)56-41(61)29(5)34(50)19-18-27(3)24-28(4)38(72-10)25-33-15-12-11-13-16-33/h11-13,15-16,18-19,24,26,28-31,34-38,40H,8,14,17,20-23,25,50H2,1-7,9-10H3,(H,54,64)(H,55,62)(H,56,61)(H,57,63)(H,58,65)(H,66,67)(H,68,69)(H,70,71)(H4,51,52,53)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1",ROJYIJPCSICOBH-GWRQVWKTSA-N,139585701,yes,Microcystis; Dolichospermum/Anabaena,[Microcystis]sp.; [Dolicospermum]sp.,[Dolichospermum flos-aquae]NIVA-CYA 656
CyanoMetDB_1796,MC-FA,,Microcystin,,C49H65N7O12,943.4691208,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H65N7O12/c1-27(24-28(2)39(68-9)26-35-18-14-11-15-19-35)20-21-36-29(3)42(58)53-37(48(64)65)22-23-40(57)56(8)33(7)46(62)51-32(6)45(61)54-38(25-34-16-12-10-13-17-34)47(63)55-41(49(66)67)30(4)43(59)50-31(5)44(60)52-36/h10-21,24,28-32,36-39,41H,7,22-23,25-26H2,1-6,8-9H3,(H,50,59)(H,51,62)(H,52,60)(H,53,58)(H,54,61)(H,55,63)(H,64,65)(H,66,67)/b21-20+,27-24+/t28-,29-,30-,31-,32+,36-,37+,38-,39-,41+/m0/s1",CQSVGARFVXWFCH-MGMRBZFQSA-N,139587197,yes,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1797,[seco?1/2]MC?LR,L?Leu?D?MeAsp(?)?L?Arg?Adda?D?Glu(?)?Mdha?D?Ala?OH ,Microcystin,,C49H76N10O13,1012.559333,O=C(O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](N)CC(C)C)C(=O)O)/C=C/C(/C)=C/[C@H](C)[C@@H](OC)Cc1ccccc1)C(=O)O,"InChI=1S/C49H76N10O13/c1-26(2)23-34(50)44(64)58-40(48(70)71)30(6)42(62)56-36(17-14-22-53-49(51)52)45(65)55-35(19-18-27(3)24-28(4)38(72-10)25-33-15-12-11-13-16-33)29(5)41(61)57-37(47(68)69)20-21-39(60)59(9)32(8)43(63)54-31(7)46(66)67/h11-13,15-16,18-19,24,26,28-31,34-38,40H,8,14,17,20-23,25,50H2,1-7,9-10H3,(H,54,63)(H,55,65)(H,56,62)(H,57,61)(H,58,64)(H,66,67)(H,68,69)(H,70,71)(H4,51,52,53)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35-,36-,37+,38-,40+/m0/s1",IENVPMAERSWHAY-RNJNOEPSSA-N,139583203,yes,Microcystis,sp.,n.a.
CyanoMetDB_1798,MC-AR,,Microcystin,,C46H68N10O12,952.5018179,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C46H68N10O12/c1-24(22-25(2)35(68-9)23-31-14-11-10-12-15-31)17-18-32-26(3)38(58)54-34(44(64)65)19-20-36(57)56(8)30(7)42(62)51-28(5)40(60)50-29(6)41(61)55-37(45(66)67)27(4)39(59)53-33(43(63)52-32)16-13-21-49-46(47)48/h10-12,14-15,17-18,22,25-29,32-35,37H,7,13,16,19-21,23H2,1-6,8-9H3,(H,50,60)(H,51,62)(H,52,63)(H,53,59)(H,54,58)(H,55,61)(H,64,65)(H,66,67)(H4,47,48,49)/b18-17+,24-22+/t25-,26-,27-,28+,29-,32-,33-,34+,35-,37+/m0/s1",PIBNCDNEMSHYQS-QBBRADEDSA-N,101619975,yes,n.a.,n.a.,n.a.
CyanoMetDB_1799,[D-Asp³]MC-RAba,[D-Asp³]MC-RAbu,Microcystin,,C46H68N10O12,952.5018179,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C46H68N10O12/c1-9-31-42(62)52-32(18-17-25(2)22-26(3)36(68-8)23-30-14-11-10-12-15-30)27(4)39(59)54-34(44(64)65)19-20-38(58)56(7)29(6)41(61)50-28(5)40(60)53-33(16-13-21-49-46(47)48)43(63)55-35(45(66)67)24-37(57)51-31/h10-12,14-15,17-18,22,26-28,31-36H,6,9,13,16,19-21,23-24H2,1-5,7-8H3,(H,50,61)(H,51,57)(H,52,62)(H,53,60)(H,54,59)(H,55,63)(H,64,65)(H,66,67)(H4,47,48,49)/b18-17+,25-22+/t26-,27-,28+,31-,32-,33-,34+,35+,36-/m0/s1",BIUWGLKOUISESS-LQCHMJEGSA-N,146683815,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1800,MC?FR,,Microcystin,,C52H72N10O12,1028.533118,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H72N10O12/c1-29(26-30(2)41(74-8)28-36-18-13-10-14-19-36)21-22-37-31(3)44(64)59-39(50(70)71)23-24-42(63)62(7)34(6)47(67)56-33(5)46(66)60-40(27-35-16-11-9-12-17-35)49(69)61-43(51(72)73)32(4)45(65)58-38(48(68)57-37)20-15-25-55-52(53)54/h9-14,16-19,21-22,26,30-33,37-41,43H,6,15,20,23-25,27-28H2,1-5,7-8H3,(H,56,67)(H,57,68)(H,58,65)(H,59,64)(H,60,66)(H,61,69)(H,70,71)(H,72,73)(H4,53,54,55)/b22-21+,29-26+/t30-,31-,32-,33+,37-,38-,39+,40-,41-,43+/m0/s1",NCIZAPYSXYPFOU-POWPIGGBSA-N,101619974,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]WR 70
CyanoMetDB_1801,MC-FAba,MC-FAbu ,Microcystin,,C50H67N7O12,957.4847709,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H67N7O12/c1-10-36-47(63)53-37(22-21-28(2)25-29(3)40(69-9)27-35-19-15-12-16-20-35)30(4)43(59)54-38(49(65)66)23-24-41(58)57(8)33(7)46(62)51-32(6)45(61)55-39(26-34-17-13-11-14-18-34)48(64)56-42(50(67)68)31(5)44(60)52-36/h11-22,25,29-32,36-40,42H,7,10,23-24,26-27H2,1-6,8-9H3,(H,51,62)(H,52,60)(H,53,63)(H,54,59)(H,55,61)(H,56,64)(H,65,66)(H,67,68)/b22-21+,28-25+/t29-,30-,31-,32+,36-,37-,38+,39-,40-,42+/m0/s1",ODVYEKWJJWPDCB-PMAKFENQSA-N,146683816,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1802,MC-RR,"Cyanoviridin-RR, Cyanogenosin-RR",Microcystin,,C49H75N13O12,1037.565815,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=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,6438357,yes,Microcystis,viridis,n.a.
CyanoMetDB_1803,[seco?1/2]MC?FR,L?Phe?D?MeAsp(?)?L?Arg?Adda?D?Glu(?)?Mdha?D?Ala?OH,Microcystin,,C52H74N10O13,1046.543683,O=C(N(C)C(C(N[C@@H](C(O)=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N)CC2=CC=CC=C2)=O)=O)=O)=O,"InChI=1S/C52H74N10O13/c1-29(26-30(2)41(75-8)28-36-18-13-10-14-19-36)21-22-38(31(3)44(64)60-40(50(71)72)23-24-42(63)62(7)34(6)46(66)57-33(5)49(69)70)58-48(68)39(20-15-25-56-52(54)55)59-45(65)32(4)43(51(73)74)61-47(67)37(53)27-35-16-11-9-12-17-35/h9-14,16-19,21-22,26,30-33,37-41,43H,6,15,20,23-25,27-28,53H2,1-5,7-8H3,(H,57,66)(H,58,68)(H,59,65)(H,60,64)(H,61,67)(H,69,70)(H,71,72)(H,73,74)(H4,54,55,56)/b22-21+,29-26+/t30-,31-,32-,33+,37-,38-,39-,40+,41-,43+/m0/s1",NGLPKMLVTYMODN-UUUMXHOZSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1804,[D-Asp³]MC-RA,,Microcystin,,C45H66N10O12,938.4861679,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C45H66N10O12/c1-24(21-25(2)35(67-8)22-30-13-10-9-11-14-30)16-17-31-26(3)38(58)53-33(43(63)64)18-19-37(57)55(7)29(6)41(61)50-28(5)40(60)52-32(15-12-20-48-45(46)47)42(62)54-34(44(65)66)23-36(56)49-27(4)39(59)51-31/h9-11,13-14,16-17,21,25-28,31-35H,6,12,15,18-20,22-23H2,1-5,7-8H3,(H,49,56)(H,50,61)(H,51,59)(H,52,60)(H,53,58)(H,54,62)(H,63,64)(H,65,66)(H4,46,47,48)/b17-16+,24-21+/t25-,26-,27-,28+,31-,32-,33+,34+,35-/m0/s1",FXSKUDKICQOZGL-JEPMYZTKSA-N,146684718,no,Hapalosiphon; Microcystis,[Hapalosiphon]hibernicus; [Microcystis]sp.,[Hapalosiphon hibernicus]BZ-3-1;[Microcystis sp.]CAWBG11
CyanoMetDB_1805,MC?AHar,,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O12/c1-25(23-26(2)36(69-9)24-32-15-11-10-12-16-32)18-19-33-27(3)39(59)55-35(45(65)66)20-21-37(58)57(8)31(7)43(63)52-29(5)41(61)51-30(6)42(62)56-38(46(67)68)28(4)40(60)54-34(44(64)53-33)17-13-14-22-50-47(48)49/h10-12,15-16,18-19,23,26-30,33-36,38H,7,13-14,17,20-22,24H2,1-6,8-9H3,(H,51,61)(H,52,63)(H,53,64)(H,54,60)(H,55,59)(H,56,62)(H,65,66)(H,67,68)(H4,48,49,50)/b19-18+,25-23+/t26-,27-,28-,29+,30-,33-,34-,35+,36-,38+/m0/s1",BMWJSAZEZUBFNG-HQXMUDDSSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1806,"[D?Asp³,DMAdda5]MC?LR",,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)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]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C47H70N10O12/c1-25(2)21-35-44(65)56-36(46(68)69)24-38(59)52-33(15-12-20-50-47(48)49)43(64)53-32(17-16-26(3)22-27(4)37(58)23-31-13-10-9-11-14-31)28(5)40(61)54-34(45(66)67)18-19-39(60)57(8)30(7)42(63)51-29(6)41(62)55-35/h9-11,13-14,16-17,22,25,27-29,32-37,58H,7,12,15,18-21,23-24H2,1-6,8H3,(H,51,63)(H,52,59)(H,53,64)(H,54,61)(H,55,62)(H,56,65)(H,66,67)(H,68,69)(H4,48,49,50)/b17-16+,26-22+/t27-,28-,29+,32-,33-,34+,35-,36+,37-/m0/s1",FYRAXCGEXQMBHA-RHFXSWBISA-N,146684737,no,Nostoc,sp.,[Nostoc sp.]UK18
CyanoMetDB_1807,"[Asp³,DMAdda5,Dhb7]MC?LR",,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C47H70N10O12/c1-8-31-42(63)51-29(7)41(62)56-35(21-25(2)3)44(65)57-36(46(68)69)24-39(60)53-33(15-12-20-50-47(48)49)43(64)54-32(28(6)40(61)55-34(45(66)67)18-19-38(59)52-31)17-16-26(4)22-27(5)37(58)23-30-13-10-9-11-14-30/h8-11,13-14,16-17,22,25,27-29,32-37,58H,12,15,18-21,23-24H2,1-7H3,(H,51,63)(H,52,59)(H,53,60)(H,54,64)(H,55,61)(H,56,62)(H,57,65)(H,66,67)(H,68,69)(H4,48,49,50)/b17-16+,26-22+,31-8?/t27-,28-,29+,32-,33-,34+,35-,36+,37-/m0/s1",UYJLVJJFDLREAV-OHXBTAIVSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1808,"[Gly1,D-Asp3,Dhb7]MC-LR",,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)CCCNC(=N)N)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O12/c1-8-31-42(62)51-25-40(60)54-35(21-26(2)3)44(64)57-36(46(67)68)24-39(59)53-33(15-12-20-50-47(48)49)43(63)55-32(29(6)41(61)56-34(45(65)66)18-19-38(58)52-31)17-16-27(4)22-28(5)37(69-7)23-30-13-10-9-11-14-30/h8-11,13-14,16-17,22,26,28-29,32-37H,12,15,18-21,23-25H2,1-7H3,(H,51,62)(H,52,58)(H,53,59)(H,54,60)(H,55,63)(H,56,61)(H,57,64)(H,65,66)(H,67,68)(H4,48,49,50)/b17-16+,27-22+,31-8?/t28-,29-,32-,33-,34+,35-,36+,37-/m0/s1",JWJFTKPARURZJD-GNURSVSOSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1809,[D-Asp3]MC-HarAba,[D-Asp3]MC-HarAbu,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)NC(=O)C[C@@H](NC(=O)[C@H](CCCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O12/c1-9-32-43(63)53-33(19-18-26(2)23-27(3)37(69-8)24-31-15-11-10-12-16-31)28(4)40(60)55-35(45(65)66)20-21-39(59)57(7)30(6)42(62)51-29(5)41(61)54-34(17-13-14-22-50-47(48)49)44(64)56-36(46(67)68)25-38(58)52-32/h10-12,15-16,18-19,23,27-29,32-37H,6,9,13-14,17,20-22,24-25H2,1-5,7-8H3,(H,51,62)(H,52,58)(H,53,63)(H,54,61)(H,55,60)(H,56,64)(H,65,66)(H,67,68)(H4,48,49,50)/b19-18+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1",QGPGQAYAXHVIEF-VCTGLOHFSA-N,146683861,no,n.a.,n.a.,n.a.
CyanoMetDB_1810,"[Gly1,D-Asp3]MC-LR",,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O12/c1-26(2)21-35-44(64)56-36(46(67)68)24-38(58)52-33(15-12-20-50-47(48)49)43(63)54-32(17-16-27(3)22-28(4)37(69-8)23-31-13-10-9-11-14-31)29(5)41(61)55-34(45(65)66)18-19-40(60)57(7)30(6)42(62)51-25-39(59)53-35/h9-11,13-14,16-17,22,26,28-29,32-37H,6,12,15,18-21,23-25H2,1-5,7-8H3,(H,51,62)(H,52,58)(H,53,59)(H,54,63)(H,55,61)(H,56,64)(H,65,66)(H,67,68)(H4,48,49,50)/b17-16+,27-22+/t28-,29-,32-,33-,34+,35-,36+,37-/m0/s1",UHGAEMBYJRDQQV-JQHMHAMLSA-N,146683832,no,n.a.,n.a.,n.a.
CyanoMetDB_1811,[D-Asp³]MC-WA,,Microcystin,,C50H64N8O12,968.4643698,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)C[C@@H](NC(=O)[C@H](Cc2c[NH]c3ccccc32)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H64N8O12/c1-27(22-28(2)41(70-8)23-33-14-10-9-11-15-33)18-19-36-29(3)44(61)55-38(49(66)67)20-21-43(60)58(7)32(6)47(64)53-31(5)46(63)56-39(24-34-26-51-37-17-13-12-16-35(34)37)48(65)57-40(50(68)69)25-42(59)52-30(4)45(62)54-36/h9-19,22,26,28-31,36,38-41,51H,6,20-21,23-25H2,1-5,7-8H3,(H,52,59)(H,53,64)(H,54,62)(H,55,61)(H,56,63)(H,57,65)(H,66,67)(H,68,69)/b19-18+,27-22+/t28-,29-,30-,31+,36-,38+,39-,40+,41-/m0/s1",YHSLBZZOBKSXCV-RQZXCYPXSA-N,146683817,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1812,[D-Asp3]MC-EE,,Microcystin,,C46H63N7O16,969.433129,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)O)NC(=O)C[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C46H63N7O16/c1-24(21-25(2)35(69-7)22-29-11-9-8-10-12-29)13-14-30-26(3)40(60)51-33(45(65)66)15-18-37(55)53(6)28(5)42(62)47-27(4)41(61)50-32(17-20-39(58)59)44(64)52-34(46(67)68)23-36(54)48-31(43(63)49-30)16-19-38(56)57/h8-14,21,25-27,30-35H,5,15-20,22-23H2,1-4,6-7H3,(H,47,62)(H,48,54)(H,49,63)(H,50,61)(H,51,60)(H,52,64)(H,56,57)(H,58,59)(H,65,66)(H,67,68)/b14-13+,24-21+/t25-,26-,27+,30-,31-,32-,33+,34+,35-/m0/s1",RRMMYXRMUVPVRF-NSKJAONYSA-N,146683811,no,Planktothrix ,prolifica ,NIVA-CYA 544
CyanoMetDB_1813,"[D-Asp3,Dha7]MC-EE(OMe)",,Microcystin,,C46H63N7O16,969.4331293,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)OC)NC(=O)C[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C46H63N7O16/c1-24(21-25(2)35(68-6)22-29-11-9-8-10-12-29)13-14-30-26(3)40(59)52-33(45(64)65)15-18-36(54)47-27(4)41(60)48-28(5)42(61)51-32(16-19-38(56)57)44(63)53-34(46(66)67)23-37(55)49-31(43(62)50-30)17-20-39(58)69-7/h8-14,21,25-26,28,30-35H,4,15-20,22-23H2,1-3,5-7H3,(H,47,54)(H,48,60)(H,49,55)(H,50,62)(H,51,61)(H,52,59)(H,53,63)(H,56,57)(H,64,65)(H,66,67)/b14-13+,24-21+/t25-,26-,28+,30-,31-,32-,33+,34+,35-/m0/s1",CKZSVUYCUATPFE-ZEHFFRFMSA-N,146683842,no,Anabaena,n.a.,[Anabaena sp.]186
CyanoMetDB_1814,MC-LM,,Microcystin,,C48H71N7O12S,969.4881417,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCSC)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H71N7O12S/c1-26(2)23-37-46(62)54-40(48(65)66)30(6)42(58)51-35(21-22-68-11)45(61)50-34(18-17-27(3)24-28(4)38(67-10)25-33-15-13-12-14-16-33)29(5)41(57)52-36(47(63)64)19-20-39(56)55(9)32(8)44(60)49-31(7)43(59)53-37/h12-18,24,26,28-31,34-38,40H,8,19-23,25H2,1-7,9-11H3,(H,49,60)(H,50,61)(H,51,58)(H,52,57)(H,53,59)(H,54,62)(H,63,64)(H,65,66)/b18-17+,27-24+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1",KZWVAQXKWCQPOF-XREXUNHVSA-N,146684695,no,Microcystis,aeruginosa,n.a.
CyanoMetDB_1815,MC-VF,,Microcystin,,C51H69N7O12,971.500421,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H69N7O12/c1-28(2)42-49(65)57-43(51(68)69)32(6)45(61)55-39(26-35-17-13-11-14-18-35)48(64)53-37(22-21-29(3)25-30(4)40(70-10)27-36-19-15-12-16-20-36)31(5)44(60)54-38(50(66)67)23-24-41(59)58(9)34(8)47(63)52-33(7)46(62)56-42/h11-22,25,28,30-33,37-40,42-43H,8,23-24,26-27H2,1-7,9-10H3,(H,52,63)(H,53,64)(H,54,60)(H,55,61)(H,56,62)(H,57,65)(H,66,67)(H,68,69)/b22-21+,29-25+/t30-,31-,32-,33+,37-,38+,39-,40-,42-,43+/m0/s1",PBXDBYLJLRGSMP-LKCZJABDSA-N,146684697,no,Microcystis,aeruginosa,[Microcystis aeruginosa]PCC7820
CyanoMetDB_1816,MC-RAba,MC?RAbu,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O12/c1-10-32-43(63)53-33(19-18-25(2)23-26(3)36(69-9)24-31-15-12-11-13-16-31)27(4)39(59)55-35(45(65)66)20-21-37(58)57(8)30(7)42(62)51-29(6)41(61)54-34(17-14-22-50-47(48)49)44(64)56-38(46(67)68)28(5)40(60)52-32/h11-13,15-16,18-19,23,26-29,32-36,38H,7,10,14,17,20-22,24H2,1-6,8-9H3,(H,51,62)(H,52,60)(H,53,63)(H,54,61)(H,55,59)(H,56,64)(H,65,66)(H,67,68)(H4,48,49,50)/b19-18+,25-23+/t26-,27-,28-,29+,32-,33-,34-,35+,36-,38+/m0/s1",WXXHHUKDBIZLGN-WGWRYDTPSA-N,146684761,no,Microcystis,sp.,n.a.
CyanoMetDB_1817,MC-YAba,MC?YAbu,Microcystin,,C50H67N7O13,973.4796855,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H67N7O13/c1-10-36-47(64)53-37(21-16-27(2)24-28(3)40(70-9)26-33-14-12-11-13-15-33)29(4)43(60)54-38(49(66)67)22-23-41(59)57(8)32(7)46(63)51-31(6)45(62)55-39(25-34-17-19-35(58)20-18-34)48(65)56-42(50(68)69)30(5)44(61)52-36/h11-21,24,28-31,36-40,42,58H,7,10,22-23,25-26H2,1-6,8-9H3,(H,51,63)(H,52,61)(H,53,64)(H,54,60)(H,55,62)(H,56,65)(H,66,67)(H,68,69)/b21-16+,27-24+/t28-,29-,30-,31+,36-,37-,38+,39-,40-,42+/m0/s1",YKLLLBNAMZGEMS-BIOYDOLKSA-N,146684754,no,n.a.,n.a.,n.a.
CyanoMetDB_1818,"[D-Asp3,Dha7]MC?LY",,Microcystin,,C50H67N7O13,973.4796855,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H67N7O13/c1-27(2)22-38-47(64)57-40(50(68)69)26-43(60)53-39(24-34-15-17-35(58)18-16-34)48(65)54-36(19-14-28(3)23-29(4)41(70-8)25-33-12-10-9-11-13-33)30(5)44(61)55-37(49(66)67)20-21-42(59)51-31(6)45(62)52-32(7)46(63)56-38/h9-19,23,27,29-30,32,36-41,58H,6,20-22,24-26H2,1-5,7-8H3,(H,51,59)(H,52,62)(H,53,60)(H,54,65)(H,55,61)(H,56,63)(H,57,64)(H,66,67)(H,68,69)/b19-14+,28-23+/t29-,30-,32+,36-,37+,38-,39-,40+,41-/m0/s1",XUJFVYZYMHMSRZ-CANMJJLKSA-N,,no,Microcystis,aeruginosa,[Microcystis aeruginosa]CYA548
CyanoMetDB_1819,"[Gly1,D-Asp3]MC-LHar",,Microcystin,,C48H72N10O12,980.5331178,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12/c1-27(2)22-36-45(65)57-37(47(68)69)25-39(59)53-34(16-12-13-21-51-48(49)50)44(64)55-33(18-17-28(3)23-29(4)38(70-8)24-32-14-10-9-11-15-32)30(5)42(62)56-35(46(66)67)19-20-41(61)58(7)31(6)43(63)52-26-40(60)54-36/h9-11,14-15,17-18,23,27,29-30,33-38H,6,12-13,16,19-22,24-26H2,1-5,7-8H3,(H,52,63)(H,53,59)(H,54,60)(H,55,64)(H,56,62)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,28-23+/t29-,30-,33-,34-,35+,36-,37+,38-/m0/s1",JSPVTQVNXUVMTI-GYSRTOPMSA-N,146683833,no,n.a.,n.a.,n.a.
CyanoMetDB_1820,"[D-Asp3,(E)-Dhb7]MC-LR",,Microcystin,,C48H72N10O12,980.5331181,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C\C)/NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12/c1-9-32-43(63)52-30(7)42(62)57-36(22-26(2)3)45(65)58-37(47(68)69)25-40(60)54-34(16-13-21-51-48(49)50)44(64)55-33(29(6)41(61)56-35(46(66)67)19-20-39(59)53-32)18-17-27(4)23-28(5)38(70-8)24-31-14-11-10-12-15-31/h9-12,14-15,17-18,23,26,28-30,33-38H,13,16,19-22,24-25H2,1-8H3,(H,52,63)(H,53,59)(H,54,60)(H,55,64)(H,56,61)(H,57,62)(H,58,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,27-23+,32-9+/t28-,29-,30+,33-,34-,35+,36-,37+,38-/m0/s1",VDTOBYMILGRBLM-ZUCGMWCSSA-N,21637043,yes,Oscillatoria/Planktothrix,agardhii,[Oscillatoria agardhii]CCAP 1459/14
CyanoMetDB_1821,[D?Asp3]MC?HilR,[D?Asp3]MC?HilR/HleR,Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](C[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H74N10O12/c1-10-27(2)24-37-46(66)58-38(48(69)70)26-40(60)54-35(17-14-22-52-49(50)51)45(65)55-34(19-18-28(3)23-29(4)39(71-9)25-33-15-12-11-13-16-33)30(5)42(62)56-36(47(67)68)20-21-41(61)59(8)32(7)44(64)53-31(6)43(63)57-37/h11-13,15-16,18-19,23,27,29-31,34-39H,7,10,14,17,20-22,24-26H2,1-6,8-9H3,(H,53,64)(H,54,60)(H,55,65)(H,56,62)(H,57,63)(H,58,66)(H,67,68)(H,69,70)(H4,50,51,52)/b19-18+,28-23+/t27-,29-,30-,31+,34-,35-,36+,37-,38+,39-/m0/s1",XRRFSPPWGAFDRM-UONDCLTESA-N,146684703,yes,Planktothrix; Dolichospermum/Anabaena,[Planktothrix]sp.; [Dolichospermum]sp.,[Planktothrix sp.]Max06;[Dolichospermum sp.]90
CyanoMetDB_1822,MC?HphR,,Microcystin,,C53H74N10O12,1042.548768,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C53H74N10O12/c1-30(28-31(2)42(75-8)29-37-18-13-10-14-19-37)21-23-38-32(3)45(65)61-41(51(71)72)25-26-43(64)63(7)35(6)48(68)57-34(5)47(67)60-40(24-22-36-16-11-9-12-17-36)50(70)62-44(52(73)74)33(4)46(66)59-39(49(69)58-38)20-15-27-56-53(54)55/h9-14,16-19,21,23,28,31-34,38-42,44H,6,15,20,22,24-27,29H2,1-5,7-8H3,(H,57,68)(H,58,69)(H,59,66)(H,60,67)(H,61,65)(H,62,70)(H,71,72)(H,73,74)(H4,54,55,56)/b23-21+,30-28+/t31-,32-,33-,34+,38-,39-,40-,41+,42-,44+/m0/s1",JBHWKMHTUYRELH-CKWYSMNFSA-N,146684779,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_1823,MC-LR,,Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"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,445434,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1824,"[D-Asp3,(Z)-Dhb7]MC-LR",,Microcystin,,C48H72N10O12,980.5331181,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12/c1-9-32-43(63)52-30(7)42(62)57-36(22-26(2)3)45(65)58-37(47(68)69)25-40(60)54-34(16-13-21-51-48(49)50)44(64)55-33(29(6)41(61)56-35(46(66)67)19-20-39(59)53-32)18-17-27(4)23-28(5)38(70-8)24-31-14-11-10-12-15-31/h9-12,14-15,17-18,23,26,28-30,33-38H,13,16,19-22,24-25H2,1-8H3,(H,52,63)(H,53,59)(H,54,60)(H,55,64)(H,56,61)(H,57,62)(H,58,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,27-23+,32-9-/t28-,29-,30+,33-,34-,35+,36-,37+,38-/m0/s1",VDTOBYMILGRBLM-LIEPGKHHSA-N,21635774,yes,Oscillatoria/Planktothrix,agardhii,n.a.
CyanoMetDB_1825,"[Gly1,D-Asp3,(E/Z)-Dhb7]MC-LHar",,Microcystin,,C48H72N10O12,980.5331181,O=C(NC(C(NCC1=O)=O)=CC)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C48H72N10O12/c1-8-32-43(63)52-26-41(61)55-36(22-27(2)3)45(65)58-37(47(68)69)25-40(60)54-34(16-12-13-21-51-48(49)50)44(64)56-33(30(6)42(62)57-35(46(66)67)19-20-39(59)53-32)18-17-28(4)23-29(5)38(70-7)24-31-14-10-9-11-15-31/h8-11,14-15,17-18,23,27,29-30,33-38H,12-13,16,19-22,24-26H2,1-7H3,(H,52,63)(H,53,59)(H,54,60)(H,55,61)(H,56,64)(H,57,62)(H,58,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,28-23+,32-8?/t29-,30-,33-,34-,35+,36-,37+,38-/m0/s1",HPNBXNCKNWSRPX-RYDRMDOGSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1826,MC?RApa,,Microcystin,,C48H72N10O12,980.5331181,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](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]1C)C(=O)O)C(=O)O)C(C)C)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12/c1-25(2)38-45(65)53-33(19-18-26(3)23-27(4)36(70-10)24-32-15-12-11-13-16-32)28(5)40(60)55-35(46(66)67)20-21-37(59)58(9)31(8)43(63)52-30(7)42(62)54-34(17-14-22-51-48(49)50)44(64)57-39(47(68)69)29(6)41(61)56-38/h11-13,15-16,18-19,23,25,27-30,33-36,38-39H,8,14,17,20-22,24H2,1-7,9-10H3,(H,52,63)(H,53,65)(H,54,62)(H,55,60)(H,56,61)(H,57,64)(H,66,67)(H,68,69)(H4,49,50,51)/b19-18+,26-23+/t27-,28-,29-,30+,33-,34-,35+,36-,38-,39+/m0/s1",JTVRQNBTJXUUHH-JKJOTVENSA-N,146684755,no,n.a.,n.a.,n.a.
CyanoMetDB_1827,MC?VR,,Microcystin,,C48H72N10O12,980.5331181,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12/c1-25(2)38-45(65)57-39(47(68)69)29(6)41(61)54-34(17-14-22-51-48(49)50)44(64)53-33(19-18-26(3)23-27(4)36(70-10)24-32-15-12-11-13-16-32)28(5)40(60)55-35(46(66)67)20-21-37(59)58(9)31(8)43(63)52-30(7)42(62)56-38/h11-13,15-16,18-19,23,25,27-30,33-36,38-39H,8,14,17,20-22,24H2,1-7,9-10H3,(H,52,63)(H,53,64)(H,54,61)(H,55,60)(H,56,62)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b19-18+,26-23+/t27-,28-,29-,30+,33-,34-,35+,36-,38-,39+/m0/s1",ZIPMGCZUAQPWCC-JKJOTVENSA-N,,no,Microcystis,aeruginosa,[Microcystis aeruginosa]MK10.10
CyanoMetDB_1828,MC-WA,,Microcystin,,C51H66N8O12,982.4800199,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2c[NH]c3ccccc32)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H66N8O12/c1-27(23-28(2)41(71-9)24-34-15-11-10-12-16-34)19-20-37-29(3)44(61)56-39(50(67)68)21-22-42(60)59(8)33(7)48(65)54-32(6)47(64)57-40(25-35-26-52-38-18-14-13-17-36(35)38)49(66)58-43(51(69)70)30(4)45(62)53-31(5)46(63)55-37/h10-20,23,26,28-32,37,39-41,43,52H,7,21-22,24-25H2,1-6,8-9H3,(H,53,62)(H,54,65)(H,55,63)(H,56,61)(H,57,64)(H,58,66)(H,67,68)(H,69,70)/b20-19+,27-23+/t28-,29-,30-,31-,32+,37-,39+,40-,41-,43+/m0/s1",JRDNHFSGYCALIM-JMEOANFWSA-N,,yes,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1829,MC-AW,,Microcystin,,C51H66N8O12,982.4800199,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2c[NH]c3ccccc32)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H66N8O12/c1-27(23-28(2)41(71-9)24-34-15-11-10-12-16-34)19-20-37-29(3)44(61)56-39(50(67)68)21-22-42(60)59(8)33(7)48(65)54-31(5)46(63)53-32(6)47(64)58-43(51(69)70)30(4)45(62)57-40(49(66)55-37)25-35-26-52-38-18-14-13-17-36(35)38/h10-20,23,26,28-32,37,39-41,43,52H,7,21-22,24-25H2,1-6,8-9H3,(H,53,63)(H,54,65)(H,55,66)(H,56,61)(H,57,62)(H,58,64)(H,67,68)(H,69,70)/b20-19+,27-23+/t28-,29-,30-,31+,32-,37-,39+,40-,41-,43+/m0/s1",ZNVPSQNWXWZTCK-XFZLWYIWSA-N,101052584,yes,n.a.,n.a.,n.a.
CyanoMetDB_1830,"[D-Ser1,D-Asp3,Dha7]MC?LR",,Microcystin,,C47H70N10O13,982.5123826,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O13/c1-25(2)20-34-43(64)56-35(46(68)69)23-39(60)52-32(14-11-19-50-47(48)49)42(63)53-31(16-15-26(3)21-27(4)37(70-7)22-30-12-9-8-10-13-30)28(5)40(61)54-33(45(66)67)17-18-38(59)51-29(6)41(62)57-36(24-58)44(65)55-34/h8-10,12-13,15-16,21,25,27-28,31-37,58H,6,11,14,17-20,22-24H2,1-5,7H3,(H,51,59)(H,52,60)(H,53,63)(H,54,61)(H,55,65)(H,56,64)(H,57,62)(H,66,67)(H,68,69)(H4,48,49,50)/b16-15+,26-21+/t27-,28-,31-,32-,33+,34-,35+,36+,37-/m0/s1",PFBNCGWLTHYUQJ-VPQOBCRSSA-N,146684719,no,Microcystis,viridis,[Microcystis viridis]NIES102
CyanoMetDB_1831,[Dha7]MC-EE(OMe),[Dha7]MC-EE(OMe),Microcystin,,C47H65N7O16,983.4487794,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H65N7O16/c1-24(22-25(2)35(69-7)23-30-12-10-9-11-13-30)14-15-31-26(3)40(59)53-34(46(65)66)16-19-36(55)48-28(5)42(61)49-29(6)43(62)52-32(17-20-37(56)57)45(64)54-39(47(67)68)27(4)41(60)51-33(44(63)50-31)18-21-38(58)70-8/h9-15,22,25-27,29,31-35,39H,5,16-21,23H2,1-4,6-8H3,(H,48,55)(H,49,61)(H,50,63)(H,51,60)(H,52,62)(H,53,59)(H,54,64)(H,56,57)(H,65,66)(H,67,68)/b15-14+,24-22+/t25-,26-,27-,29+,31-,32-,33-,34+,35-,39+/m0/s1",JOQXNOGRNWPZHJ-AFNORIDRSA-N,146683843,no,Anabaena,n.a.,[Anabaena sp.]186
CyanoMetDB_1832,"[D-Asp3,Dha7]MC-E(OMe)E(OMe)",,Microcystin,,C47H65N7O16,983.4487794,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)OC)NC(=O)C[C@@H](NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H65N7O16/c1-25(22-26(2)36(68-6)23-30-12-10-9-11-13-30)14-15-31-27(3)41(59)53-34(46(64)65)16-19-37(55)48-28(4)42(60)49-29(5)43(61)52-33(18-21-40(58)70-8)45(63)54-35(47(66)67)24-38(56)50-32(44(62)51-31)17-20-39(57)69-7/h9-15,22,26-27,29,31-36H,4,16-21,23-24H2,1-3,5-8H3,(H,48,55)(H,49,60)(H,50,56)(H,51,62)(H,52,61)(H,53,59)(H,54,63)(H,64,65)(H,66,67)/b15-14+,25-22+/t26-,27-,29+,31-,32-,33-,34+,35+,36-/m0/s1",HWVHMIUFTWETCB-NPBCHJBDSA-N,146683844,no,Anabaena,n.a.,[Anabaena sp.]186
CyanoMetDB_1833,"[D-Asp3,Ser7]MC-LR",demethyl-[L-Ser7]MC-LR; demethyl-[Ser7]MC-LR,Microcystin,,C47H72N10O13,984.5280327,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H72N10O13/c1-25(2)20-34-43(64)57-35(46(68)69)23-39(60)52-32(14-11-19-50-47(48)49)42(63)54-31(16-15-26(3)21-27(4)37(70-7)22-30-12-9-8-10-13-30)28(5)40(61)55-33(45(66)67)17-18-38(59)53-36(24-58)44(65)51-29(6)41(62)56-34/h8-10,12-13,15-16,21,25,27-29,31-37,58H,11,14,17-20,22-24H2,1-7H3,(H,51,65)(H,52,60)(H,53,59)(H,54,63)(H,55,61)(H,56,62)(H,57,64)(H,66,67)(H,68,69)(H4,48,49,50)/b16-15+,26-21+/t27-,28-,29+,31-,32-,33+,34-,35+,36-,37-/m0/s1",YWSITNAXFNIQML-MJDATHQWSA-N,146684720,no,Anabaena,n.a.,[Anabaena sp.]66A
CyanoMetDB_1834,"[D-Leu1,D-Asp3]MC-LR",,Microcystin,,C51H78N10O12,1022.580068,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H78N10O12/c1-28(2)23-38-47(67)59-39(24-29(3)4)48(68)60-40(50(71)72)27-42(62)55-36(17-14-22-54-51(52)53)46(66)56-35(19-18-30(5)25-31(6)41(73-10)26-34-15-12-11-13-16-34)32(7)44(64)57-37(49(69)70)20-21-43(63)61(9)33(8)45(65)58-38/h11-13,15-16,18-19,25,28-29,31-32,35-41H,8,14,17,20-24,26-27H2,1-7,9-10H3,(H,55,62)(H,56,66)(H,57,64)(H,58,65)(H,59,67)(H,60,68)(H,69,70)(H,71,72)(H4,52,53,54)/b19-18+,30-25+/t31-,32-,35-,36-,37+,38+,39-,40+,41-/m0/s1",AVSMHCMQBTVLHC-IBQQIYNOSA-N,146683869,no,n.a.,n.a.,n.a.
CyanoMetDB_1835,MC-FL,MC-FL,Microcystin,,C52H71N7O12,985.516071,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H71N7O12/c1-29(2)25-40-49(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)57-41(27-36-17-13-11-14-18-36)50(66)58-44(52(69)70)33(6)46(62)56-40/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+/t31-,32-,33-,34+,38-,39+,40-,41-,42-,44+/m0/s1",JNMCFADRRBGAIM-QVWKUIOOSA-N,146683818,no,Microcystis ,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1836,MC-KynA,MC?KynA (oxidized W),Microcystin,,C50H66N8O13,986.4749345,Nc1ccccc1C(=O)C[C@@H]1NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@H](/C=CC(\C)=C\[C@H](C)[C@H](Cc2ccccc2)OC)NC(=O)[C@H](C)NC(=O)[C@@H](C)[C@@H](NC1=O)C(=O)O)C(=O)O,"InChI=1S/C50H66N8O13/c1-26(23-27(2)40(71-9)24-33-15-11-10-12-16-33)19-20-36-28(3)43(61)55-37(49(67)68)21-22-41(60)58(8)32(7)47(65)53-31(6)46(64)56-38(25-39(59)34-17-13-14-18-35(34)51)48(66)57-42(50(69)70)29(4)44(62)52-30(5)45(63)54-36/h10-20,23,27-31,36-38,40,42H,7,21-22,24-25,51H2,1-6,8-9H3,(H,52,62)(H,53,65)(H,54,63)(H,55,61)(H,56,64)(H,57,66)(H,67,68)(H,69,70)/b20-19+,26-23+/t27-,28-,29-,30-,31+,36-,37+,38-,40-,42+/m0/s1",QXEKHQIBOJQMSZ-VTPQHVAHSA-N,,no,Microcystis ,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1837,[D-Asp3]MC-LY,,Microcystin,,C51H69N7O13,987.4953356,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H69N7O13/c1-28(2)23-39-48(65)57-41(51(69)70)27-43(60)53-40(25-35-16-18-36(59)19-17-35)49(66)54-37(20-15-29(3)24-30(4)42(71-9)26-34-13-11-10-12-14-34)31(5)45(62)55-38(50(67)68)21-22-44(61)58(8)33(7)47(64)52-32(6)46(63)56-39/h10-20,24,28,30-32,37-42,59H,7,21-23,25-27H2,1-6,8-9H3,(H,52,64)(H,53,60)(H,54,66)(H,55,62)(H,56,63)(H,57,65)(H,67,68)(H,69,70)/b20-15+,29-24+/t30-,31-,32+,37-,38+,39-,40-,41+,42-/m0/s1",HKCABZRGOQVKMF-XMKUQBJCSA-N,,no,Microcystis,sp.,[Microcystis sp.]CYA548
CyanoMetDB_1838,[NMe-Ser7]MC?YR,[Ser(NMe)7]MC?YR; [Mser7]MC-YR,Microcystin,,C52H74N10O14,1062.538597,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H74N10O14/c1-28(24-29(2)41(76-7)26-33-12-9-8-10-13-33)15-20-36-30(3)44(66)59-38(50(72)73)21-22-42(65)62(6)40(27-63)49(71)56-32(5)46(68)60-39(25-34-16-18-35(64)19-17-34)48(70)61-43(51(74)75)31(4)45(67)58-37(47(69)57-36)14-11-23-55-52(53)54/h8-10,12-13,15-20,24,29-32,36-41,43,63-64H,11,14,21-23,25-27H2,1-7H3,(H,56,71)(H,57,69)(H,58,67)(H,59,66)(H,60,68)(H,61,70)(H,72,73)(H,74,75)(H4,53,54,55)/b20-15+,28-24+/t29-,30-,31-,32+,36-,37-,38+,39-,40-,41-,43+/m0/s1",VCGGYPLSRQMFSB-SNPRYZSRSA-N,146683855,yes,Microcystis,sp.,[Microcystis sp.]AB2011/53 (isolated from Hartbeespoort Dam)
CyanoMetDB_1839,"[Gly1,D-Asp³,ADMAdda5,Dhb7]MC?LR",,Microcystin,,C48H70N10O13,994.5123826,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)CCCNC(=N)N,"InChI=1S/C48H70N10O13/c1-8-32-43(64)52-25-41(62)55-36(21-26(2)3)45(66)58-37(47(69)70)24-40(61)54-34(15-12-20-51-48(49)50)44(65)56-33(29(6)42(63)57-35(46(67)68)18-19-39(60)53-32)17-16-27(4)22-28(5)38(71-30(7)59)23-31-13-10-9-11-14-31/h8-11,13-14,16-17,22,26,28-29,33-38H,12,15,18-21,23-25H2,1-7H3,(H,52,64)(H,53,60)(H,54,61)(H,55,62)(H,56,65)(H,57,63)(H,58,66)(H,67,68)(H,69,70)(H4,49,50,51)/b17-16+,27-22+,32-8?/t28-,29-,33-,34-,35+,36-,37+,38-/m0/s1",KFIUIFFHYOQVQQ-FMOMRVHJSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1840,"[D?Asp³,ADMAdda5]MC?VR",,Microcystin,,C48H70N10O13,994.5123826,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(C)C)C(=O)O,"InChI=1S/C48H70N10O13/c1-25(2)40-45(66)56-36(47(69)70)24-38(60)53-34(16-13-21-51-48(49)50)44(65)54-33(18-17-26(3)22-27(4)37(71-31(8)59)23-32-14-11-10-12-15-32)28(5)41(62)55-35(46(67)68)19-20-39(61)58(9)30(7)43(64)52-29(6)42(63)57-40/h10-12,14-15,17-18,22,25,27-29,33-37,40H,7,13,16,19-21,23-24H2,1-6,8-9H3,(H,52,64)(H,53,60)(H,54,65)(H,55,62)(H,56,66)(H,57,63)(H,67,68)(H,69,70)(H4,49,50,51)/b18-17+,26-22+/t27-,28-,29+,33-,34-,35+,36+,37-,40-/m0/s1",HISFNJANPCSYHI-VVVSBFLZSA-N,146684721,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1841,"[D-Asp3,ADMAdda5,Dha7]MC-LR",,Microcystin,,C48H70N10O13,994.5123826,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C48H70N10O13/c1-25(2)21-36-45(66)58-37(47(69)70)24-40(61)54-34(15-12-20-51-48(49)50)44(65)55-33(17-16-26(3)22-27(4)38(71-31(8)59)23-32-13-10-9-11-14-32)28(5)41(62)56-35(46(67)68)18-19-39(60)52-29(6)42(63)53-30(7)43(64)57-36/h9-11,13-14,16-17,22,25,27-28,30,33-38H,6,12,15,18-21,23-24H2,1-5,7-8H3,(H,52,60)(H,53,63)(H,54,61)(H,55,65)(H,56,62)(H,57,64)(H,58,66)(H,67,68)(H,69,70)(H4,49,50,51)/b17-16+,26-22+/t27-,28-,30+,33-,34-,35+,36-,37+,38-/m0/s1",PEAMJSDEWPXKFC-ZXQKFZIYSA-N,146684722,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1842,"[Gly1,D-Asp3,ADMAdda5]MC-LR",,Microcystin,,C48H70N10O13,994.51238,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C48H70N10O13/c1-26(2)21-36-45(66)57-37(47(69)70)24-39(60)53-34(15-12-20-51-48(49)50)44(65)55-33(17-16-27(3)22-28(4)38(71-31(7)59)23-32-13-10-9-11-14-32)29(5)42(63)56-35(46(67)68)18-19-41(62)58(8)30(6)43(64)52-25-40(61)54-36/h9-11,13-14,16-17,22,26,28-29,33-38H,6,12,15,18-21,23-25H2,1-5,7-8H3,(H,52,64)(H,53,60)(H,54,61)(H,55,65)(H,56,63)(H,57,66)(H,67,68)(H,69,70)(H4,49,50,51)/b17-16+,27-22+/t28-,29-,33-,34-,35+,36-,37+,38-/m0/s1",BUNWICSOQSWSFW-HPRKGSLFSA-N,146683834,no,n.a.,n.a.,n.a.
CyanoMetDB_1843,MC-YM(O),,Microcystin,,C51H69N7O14S,1035.462321,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCS(C)=O)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H69N7O14S/c1-28(25-29(2)41(72-8)27-34-13-11-10-12-14-34)15-20-37-30(3)44(61)55-39(50(67)68)21-22-42(60)58(7)33(6)47(64)52-32(5)46(63)56-40(26-35-16-18-36(59)19-17-35)49(66)57-43(51(69)70)31(4)45(62)54-38(48(65)53-37)23-24-73(9)71/h10-20,25,29-32,37-41,43,59H,6,21-24,26-27H2,1-5,7-9H3,(H,52,64)(H,53,65)(H,54,62)(H,55,61)(H,56,63)(H,57,66)(H,67,68)(H,69,70)/b20-15+,28-25+/t29-,30-,31-,32+,37-,38-,39+,40-,41-,43+,73?/m0/s1",UIWFJMNTVWNHGQ-PWIVRUSVSA-N,146684877,yes,Microcystis,aeruginosa,UTEX 2670
CyanoMetDB_1844,MC-YR,,Microcystin,,C52H72N10O13,1044.528033,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=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,6437088,yes,Microcystis,aeruginosa,n.a.
CyanoMetDB_1845,"[D-Asp3,ADMAdda5]MC-LHar",,Microcystin,,C50H74N10O13,1022.543683,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=N)N)NC(=O)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]1C)C(=O)O)C(=O)O,"InChI=1S/C50H74N10O13/c1-27(2)23-38-47(68)59-39(49(71)72)26-41(62)55-36(17-13-14-22-53-50(51)52)46(67)56-35(19-18-28(3)24-29(4)40(73-33(8)61)25-34-15-11-10-12-16-34)30(5)43(64)57-37(48(69)70)20-21-42(63)60(9)32(7)45(66)54-31(6)44(65)58-38/h10-12,15-16,18-19,24,27,29-31,35-40H,7,13-14,17,20-23,25-26H2,1-6,8-9H3,(H,54,66)(H,55,62)(H,56,67)(H,57,64)(H,58,65)(H,59,68)(H,69,70)(H,71,72)(H4,51,52,53)/b19-18+,28-24+/t29-,30-,31+,35-,36-,37+,38-,39+,40-/m0/s1",WJEBNDAWEAQNLR-KDMHZOGOSA-N,6441259,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1846,[Dha7]MC-HilR,,Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H74N10O12/c1-10-26(2)24-37-46(66)59-40(48(69)70)30(6)42(62)56-35(17-14-22-52-49(50)51)45(65)55-34(19-18-27(3)23-28(4)38(71-9)25-33-15-12-11-13-16-33)29(5)41(61)57-36(47(67)68)20-21-39(60)53-31(7)43(63)54-32(8)44(64)58-37/h11-13,15-16,18-19,23,26,28-30,32,34-38,40H,7,10,14,17,20-22,24-25H2,1-6,8-9H3,(H,53,60)(H,54,63)(H,55,65)(H,56,62)(H,57,61)(H,58,64)(H,59,66)(H,67,68)(H,69,70)(H4,50,51,52)/b19-18+,27-23+/t26-,28-,29-,30-,32+,34-,35-,36+,37-,38-,40+/m0/s1",SHJJNWJJWOOLFA-WKOHKIDGSA-N,146684734,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]NIES CRM No. 26
CyanoMetDB_1847,"[D?Asp³,(E)-Dhb7]MC?HilR",,Microcystin,,C49H74N10O12,994.5487682,O=C(N/C(C(N[C@@H](C1=O)C)=O)=C/C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)C[C@@H](C)CC)=O)=O)=O)=O,"InChI=1S/C49H74N10O12/c1-9-27(3)24-37-46(66)59-38(48(69)70)26-41(61)55-35(17-14-22-52-49(50)51)45(65)56-34(19-18-28(4)23-29(5)39(71-8)25-32-15-12-11-13-16-32)30(6)42(62)57-36(47(67)68)20-21-40(60)54-33(10-2)44(64)53-31(7)43(63)58-37/h10-13,15-16,18-19,23,27,29-31,34-39H,9,14,17,20-22,24-26H2,1-8H3,(H,53,64)(H,54,60)(H,55,61)(H,56,65)(H,57,62)(H,58,63)(H,59,66)(H,67,68)(H,69,70)(H4,50,51,52)/b19-18+,28-23+,33-10+/t27-,29-,30-,31+,34-,35-,36+,37-,38+,39-/m0/s1",CJBURLKHSGYKKJ-LOEFFASASA-N,11193981,yes,Oscillatoria/Planktothrix,rubescens,[Oscillatoria/Planktothrix rubescens]CCAP 1459/14
CyanoMetDB_1848,"[D-Asp3,D-MeO-Glu6]MC-LR","[D-Asp3,D-Glu(OMe)6]MC-LR",Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)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]1C)C(=O)OC)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H74N10O12/c1-27(2)23-37-46(66)58-38(47(67)68)26-40(60)54-35(17-14-22-52-49(50)51)45(65)55-34(19-18-28(3)24-29(4)39(70-9)25-33-15-12-11-13-16-33)30(5)42(62)56-36(48(69)71-10)20-21-41(61)59(8)32(7)44(64)53-31(6)43(63)57-37/h11-13,15-16,18-19,24,27,29-31,34-39H,7,14,17,20-23,25-26H2,1-6,8-10H3,(H,53,64)(H,54,60)(H,55,65)(H,56,62)(H,57,63)(H,58,66)(H,67,68)(H4,50,51,52)/b19-18+,28-24+/t29-,30-,31+,34-,35-,36+,37-,38+,39-/m0/s1",TWEYNHXDPXMESM-QYZWFTJFSA-N,101644064,no,Anabaena/Dolichospermum,flos aquae,CYA 83/1
CyanoMetDB_1849,"[D-Asp³,Dhb7]MC?AhaR","[D-Asp³,Dhb7]MC?AhaR or could be [D-Asp3,Dhb7]MC-HilR",Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCCC)NC(=O)[C@@H](C)NC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H74N10O12/c1-8-10-12-18-36-46(66)59-38(48(69)70)27-41(61)55-35(19-15-24-52-49(50)51)45(65)56-34(21-20-28(3)25-29(4)39(71-7)26-32-16-13-11-14-17-32)30(5)42(62)58-37(47(67)68)22-23-40(60)54-33(9-2)44(64)53-31(6)43(63)57-36/h9,11,13-14,16-17,20-21,25,29-31,34-39H,8,10,12,15,18-19,22-24,26-27H2,1-7H3,(H,53,64)(H,54,60)(H,55,61)(H,56,65)(H,57,63)(H,58,62)(H,59,66)(H,67,68)(H,69,70)(H4,50,51,52)/b21-20+,28-25+,33-9?/t29-,30-,31+,34-,35-,36-,37+,38+,39-/m0/s1",IHQWIGUDUPUIKA-JZRHOFFSSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1850,[DMAdda5]MC?HilR,,Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C49H74N10O12/c1-10-26(2)24-37-46(67)58-40(48(70)71)30(6)42(63)55-35(17-14-22-52-49(50)51)45(66)54-34(19-18-27(3)23-28(4)38(60)25-33-15-12-11-13-16-33)29(5)41(62)56-36(47(68)69)20-21-39(61)59(9)32(8)44(65)53-31(7)43(64)57-37/h11-13,15-16,18-19,23,26,28-31,34-38,40,60H,8,10,14,17,20-22,24-25H2,1-7,9H3,(H,53,65)(H,54,66)(H,55,63)(H,56,62)(H,57,64)(H,58,67)(H,68,69)(H,70,71)(H4,50,51,52)/b19-18+,27-23+/t26-,28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1",HWPKSGNNNYHECD-LNFSOKIGSA-N,146684723,no,Nostoc,sp.,[Nostoc sp.]IO-102-I
CyanoMetDB_1851,[DMAdda5]MC?LHar,,Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=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]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C49H74N10O12/c1-26(2)23-37-46(67)58-40(48(70)71)30(6)42(63)55-35(17-13-14-22-52-49(50)51)45(66)54-34(19-18-27(3)24-28(4)38(60)25-33-15-11-10-12-16-33)29(5)41(62)56-36(47(68)69)20-21-39(61)59(9)32(8)44(65)53-31(7)43(64)57-37/h10-12,15-16,18-19,24,26,28-31,34-38,40,60H,8,13-14,17,20-23,25H2,1-7,9H3,(H,53,65)(H,54,66)(H,55,63)(H,56,62)(H,57,64)(H,58,67)(H,68,69)(H,70,71)(H4,50,51,52)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1",RZJXAEDFXOQJKZ-GWRQVWKTSA-N,146684724,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1852,MC?RL,,Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC(C)C)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H74N10O12/c1-26(2)23-37-46(66)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)55-35(17-14-22-52-49(50)51)45(65)58-40(48(69)70)30(6)42(62)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,54,66)(H,55,63)(H,56,61)(H,57,62)(H,58,65)(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",JHVINXDONYNELG-GWRQVWKTSA-N,146684756,no,n.a.,n.a.,n.a.
CyanoMetDB_1853,[D-Asp3]MC-ER,,Microcystin,,C47H68N10O14,996.4916469,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H68N10O14/c1-25(22-26(2)36(71-7)23-30-12-9-8-10-13-30)15-16-31-27(3)40(62)55-34(45(67)68)17-19-38(59)57(6)29(5)42(64)51-28(4)41(63)54-33(18-20-39(60)61)44(66)56-35(46(69)70)24-37(58)52-32(43(65)53-31)14-11-21-50-47(48)49/h8-10,12-13,15-16,22,26-28,31-36H,5,11,14,17-21,23-24H2,1-4,6-7H3,(H,51,64)(H,52,58)(H,53,65)(H,54,63)(H,55,62)(H,56,66)(H,60,61)(H,67,68)(H,69,70)(H4,48,49,50)/b16-15+,25-22+/t26-,27-,28+,31-,32-,33-,34+,35+,36-/m0/s1",AHXOFCOHTAKFKX-KAXOOBBASA-N,146683812,no,Planktothrix ,prolifica ,NIVA-CYA 544
CyanoMetDB_1854,MC-WAba,MC-WAbu,Microcystin,,C52H68N8O12,996.4956699,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2c[NH]c3ccccc32)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H68N8O12/c1-10-37-49(66)56-38(21-20-28(2)24-29(3)42(72-9)25-34-16-12-11-13-17-34)30(4)45(62)57-40(51(68)69)22-23-43(61)60(8)33(7)48(65)54-32(6)47(64)58-41(26-35-27-53-39-19-15-14-18-36(35)39)50(67)59-44(52(70)71)31(5)46(63)55-37/h11-21,24,27,29-32,37-38,40-42,44,53H,7,10,22-23,25-26H2,1-6,8-9H3,(H,54,65)(H,55,63)(H,56,66)(H,57,62)(H,58,64)(H,59,67)(H,68,69)(H,70,71)/b21-20+,28-24+/t29-,30-,31-,32+,37-,38-,40+,41-,42-,44+/m0/s1",NKNOACROYYAXRI-SWBRTAFISA-N,,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1855,[NMe-Ala7]MC-LR,[L-NMe-Ala7]MC-LR,Microcystin,,C49H76N10O12,996.5644182,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)CC(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H76N10O12/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/h11-13,15-16,18-19,24,26,28-32,34-38,40H,14,17,20-23,25H2,1-10H3,(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+,32-,34-,35-,36+,37-,38-,40+/m0/s1",XVXFRYMCSIZPFI-CMNXQPOWSA-N,,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]PCC7820
CyanoMetDB_1856,[Dha7]MC-E(OMe)E(OMe),,Microcystin,,C48H67N7O16,997.4644294,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H67N7O16/c1-25(23-26(2)36(69-7)24-31-13-11-10-12-14-31)15-16-32-27(3)41(59)54-35(47(65)66)17-20-37(56)49-29(5)43(61)50-30(6)44(62)53-34(19-22-39(58)71-9)46(64)55-40(48(67)68)28(4)42(60)52-33(45(63)51-32)18-21-38(57)70-8/h10-16,23,26-28,30,32-36,40H,5,17-22,24H2,1-4,6-9H3,(H,49,56)(H,50,61)(H,51,63)(H,52,60)(H,53,62)(H,54,59)(H,55,64)(H,65,66)(H,67,68)/b16-15+,25-23+/t26-,27-,28-,30+,32-,33-,34-,35+,36-,40+/m0/s1",RODJROXYYNRFDY-GHJXESGZSA-N,146683845,no,Anabaena,n.a.,[Anabaena sp.]186
CyanoMetDB_1857,MC-OiaA,,Microcystin,,C51H66N8O13,998.4749345,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC2c3ccccc3NC2=O)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H66N8O13/c1-26(23-27(2)40(72-9)24-33-15-11-10-12-16-33)19-20-36-28(3)43(61)56-38(50(68)69)21-22-41(60)59(8)32(7)47(65)53-31(6)46(64)57-39(25-35-34-17-13-14-18-37(34)55-48(35)66)49(67)58-42(51(70)71)29(4)44(62)52-30(5)45(63)54-36/h10-20,23,27-31,35-36,38-40,42H,7,21-22,24-25H2,1-6,8-9H3,(H,52,62)(H,53,65)(H,54,63)(H,55,66)(H,56,61)(H,57,64)(H,58,67)(H,68,69)(H,70,71)/b20-19+,26-23+/t27-,28-,29-,30-,31+,35?,36-,38+,39-,40-,42+/m0/s1",HNAQQSWIMKHJPV-USSSJJRQSA-N,146683822,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1858,[D-Asp³]MC?MR,,Microcystin,,C47H70N10O12S,998.4895387,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O12S/c1-26(23-27(2)37(69-7)24-31-13-10-9-11-14-31)16-17-32-28(3)40(60)55-35(45(65)66)18-19-39(59)57(6)30(5)42(62)51-29(4)41(61)54-34(20-22-70-8)44(64)56-36(46(67)68)25-38(58)52-33(43(63)53-32)15-12-21-50-47(48)49/h9-11,13-14,16-17,23,27-29,32-37H,5,12,15,18-22,24-25H2,1-4,6-8H3,(H,51,62)(H,52,58)(H,53,63)(H,54,61)(H,55,60)(H,56,64)(H,65,66)(H,67,68)(H4,48,49,50)/b17-16+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1",SAOKRPLOVXDUIY-QTDAUVDESA-N,146684780,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_1859,[Ser7]MC-LR,[L-Ser7]MC-LR,Microcystin,,C48H74N10O13,998.5436828,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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@H](CO)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H74N10O13/c1-25(2)21-35-44(65)58-39(47(69)70)29(6)41(62)55-33(15-12-20-51-48(49)50)43(64)54-32(17-16-26(3)22-27(4)37(71-8)23-31-13-10-9-11-14-31)28(5)40(61)56-34(46(67)68)18-19-38(60)53-36(24-59)45(66)52-30(7)42(63)57-35/h9-11,13-14,16-17,22,25,27-30,32-37,39,59H,12,15,18-21,23-24H2,1-8H3,(H,52,66)(H,53,60)(H,54,64)(H,55,62)(H,56,61)(H,57,63)(H,58,65)(H,67,68)(H,69,70)(H4,49,50,51)/b17-16+,26-22+/t27-,28-,29-,30+,32-,33-,34+,35-,36-,37-,39+/m0/s1",PWCXBLSMFHTSOU-GUMWKJIBSA-N,101642887,no,Anabaena,n.a.,"[Anabaena sp.]202 A1, [Anabaena sp.]202 A2"
CyanoMetDB_1860,[seco?4/5][D-Asp³]MC?LR,,Microcystin,,C48H74N10O13,998.5436828,O=C(O)[C@H](CCCNC(=N)N)NC(=O)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](C)[C@@H](N)/C=C/C(/C)=C/[C@H](C)[C@@H](OC)Cc1ccccc1)C(=O)O)C(=O)O,"InChI=1S/C48H74N10O13/c1-26(2)22-36(44(64)57-37(47(69)70)25-39(59)54-34(45(65)66)16-13-21-52-48(50)51)56-42(62)30(6)53-43(63)31(7)58(8)40(60)20-19-35(46(67)68)55-41(61)29(5)33(49)18-17-27(3)23-28(4)38(71-9)24-32-14-11-10-12-15-32/h10-12,14-15,17-18,23,26,28-30,33-38H,7,13,16,19-22,24-25,49H2,1-6,8-9H3,(H,53,63)(H,54,59)(H,55,61)(H,56,62)(H,57,64)(H,65,66)(H,67,68)(H,69,70)(H4,50,51,52)/b18-17+,27-23+/t28-,29-,30+,33-,34-,35+,36-,37+,38-/m0/s1",LHOZHBTYSUFUSJ-MREVJOSWSA-N,146684781,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_1861,[Dha7]MC-LR,,Microcystin,,C48H72N10O12,980.5331181,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC\N=C(/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)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12/c1-25(2)22-36-45(65)58-39(47(68)69)29(6)41(61)55-34(16-13-21-51-48(49)50)44(64)54-33(18-17-26(3)23-27(4)37(70-9)24-32-14-11-10-12-15-32)28(5)40(60)56-35(46(66)67)19-20-38(59)52-30(7)42(62)53-31(8)43(63)57-36/h10-12,14-15,17-18,23,25,27-29,31,33-37,39H,7,13,16,19-22,24H2,1-6,8-9H3,(H,52,59)(H,53,62)(H,54,64)(H,55,61)(H,56,60)(H,57,63)(H,58,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,26-23+/t27-,28-,29-,31+,33-,34-,35+,36-,37-,39+/m0/s1",WLWITBHAANNFHV-NDUWXMRTSA-N,101642889,yes,Microcystis,aeruginosa,K-139
CyanoMetDB_1862,MC?LHph,,Microcystin,,C53H73N7O12,999.5317211,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCc2ccccc2)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C53H73N7O12/c1-30(2)27-42-51(67)59-45(53(70)71)34(6)47(63)56-40(24-22-37-17-13-11-14-18-37)50(66)55-39(23-21-31(3)28-32(4)43(72-10)29-38-19-15-12-16-20-38)33(5)46(62)57-41(52(68)69)25-26-44(61)60(9)36(8)49(65)54-35(7)48(64)58-42/h11-21,23,28,30,32-35,39-43,45H,8,22,24-27,29H2,1-7,9-10H3,(H,54,65)(H,55,66)(H,56,63)(H,57,62)(H,58,64)(H,59,67)(H,68,69)(H,70,71)/b23-21+,31-28+/t32-,33-,34-,35+,39-,40-,41+,42-,43-,45+/m0/s1",LVCIVARPKLCTRB-OVBXAQJQSA-N,146684762,no,Phormidium,sp.,[Phormidium sp.]DVL1003c
CyanoMetDB_1863,MC?KynAba,MC-KynAbu,Microcystin,,C51H68N8O13,1000.490585,Nc1ccccc1C(=O)C[C@@H]1NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@H](/C=CC(\C)=C\[C@H](C)[C@H](Cc2ccccc2)OC)NC(=O)[C@H](CC)NC(=O)[C@@H](C)[C@@H](NC1=O)C(=O)O)C(=O)O,"InChI=1S/C51H68N8O13/c1-10-36-48(66)55-37(21-20-27(2)24-28(3)41(72-9)25-33-16-12-11-13-17-33)29(4)44(62)56-38(50(68)69)22-23-42(61)59(8)32(7)47(65)53-31(6)46(64)57-39(26-40(60)34-18-14-15-19-35(34)52)49(67)58-43(51(70)71)30(5)45(63)54-36/h11-21,24,28-31,36-39,41,43H,7,10,22-23,25-26,52H2,1-6,8-9H3,(H,53,65)(H,54,63)(H,55,66)(H,56,62)(H,57,64)(H,58,67)(H,68,69)(H,70,71)/b21-20+,27-24+/t28-,29-,30-,31+,36-,37-,38+,39-,41-,43+/m0/s1",RLKQRHBFVMIWTE-BWYSDFBGSA-N,,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1864,"[D?Asp3,Dha7]MC?FR",,Microcystin,,C50H68N10O12,1000.501818,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H68N10O12/c1-28(24-29(2)40(72-6)26-34-16-11-8-12-17-34)19-20-35-30(3)43(63)58-37(48(68)69)21-22-41(61)54-31(4)44(64)55-32(5)45(65)59-38(25-33-14-9-7-10-15-33)47(67)60-39(49(70)71)27-42(62)56-36(46(66)57-35)18-13-23-53-50(51)52/h7-12,14-17,19-20,24,29-30,32,35-40H,4,13,18,21-23,25-27H2,1-3,5-6H3,(H,54,61)(H,55,64)(H,56,62)(H,57,66)(H,58,63)(H,59,65)(H,60,67)(H,68,69)(H,70,71)(H4,51,52,53)/b20-19+,28-24+/t29-,30-,32+,35-,36-,37+,38-,39+,40-/m0/s1",NELUXDWVSZSXBG-MCVAKWTKSA-N,146684725,no,Anabaena,n.a.,[Anabaena sp.]66A
CyanoMetDB_1865,[L-Ser7]MC-EE(OMe),[Ser7]MC-EE(OMe),Microcystin,,C47H67N7O17,1001.459344,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H67N7O17/c1-24(21-25(2)35(70-6)22-29-11-9-8-10-12-29)13-14-30-26(3)40(60)53-33(46(66)67)15-18-36(56)49-34(23-55)45(65)48-28(5)42(62)52-31(16-19-37(57)58)44(64)54-39(47(68)69)27(4)41(61)51-32(43(63)50-30)17-20-38(59)71-7/h8-14,21,25-28,30-35,39,55H,15-20,22-23H2,1-7H3,(H,48,65)(H,49,56)(H,50,63)(H,51,61)(H,52,62)(H,53,60)(H,54,64)(H,57,58)(H,66,67)(H,68,69)/b14-13+,24-21+/t25-,26-,27-,28+,30-,31-,32-,33+,34-,35-,39+/m0/s1",RCXSHZJBABBPCQ-XSTWSXKBSA-N,146683846,no,Anabaena,n.a.,[Anabaena sp.]186
CyanoMetDB_1866,"[D-Asp3,Ser7]MC-E(OMe)E(OMe)",,Microcystin,,C47H67N7O17,1001.459344,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)OC)NC(=O)C[C@@H](NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H67N7O17/c1-25(21-26(2)36(69-5)22-29-11-9-8-10-12-29)13-14-30-27(3)41(60)53-33(46(65)66)15-18-37(56)50-35(24-55)45(64)48-28(4)42(61)52-32(17-20-40(59)71-7)44(63)54-34(47(67)68)23-38(57)49-31(43(62)51-30)16-19-39(58)70-6/h8-14,21,26-28,30-36,55H,15-20,22-24H2,1-7H3,(H,48,64)(H,49,57)(H,50,56)(H,51,62)(H,52,61)(H,53,60)(H,54,63)(H,65,66)(H,67,68)/b14-13+,25-21+/t26-,27-,28+,30-,31-,32-,33+,34+,35-,36-/m0/s1",ZPWBUZCVOZVOLS-FTHMBYDKSA-N,146683847,no,Anabaena,n.a.,[Anabaena sp.]186
CyanoMetDB_1867,MC-(H4)YR,,Microcystin,,C52H76N10O13,1048.559333,O=C(CC[C@@H](NC([C@H]([C@@H](NC([C@@H](NC([C@H]([C@@H](NC([C@H](C[C@]1(C=C[C@@H](CC1)O)[H])N2)=O)C(O)=O)C)=O)CCCNC(N)=N)=O)/C=C/C(C)=C/[C@@H]([C@H](CC3=CC=CC=C3)OC)C)C)=O)C(O)=O)N(C(C(N[C@H](C)C2=O)=O)=C)C,"InChI=1S/C52H76N10O13/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/h9-11,13-14,16-17,19,21,25,29-32,35-41,43,63H,6,12,15,18,20,22-24,26-27H2,1-5,7-8H3,(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+,35-,36-,37-,38-,39+,40-,41-,43+/m0/s1",PITACCAFEGTDMU-WPROKLQDSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_1868,[D-Asp³]MC?HilY,,Microcystin,,C52H71N7O13,1001.510986,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC(C[C@H](C(O)=O)NC([C@@H](N1)C[C@@H](C)CC)=O)=O)=O)=O,"InChI=1S/C52H71N7O13/c1-10-29(2)25-40-49(66)58-42(52(70)71)28-44(61)54-41(26-36-17-19-37(60)20-18-36)50(67)55-38(21-16-30(3)24-31(4)43(72-9)27-35-14-12-11-13-15-35)32(5)46(63)56-39(51(68)69)22-23-45(62)59(8)34(7)48(65)53-33(6)47(64)57-40/h11-21,24,29,31-33,38-43,60H,7,10,22-23,25-28H2,1-6,8-9H3,(H,53,65)(H,54,61)(H,55,67)(H,56,63)(H,57,64)(H,58,66)(H,68,69)(H,70,71)/b21-16+,30-24+/t29-,31-,32-,33+,38-,39+,40-,41-,42+,43-/m0/s1",WLBVWRVOGXOSNA-SLNOSVEWSA-N,,no,Microcystis,aeruginosa,NIVA-CYA 548
CyanoMetDB_1869,MC?YL,,Microcystin,,C52H71N7O13,1001.510986,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H71N7O13/c1-28(2)24-40-49(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)57-41(26-36-17-19-37(60)20-18-36)50(67)58-44(52(70)71)32(6)46(63)56-40/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+/t30-,31-,32-,33+,38-,39+,40-,41-,42-,44+/m0/s1",ULVKNPZLIDQRTH-WSTSHCHISA-N,146683865,no,Microcystis,aeruginosa,[Microcystis aeruginosa]UTEX 2670
CyanoMetDB_1870,"[D?Asp³,Mser7]MC?LY",,Microcystin,,C51H71N7O14,1005.5059,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CO)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)CC(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H71N7O14/c1-28(2)22-38-47(65)57-40(51(70)71)26-43(61)53-39(24-34-15-17-35(60)18-16-34)48(66)54-36(19-14-29(3)23-30(4)42(72-8)25-33-12-10-9-11-13-33)31(5)45(63)55-37(50(68)69)20-21-44(62)58(7)41(27-59)49(67)52-32(6)46(64)56-38/h9-19,23,28,30-32,36-42,59-60H,20-22,24-27H2,1-8H3,(H,52,67)(H,53,61)(H,54,66)(H,55,63)(H,56,64)(H,57,65)(H,68,69)(H,70,71)/b19-14+,29-23+/t30-,31-,32+,36-,37+,38-,39-,40+,41-,42-/m0/s1",CWFJBZPUEILZER-NYHXZKTISA-N,,no,Microcystis,aeruginosa,NIVA-CYA 548
CyanoMetDB_1871,"[Gly1,D-Asp3,ADMAdda5]MC-LHar",,Microcystin,,C49H72N10O13,1008.528032,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C49H72N10O13/c1-27(2)22-37-46(67)58-38(48(70)71)25-40(61)54-35(16-12-13-21-52-49(50)51)45(66)56-34(18-17-28(3)23-29(4)39(72-32(7)60)24-33-14-10-9-11-15-33)30(5)43(64)57-36(47(68)69)19-20-42(63)59(8)31(6)44(65)53-26-41(62)55-37/h9-11,14-15,17-18,23,27,29-30,34-39H,6,12-13,16,19-22,24-26H2,1-5,7-8H3,(H,53,65)(H,54,61)(H,55,62)(H,56,66)(H,57,64)(H,58,67)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,28-23+/t29-,30-,34-,35-,36+,37-,38+,39-/m0/s1",OGIULMWAEYWUMA-CFKDJMJKSA-N,146683835,no,n.a.,n.a.,n.a.
CyanoMetDB_1872,[D-Asp3]MC-LF,,Microcystin,,C51H69N7O12,971.500421,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H69N7O12/c1-29(2)24-39-48(64)57-41(51(68)69)28-43(59)53-40(26-35-16-12-10-13-17-35)49(65)54-37(21-20-30(3)25-31(4)42(70-9)27-36-18-14-11-15-19-36)32(5)45(61)55-38(50(66)67)22-23-44(60)58(8)34(7)47(63)52-33(6)46(62)56-39/h10-21,25,29,31-33,37-42H,7,22-24,26-28H2,1-6,8-9H3,(H,52,63)(H,53,59)(H,54,65)(H,55,61)(H,56,62)(H,57,64)(H,66,67)(H,68,69)/b21-20+,30-25+/t31-,32-,33+,37-,38+,39-,40-,41+,42-/m0/s1",BWSABZLQEYMURK-BMUDUOPCSA-N,,no,Microcystis,aeruginosa,[Microcystis aeruginosa]PCC7820
CyanoMetDB_1873,"[ADMAdda5,Dha7]MC?LR",,Microcystin,,C49H72N10O13,1008.528033,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=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)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C49H72N10O13/c1-25(2)22-37-46(67)59-40(48(70)71)29(6)42(63)56-35(16-13-21-52-49(50)51)45(66)55-34(18-17-26(3)23-27(4)38(72-32(9)60)24-33-14-11-10-12-15-33)28(5)41(62)57-36(47(68)69)19-20-39(61)53-30(7)43(64)54-31(8)44(65)58-37/h10-12,14-15,17-18,23,25,27-29,31,34-38,40H,7,13,16,19-22,24H2,1-6,8-9H3,(H,53,61)(H,54,64)(H,55,66)(H,56,63)(H,57,62)(H,58,65)(H,59,67)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,26-23+/t27-,28-,29-,31+,34-,35-,36+,37-,38-,40+/m0/s1",OXEWVIJLTMFSCK-RJPWZEGISA-N,146684726,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1874,"[D?Asp3,ADMAdda5,Dha7]MC?HilR",,Microcystin,,C49H72N10O13,1008.528033,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](C[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C49H72N10O13/c1-9-26(2)23-37-46(67)59-38(48(70)71)25-41(62)55-35(16-13-21-52-49(50)51)45(66)56-34(18-17-27(3)22-28(4)39(72-32(8)60)24-33-14-11-10-12-15-33)29(5)42(63)57-36(47(68)69)19-20-40(61)53-30(6)43(64)54-31(7)44(65)58-37/h10-12,14-15,17-18,22,26,28-29,31,34-39H,6,9,13,16,19-21,23-25H2,1-5,7-8H3,(H,53,61)(H,54,64)(H,55,62)(H,56,66)(H,57,63)(H,58,65)(H,59,67)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,27-22+/t26-,28-,29-,31+,34-,35-,36+,37-,38+,39-/m0/s1",DYVNDYGAKNUGLZ-PVSWEASFSA-N,146684727,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1875,"[Gly1,D-Asp3,ADMAdda5,(E/Z)-Dhb7]MC-LHar",,Microcystin,,C49H72N10O13,1008.528033,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(=CC)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)CCCCNC(=N)N,"InChI=1S/C49H72N10O13/c1-8-33-44(65)53-26-42(63)56-37(22-27(2)3)46(67)59-38(48(70)71)25-41(62)55-35(16-12-13-21-52-49(50)51)45(66)57-34(30(6)43(64)58-36(47(68)69)19-20-40(61)54-33)18-17-28(4)23-29(5)39(72-31(7)60)24-32-14-10-9-11-15-32/h8-11,14-15,17-18,23,27,29-30,34-39H,12-13,16,19-22,24-26H2,1-7H3,(H,53,65)(H,54,61)(H,55,62)(H,56,63)(H,57,66)(H,58,64)(H,59,67)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,28-23+,33-8?/t29-,30-,34-,35-,36+,37-,38+,39-/m0/s1",YDRTZHHACZYGHJ-RCJRYNDHSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1876,"[D-Asp3,ADMAdda5,(E/Z)-Dhb7]MC?LR",,Microcystin,,C49H72N10O13,1008.528033,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C49H72N10O13/c1-9-33-44(65)53-30(7)43(64)58-37(22-26(2)3)46(67)59-38(48(70)71)25-41(62)55-35(16-13-21-52-49(50)51)45(66)56-34(29(6)42(63)57-36(47(68)69)19-20-40(61)54-33)18-17-27(4)23-28(5)39(72-31(8)60)24-32-14-11-10-12-15-32/h9-12,14-15,17-18,23,26,28-30,34-39H,13,16,19-22,24-25H2,1-8H3,(H,53,65)(H,54,61)(H,55,62)(H,56,66)(H,57,63)(H,58,64)(H,59,67)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,27-23+,33-9?/t28-,29-,30+,34-,35-,36+,37-,38+,39-/m0/s1",LTHMLXBUIQLYAJ-HUBHJHLRSA-N,139585968,yes,Nostoc,sp.,[Nostoc sp.]DUN901
CyanoMetDB_1877,[D-MeO-Glu6]MC-LR,[D-Glu(OMe)6]MC-LR,Microcystin,,C50H76N10O12,1008.564418,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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]1C)C(=O)OC)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H76N10O12/c1-27(2)24-38-47(67)59-41(48(68)69)31(6)43(63)56-36(18-15-23-53-50(51)52)46(66)55-35(20-19-28(3)25-29(4)39(71-10)26-34-16-13-12-14-17-34)30(5)42(62)57-37(49(70)72-11)21-22-40(61)60(9)33(8)45(65)54-32(7)44(64)58-38/h12-14,16-17,19-20,25,27,29-32,35-39,41H,8,15,18,21-24,26H2,1-7,9-11H3,(H,54,65)(H,55,66)(H,56,63)(H,57,62)(H,58,64)(H,59,67)(H,68,69)(H4,51,52,53)/b20-19+,28-25+/t29-,30-,31-,32+,35-,36-,37+,38-,39-,41+/m0/s1",PONFOSATPJORFV-AFQNMZSJSA-N,101643573,no,Anabaena/Dolichospermum,flos aquae,CYA 83/1
CyanoMetDB_1878,[Mdhb7]MC-LR,,Microcystin,,C50H76N10O12,1008.564418,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)C(=CC)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)CC(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H76N10O12/c1-11-38-47(67)54-32(8)44(64)58-37(24-27(2)3)46(66)59-41(49(70)71)31(7)43(63)56-35(18-15-23-53-50(51)52)45(65)55-34(30(6)42(62)57-36(48(68)69)21-22-40(61)60(38)9)20-19-28(4)25-29(5)39(72-10)26-33-16-13-12-14-17-33/h11-14,16-17,19-20,25,27,29-32,34-37,39,41H,15,18,21-24,26H2,1-10H3,(H,54,67)(H,55,65)(H,56,63)(H,57,62)(H,58,64)(H,59,66)(H,68,69)(H,70,71)(H4,51,52,53)/b20-19+,28-25+,38-11?/t29-,30-,31-,32+,34-,35-,36+,37-,39-,41+/m0/s1",ZKRLHZKOFKCNKD-BNILPYKLSA-N,146684878,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1879,MC-HilR,,Microcystin,,C50H76N10O12,1008.564418,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H76N10O12/c1-11-27(2)25-38-47(67)59-41(49(70)71)31(6)43(63)56-36(18-15-23-53-50(51)52)46(66)55-35(20-19-28(3)24-29(4)39(72-10)26-34-16-13-12-14-17-34)30(5)42(62)57-37(48(68)69)21-22-40(61)60(9)33(8)45(65)54-32(7)44(64)58-38/h12-14,16-17,19-20,24,27,29-32,35-39,41H,8,11,15,18,21-23,25-26H2,1-7,9-10H3,(H,54,65)(H,55,66)(H,56,63)(H,57,62)(H,58,64)(H,59,67)(H,68,69)(H,70,71)(H4,51,52,53)/b20-19+,28-24+/t27-,29-,30-,31-,32+,35-,36-,37+,38-,39-,41+/m0/s1",PJPFCNPJHGMQBK-GHDNJWGDSA-N,10486193,yes,n.a.,n.a.,n.a.
CyanoMetDB_1880,MC-LHar,,Microcystin,,C50H76N10O12,1008.564418,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H76N10O12/c1-27(2)24-38-47(67)59-41(49(70)71)31(6)43(63)56-36(18-14-15-23-53-50(51)52)46(66)55-35(20-19-28(3)25-29(4)39(72-10)26-34-16-12-11-13-17-34)30(5)42(62)57-37(48(68)69)21-22-40(61)60(9)33(8)45(65)54-32(7)44(64)58-38/h11-13,16-17,19-20,25,27,29-32,35-39,41H,8,14-15,18,21-24,26H2,1-7,9-10H3,(H,54,65)(H,55,66)(H,56,63)(H,57,62)(H,58,64)(H,59,67)(H,68,69)(H,70,71)(H4,51,52,53)/b20-19+,28-25+/t29-,30-,31-,32+,35-,36-,37+,38-,39-,41+/m0/s1",HMGQXYULLUEIPT-AFQNMZSJSA-N,146683854,yes,Oscillatoria,tenuis,[Oscillatoria tenuis]E6
CyanoMetDB_1882,"[D-Leu1,D-Asp³,DMAdda5]MC?LR",,Microcystin,,C50H76N10O12,1008.564418,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C50H76N10O12/c1-27(2)22-37-46(67)58-38(23-28(3)4)47(68)59-39(49(71)72)26-41(62)54-35(16-13-21-53-50(51)52)45(66)55-34(18-17-29(5)24-30(6)40(61)25-33-14-11-10-12-15-33)31(7)43(64)56-36(48(69)70)19-20-42(63)60(9)32(8)44(65)57-37/h10-12,14-15,17-18,24,27-28,30-31,34-40,61H,8,13,16,19-23,25-26H2,1-7,9H3,(H,54,62)(H,55,66)(H,56,64)(H,57,65)(H,58,67)(H,59,68)(H,69,70)(H,71,72)(H4,51,52,53)/b18-17+,29-24+/t30-,31-,34-,35-,36+,37+,38-,39+,40-/m0/s1",KIYYTZXXJAGYEI-AGNPPKSKSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1883,"[Gly1,D-Asp3]MC-RR",,Microcystin,,C47H71N13O12,1009.53451,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H71N13O12/c1-26(22-27(2)36(72-6)23-30-12-8-7-9-13-30)16-17-31-28(3)40(64)58-34(44(68)69)18-19-39(63)60(5)29(4)41(65)54-25-38(62)56-33(15-11-21-53-47(50)51)43(67)59-35(45(70)71)24-37(61)55-32(42(66)57-31)14-10-20-52-46(48)49/h7-9,12-13,16-17,22,27-28,31-36H,4,10-11,14-15,18-21,23-25H2,1-3,5-6H3,(H,54,65)(H,55,61)(H,56,62)(H,57,66)(H,58,64)(H,59,67)(H,68,69)(H,70,71)(H4,48,49,52)(H4,50,51,53)/b17-16+,26-22+/t27-,28-,31-,32-,33-,34+,35+,36-/m0/s1",XZTWPWTUTORJDG-XDZREONBSA-N,146683836,no,n.a.,n.a.,n.a.
CyanoMetDB_1884,"[D-Asp3,Dha7]MC-RR",,Microcystin,,C47H71N13O12,1009.534515,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H71N13O12/c1-25(22-26(2)36(72-6)23-30-12-8-7-9-13-30)16-17-31-27(3)39(63)59-34(44(68)69)18-19-37(61)54-28(4)40(64)55-29(5)41(65)58-33(15-11-21-53-47(50)51)43(67)60-35(45(70)71)24-38(62)56-32(42(66)57-31)14-10-20-52-46(48)49/h7-9,12-13,16-17,22,26-27,29,31-36H,4,10-11,14-15,18-21,23-24H2,1-3,5-6H3,(H,54,61)(H,55,64)(H,56,62)(H,57,66)(H,58,65)(H,59,63)(H,60,67)(H,68,69)(H,70,71)(H4,48,49,52)(H4,50,51,53)/b17-16+,25-22+/t26-,27-,29+,31-,32-,33-,34+,35+,36-/m0/s1",UWKDRDKCWDBPNK-WXJJDZFKSA-N,6449930,no,Microcystis,aeruginosa,n.a.
CyanoMetDB_1885,"[D-Asp³,DMAdda5]MC?RR",,Microcystin,,C47H71N13O12,1009.534515,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)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]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C47H71N13O12/c1-25(22-26(2)36(61)23-30-12-8-7-9-13-30)16-17-31-27(3)39(64)58-34(44(69)70)18-19-38(63)60(6)29(5)41(66)54-28(4)40(65)57-33(15-11-21-53-47(50)51)43(68)59-35(45(71)72)24-37(62)55-32(42(67)56-31)14-10-20-52-46(48)49/h7-9,12-13,16-17,22,26-28,31-36,61H,5,10-11,14-15,18-21,23-24H2,1-4,6H3,(H,54,66)(H,55,62)(H,56,67)(H,57,65)(H,58,64)(H,59,68)(H,69,70)(H,71,72)(H4,48,49,52)(H4,50,51,53)/b17-16+,25-22+/t26-,27-,28+,31-,32-,33-,34+,35+,36-/m0/s1",SZNUVOZIIWMKCN-KSLDGVDMSA-N,146684701,no,Oscillatoria/Planktothrix,agardhii,[Oscillatoria/Planktothrix]CYA126/8
CyanoMetDB_1886,"[Gly1,D-Asp3,Dhb7]MC-RR",,Microcystin,,C47H71N13O12,1009.534515,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C(=CC)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)CCCNC(=N)N)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H71N13O12/c1-6-30-41(65)54-25-39(63)57-33(15-11-21-53-47(50)51)43(67)60-35(45(70)71)24-38(62)56-32(14-10-20-52-46(48)49)42(66)58-31(28(4)40(64)59-34(44(68)69)18-19-37(61)55-30)17-16-26(2)22-27(3)36(72-5)23-29-12-8-7-9-13-29/h6-9,12-13,16-17,22,27-28,31-36H,10-11,14-15,18-21,23-25H2,1-5H3,(H,54,65)(H,55,61)(H,56,62)(H,57,63)(H,58,66)(H,59,64)(H,60,67)(H,68,69)(H,70,71)(H4,48,49,52)(H4,50,51,53)/b17-16+,26-22+,30-6?/t27-,28-,31-,32-,33-,34+,35+,36-/m0/s1",KRUAITXTWMLKOY-AGFRCYLPSA-N,146683803,no,n.a.,n.a.,n.a.
CyanoMetDB_1887,MC-ER,,Microcystin,,C48H70N10O14,1010.507297,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC(O)=O)=O)=O)=O)=O,"InChI=1S/C48H70N10O14/c1-25(23-26(2)36(72-8)24-31-13-10-9-11-14-31)16-17-32-27(3)40(62)56-35(46(68)69)18-20-37(59)58(7)30(6)43(65)52-29(5)42(64)55-34(19-21-38(60)61)45(67)57-39(47(70)71)28(4)41(63)54-33(44(66)53-32)15-12-22-51-48(49)50/h9-11,13-14,16-17,23,26-29,32-36,39H,6,12,15,18-22,24H2,1-5,7-8H3,(H,52,65)(H,53,66)(H,54,63)(H,55,64)(H,56,62)(H,57,67)(H,60,61)(H,68,69)(H,70,71)(H4,49,50,51)/b17-16+,25-23+/t26-,27-,28-,29+,32-,33-,34-,35+,36-,39+/m0/s1",ONKWEJXQUSPSTI-CGABAVKJSA-N,146684955,no,Microcystis,n.a.,"AB2017/14, AB2017/15"
CyanoMetDB_1888,[D-Asp3]MC-LW,,Microcystin,,C53H70N8O12,1010.51132,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2c[NH]c3ccccc32)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C53H70N8O12/c1-29(2)23-41-50(67)60-43(53(71)72)27-45(62)56-42(26-36-28-54-39-18-14-13-17-37(36)39)51(68)57-38(20-19-30(3)24-31(4)44(73-9)25-35-15-11-10-12-16-35)32(5)47(64)58-40(52(69)70)21-22-46(63)61(8)34(7)49(66)55-33(6)48(65)59-41/h10-20,24,28-29,31-33,38,40-44,54H,7,21-23,25-27H2,1-6,8-9H3,(H,55,66)(H,56,62)(H,57,68)(H,58,64)(H,59,65)(H,60,67)(H,69,70)(H,71,72)/b20-19+,30-24+/t31-,32-,33+,38-,40+,41-,42-,43+,44-/m0/s1",KEUIEPSPMZCRNU-MGDFNBQSSA-N,,no,Microcystis,aeruginosa,[Microcystis aeruginosa]PCC7820
CyanoMetDB_1889,"[D-Asp3,(E)-Dhb7]MC-LW","[D-Asp3,(E)-Dhb7]MC-LW",Microcystin,,C53H70N8O12,1010.51132,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2c[NH]c3ccccc32)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C\C)/NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C53H70N8O12/c1-9-37-49(66)55-33(7)48(65)60-41(23-29(2)3)50(67)61-43(53(71)72)27-46(63)57-42(26-35-28-54-39-18-14-13-17-36(35)39)51(68)58-38(32(6)47(64)59-40(52(69)70)21-22-45(62)56-37)20-19-30(4)24-31(5)44(73-8)25-34-15-11-10-12-16-34/h9-20,24,28-29,31-33,38,40-44,54H,21-23,25-27H2,1-8H3,(H,55,66)(H,56,62)(H,57,63)(H,58,68)(H,59,64)(H,60,65)(H,61,67)(H,69,70)(H,71,72)/b20-19+,30-24+,37-9+/t31-,32-,33+,38-,40+,41-,42-,43+,44-/m0/s1",MPMAWWUGDHJXMB-GJVNGLMXSA-N,146684777,yes,Oscillatoria/Planktothrix,rubescens,80
CyanoMetDB_1890,[epoxyAdda5]MC-LR,,Microcystin,,C49H74N10O13,1010.543682,O=C(O)[C@@H]1NC(=O)[C@@H](C)[C@H](/C=C/C2(C)OC2[C@H](C)[C@@H](OC)Cc2ccccc2)NC(=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)CC1)C(=O)O,"InChI=1S/C49H74N10O13/c1-25(2)23-35-45(66)58-38(47(69)70)28(5)41(62)55-33(17-14-22-52-48(50)51)44(65)54-32(20-21-49(8)39(72-49)27(4)36(71-10)24-31-15-12-11-13-16-31)26(3)40(61)56-34(46(67)68)18-19-37(60)59(9)30(7)43(64)53-29(6)42(63)57-35/h11-13,15-16,20-21,25-29,32-36,38-39H,7,14,17-19,22-24H2,1-6,8-10H3,(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)/b21-20+/t26-,27+,28-,29+,32-,33-,34+,35-,36-,38+,39?,49?/m0/s1",ULEIGMUDFOUZQL-MGVLZLMXSA-N,146683856,no,n.a.,n.a.,n.a.
CyanoMetDB_1891,MC?OiaAba,"MC?OiaAbu (oxidised W), MC-oxindolylalanine-aminobutanoic acid",Microcystin,,C52H68N8O13,1012.490585,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC2c3ccccc3NC2=O)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H68N8O13/c1-10-36-49(67)55-37(21-20-27(2)24-28(3)41(73-9)25-33-16-12-11-13-17-33)29(4)44(62)57-39(51(69)70)22-23-42(61)60(8)32(7)47(65)53-31(6)46(64)58-40(26-35-34-18-14-15-19-38(34)56-48(35)66)50(68)59-43(52(71)72)30(5)45(63)54-36/h11-21,24,28-31,35-37,39-41,43H,7,10,22-23,25-26H2,1-6,8-9H3,(H,53,65)(H,54,63)(H,55,67)(H,56,66)(H,57,62)(H,58,64)(H,59,68)(H,69,70)(H,71,72)/b21-20+,27-24+/t28-,29-,30-,31+,35?,36-,37-,39+,40-,41-,43+/m0/s1",RMLFSXGWVPECCA-NNOGGRAWSA-N,146683824,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1892,MC-MR,,Microcystin,,C48H72N10O12S,1012.505189,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCSC)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12S/c1-26(24-27(2)37(70-8)25-32-14-11-10-12-15-32)17-18-33-28(3)40(60)56-36(46(66)67)19-20-38(59)58(7)31(6)43(63)52-30(5)42(62)55-35(21-23-71-9)45(65)57-39(47(68)69)29(4)41(61)54-34(44(64)53-33)16-13-22-51-48(49)50/h10-12,14-15,17-18,24,27-30,33-37,39H,6,13,16,19-23,25H2,1-5,7-9H3,(H,52,63)(H,53,64)(H,54,61)(H,55,62)(H,56,60)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,26-24+/t27-,28-,29-,30+,33-,34-,35-,36+,37-,39+/m0/s1",IZYCTPOMKJTWJD-MCUDKQGFSA-N,146684782,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_1893,"[D-Asp3,Mser7]MC?LR","[D-Asp3, L-NMe-Ser7]MC?LR",Microcystin,,C48H74N10O13,998.5436828,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CO)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)CC(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H74N10O13/c1-26(2)21-35-44(65)57-36(47(69)70)24-39(60)53-33(15-12-20-51-48(49)50)43(64)54-32(17-16-27(3)22-28(4)38(71-8)23-31-13-10-9-11-14-31)29(5)41(62)55-34(46(67)68)18-19-40(61)58(7)37(25-59)45(66)52-30(6)42(63)56-35/h9-11,13-14,16-17,22,26,28-30,32-38,59H,12,15,18-21,23-25H2,1-8H3,(H,52,66)(H,53,60)(H,54,64)(H,55,62)(H,56,63)(H,57,65)(H,67,68)(H,69,70)(H4,49,50,51)/b17-16+,27-22+/t28-,29-,30+,32-,33-,34+,35-,36+,37-,38-/m0/s1",HBXZQNYNISTYMB-PRSKPVKISA-N,146684704,no,Planktothrix; Dolichospermum/Anabaena,[Planktothrix]sp.; [Dolicospermum]sp.,[Planktothrix sp.]Max06;[Dolicospermum sp.]NIVA-CYA 656
CyanoMetDB_1894,MC-LA,,Microcystin,,C46H67N7O12,909.4847709,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"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,6437382,yes,Microcystis,aeruginosa,B2666
CyanoMetDB_1895,[D-Asp3]MC-RY,,Microcystin,,C51H70N10O13,1030.512383,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C51H70N10O13/c1-28(24-29(2)41(74-7)26-33-12-9-8-10-13-33)15-20-36-30(3)44(65)59-38(49(70)71)21-22-43(64)61(6)32(5)46(67)55-31(4)45(66)58-37(14-11-23-54-51(52)53)47(68)60-40(50(72)73)27-42(63)56-39(48(69)57-36)25-34-16-18-35(62)19-17-34/h8-10,12-13,15-20,24,29-31,36-41,62H,5,11,14,21-23,25-27H2,1-4,6-7H3,(H,55,67)(H,56,63)(H,57,69)(H,58,66)(H,59,65)(H,60,68)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,28-24+/t29-,30-,31+,36-,37-,38+,39-,40+,41-/m0/s1",AKRUYPJUAZTDLQ-XAIZWMDNSA-N,,yes,Microcystis,aeruginosa,NIVA-CYA 548
CyanoMetDB_1896,MC-NfkA,MC?NfkA (oxidised W),Microcystin,,C51H66N8O14,1014.469849,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C(C=CC=C3)=C3NC=O)=O)=O)=O)=O)=O,"InChI=1S/C51H66N8O14/c1-27(23-28(2)41(73-9)24-34-15-11-10-12-16-34)19-20-36-29(3)44(63)56-38(50(69)70)21-22-42(62)59(8)33(7)48(67)54-32(6)47(66)57-39(25-40(61)35-17-13-14-18-37(35)52-26-60)49(68)58-43(51(71)72)30(4)45(64)53-31(5)46(65)55-36/h10-20,23,26,28-32,36,38-39,41,43H,7,21-22,24-25H2,1-6,8-9H3,(H,52,60)(H,53,64)(H,54,67)(H,55,65)(H,56,63)(H,57,66)(H,58,68)(H,69,70)(H,71,72)/b20-19+,27-23+/t28-,29-,30-,31-,32+,36-,38+,39-,41-,43+/m0/s1",PLRHHYYFAQRVST-DJNDZUCYSA-N,,yes,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1897,[D-Asp³]MC?M(O)R,[Asp3]MC?M(O)R (oxidation artefact),Microcystin,,C47H70N10O13S,1014.484453,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCS(C)=O)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O13S/c1-26(23-27(2)37(70-7)24-31-13-10-9-11-14-31)16-17-32-28(3)40(60)55-35(45(65)66)18-19-39(59)57(6)30(5)42(62)51-29(4)41(61)54-34(20-22-71(8)69)44(64)56-36(46(67)68)25-38(58)52-33(43(63)53-32)15-12-21-50-47(48)49/h9-11,13-14,16-17,23,27-29,32-37H,5,12,15,18-22,24-25H2,1-4,6-8H3,(H,51,62)(H,52,58)(H,53,63)(H,54,61)(H,55,60)(H,56,64)(H,65,66)(H,67,68)(H4,48,49,50)/b17-16+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-,71?/m0/s1",OJRPYWXWCYXSKY-YJSIYZBQSA-N,146684783,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_1898,[D-Asp3]MC-FR,,Microcystin,,C51H70N10O12,1014.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H70N10O12/c1-29(25-30(2)41(73-7)27-35-17-12-9-13-18-35)20-21-36-31(3)44(64)58-38(49(69)70)22-23-43(63)61(6)33(5)46(66)55-32(4)45(65)59-39(26-34-15-10-8-11-16-34)48(68)60-40(50(71)72)28-42(62)56-37(47(67)57-36)19-14-24-54-51(52)53/h8-13,15-18,20-21,25,30-32,36-41H,5,14,19,22-24,26-28H2,1-4,6-7H3,(H,55,66)(H,56,62)(H,57,67)(H,58,64)(H,59,65)(H,60,68)(H,69,70)(H,71,72)(H4,52,53,54)/b21-20+,29-25+/t30-,31-,32+,36-,37-,38+,39-,40+,41-/m0/s1",SLBUJXKVOVJXQZ-KUOJBGIXSA-N,,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]M.TN-2
CyanoMetDB_1899,[Dha7]MC-FR,,Microcystin,,C51H70N10O12,1014.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H70N10O12/c1-28(25-29(2)40(73-7)27-35-17-12-9-13-18-35)20-21-36-30(3)43(63)59-38(49(69)70)22-23-41(62)55-32(5)45(65)56-33(6)46(66)60-39(26-34-15-10-8-11-16-34)48(68)61-42(50(71)72)31(4)44(64)58-37(47(67)57-36)19-14-24-54-51(52)53/h8-13,15-18,20-21,25,29-31,33,36-40,42H,5,14,19,22-24,26-27H2,1-4,6-7H3,(H,55,62)(H,56,65)(H,57,67)(H,58,64)(H,59,63)(H,60,66)(H,61,68)(H,69,70)(H,71,72)(H4,52,53,54)/b21-20+,28-25+/t29-,30-,31-,33+,36-,37-,38+,39-,40-,42+/m0/s1",CKQUGBQJZGUNMT-PLADHRKZSA-N,101659871,no,Microcystis,aeruginosa,[Microcystis aeruginosa]98
CyanoMetDB_1900,"[D?Asp3,Dha7]MC?HphR",,Microcystin,,C51H70N10O12,1014.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H70N10O12/c1-29(26-30(2)41(73-6)27-35-16-11-8-12-17-35)19-21-36-31(3)44(64)60-39(49(69)70)23-24-42(62)55-32(4)45(65)56-33(5)46(66)59-38(22-20-34-14-9-7-10-15-34)48(68)61-40(50(71)72)28-43(63)57-37(47(67)58-36)18-13-25-54-51(52)53/h7-12,14-17,19,21,26,30-31,33,36-41H,4,13,18,20,22-25,27-28H2,1-3,5-6H3,(H,55,62)(H,56,65)(H,57,63)(H,58,67)(H,59,66)(H,60,64)(H,61,68)(H,69,70)(H,71,72)(H4,52,53,54)/b21-19+,29-26+/t30-,31-,33+,36-,37-,38-,39+,40+,41-/m0/s1",OAEKMBBQVHZUFO-YGMMJAELSA-N,146684728,no,Anabaena,n.a.,[Anabaena sp.]66A
CyanoMetDB_1901,[DMAdda5]MC?FR,,Microcystin,,C51H70N10O12,1014.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C51H70N10O12/c1-28(25-29(2)40(62)27-35-17-12-9-13-18-35)20-21-36-30(3)43(64)58-38(49(70)71)22-23-41(63)61(7)33(6)46(67)55-32(5)45(66)59-39(26-34-15-10-8-11-16-34)48(69)60-42(50(72)73)31(4)44(65)57-37(47(68)56-36)19-14-24-54-51(52)53/h8-13,15-18,20-21,25,29-32,36-40,42,62H,6,14,19,22-24,26-27H2,1-5,7H3,(H,55,67)(H,56,68)(H,57,65)(H,58,64)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b21-20+,28-25+/t29-,30-,31-,32+,36-,37-,38+,39-,40-,42+/m0/s1",QOQCTPNZCVODIX-DXENUKDNSA-N,146684738,no,Nostoc,sp.,[Nostoc sp.]UK18
CyanoMetDB_1902,[D-Asp³]MC?RF,,Microcystin,,C51H70N10O12,1014.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H70N10O12/c1-29(25-30(2)41(73-7)27-35-17-12-9-13-18-35)20-21-36-31(3)44(64)59-38(49(69)70)22-23-43(63)61(6)33(5)46(66)55-32(4)45(65)58-37(19-14-24-54-51(52)53)47(67)60-40(50(71)72)28-42(62)56-39(48(68)57-36)26-34-15-10-8-11-16-34/h8-13,15-18,20-21,25,30-32,36-41H,5,14,19,22-24,26-28H2,1-4,6-7H3,(H,55,66)(H,56,62)(H,57,68)(H,58,65)(H,59,64)(H,60,67)(H,69,70)(H,71,72)(H4,52,53,54)/b21-20+,29-25+/t30-,31-,32+,36-,37-,38+,39-,40+,41-/m0/s1",JVGZZTIFWWWSIC-KUOJBGIXSA-N,,no,Microcystis,aeruginosa,[Microcystis aeruginosa]CYA548
CyanoMetDB_1903,[L-Ser7]MC-E(OMe)E(OMe),,Microcystin,,C48H69N7O17,1015.474994,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCC(=O)OC)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H69N7O17/c1-25(22-26(2)36(70-6)23-30-12-10-9-11-13-30)14-15-31-27(3)41(60)54-34(47(66)67)16-19-37(57)50-35(24-56)46(65)49-29(5)43(62)53-33(18-21-39(59)72-8)45(64)55-40(48(68)69)28(4)42(61)52-32(44(63)51-31)17-20-38(58)71-7/h9-15,22,26-29,31-36,40,56H,16-21,23-24H2,1-8H3,(H,49,65)(H,50,57)(H,51,63)(H,52,61)(H,53,62)(H,54,60)(H,55,64)(H,66,67)(H,68,69)/b15-14+,25-22+/t26-,27-,28-,29+,31-,32-,33-,34+,35-,36-,40+/m0/s1",AMOBUNZQEUJLCJ-WBINVAHYSA-N,146683848,no,Anabaena,n.a.,[Anabaena sp.]186
CyanoMetDB_1904,MC?LHty,,Microcystin,,C53H73N7O13,1015.526636,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCc2ccc(O)cc2)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C53H73N7O13/c1-29(2)26-42-51(68)59-45(53(71)72)33(6)47(64)56-40(23-19-36-17-20-38(61)21-18-36)50(67)55-39(22-16-30(3)27-31(4)43(73-10)28-37-14-12-11-13-15-37)32(5)46(63)57-41(52(69)70)24-25-44(62)60(9)35(8)49(66)54-34(7)48(65)58-42/h11-18,20-22,27,29,31-34,39-43,45,61H,8,19,23-26,28H2,1-7,9-10H3,(H,54,66)(H,55,67)(H,56,64)(H,57,63)(H,58,65)(H,59,68)(H,69,70)(H,71,72)/b22-16+,30-27+/t31-,32-,33-,34+,39-,40-,41+,42-,43-,45+/m0/s1",DBXKFHRYAHVEAX-NCUDYEQPSA-N,146684774,no,Phormidium,sp.,[Phormidium sp.]DVL1003c
CyanoMetDB_1905,"[D-Asp³,Dha7]MC?RY",,Microcystin,,C50H68N10O13,1016.496733,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H68N10O13/c1-27(23-28(2)40(73-6)25-32-11-8-7-9-12-32)14-19-35-29(3)43(64)59-37(48(69)70)20-21-41(62)54-30(4)44(65)55-31(5)45(66)58-36(13-10-22-53-50(51)52)46(67)60-39(49(71)72)26-42(63)56-38(47(68)57-35)24-33-15-17-34(61)18-16-33/h7-9,11-12,14-19,23,28-29,31,35-40,61H,4,10,13,20-22,24-26H2,1-3,5-6H3,(H,54,62)(H,55,65)(H,56,63)(H,57,68)(H,58,66)(H,59,64)(H,60,67)(H,69,70)(H,71,72)(H4,51,52,53)/b19-14+,27-23+/t28-,29-,31+,35-,36-,37+,38-,39+,40-/m0/s1",IHHURHYXJGJEHX-FAJQDCQVSA-N,,no,Microcystis,aeruginosa,[Microcystis aeruginosa]CYA548
CyanoMetDB_1906,"[Asp³,DMAdda5]MC?RY",,Microcystin,,C50H68N10O13,1016.496733,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)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]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C50H68N10O13/c1-27(23-28(2)40(62)25-32-11-8-7-9-12-32)14-19-35-29(3)43(65)58-37(48(70)71)20-21-42(64)60(6)31(5)45(67)54-30(4)44(66)57-36(13-10-22-53-50(51)52)46(68)59-39(49(72)73)26-41(63)55-38(47(69)56-35)24-33-15-17-34(61)18-16-33/h7-9,11-12,14-19,23,28-30,35-40,61-62H,5,10,13,20-22,24-26H2,1-4,6H3,(H,54,67)(H,55,63)(H,56,69)(H,57,66)(H,58,65)(H,59,68)(H,70,71)(H,72,73)(H4,51,52,53)/b19-14+,27-23+/t28-,29-,30+,35-,36-,37+,38-,39+,40-/m0/s1",ZNQSNIUNDKWLHS-XEHWMUBVSA-N,146684751,no,n.a.,n.a.,n.a.
CyanoMetDB_1907,MC-LL,,Microcystin,,C49H73N7O12,951.5317211,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC(C)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H73N7O12/c1-26(2)22-37-46(62)51-35(19-18-28(5)24-29(6)39(68-12)25-34-16-14-13-15-17-34)30(7)42(58)52-36(48(64)65)20-21-40(57)56(11)33(10)45(61)50-32(9)44(60)54-38(23-27(3)4)47(63)55-41(49(66)67)31(8)43(59)53-37/h13-19,24,26-27,29-32,35-39,41H,10,20-23,25H2,1-9,11-12H3,(H,50,61)(H,51,62)(H,52,58)(H,53,59)(H,54,60)(H,55,63)(H,64,65)(H,66,67)/b19-18+,28-24+/t29-,30-,31-,32+,35-,36+,37-,38-,39-,41+/m0/s1",GLDUYXHQWLQPRR-JKUQGWAOSA-N,102580315,no,n.a.,aeruginosa,[Diehnelt 2006] [Microcystis sp.]CAWBG11
CyanoMetDB_1908,MC-LF,,Microcystin,,C52H71N7O12,985.516071,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccccc2)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"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+/t31-,32-,33-,34+,38-,39+,40-,41-,42-,44+/m0/s1",FEVBMCJUKWWWBT-QVWKUIOOSA-N,16760563,no,Microcystis,aeruginosa,[Microcystis aeruginosa]NPJB-1
CyanoMetDB_1909,[ADMAdda5]MC?LR,,Microcystin,,C50H74N10O13,1022.543683,C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)[C@H]([C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)C)CCCN=C(N)N)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC(=O)C)/C,"InChI=1S/C50H74N10O13/c1-26(2)23-38-47(68)59-41(49(71)72)30(6)43(64)56-36(17-14-22-53-50(51)52)46(67)55-35(19-18-27(3)24-28(4)39(73-33(9)61)25-34-15-12-11-13-16-34)29(5)42(63)57-37(48(69)70)20-21-40(62)60(10)32(8)45(66)54-31(7)44(65)58-38/h11-13,15-16,18-19,24,26,28-31,35-39,41H,8,14,17,20-23,25H2,1-7,9-10H3,(H,54,66)(H,55,67)(H,56,64)(H,57,63)(H,58,65)(H,59,68)(H,69,70)(H,71,72)(H4,51,52,53)/b19-18+,27-24+/t28-,29-,30-,31+,35-,36-,37+,38-,39-,41+/m0/s1",DDMJZWZMKZNCTP-RASTYGMGSA-N,14752800,yes,Nostoc,n.a.,152; IO-102-I
CyanoMetDB_1910,MC-YA,,Microcystin,,C49H65N7O13,959.4640355,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H65N7O13/c1-26(23-27(2)39(69-9)25-33-13-11-10-12-14-33)15-20-36-28(3)42(59)53-37(48(65)66)21-22-40(58)56(8)32(7)46(63)51-31(6)45(62)54-38(24-34-16-18-35(57)19-17-34)47(64)55-41(49(67)68)29(4)43(60)50-30(5)44(61)52-36/h10-20,23,27-31,36-39,41,57H,7,21-22,24-25H2,1-6,8-9H3,(H,50,60)(H,51,63)(H,52,61)(H,53,59)(H,54,62)(H,55,64)(H,65,66)(H,67,68)/b20-15+,26-23+/t27-,28-,29-,30-,31+,36-,37+,38-,39-,41+/m0/s1",JODAXCVFVMHOSN-LZUXOUIYSA-N,101619977,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]UTEX 2670
CyanoMetDB_1911,"[D-Leu1,Dha7]MC-LR",,Microcystin,,C51H78N10O12,1022.580068,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H78N10O12/c1-27(2)23-38-47(67)60-39(24-28(3)4)48(68)61-42(50(71)72)32(8)44(64)57-36(17-14-22-54-51(52)53)46(66)56-35(19-18-29(5)25-30(6)40(73-10)26-34-15-12-11-13-16-34)31(7)43(63)58-37(49(69)70)20-21-41(62)55-33(9)45(65)59-38/h11-13,15-16,18-19,25,27-28,30-32,35-40,42H,9,14,17,20-24,26H2,1-8,10H3,(H,55,62)(H,56,66)(H,57,64)(H,58,63)(H,59,65)(H,60,67)(H,61,68)(H,69,70)(H,71,72)(H4,52,53,54)/b19-18+,29-25+/t30-,31-,32-,35-,36-,37+,38+,39-,40-,42+/m0/s1",KOIJCFISWXUGAO-NEFNCPLOSA-N,146684763,no,Nostoc; Microcystis,[Nostoc]sp.; [Microcystis]aeruginosa,[Nostoc sp.]UK8911A;[Microcystis aeruginosa]NPLJ-4
CyanoMetDB_1912,[D-Val1]MC?LR,,Microcystin,,C51H78N10O12,1022.580068,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(C)C)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H78N10O12/c1-27(2)24-38-47(67)60-42(50(71)72)32(8)44(64)56-36(18-15-23-54-51(52)53)46(66)55-35(20-19-29(5)25-30(6)39(73-11)26-34-16-13-12-14-17-34)31(7)43(63)57-37(49(69)70)21-22-40(62)61(10)33(9)45(65)59-41(28(3)4)48(68)58-38/h12-14,16-17,19-20,25,27-28,30-32,35-39,41-42H,9,15,18,21-24,26H2,1-8,10-11H3,(H,55,66)(H,56,64)(H,57,63)(H,58,68)(H,59,65)(H,60,67)(H,69,70)(H,71,72)(H4,52,53,54)/b20-19+,29-25+/t30-,31-,32-,35-,36-,37+,38-,39-,41+,42+/m0/s1",QEBMEJHOLOTQNA-ZTAMYMMKSA-N,146684764,no,Microcystis,aeruginosa,[Microcystis aeruginosa]NPLJ-4
CyanoMetDB_1913,"[D-Leu1,DMAdda5]MC-LR",,Microcystin,,C51H78N10O12,1022.5801,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C51H78N10O12/c1-27(2)23-38-47(68)59-39(24-28(3)4)48(69)60-42(50(72)73)32(8)44(65)56-36(17-14-22-54-51(52)53)46(67)55-35(19-18-29(5)25-30(6)40(62)26-34-15-12-11-13-16-34)31(7)43(64)57-37(49(70)71)20-21-41(63)61(10)33(9)45(66)58-38/h11-13,15-16,18-19,25,27-28,30-32,35-40,42,62H,9,14,17,20-24,26H2,1-8,10H3,(H,55,67)(H,56,65)(H,57,64)(H,58,66)(H,59,68)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b19-18+,29-25+/t30-,31-,32-,35-,36-,37+,38+,39-,40-,42+/m0/s1",ZHYBUNDBGXRGAL-NEFNCPLOSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1914,"[D-Leu1,dmAdda5]MC-LR (isomer 1)","[D-Leu1,(8-desmethyl)Adda5]MC-LR is depicted",Microcystin,,C51H78N10O12,1022.5801,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/C[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C51H78N10O12/c1-28(2)25-39-47(67)59-40(26-29(3)4)48(68)60-42(50(71)72)32(7)44(64)56-37(17-14-24-54-51(52)53)46(66)55-36(21-19-30(5)18-20-35(73-10)27-34-15-12-11-13-16-34)31(6)43(63)57-38(49(69)70)22-23-41(62)61(9)33(8)45(65)58-39/h11-13,15-16,18-19,21,28-29,31-32,35-40,42H,8,14,17,20,22-27H2,1-7,9-10H3,(H,55,66)(H,56,64)(H,57,63)(H,58,65)(H,59,67)(H,60,68)(H,69,70)(H,71,72)(H4,52,53,54)/b21-19+,30-18+/t31-,32-,35+,36-,37-,38+,39+,40-,42+/m0/s1",SCAWNGGFANAHEA-YFVOVKPZSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1915,"[D-Leu1,dmAdda5]MC-LR (isomer 2)","[D-Leu1,(6-desmethyl)Adda5]MC-LR is depicted",Microcystin,,C51H78N10O12,1022.5801,CC(C)C[C@H]1NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@H](\C=C\C=C\[C@H](C)[C@H](Cc2ccccc2)OC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC1=O)C(=O)O)C(=O)O,"InChI=1S/C51H78N10O12/c1-28(2)25-38-47(67)59-39(26-29(3)4)48(68)60-42(50(71)72)32(7)44(64)56-36(21-16-24-54-51(52)53)46(66)55-35(20-15-14-17-30(5)40(73-10)27-34-18-12-11-13-19-34)31(6)43(63)57-37(49(69)70)22-23-41(62)61(9)33(8)45(65)58-38/h11-15,17-20,28-32,35-40,42H,8,16,21-27H2,1-7,9-10H3,(H,55,66)(H,56,64)(H,57,63)(H,58,65)(H,59,67)(H,60,68)(H,69,70)(H,71,72)(H4,52,53,54)/b17-14+,20-15+/t30-,31-,32-,35-,36-,37+,38+,39-,40-,42+/m0/s1",ZUIGOPVLTVMXIU-UIZUBYECSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1916,MC-LY,,Microcystin,,C52H71N7O13,1001.510986,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"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+/t30-,31-,32-,33+,38-,39+,40-,41-,42-,44+/m0/s1",SIGQAYSWORHPPH-WSTSHCHISA-N,71312414,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]UAM-1303
CyanoMetDB_1917,MC-YM,,Microcystin,,C51H69N7O13S,1019.467406,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCSC)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H69N7O13S/c1-28(25-29(2)41(71-8)27-34-13-11-10-12-14-34)15-20-37-30(3)44(61)55-39(50(67)68)21-22-42(60)58(7)33(6)47(64)52-32(5)46(63)56-40(26-35-16-18-36(59)19-17-35)49(66)57-43(51(69)70)31(4)45(62)54-38(23-24-72-9)48(65)53-37/h10-20,25,29-32,37-41,43,59H,6,21-24,26-27H2,1-5,7-9H3,(H,52,64)(H,53,65)(H,54,62)(H,55,61)(H,56,63)(H,57,66)(H,67,68)(H,69,70)/b20-15+,28-25+/t29-,30-,31-,32+,37-,38-,39+,40-,41-,43+/m0/s1",CZNWJIGJNMVYOS-PQCSFXGESA-N,146683864,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]UTEX 2670
CyanoMetDB_1918,[Dha7]MC-RR,,Microcystin,,C48H73N13O12,1023.550165,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H73N13O12/c1-25(23-26(2)36(73-7)24-31-13-9-8-10-14-31)17-18-32-27(3)39(63)60-35(45(69)70)19-20-37(62)55-29(5)41(65)56-30(6)42(66)59-34(16-12-22-54-48(51)52)44(68)61-38(46(71)72)28(4)40(64)58-33(43(67)57-32)15-11-21-53-47(49)50/h8-10,13-14,17-18,23,26-28,30,32-36,38H,5,11-12,15-16,19-22,24H2,1-4,6-7H3,(H,55,62)(H,56,65)(H,57,67)(H,58,64)(H,59,66)(H,60,63)(H,61,68)(H,69,70)(H,71,72)(H4,49,50,53)(H4,51,52,54)/b18-17+,25-23+/t26-,27-,28-,30+,32-,33-,34-,35+,36-,38+/m0/s1",ANEDRERLGQEWQI-UAWDZTONSA-N,6441234,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]205
CyanoMetDB_1919,"[Gly1,D-Asp³,Dhb7]MC?Rhar",,Microcystin,,C48H73N13O12,1023.550165,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C(=CC)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)CCCCNC(=N)N)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H73N13O12/c1-6-31-42(66)55-26-40(64)58-34(16-12-22-54-48(51)52)44(68)61-36(46(71)72)25-39(63)57-33(15-10-11-21-53-47(49)50)43(67)59-32(29(4)41(65)60-35(45(69)70)19-20-38(62)56-31)18-17-27(2)23-28(3)37(73-5)24-30-13-8-7-9-14-30/h6-9,13-14,17-18,23,28-29,32-37H,10-12,15-16,19-22,24-26H2,1-5H3,(H,55,66)(H,56,62)(H,57,63)(H,58,64)(H,59,67)(H,60,65)(H,61,68)(H,69,70)(H,71,72)(H4,49,50,53)(H4,51,52,54)/b18-17+,27-23+,31-6?/t28-,29-,32-,33-,34-,35+,36+,37-/m0/s1",XXDSTGLUHVLWDL-QXXCSYONSA-N,146683804,no,n.a.,n.a.,n.a.
CyanoMetDB_1920,"[Gly1,D-Asp3]MC-RHar",,Microcystin,,C48H73N13O12,1023.5502,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H73N13O12/c1-27(23-28(2)37(73-6)24-31-13-8-7-9-14-31)17-18-32-29(3)41(65)59-35(45(69)70)19-20-40(64)61(5)30(4)42(66)55-26-39(63)57-34(16-12-22-54-48(51)52)44(68)60-36(46(71)72)25-38(62)56-33(43(67)58-32)15-10-11-21-53-47(49)50/h7-9,13-14,17-18,23,28-29,32-37H,4,10-12,15-16,19-22,24-26H2,1-3,5-6H3,(H,55,66)(H,56,62)(H,57,63)(H,58,67)(H,59,65)(H,60,68)(H,69,70)(H,71,72)(H4,49,50,53)(H4,51,52,54)/b18-17+,27-23+/t28-,29-,32-,33-,34-,35+,36+,37-/m0/s1",OFONZIYCWCBBSK-QTEMMPDJSA-N,146683837,no,n.a.,n.a.,n.a.
CyanoMetDB_1921,[DMAdda5]MC-RR,,Microcystin,,C48H73N13O12,1023.5502,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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]1C)C(=O)O)C(=O)O)[C@@H](O)Cc1ccccc1,"InChI=1S/C48H73N13O12/c1-25(23-26(2)36(62)24-31-13-9-8-10-14-31)17-18-32-27(3)39(64)59-35(45(70)71)19-20-37(63)61(7)30(6)42(67)55-29(5)41(66)58-34(16-12-22-54-48(51)52)44(69)60-38(46(72)73)28(4)40(65)57-33(43(68)56-32)15-11-21-53-47(49)50/h8-10,13-14,17-18,23,26-29,32-36,38,62H,6,11-12,15-16,19-22,24H2,1-5,7H3,(H,55,67)(H,56,68)(H,57,65)(H,58,66)(H,59,64)(H,60,69)(H,70,71)(H,72,73)(H4,49,50,53)(H4,51,52,54)/b18-17+,25-23+/t26-,27-,28-,29+,32-,33-,34-,35+,36-,38+/m0/s1",QNXSMJGNFUUQFQ-BLNINCLDSA-N,146683857,no,n.a.,n.a.,n.a.
CyanoMetDB_1922,MC-LW,,Microcystin,,C54H72N8O12,1024.52697,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2c[NH]c3ccccc32)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"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,16760564,no,Microcystis,aeruginosa,[Microcystis aeruginosa]PCC7820
CyanoMetDB_1923,MC-WL,,Microcystin,,C54H72N8O12,1024.52697,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2c[NH]c3ccccc32)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C54H72N8O12/c1-29(2)24-42-51(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)60-43(27-37-28-55-40-19-15-14-18-38(37)40)52(69)61-46(54(72)73)33(6)48(65)59-42/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",STMJLSNDMMJCDL-LNXRSHCCSA-N,,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_1924,[D-Asp3]MC-RCit,,Microcystin,,C48H72N12O13,1024.5342,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(N)=O)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N12O13/c1-26(23-27(2)37(73-7)24-31-13-9-8-10-14-31)17-18-32-28(3)40(63)58-35(45(68)69)19-20-39(62)60(6)30(5)42(65)54-29(4)41(64)57-34(16-11-21-52-47(49)50)44(67)59-36(46(70)71)25-38(61)55-33(43(66)56-32)15-12-22-53-48(51)72/h8-10,13-14,17-18,23,27-29,32-37H,5,11-12,15-16,19-22,24-25H2,1-4,6-7H3,(H,54,65)(H,55,61)(H,56,66)(H,57,64)(H,58,63)(H,59,67)(H,68,69)(H,70,71)(H4,49,50,52)(H3,51,53,72)/b18-17+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1",MWOUSUQNUHRYLP-LTPNNWFFSA-N,146683813,no,Planktothrix ,prolifica ,NIVA-CYA 544
CyanoMetDB_1925,"[D-Asp3,ADMAdda5,Thr7]MC-LR",,Microcystin,,C49H74N10O14,1026.538597,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC1=CC=CC=C1)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N2)CC(C)C)=O)=O)=O)=O)N[C@@H](C(O)C)C(N[C@@H](C2=O)C)=O,"InChI=1S/C49H74N10O14/c1-25(2)21-36-45(67)58-37(48(71)72)24-40(63)54-34(15-12-20-52-49(50)51)44(66)55-33(17-16-26(3)22-27(4)38(73-31(8)61)23-32-13-10-9-11-14-32)28(5)42(64)56-35(47(69)70)18-19-39(62)59-41(30(7)60)46(68)53-29(6)43(65)57-36/h9-11,13-14,16-17,22,25,27-30,33-38,41,60H,12,15,18-21,23-24H2,1-8H3,(H,53,68)(H,54,63)(H,55,66)(H,56,64)(H,57,65)(H,58,67)(H,59,62)(H,69,70)(H,71,72)(H4,50,51,52)/b17-16+,26-22+/t27-,28-,29+,30?,33-,34-,35+,36-,37+,38-,41-/m0/s1",QJNPZTRQEFLDPL-KDMVTSMASA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1926,[seco-1/2]MC-HilR,H?(L?Hil)?(MeAsp)?(L?Arg)?(Adda)?(D?Glu)?(Mdha)?(D?Ala)?OH,Microcystin,,C50H78N10O13,1026.574983,O=C(O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](N)C[C@@H](C)CC)C(=O)O)/C=C/C(/C)=C/[C@H](C)[C@@H](OC)Cc1ccccc1)C(=O)O,"InChI=1S/C50H78N10O13/c1-11-27(2)25-35(51)45(65)59-41(49(71)72)31(6)43(63)57-37(18-15-23-54-50(52)53)46(66)56-36(20-19-28(3)24-29(4)39(73-10)26-34-16-13-12-14-17-34)30(5)42(62)58-38(48(69)70)21-22-40(61)60(9)33(8)44(64)55-32(7)47(67)68/h12-14,16-17,19-20,24,27,29-32,35-39,41H,8,11,15,18,21-23,25-26,51H2,1-7,9-10H3,(H,55,64)(H,56,66)(H,57,63)(H,58,62)(H,59,65)(H,67,68)(H,69,70)(H,71,72)(H4,52,53,54)/b20-19+,28-24+/t27-,29-,30-,31-,32+,35-,36-,37-,38+,39-,41+/m0/s1",TWKTYHOANJLEMM-RZMACXILSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1927,"[D-Asp3,Ser7]MC-RR",,Microcystin,,C47H73N13O13,1027.5451,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H73N13O13/c1-25(21-26(2)36(73-5)22-29-11-7-6-8-12-29)15-16-30-27(3)39(64)59-33(44(69)70)17-18-37(62)56-35(24-61)43(68)54-28(4)40(65)58-32(14-10-20-53-47(50)51)42(67)60-34(45(71)72)23-38(63)55-31(41(66)57-30)13-9-19-52-46(48)49/h6-8,11-12,15-16,21,26-28,30-36,61H,9-10,13-14,17-20,22-24H2,1-5H3,(H,54,68)(H,55,63)(H,56,62)(H,57,66)(H,58,65)(H,59,64)(H,60,67)(H,69,70)(H,71,72)(H4,48,49,52)(H4,50,51,53)/b16-15+,25-21+/t26-,27-,28+,30-,31-,32-,33+,34+,35-,36-/m0/s1",WSHYAOXMZXNUAQ-MPCPOGOHSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1928,MC-NfkAba,MC?NfkAbu (oxidised W),Microcystin,,C52H68N8O14,1028.485499,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C(C=CC=C3)=C3NC=O)=O)=O)=O)=O)=O,"InChI=1S/C52H68N8O14/c1-10-36-49(68)56-37(21-20-28(2)24-29(3)42(74-9)25-34-16-12-11-13-17-34)30(4)45(64)57-39(51(70)71)22-23-43(63)60(8)33(7)48(67)54-32(6)47(66)58-40(26-41(62)35-18-14-15-19-38(35)53-27-61)50(69)59-44(52(72)73)31(5)46(65)55-36/h11-21,24,27,29-32,36-37,39-40,42,44H,7,10,22-23,25-26H2,1-6,8-9H3,(H,53,61)(H,54,67)(H,55,65)(H,56,68)(H,57,64)(H,58,66)(H,59,69)(H,70,71)(H,72,73)/b21-20+,28-24+/t29-,30-,31-,32+,36-,37-,39+,40-,42-,44+/m0/s1",USXZNWBTSVNVRL-NHEVINJRSA-N,146683826,no,Microcystis,n.a.,CAWBG11
CyanoMetDB_1929,MC-M(O)R,MC?M(O)R,Microcystin,,C48H72N10O13S,1028.500103,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCS(C)=O)=O)=O)=O)=O,"InChI=1S/C48H72N10O13S/c1-26(24-27(2)37(71-8)25-32-14-11-10-12-15-32)17-18-33-28(3)40(60)56-36(46(66)67)19-20-38(59)58(7)31(6)43(63)52-30(5)42(62)55-35(21-23-72(9)70)45(65)57-39(47(68)69)29(4)41(61)54-34(44(64)53-33)16-13-22-51-48(49)50/h10-12,14-15,17-18,24,27-30,33-37,39H,6,13,16,19-23,25H2,1-5,7-9H3,(H,52,63)(H,53,64)(H,54,61)(H,55,62)(H,56,60)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,26-24+/t27-,28-,29-,30+,33-,34-,35-,36+,37-,39+,72?/m0/s1",RUYWGLHBHWTKHT-SSYCBDRMSA-N,101619978,yes,n.a.,n.a.,n.a.
CyanoMetDB_1930,"[D-Asp3,(E)-Dhb7]MC-HphR",Cyanoviridin-RR,Microcystin,,C52H72N10O12,1028.533118,O=C(N/C(C(N[C@@H](C1=O)C)=O)=C/C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O12/c1-7-36-47(67)56-33(5)46(66)60-39(23-21-34-15-10-8-11-16-34)49(69)62-41(51(72)73)29-44(64)58-38(19-14-26-55-52(53)54)48(68)59-37(32(4)45(65)61-40(50(70)71)24-25-43(63)57-36)22-20-30(2)27-31(3)42(74-6)28-35-17-12-9-13-18-35/h7-13,15-18,20,22,27,31-33,37-42H,14,19,21,23-26,28-29H2,1-6H3,(H,56,67)(H,57,63)(H,58,64)(H,59,68)(H,60,66)(H,61,65)(H,62,69)(H,70,71)(H,72,73)(H4,53,54,55)/b22-20+,30-27+,36-7+/t31-,32-,33+,37-,38-,39-,40+,41+,42-/m0/s1",BQQVLFQTGZVVKM-ANYUHGQASA-N,,yes,Oscillatoria/Planktothrix,rubescens,UTCC507
CyanoMetDB_1931,[D-Asp3]MC?HphR,,Microcystin,,C52H72N10O12,1028.533118,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H72N10O12/c1-30(27-31(2)42(74-7)28-36-17-12-9-13-18-36)20-22-37-32(3)45(65)60-40(50(70)71)24-25-44(64)62(6)34(5)47(67)56-33(4)46(66)59-39(23-21-35-15-10-8-11-16-35)49(69)61-41(51(72)73)29-43(63)57-38(48(68)58-37)19-14-26-55-52(53)54/h8-13,15-18,20,22,27,31-33,37-42H,5,14,19,21,23-26,28-29H2,1-4,6-7H3,(H,56,67)(H,57,63)(H,58,68)(H,59,66)(H,60,65)(H,61,69)(H,70,71)(H,72,73)(H4,53,54,55)/b22-20+,30-27+/t31-,32-,33+,37-,38-,39-,40+,41+,42-/m0/s1",SNSOAISNMANBOH-PAAISOOGSA-N,146684705,no,Planktothrix,sp.,[Planktothrix sp.]Max06
CyanoMetDB_1932,[Dha7]MC-HphR,,Microcystin,,C52H72N10O12,1028.533118,O=C(NC(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O12/c1-29(27-30(2)41(74-7)28-36-17-12-9-13-18-36)20-22-37-31(3)44(64)61-40(50(70)71)24-25-42(63)56-33(5)46(66)57-34(6)47(67)60-39(23-21-35-15-10-8-11-16-35)49(69)62-43(51(72)73)32(4)45(65)59-38(48(68)58-37)19-14-26-55-52(53)54/h8-13,15-18,20,22,27,30-32,34,37-41,43H,5,14,19,21,23-26,28H2,1-4,6-7H3,(H,56,63)(H,57,66)(H,58,68)(H,59,65)(H,60,67)(H,61,64)(H,62,69)(H,70,71)(H,72,73)(H4,53,54,55)/b22-20+,29-27+/t30-,31-,32-,34+,37-,38-,39-,40+,41-,43+/m0/s1",DCAGLOYSRZSAJK-ZIHFDJJESA-N,146683849,no,Anabaena,n.a.,[Anabaena sp.]66
CyanoMetDB_1933,MC?LV,,Microcystin,,C48H71N7O12,937.516071,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](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]1C)C(=O)O)C(=O)O)C(C)C)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H71N7O12/c1-25(2)22-36-45(61)54-40(48(65)66)30(8)42(58)53-39(26(3)4)46(62)50-34(19-18-27(5)23-28(6)37(67-12)24-33-16-14-13-15-17-33)29(7)41(57)51-35(47(63)64)20-21-38(56)55(11)32(10)44(60)49-31(9)43(59)52-36/h13-19,23,25-26,28-31,34-37,39-40H,10,20-22,24H2,1-9,11-12H3,(H,49,60)(H,50,62)(H,51,57)(H,52,59)(H,53,58)(H,54,61)(H,63,64)(H,65,66)/b19-18+,27-23+/t28-,29-,30-,31+,34-,35+,36-,37-,39-,40+/m0/s1",AJUZGGJRRWZCKO-LGJGRGOKSA-N,146684729,no,Hapalosiphon,hibernicus,[Hapalosiphon hibernicus]BZ-3-1
CyanoMetDB_1934,MC?RF,,Microcystin,,C52H72N10O12,1028.533118,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=CC=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C52H72N10O12/c1-29(26-30(2)41(74-8)28-36-18-13-10-14-19-36)21-22-37-31(3)44(64)59-39(50(70)71)23-24-42(63)62(7)34(6)47(67)56-33(5)46(66)58-38(20-15-25-55-52(53)54)48(68)61-43(51(72)73)32(4)45(65)60-40(49(69)57-37)27-35-16-11-9-12-17-35/h9-14,16-19,21-22,26,30-33,37-41,43H,6,15,20,23-25,27-28H2,1-5,7-8H3,(H,56,67)(H,57,69)(H,58,66)(H,59,64)(H,60,65)(H,61,68)(H,70,71)(H,72,73)(H4,53,54,55)/b22-21+,29-26+/t30-,31-,32-,33+,37-,38-,39+,40-,41-,43+/m0/s1",IDRFLSYJDPQZQQ-POWPIGGBSA-N,146684757,no,n.a.,n.a.,n.a.
CyanoMetDB_1935,[D-Asp³]MC?M(O2)R,[Asp3]MC?M(O2)R (oxidation artefact),Microcystin,,C47H70N10O14S,1030.479368,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCS(C)(=O)=O)=O)=O)=O)=O,"InChI=1S/C47H70N10O14S/c1-26(23-27(2)37(71-7)24-31-13-10-9-11-14-31)16-17-32-28(3)40(60)55-35(45(65)66)18-19-39(59)57(6)30(5)42(62)51-29(4)41(61)54-34(20-22-72(8,69)70)44(64)56-36(46(67)68)25-38(58)52-33(43(63)53-32)15-12-21-50-47(48)49/h9-11,13-14,16-17,23,27-29,32-37H,5,12,15,18-22,24-25H2,1-4,6-8H3,(H,51,62)(H,52,58)(H,53,63)(H,54,61)(H,55,60)(H,56,64)(H,65,66)(H,67,68)(H4,48,49,50)/b17-16+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1",OKBMXOMXWWVSNC-QTDAUVDESA-N,146684784,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_1936,"[D-Asp3,Dha7]MC-HtyR",,Microcystin,,C51H70N10O13,1030.512383,O=C(NC(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C51H70N10O13/c1-28(25-29(2)41(74-6)26-34-11-8-7-9-12-34)14-20-36-30(3)44(65)60-39(49(70)71)22-23-42(63)55-31(4)45(66)56-32(5)46(67)59-38(21-17-33-15-18-35(62)19-16-33)48(69)61-40(50(72)73)27-43(64)57-37(47(68)58-36)13-10-24-54-51(52)53/h7-9,11-12,14-16,18-20,25,29-30,32,36-41,62H,4,10,13,17,21-24,26-27H2,1-3,5-6H3,(H,55,63)(H,56,66)(H,57,64)(H,58,68)(H,59,67)(H,60,65)(H,61,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-14+,28-25+/t29-,30-,32+,36-,37-,38-,39+,40+,41-/m0/s1",HNBGKQBQBJXYNW-MRZPJGPASA-N,146683850,no,Anabaena,n.a.,[Anabaena sp.]66
CyanoMetDB_1937,[D-Asp3]MC-YR,,Microcystin,,C51H70N10O13,1030.512383,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H70N10O13/c1-28(24-29(2)41(74-7)26-33-12-9-8-10-13-33)15-20-36-30(3)44(65)58-38(49(70)71)21-22-43(64)61(6)32(5)46(67)55-31(4)45(66)59-39(25-34-16-18-35(62)19-17-34)48(69)60-40(50(72)73)27-42(63)56-37(47(68)57-36)14-11-23-54-51(52)53/h8-10,12-13,15-20,24,29-31,36-41,62H,5,11,14,21-23,25-27H2,1-4,6-7H3,(H,55,67)(H,56,63)(H,57,68)(H,58,65)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,28-24+/t29-,30-,31+,36-,37-,38+,39-,40+,41-/m0/s1",QZMBFAWAEGLVMI-XAIZWMDNSA-N,101642890,no,n.a.,n.a.,n.a.
CyanoMetDB_1938,[Dha7]MC-YR,,Microcystin,,C51H70N10O13,1030.512383,O=C(NC(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C51H70N10O13/c1-27(24-28(2)40(74-7)26-33-12-9-8-10-13-33)15-20-36-29(3)43(64)59-38(49(70)71)21-22-41(63)55-31(5)45(66)56-32(6)46(67)60-39(25-34-16-18-35(62)19-17-34)48(69)61-42(50(72)73)30(4)44(65)58-37(47(68)57-36)14-11-23-54-51(52)53/h8-10,12-13,15-20,24,28-30,32,36-40,42,62H,5,11,14,21-23,25-26H2,1-4,6-7H3,(H,55,63)(H,56,66)(H,57,68)(H,58,65)(H,59,64)(H,60,67)(H,61,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,27-24+/t28-,29-,30-,32+,36-,37-,38+,39-,40-,42+/m0/s1",IRVUYTLKKQEENF-YMOIXCTBSA-N,101643556,no,Microcystis,aeruginosa,[Microcystis aeruginosa]CALU 972
CyanoMetDB_1939,[DMAdda5]MC?YR,,Microcystin,,C51H70N10O13,1030.512383,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C51H70N10O13/c1-27(24-28(2)40(63)26-33-12-9-8-10-13-33)15-20-36-29(3)43(65)58-38(49(71)72)21-22-41(64)61(7)32(6)46(68)55-31(5)45(67)59-39(25-34-16-18-35(62)19-17-34)48(70)60-42(50(73)74)30(4)44(66)57-37(47(69)56-36)14-11-23-54-51(52)53/h8-10,12-13,15-20,24,28-31,36-40,42,62-63H,6,11,14,21-23,25-26H2,1-5,7H3,(H,55,68)(H,56,69)(H,57,66)(H,58,65)(H,59,67)(H,60,70)(H,71,72)(H,73,74)(H4,52,53,54)/b20-15+,27-24+/t28-,29-,30-,31+,36-,37-,38+,39-,40-,42+/m0/s1",WZIFCFVNRWFPIQ-GAOADQHISA-N,,no,Microcystis,n.a.,AB2011/53 (isolated from Hartbeespoort Dam)
CyanoMetDB_1940,"[D-Asp3,DMAdda5]MC?HtyR",,Microcystin,,C51H70N10O13,1030.512383,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C51H70N10O13/c1-28(25-29(2)41(63)26-34-11-8-7-9-12-34)14-20-36-30(3)44(66)59-39(49(71)72)22-23-43(65)61(6)32(5)46(68)55-31(4)45(67)58-38(21-17-33-15-18-35(62)19-16-33)48(70)60-40(50(73)74)27-42(64)56-37(47(69)57-36)13-10-24-54-51(52)53/h7-9,11-12,14-16,18-20,25,29-31,36-41,62-63H,5,10,13,17,21-24,26-27H2,1-4,6H3,(H,55,68)(H,56,64)(H,57,69)(H,58,67)(H,59,66)(H,60,70)(H,71,72)(H,73,74)(H4,52,53,54)/b20-14+,28-25+/t29-,30-,31+,36-,37-,38-,39+,40+,41-/m0/s1",BMYLDJWLCUBHCY-SMHKPUPISA-N,146683867,no,Planktothrix,sp.,[Planktothrix sp.]Max06
CyanoMetDB_1941,[D-Asp3]MC-RR,,Microcystin,,C48H73N13O12,1023.550165,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H73N13O12/c1-26(23-27(2)37(73-7)24-31-13-9-8-10-14-31)17-18-32-28(3)40(64)59-35(45(69)70)19-20-39(63)61(6)30(5)42(66)55-29(4)41(65)58-34(16-12-22-54-48(51)52)44(68)60-36(46(71)72)25-38(62)56-33(43(67)57-32)15-11-21-53-47(49)50/h8-10,13-14,17-18,23,27-29,32-37H,5,11-12,15-16,19-22,24-25H2,1-4,6-7H3,(H,55,66)(H,56,62)(H,57,67)(H,58,65)(H,59,64)(H,60,68)(H,69,70)(H,71,72)(H4,49,50,53)(H4,51,52,54)/b18-17+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1",UNKUVURYGRFCIZ-LTPNNWFFSA-N,21576447,yes,Oscillatoria/Planktothrix,agardhii,[Oscillatoria/Planktothrix agardhii]CYA-29
CyanoMetDB_1942,[Dha7]MC?RY,,Microcystin,,C51H70N10O13,1030.512383,O=C(NC(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C51H70N10O13/c1-27(24-28(2)40(74-7)26-33-12-9-8-10-13-33)15-20-36-29(3)43(64)59-38(49(70)71)21-22-41(63)55-31(5)45(66)56-32(6)46(67)58-37(14-11-23-54-51(52)53)47(68)61-42(50(72)73)30(4)44(65)60-39(48(69)57-36)25-34-16-18-35(62)19-17-34/h8-10,12-13,15-20,24,28-30,32,36-40,42,62H,5,11,14,21-23,25-26H2,1-4,6-7H3,(H,55,63)(H,56,66)(H,57,69)(H,58,67)(H,59,64)(H,60,65)(H,61,68)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,27-24+/t28-,29-,30-,32+,36-,37-,38+,39-,40-,42+/m0/s1",GEDLVCGECHWHFL-YMOIXCTBSA-N,146684758,no,n.a.,n.a.,n.a.
CyanoMetDB_1943,"[D-Asp³,Dhb7]MC?RY",,Microcystin,,C51H70N10O13,1030.512383,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CC2=CC=C(O)C=C2)NC(C[C@H](C(O)=O)NC([C@@H](N3)CCCNC(N)=N)=O)=O)=O)=O)NC(C(N[C@@H](C3=O)C)=O)=CC,"InChI=1S/C51H70N10O13/c1-7-35-46(67)55-31(5)45(66)59-37(14-11-23-54-51(52)53)47(68)61-40(50(72)73)27-43(64)57-39(25-33-16-18-34(62)19-17-33)48(69)58-36(30(4)44(65)60-38(49(70)71)21-22-42(63)56-35)20-15-28(2)24-29(3)41(74-6)26-32-12-9-8-10-13-32/h7-10,12-13,15-20,24,29-31,36-41,62H,11,14,21-23,25-27H2,1-6H3,(H,55,67)(H,56,63)(H,57,64)(H,58,69)(H,59,66)(H,60,65)(H,61,68)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,28-24+,35-7?/t29-,30-,31+,36-,37-,38+,39-,40+,41-/m0/s1",VLFZRTCMEIPKAG-DWHNULMMSA-N,146684752,no,n.a.,n.a.,multiple strains
CyanoMetDB_1944,"[D-Asp3,(E)-Dhb7]MC-YR","[Asp3, (E)?Dhb7]MC?YR",Microcystin,,C51H70N10O13,1030.512383,O=C(N/C(C(N[C@@H](C1=O)C)=O)=C/C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C51H70N10O13/c1-7-35-46(67)55-31(5)45(66)60-39(25-33-16-18-34(62)19-17-33)48(69)61-40(50(72)73)27-43(64)57-37(14-11-23-54-51(52)53)47(68)58-36(30(4)44(65)59-38(49(70)71)21-22-42(63)56-35)20-15-28(2)24-29(3)41(74-6)26-32-12-9-8-10-13-32/h7-10,12-13,15-20,24,29-31,36-41,62H,11,14,21-23,25-27H2,1-6H3,(H,55,67)(H,56,63)(H,57,64)(H,58,68)(H,59,65)(H,60,66)(H,61,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,28-24+,35-7+/t29-,30-,31+,36-,37-,38+,39-,40+,41-/m0/s1",HCSRXVAEHOQWBK-RYYUPNNBSA-N,146683830,yes,Oscillatoria/Planktothrix,rubescens,[Oscillatoria/Planktothrix rubescens]CBT 310
CyanoMetDB_1945,MC?LY(OMe),,Microcystin,,C53H73N7O14,1031.52155,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC(OC)=C(O)C=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C53H73N7O14/c1-28(2)23-39-51(68)59-45(53(71)72)32(6)47(64)57-40(25-36-18-21-41(61)43(27-36)74-11)50(67)55-37(19-17-29(3)24-30(4)42(73-10)26-35-15-13-12-14-16-35)31(5)46(63)56-38(52(69)70)20-22-44(62)60(9)34(8)49(66)54-33(7)48(65)58-39/h12-19,21,24,27-28,30-33,37-40,42,45,61H,8,20,22-23,25-26H2,1-7,9-11H3,(H,54,66)(H,55,67)(H,56,63)(H,57,64)(H,58,65)(H,59,68)(H,69,70)(H,71,72)/b19-17+,29-24+/t30-,31-,32-,33+,37-,38+,39-,40-,42-,45+/m0/s1",QARMBORJLOKVDT-PWMZSGMGSA-N,,no,Microcystis,aeruginosa,CYA548
CyanoMetDB_1946,[D-Asp3]MC-(H2)YR,,Microcystin,,C51H72N10O13,1032.528032,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC3=CC[C@@H](O)C=C3)=O)=O)=O)=O,"InChI=1S/C51H72N10O13/c1-28(24-29(2)41(74-7)26-33-12-9-8-10-13-33)15-20-36-30(3)44(65)58-38(49(70)71)21-22-43(64)61(6)32(5)46(67)55-31(4)45(66)59-39(25-34-16-18-35(62)19-17-34)48(69)60-40(50(72)73)27-42(63)56-37(47(68)57-36)14-11-23-54-51(52)53/h8-10,12-13,15-18,20,24,29-31,35-41,62H,5,11,14,19,21-23,25-27H2,1-4,6-7H3,(H,55,67)(H,56,63)(H,57,68)(H,58,65)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,28-24+/t29-,30-,31+,35-,36-,37-,38+,39-,40+,41-/m0/s1",CJOJWAGHCMFLCT-PYVADERCSA-N,146684956,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_1947,[Dha7]MC?(H4)YR,,Microcystin,,C51H74N10O13,1034.543683,O=C(CC[C@@H](NC([C@H]([C@@H](NC([C@@H](NC([C@H]([C@@H](NC([C@H](C[C@]1(C=C[C@@H](CC1)O)[H])N2)=O)C(O)=O)C)=O)CCCNC(N)=N)=O)/C=C/C(C)=C/[C@@H]([C@H](CC3=CC=CC=C3)OC)C)C)=O)C(O)=O)NC(C(N[C@H](C)C2=O)=O)=C,"InChI=1S/C51H74N10O13/c1-27(24-28(2)40(74-7)26-33-12-9-8-10-13-33)15-20-36-29(3)43(64)59-38(49(70)71)21-22-41(63)55-31(5)45(66)56-32(6)46(67)60-39(25-34-16-18-35(62)19-17-34)48(69)61-42(50(72)73)30(4)44(65)58-37(47(68)57-36)14-11-23-54-51(52)53/h8-10,12-13,15-16,18,20,24,28-30,32,34-40,42,62H,5,11,14,17,19,21-23,25-26H2,1-4,6-7H3,(H,55,63)(H,56,66)(H,57,68)(H,58,65)(H,59,64)(H,60,67)(H,61,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,27-24+/t28-,29-,30-,32+,34-,35-,36-,37-,38+,39-,40-,42+/m0/s1",TUAADMHCVHCCPV-UIBXFZKZSA-N,146684735,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]NIES CRM No. 26
CyanoMetDB_1948,[D-Asp³]MC?(H4)YR,,Microcystin,,C51H74N10O13,1034.543683,O=C(CC[C@@H](NC([C@H]([C@@H](NC([C@@H](NC(C[C@@H](NC([C@H](C[C@]1(C=C[C@@H](CC1)O)[H])N2)=O)C(O)=O)=O)CCCNC(N)=N)=O)/C=C/C(C)=C/[C@@H]([C@H](CC3=CC=CC=C3)OC)C)C)=O)C(O)=O)N(C(C(N[C@H](C)C2=O)=O)=C)C,"InChI=1S/C51H74N10O13/c1-28(24-29(2)41(74-7)26-33-12-9-8-10-13-33)15-20-36-30(3)44(65)58-38(49(70)71)21-22-43(64)61(6)32(5)46(67)55-31(4)45(66)59-39(25-34-16-18-35(62)19-17-34)48(69)60-40(50(72)73)27-42(63)56-37(47(68)57-36)14-11-23-54-51(52)53/h8-10,12-13,15-16,18,20,24,29-31,34-41,62H,5,11,14,17,19,21-23,25-27H2,1-4,6-7H3,(H,55,67)(H,56,63)(H,57,68)(H,58,65)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-15+,28-24+/t29-,30-,31+,34-,35-,36-,37-,38+,39-,40+,41-/m0/s1",JAXVACFEWWEOKE-NMOCKCCNSA-N,,no,Microcystis,aeruginosa,AB2011/53
CyanoMetDB_1949,[DMAdda5]MC?(H4)YR,,Microcystin,,C51H74N10O13,1034.543683,O=C(CC[C@@H](NC([C@H]([C@@H](NC([C@@H](NC([C@H]([C@@H](NC([C@H](C[C@]1(C=C[C@@H](CC1)O)[H])N2)=O)C(O)=O)C)=O)CCCNC(N)=N)=O)/C=C/C(C)=C/[C@@H]([C@H](CC3=CC=CC=C3)O)C)C)=O)C(O)=O)N(C(C(N[C@H](C)C2=O)=O)=C)C,"InChI=1S/C51H74N10O13/c1-27(24-28(2)40(63)26-33-12-9-8-10-13-33)15-20-36-29(3)43(65)58-38(49(71)72)21-22-41(64)61(7)32(6)46(68)55-31(5)45(67)59-39(25-34-16-18-35(62)19-17-34)48(70)60-42(50(73)74)30(4)44(66)57-37(47(69)56-36)14-11-23-54-51(52)53/h8-10,12-13,15-16,18,20,24,28-31,34-40,42,62-63H,6,11,14,17,19,21-23,25-26H2,1-5,7H3,(H,55,68)(H,56,69)(H,57,66)(H,58,65)(H,59,67)(H,60,70)(H,71,72)(H,73,74)(H4,52,53,54)/b20-15+,27-24+/t28-,29-,30-,31+,34-,35-,36-,37-,38+,39-,40-,42+/m0/s1",LWTYIWMPGBPRGQ-ZVRPPTPOSA-N,146684739,no,Nostoc,sp.,[Nostoc sp.]UK18
CyanoMetDB_1950,"[D-Asp3,Dha7]MC-LR",,Microcystin,,C47H70N10O12,966.517468,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C47H70N10O12/c1-25(2)21-35-44(64)57-36(46(67)68)24-39(59)53-33(15-12-20-50-47(48)49)43(63)54-32(17-16-26(3)22-27(4)37(69-8)23-31-13-10-9-11-14-31)28(5)40(60)55-34(45(65)66)18-19-38(58)51-29(6)41(61)52-30(7)42(62)56-35/h9-11,13-14,16-17,22,25,27-28,30,32-37H,6,12,15,18-21,23-24H2,1-5,7-8H3,(H,51,58)(H,52,61)(H,53,59)(H,54,63)(H,55,60)(H,56,62)(H,57,64)(H,65,66)(H,67,68)(H4,48,49,50)/b17-16+,26-22+/t27-,28-,30+,32-,33-,34+,35-,36+,37-/m0/s1",PENYTKSZIDPONS-NGLWDUFTSA-N,6441615,no,Microcystis,aeruginosa,[Microcystis aeruginosa]K-139
CyanoMetDB_1951,[ADMAdda5]MC-LHar,,Microcystin,,C51H76N10O13,1036.559333,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C51H76N10O13/c1-27(2)24-39-48(69)60-42(50(72)73)31(6)44(65)57-37(18-14-15-23-54-51(52)53)47(68)56-36(20-19-28(3)25-29(4)40(74-34(9)62)26-35-16-12-11-13-17-35)30(5)43(64)58-38(49(70)71)21-22-41(63)61(10)33(8)46(67)55-32(7)45(66)59-39/h11-13,16-17,19-20,25,27,29-32,36-40,42H,8,14-15,18,21-24,26H2,1-7,9-10H3,(H,55,67)(H,56,68)(H,57,65)(H,58,64)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-19+,28-25+/t29-,30-,31-,32+,36-,37-,38+,39-,40-,42+/m0/s1",HSOIUAGRQAPKJZ-PMZUZRGZSA-N,14752802,yes,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1952,[ADMAdda5]MC?HilR,,Microcystin,,C51H76N10O13,1036.559333,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C51H76N10O13/c1-11-27(2)25-39-48(69)60-42(50(72)73)31(6)44(65)57-37(18-15-23-54-51(52)53)47(68)56-36(20-19-28(3)24-29(4)40(74-34(9)62)26-35-16-13-12-14-17-35)30(5)43(64)58-38(49(70)71)21-22-41(63)61(10)33(8)46(67)55-32(7)45(66)59-39/h12-14,16-17,19-20,24,27,29-32,36-40,42H,8,11,15,18,21-23,25-26H2,1-7,9-10H3,(H,55,67)(H,56,68)(H,57,65)(H,58,64)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b20-19+,28-24+/t27-,29-,30-,31-,32+,36-,37-,38+,39-,40-,42+/m0/s1",SJPOBNMEGAYSAV-XZKVJARFSA-N,146684730,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1953,[D-Asp3]MC-LR,3-desmethylmicrocystin LR,Microcystin,,C48H72N10O12,980.5331181,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H72N10O12/c1-26(2)22-36-45(65)57-37(47(68)69)25-39(59)53-34(16-13-21-51-48(49)50)44(64)54-33(18-17-27(3)23-28(4)38(70-9)24-32-14-11-10-12-15-32)29(5)41(61)55-35(46(66)67)19-20-40(60)58(8)31(7)43(63)52-30(6)42(62)56-36/h10-12,14-15,17-18,23,26,28-30,33-38H,7,13,16,19-22,24-25H2,1-6,8-9H3,(H,52,63)(H,53,59)(H,54,64)(H,55,61)(H,56,62)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,27-23+/t28-,29-,30+,33-,34-,35+,36-,37+,38-/m0/s1",VYEBKSHVYPDMQQ-MREVJOSWSA-N,6440025,no,Anabaena,flos aquae,[Anabaena flos-aquae]S-23-g-1
CyanoMetDB_1954,MC?AnaR,,Microcystin,,C52H80N10O12,1036.595718,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCCCCC)=O)=O)=O)=O,"InChI=1S/C52H80N10O12/c1-10-11-12-13-17-21-38-49(69)61-43(51(72)73)33(5)45(65)58-39(22-18-27-55-52(53)54)48(68)57-37(24-23-30(2)28-31(3)41(74-9)29-36-19-15-14-16-20-36)32(4)44(64)60-40(50(70)71)25-26-42(63)62(8)35(7)47(67)56-34(6)46(66)59-38/h14-16,19-20,23-24,28,31-34,37-41,43H,7,10-13,17-18,21-22,25-27,29H2,1-6,8-9H3,(H,56,67)(H,57,68)(H,58,65)(H,59,66)(H,60,64)(H,61,69)(H,70,71)(H,72,73)(H4,53,54,55)/b24-23+,30-28+/t31-,32-,33-,34+,37-,38-,39-,40+,41-,43+/m0/s1",MKFNFTJHXRTWHG-LFTVSPSXSA-N,,no,Microcystis,n.a.,AB2011/53
CyanoMetDB_1955,[D-Asp³]MC?YY,,Microcystin,,C54H67N7O14,1037.4746,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CC2=CC=C(O)C=C2)NC(C[C@H](C(O)=O)NC([C@@H](N3)CC4=CC=C(O)C=C4)=O)=O)=O)=O)N(C)C(C(N[C@@H](C3=O)C)=O)=C,"InChI=1S/C54H67N7O14/c1-30(25-31(2)45(75-7)28-35-11-9-8-10-12-35)13-22-40-32(3)48(66)58-41(53(71)72)23-24-47(65)61(6)34(5)50(68)55-33(4)49(67)59-43(27-37-16-20-39(63)21-17-37)52(70)60-44(54(73)74)29-46(64)56-42(51(69)57-40)26-36-14-18-38(62)19-15-36/h8-22,25,31-33,40-45,62-63H,5,23-24,26-29H2,1-4,6-7H3,(H,55,68)(H,56,64)(H,57,69)(H,58,66)(H,59,67)(H,60,70)(H,71,72)(H,73,74)/b22-13+,30-25+/t31-,32-,33+,40-,41+,42-,43-,44+,45-/m0/s1",OCYZRCVDCXSNRA-JFMOJRJTSA-N,,no,Microcystis,aeruginosa,CYA548
CyanoMetDB_1956,"[Gly1,D-Asp3,ADMAdda5,Dhb7]MC-RR",,Microcystin,,C48H71N13O13,1037.52943,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C(=CC)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)CCCNC(=N)N,"InChI=1S/C48H71N13O13/c1-6-31-42(67)55-25-40(65)58-34(15-11-21-54-48(51)52)44(69)61-36(46(72)73)24-39(64)57-33(14-10-20-53-47(49)50)43(68)59-32(28(4)41(66)60-35(45(70)71)18-19-38(63)56-31)17-16-26(2)22-27(3)37(74-29(5)62)23-30-12-8-7-9-13-30/h6-9,12-13,16-17,22,27-28,32-37H,10-11,14-15,18-21,23-25H2,1-5H3,(H,55,67)(H,56,63)(H,57,64)(H,58,65)(H,59,68)(H,60,66)(H,61,69)(H,70,71)(H,72,73)(H4,49,50,53)(H4,51,52,54)/b17-16+,26-22+,31-6?/t27-,28-,32-,33-,34-,35+,36+,37-/m0/s1",KSYULEJYRAZDKO-DKIRLTFKSA-N,146683805,no,n.a.,n.a.,n.a.
CyanoMetDB_1957,"[Gly1,D-Asp3,ADMAdda5]MC-RR",,Microcystin,,C48H71N13O13,1037.52943,O=C(N(C)C(C(NCC1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C48H71N13O13/c1-26(22-27(2)37(74-30(5)62)23-31-12-8-7-9-13-31)16-17-32-28(3)41(66)59-35(45(70)71)18-19-40(65)61(6)29(4)42(67)55-25-39(64)57-34(15-11-21-54-48(51)52)44(69)60-36(46(72)73)24-38(63)56-33(43(68)58-32)14-10-20-53-47(49)50/h7-9,12-13,16-17,22,27-28,32-37H,4,10-11,14-15,18-21,23-25H2,1-3,5-6H3,(H,55,67)(H,56,63)(H,57,64)(H,58,68)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,49,50,53)(H4,51,52,54)/b17-16+,26-22+/t27-,28-,32-,33-,34-,35+,36+,37-/m0/s1",UBDNPCAZTHQJTO-KTRJARRNSA-N,146683838,no,Nostoc,cyanobacterial mat,n.a.
CyanoMetDB_1958,[D-Asp3]MC-RHar,,Microcystin,,C49H75N13O12,1037.565815,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C49H75N13O12/c1-27(24-28(2)38(74-7)25-32-14-9-8-10-15-32)18-19-33-29(3)41(65)60-36(46(70)71)20-21-40(64)62(6)31(5)43(67)56-30(4)42(66)59-35(17-13-23-55-49(52)53)45(69)61-37(47(72)73)26-39(63)57-34(44(68)58-33)16-11-12-22-54-48(50)51/h8-10,14-15,18-19,24,28-30,33-38H,5,11-13,16-17,20-23,25-26H2,1-4,6-7H3,(H,56,67)(H,57,63)(H,58,68)(H,59,66)(H,60,65)(H,61,69)(H,70,71)(H,72,73)(H4,50,51,54)(H4,52,53,55)/b19-18+,27-24+/t28-,29-,30+,33-,34-,35-,36+,37+,38-/m0/s1",PNAKPAPXVBSBCP-ZFXYJWGJSA-N,146683807,no,n.a.,n.a.,n.a.
CyanoMetDB_1959,"[D-Asp3,D-MeO-Glu6]MC-RR","[D-Asp3,D-Glu(OMe)6]MC-RR",Microcystin,,C49H75N13O12,1037.565815,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C49H75N13O12/c1-27(24-28(2)38(73-7)25-32-14-10-9-11-15-32)18-19-33-29(3)41(65)60-36(47(72)74-8)20-21-40(64)62(6)31(5)43(67)56-30(4)42(66)59-35(17-13-23-55-49(52)53)45(69)61-37(46(70)71)26-39(63)57-34(44(68)58-33)16-12-22-54-48(50)51/h9-11,14-15,18-19,24,28-30,33-38H,5,12-13,16-17,20-23,25-26H2,1-4,6-8H3,(H,56,67)(H,57,63)(H,58,68)(H,59,66)(H,60,65)(H,61,69)(H,70,71)(H4,50,51,54)(H4,52,53,55)/b19-18+,27-24+/t28-,29-,30+,33-,34-,35-,36+,37+,38-/m0/s1",DHJZAIAJHLMMPF-ZFXYJWGJSA-N,23248162,yes,n.a.,rubescens,n.a.
CyanoMetDB_1961,"[Asp3,Dhb7]MC-LY","[Asp3,Dhb7]MC?LY",Microcystin,,C51H69N7O13,987.4953356,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H69N7O13/c1-9-36-47(64)52-32(7)46(63)57-39(23-28(2)3)48(65)58-41(51(69)70)27-44(61)54-40(25-34-16-18-35(59)19-17-34)49(66)55-37(31(6)45(62)56-38(50(67)68)21-22-43(60)53-36)20-15-29(4)24-30(5)42(71-8)26-33-13-11-10-12-14-33/h9-20,24,28,30-32,37-42,59H,21-23,25-27H2,1-8H3,(H,52,64)(H,53,60)(H,54,61)(H,55,66)(H,56,62)(H,57,63)(H,58,65)(H,67,68)(H,69,70)/b20-15+,29-24+,36-9?/t30-,31-,32+,37-,38+,39-,40-,41+,42-/m0/s1",OSIYJQIKKULRMP-MNXMRTDASA-N,,no,Oscillatoria/Planktothrix,rubescens,n.a.
CyanoMetDB_1962,"[D-Asp3,(E)-Dhb7]MC-RR",,Microcystin,,C48H73N13O12,1023.550165,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(=C\C)/NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H73N13O12/c1-7-31-42(66)55-29(5)41(65)59-34(16-12-22-54-48(51)52)44(68)61-36(46(71)72)25-39(63)57-33(15-11-21-53-47(49)50)43(67)58-32(28(4)40(64)60-35(45(69)70)19-20-38(62)56-31)18-17-26(2)23-27(3)37(73-6)24-30-13-9-8-10-14-30/h7-10,13-14,17-18,23,27-29,32-37H,11-12,15-16,19-22,24-25H2,1-6H3,(H,55,66)(H,56,62)(H,57,63)(H,58,67)(H,59,65)(H,60,64)(H,61,68)(H,69,70)(H,71,72)(H4,49,50,53)(H4,51,52,54)/b18-17+,26-23+,31-7+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1",JIVQGWHGELHXHV-UTGMKIGISA-N,117064449,yes,Oscillatoria/Planktothrix,sp.; agardhii,[Oscillatoria agardhii]NIES 610
CyanoMetDB_1963,"[D-Ser1,ADMAdda5]MC-LR",,Microcystin,,C50H74N10O14,1038.538597,O=C(N(C)C(C(N[C@@H](C1=O)CO)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C50H74N10O14/c1-26(2)22-37-46(68)59-41(49(72)73)30(6)43(65)55-35(16-13-21-53-50(51)52)45(67)54-34(18-17-27(3)23-28(4)39(74-32(8)62)24-33-14-11-10-12-15-33)29(5)42(64)56-36(48(70)71)19-20-40(63)60(9)31(7)44(66)58-38(25-61)47(69)57-37/h10-12,14-15,17-18,23,26,28-30,34-39,41,61H,7,13,16,19-22,24-25H2,1-6,8-9H3,(H,54,67)(H,55,65)(H,56,64)(H,57,69)(H,58,66)(H,59,68)(H,70,71)(H,72,73)(H4,51,52,53)/b18-17+,27-23+/t28-,29-,30-,34-,35-,36+,37-,38+,39-,41+/m0/s1",LIAFLGINUNSQGF-ABEBPWJESA-N,101641980,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1964,"[D-Met1,D-Asp3]MC-LR",,Microcystin,,C50H76N10O12S,1040.536489,O=C(N(C)C(C(N[C@@H](C1=O)CCSC)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C50H76N10O12S/c1-28(2)24-38-47(67)59-39(49(70)71)27-41(61)54-35(16-13-22-53-50(51)52)45(65)55-34(18-17-29(3)25-30(4)40(72-8)26-33-14-11-10-12-15-33)31(5)43(63)57-37(48(68)69)19-20-42(62)60(7)32(6)44(64)56-36(21-23-73-9)46(66)58-38/h10-12,14-15,17-18,25,28,30-31,34-40H,6,13,16,19-24,26-27H2,1-5,7-9H3,(H,54,61)(H,55,65)(H,56,64)(H,57,63)(H,58,66)(H,59,67)(H,68,69)(H,70,71)(H4,51,52,53)/b18-17+,29-25+/t30-,31-,34-,35-,36+,37+,38-,39+,40-/m0/s1",AKMHMZBZMVAHQA-OWQGMYRZSA-N,146684765,no,Microcystis,aeruginosa,[Microcystis aeruginosa]NPLJ-4
CyanoMetDB_1965,"[ADMAdda5,Mser7]MC-LR",,Microcystin,,C50H76N10O14,1040.554247,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C50H76N10O14/c1-26(2)22-37-46(68)59-41(49(72)73)30(6)43(65)56-35(16-13-21-53-50(51)52)45(67)55-34(18-17-27(3)23-28(4)39(74-32(8)62)24-33-14-11-10-12-15-33)29(5)42(64)57-36(48(70)71)19-20-40(63)60(9)38(25-61)47(69)54-31(7)44(66)58-37/h10-12,14-15,17-18,23,26,28-31,34-39,41,61H,13,16,19-22,24-25H2,1-9H3,(H,54,69)(H,55,67)(H,56,65)(H,57,64)(H,58,66)(H,59,68)(H,70,71)(H,72,73)(H4,51,52,53)/b18-17+,27-23+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,39-,41+/m0/s1",FGMNKDLRQCTWIB-BYOYILFWSA-N,6450141,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1966,"[D?Asp³,Mser7]MC?RR",,Microcystin,,C48H75N13O13,1041.56073,O=C(N(C)[C@@H](CO)C(N[C@H](C)C1=O)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C48H75N13O13/c1-26(22-27(2)37(74-6)23-30-12-8-7-9-13-30)16-17-31-28(3)40(65)59-34(45(70)71)18-19-39(64)61(5)36(25-62)44(69)55-29(4)41(66)58-33(15-11-21-54-48(51)52)43(68)60-35(46(72)73)24-38(63)56-32(42(67)57-31)14-10-20-53-47(49)50/h7-9,12-13,16-17,22,27-29,31-37,62H,10-11,14-15,18-21,23-25H2,1-6H3,(H,55,69)(H,56,63)(H,57,67)(H,58,66)(H,59,65)(H,60,68)(H,70,71)(H,72,73)(H4,49,50,53)(H4,51,52,54)/b17-16+,26-22+/t27-,28-,29+,31-,32-,33-,34+,35+,36-,37-/m0/s1",JSNLJCSMZZDASS-UPNJEQNISA-N,146684696,no,Oscillatoria/Planktothrix,agardhii,"49, 195, 214"
CyanoMetDB_1967,[Ser7]MC-RR,,Microcystin,,C48H75N13O13,1041.56073,O=C(N[C@@H](CO)C(N[C@H](C)C1=O)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C48H75N13O13/c1-25(22-26(2)36(74-6)23-30-12-8-7-9-13-30)16-17-31-27(3)39(64)60-34(45(70)71)18-19-37(63)56-35(24-62)44(69)55-29(5)41(66)59-33(15-11-21-54-48(51)52)43(68)61-38(46(72)73)28(4)40(65)58-32(42(67)57-31)14-10-20-53-47(49)50/h7-9,12-13,16-17,22,26-29,31-36,38,62H,10-11,14-15,18-21,23-24H2,1-6H3,(H,55,69)(H,56,63)(H,57,67)(H,58,65)(H,59,66)(H,60,64)(H,61,68)(H,70,71)(H,72,73)(H4,49,50,53)(H4,51,52,54)/b17-16+,25-22+/t26-,27-,28-,29+,31-,32-,33-,34+,35-,36-,38+/m0/s1",OYVAKSWRYSRRKU-LLELUXQJSA-N,101642888,no,Anabaena,n.a.,"[Anabaena sp.]202 A1, [Anabaena sp.]202 A2"
CyanoMetDB_1968,[seco7][D-Asp3]MC-RR,[seco-1/7][D-Asp3]MC-RR,Microcystin,,C48H75N13O13,1041.56073,CC(=O)C(=O)N[C@H](C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@H](CC(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](/C=C/C(/C)=C/[C@H](C)[C@@H](OC)Cc1ccccc1)[C@H](C)C(=O)N[C@H](CCC(=O)NC)C(=O)O)C(=O)O,"InChI=1S/C48H75N13O13/c1-26(23-27(2)37(74-7)24-31-13-9-8-10-14-31)17-18-32(28(3)40(65)60-35(45(70)71)19-20-38(63)53-6)58-43(68)33(15-11-21-54-47(49)50)57-39(64)25-36(46(72)73)61-44(69)34(16-12-22-55-48(51)52)59-41(66)29(4)56-42(67)30(5)62/h8-10,13-14,17-18,23,27-29,32-37H,11-12,15-16,19-22,24-25H2,1-7H3,(H,53,63)(H,56,67)(H,57,64)(H,58,68)(H,59,66)(H,60,65)(H,61,69)(H,70,71)(H,72,73)(H4,49,50,54)(H4,51,52,55)/b18-17+,26-23+/t27-,28-,29+,32-,33-,34-,35+,36+,37-/m0/s1",RDMMSXPNHDOGME-LTPNNWFFSA-N,11815573,yes,Oscillatoria/Planktothrix,rubescens,n.a.
CyanoMetDB_1969,"[D-Asp3,Thr7]MC?RR",,Microcystin,,C48H75N13O13,1041.56073,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(C)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C48H75N13O13/c1-25(22-26(2)36(74-6)23-30-12-8-7-9-13-30)16-17-31-27(3)40(65)59-34(45(70)71)18-19-37(63)61-39(29(5)62)44(69)55-28(4)41(66)58-33(15-11-21-54-48(51)52)43(68)60-35(46(72)73)24-38(64)56-32(42(67)57-31)14-10-20-53-47(49)50/h7-9,12-13,16-17,22,26-29,31-36,39,62H,10-11,14-15,18-21,23-24H2,1-6H3,(H,55,69)(H,56,64)(H,57,67)(H,58,66)(H,59,65)(H,60,68)(H,61,63)(H,70,71)(H,72,73)(H4,49,50,53)(H4,51,52,54)/b17-16+,25-22+/t26-,27-,28+,29?,31-,32-,33-,34+,35+,36-,39?/m0/s1",IVVHVGUGWVJZKJ-VBYGUZBDSA-N,146684712,no,Planktothrix,rubescens,"173, 208"
CyanoMetDB_1970,MC?HphHty,,Microcystin,,C57H73N7O13,1063.526636,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCc2ccc(O)cc2)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CCc2ccccc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C57H73N7O13/c1-33(31-34(2)47(77-8)32-41-17-13-10-14-18-41)19-26-43-35(3)50(67)62-46(56(73)74)29-30-48(66)64(7)38(6)53(70)58-37(5)52(69)61-45(27-22-39-15-11-9-12-16-39)55(72)63-49(57(75)76)36(4)51(68)60-44(54(71)59-43)28-23-40-20-24-42(65)25-21-40/h9-21,24-26,31,34-37,43-47,49,65H,6,22-23,27-30,32H2,1-5,7-8H3,(H,58,70)(H,59,71)(H,60,68)(H,61,69)(H,62,67)(H,63,72)(H,73,74)(H,75,76)/b26-19+,33-31+/t34-,35-,36-,37+,43-,44-,45-,46+,47-,49+/m0/s1",GPSIPJQQMCPLFC-ZOGHLDEHSA-N,146684766,no,Phormidium,n.a.,DVL1003c; LP904C
CyanoMetDB_1971,[D-MeO-Glu6]MC-FR,[D-Glu(OMe)6]MC-FR,Microcystin,,C53H74N10O12,1042.5488,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C53H74N10O12/c1-30(27-31(2)42(74-8)29-37-19-14-11-15-20-37)22-23-38-32(3)45(65)60-40(52(73)75-9)24-25-43(64)63(7)35(6)48(68)57-34(5)47(67)61-41(28-36-17-12-10-13-18-36)50(70)62-44(51(71)72)33(4)46(66)59-39(49(69)58-38)21-16-26-56-53(54)55/h10-15,17-20,22-23,27,31-34,38-42,44H,6,16,21,24-26,28-29H2,1-5,7-9H3,(H,57,68)(H,58,69)(H,59,66)(H,60,65)(H,61,67)(H,62,70)(H,71,72)(H4,54,55,56)/b23-22+,30-27+/t31-,32-,33-,34+,38-,39-,40+,41-,42-,44+/m0/s1",TUXKJPGQNPVSCV-LBEBTBASSA-N,146683862,no,n.a.,sp.,n.a.
CyanoMetDB_1972,[D-Leu1]MC-LY,,Microcystin,,C55H77N7O13,1043.5579,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C55H77N7O13/c1-30(2)25-42-51(68)60-43(26-31(3)4)53(70)61-47(55(73)74)35(8)49(66)58-44(28-38-18-20-39(63)21-19-38)52(69)56-40(22-17-32(5)27-33(6)45(75-11)29-37-15-13-12-14-16-37)34(7)48(65)57-41(54(71)72)23-24-46(64)62(10)36(9)50(67)59-42/h12-22,27,30-31,33-35,40-45,47,63H,9,23-26,28-29H2,1-8,10-11H3,(H,56,69)(H,57,65)(H,58,66)(H,59,67)(H,60,68)(H,61,70)(H,71,72)(H,73,74)/b22-17+,32-27+/t33-,34-,35-,40-,41+,42+,43-,44-,45-,47+/m0/s1",ANDKUSLFYHFLNO-WVYYMHGOSA-N,139594199,yes,Microcystis,aeruginosa,CPCC 464
CyanoMetDB_1973,MC?M(O2)R,MC?M(O2)R (oxidation artefact),Microcystin,,C48H72N10O14S,1044.495018,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCS(C)(=O)=O)=O)=O)=O)=O,"InChI=1S/C48H72N10O14S/c1-26(24-27(2)37(72-8)25-32-14-11-10-12-15-32)17-18-33-28(3)40(60)56-36(46(66)67)19-20-38(59)58(7)31(6)43(63)52-30(5)42(62)55-35(21-23-73(9,70)71)45(65)57-39(47(68)69)29(4)41(61)54-34(44(64)53-33)16-13-22-51-48(49)50/h10-12,14-15,17-18,24,27-30,33-37,39H,6,13,16,19-23,25H2,1-5,7-9H3,(H,52,63)(H,53,64)(H,54,61)(H,55,62)(H,56,60)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,26-24+/t27-,28-,29-,30+,33-,34-,35-,36+,37-,39+/m0/s1",NHPKXVVXNWNWBU-MCUDKQGFSA-N,146684785,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_1974,[Dhb7]MC-YR,,Microcystin,,C52H72N10O13,1044.528032,O=C(NC(C(N[C@@H](C1=O)C)=O)=CC)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O13/c1-8-36-47(68)56-32(6)46(67)61-40(26-34-17-19-35(63)20-18-34)49(70)62-43(51(73)74)31(5)45(66)59-38(15-12-24-55-52(53)54)48(69)58-37(30(4)44(65)60-39(50(71)72)22-23-42(64)57-36)21-16-28(2)25-29(3)41(75-7)27-33-13-10-9-11-14-33/h8-11,13-14,16-21,25,29-32,37-41,43,63H,12,15,22-24,26-27H2,1-7H3,(H,56,68)(H,57,64)(H,58,69)(H,59,66)(H,60,65)(H,61,67)(H,62,70)(H,71,72)(H,73,74)(H4,53,54,55)/b21-16+,28-25+,36-8?/t29-,30-,31-,32+,37-,38-,39+,40-,41-,43+/m0/s1",XJSOCTMEOQATBC-GWDXHOIDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1975,"[D-Asp3,ADMAdda5]MC-LR",,Microcystin,,C49H72N10O13,1008.528033,C[C@H]1[C@@H](NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)C(=C)N(C(=O)CC[C@@H](NC1=O)C(=O)O)C)C)CC(C)C)C(=O)O)CCCN=C(N)N)/C=C/C(=C/[C@H](C)[C@H](CC2=CC=CC=C2)OC(=O)C)/C,"InChI=1S/C49H72N10O13/c1-26(2)22-37-46(67)58-38(48(70)71)25-40(61)54-35(16-13-21-52-49(50)51)45(66)55-34(18-17-27(3)23-28(4)39(72-32(8)60)24-33-14-11-10-12-15-33)29(5)42(63)56-36(47(68)69)19-20-41(62)59(9)31(7)44(65)53-30(6)43(64)57-37/h10-12,14-15,17-18,23,26,28-30,34-39H,7,13,16,19-22,24-25H2,1-6,8-9H3,(H,53,65)(H,54,61)(H,55,66)(H,56,63)(H,57,64)(H,58,67)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,27-23+/t28-,29-,30+,34-,35-,36+,37-,38+,39-/m0/s1",PLFFZWBHDRTEHV-VLVYYTPOSA-N,14752804,yes,Nostoc,n.a.,152; IO-102-I
CyanoMetDB_1976,[Dha7]MC-HtyR,,Microcystin,,C52H72N10O13,1044.528033,O=C(NC(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O13/c1-28(26-29(2)41(75-7)27-35-12-9-8-10-13-35)15-21-37-30(3)44(65)61-40(50(71)72)23-24-42(64)56-32(5)46(67)57-33(6)47(68)60-39(22-18-34-16-19-36(63)20-17-34)49(70)62-43(51(73)74)31(4)45(66)59-38(48(69)58-37)14-11-25-55-52(53)54/h8-10,12-13,15-17,19-21,26,29-31,33,37-41,43,63H,5,11,14,18,22-25,27H2,1-4,6-7H3,(H,56,64)(H,57,67)(H,58,69)(H,59,66)(H,60,68)(H,61,65)(H,62,70)(H,71,72)(H,73,74)(H4,53,54,55)/b21-15+,28-26+/t29-,30-,31-,33+,37-,38-,39-,40+,41-,43+/m0/s1",KGAVCHMHGJSYBJ-ZNUBTALFSA-N,101642107,yes,Anabaena,n.a.,[Anabaena sp.]66
CyanoMetDB_1977,"[D-Asp3,(E)-Dhb7]MC-HtyR",,Microcystin,,C52H72N10O13,1044.528033,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C\C)/NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H72N10O13/c1-7-36-47(68)56-32(5)46(67)60-39(22-18-33-16-19-35(63)20-17-33)49(70)62-41(51(73)74)28-44(65)58-38(14-11-25-55-52(53)54)48(69)59-37(31(4)45(66)61-40(50(71)72)23-24-43(64)57-36)21-15-29(2)26-30(3)42(75-6)27-34-12-9-8-10-13-34/h7-10,12-13,15-17,19-21,26,30-32,37-42,63H,11,14,18,22-25,27-28H2,1-6H3,(H,56,68)(H,57,64)(H,58,65)(H,59,69)(H,60,67)(H,61,66)(H,62,70)(H,71,72)(H,73,74)(H4,53,54,55)/b21-15+,29-26+,36-7+/t30-,31-,32+,37-,38-,39-,40+,41+,42-/m0/s1",VRSPDCJDWOZKSK-FDUALHMESA-N,15837270,yes,Oscillatoria/Planktothrix,agardhii,[Oscillatoria/Planktothrix agardhii]CCAP 1459/14
CyanoMetDB_1978,"[D-Asp3,(Z)-Dhb7]MC-HtyR",,Microcystin,,C52H72N10O13,1044.528033,O=C(N/C(C(N[C@H](C)C1=O)=O)=C\C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O13/c1-7-36-47(68)56-32(5)46(67)60-39(22-18-33-16-19-35(63)20-17-33)49(70)62-41(51(73)74)28-44(65)58-38(14-11-25-55-52(53)54)48(69)59-37(31(4)45(66)61-40(50(71)72)23-24-43(64)57-36)21-15-29(2)26-30(3)42(75-6)27-34-12-9-8-10-13-34/h7-10,12-13,15-17,19-21,26,30-32,37-42,63H,11,14,18,22-25,27-28H2,1-6H3,(H,56,68)(H,57,64)(H,58,65)(H,59,69)(H,60,67)(H,61,66)(H,62,70)(H,71,72)(H,73,74)(H4,53,54,55)/b21-15+,29-26+,36-7-/t30-,31-,32+,37-,38-,39-,40+,41+,42-/m0/s1",VRSPDCJDWOZKSK-ZWNPEXSNSA-N,21635773,yes,Oscillatoria/Planktothrix,agardhii,bloom
CyanoMetDB_1979,[(6Z)-Adda5]MC-LR,,Microcystin,,C49H74N10O12,994.5487682,C[C@@H](\C=C(\C)/C=C/[C@@H]1NC(=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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"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-SGIIWDTFSA-N,6540780,yes,Microcystis,viridis,n.a.
CyanoMetDB_1980,[D-Asp3]MC-HtyR,,Microcystin,,C52H72N10O13,1044.528033,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O13/c1-29(26-30(2)42(75-7)27-35-12-9-8-10-13-35)15-21-37-31(3)45(66)60-40(50(71)72)23-24-44(65)62(6)33(5)47(68)56-32(4)46(67)59-39(22-18-34-16-19-36(63)20-17-34)49(70)61-41(51(73)74)28-43(64)57-38(48(69)58-37)14-11-25-55-52(53)54/h8-10,12-13,15-17,19-21,26,30-32,37-42,63H,5,11,14,18,22-25,27-28H2,1-4,6-7H3,(H,56,68)(H,57,64)(H,58,69)(H,59,67)(H,60,66)(H,61,70)(H,71,72)(H,73,74)(H4,53,54,55)/b21-15+,29-26+/t30-,31-,32+,37-,38-,39-,40+,41+,42-/m0/s1",BTHUKOWVYGPUOP-QDFQMAEMSA-N,15160479,yes,Anabaena/Dolichospermum,flos aquae,NRC 525-17
CyanoMetDB_1981,[(6Z)-Adda5]MC-RR,,Microcystin,,C49H75N13O12,1037.565815,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C\[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=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-SRKJTSIASA-N,71312371,yes,n.a.,n.a.,n.a.
CyanoMetDB_1982,MC-(H2)YR,,Microcystin,,C52H74N10O13,1046.54368,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC[C@@H](O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H74N10O13/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/h9-11,13-14,16-19,21,25,29-32,36-41,43,63H,6,12,15,20,22-24,26-27H2,1-5,7-8H3,(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+,36-,37-,38-,39+,40-,41-,43+/m0/s1",BYGCVEXGEJFNCQ-JPSVLHQASA-N,146683858,no,Microcystis,aeruginosa,AQUAMEB-24
CyanoMetDB_1983,MC?HphHph,,Microcystin,,C57H73N7O12,1047.531721,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCC3=CC=CC=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC4=CC=CC=C4)=O)=O)=O)=O,"InChI=1S/C57H73N7O12/c1-34(32-35(2)47(76-8)33-42-22-16-11-17-23-42)24-27-43-36(3)50(66)62-46(56(72)73)30-31-48(65)64(7)39(6)53(69)58-38(5)52(68)61-45(29-26-41-20-14-10-15-21-41)55(71)63-49(57(74)75)37(4)51(67)60-44(54(70)59-43)28-25-40-18-12-9-13-19-40/h9-24,27,32,35-38,43-47,49H,6,25-26,28-31,33H2,1-5,7-8H3,(H,58,69)(H,59,70)(H,60,67)(H,61,68)(H,62,66)(H,63,71)(H,72,73)(H,74,75)/b27-24+,34-32+/t35-,36-,37-,38+,43-,44-,45-,46+,47-,49+/m0/s1",VJPJHXOXFRNWQY-VKXHRRFASA-N,146684767,no,Phormidium,n.a.,DVL1003c; LP904C
CyanoMetDB_1984,"[D?Asp3,Ser7]MC?HtyR",,Microcystin,,C51H72N10O14,1048.522947,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)[C@H](CO)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H72N10O14/c1-28(24-29(2)41(75-5)25-33-10-7-6-8-11-33)13-19-35-30(3)44(66)60-38(49(71)72)21-22-42(64)57-40(27-62)48(70)55-31(4)45(67)59-37(20-16-32-14-17-34(63)18-15-32)47(69)61-39(50(73)74)26-43(65)56-36(46(68)58-35)12-9-23-54-51(52)53/h6-8,10-11,13-15,17-19,24,29-31,35-41,62-63H,9,12,16,20-23,25-27H2,1-5H3,(H,55,70)(H,56,65)(H,57,64)(H,58,68)(H,59,67)(H,60,66)(H,61,69)(H,71,72)(H,73,74)(H4,52,53,54)/b19-13+,28-24+/t29-,30-,31+,35-,36-,37-,38+,39+,40-,41-/m0/s1",OAOGBTSKBZVXOB-FQYRTJBPSA-N,146684731,no,Anabaena,n.a.,[Anabaena sp.]66A
CyanoMetDB_1985,"[D-Asp³,Mser7]MC?RY",,Microcystin,,C51H72N10O14,1048.522947,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C51H72N10O14/c1-28(23-29(2)41(75-6)25-32-11-8-7-9-12-32)14-19-35-30(3)44(66)59-37(49(71)72)20-21-43(65)61(5)40(27-62)48(70)55-31(4)45(67)58-36(13-10-22-54-51(52)53)46(68)60-39(50(73)74)26-42(64)56-38(47(69)57-35)24-33-15-17-34(63)18-16-33/h7-9,11-12,14-19,23,29-31,35-41,62-63H,10,13,20-22,24-27H2,1-6H3,(H,55,70)(H,56,64)(H,57,69)(H,58,67)(H,59,66)(H,60,68)(H,71,72)(H,73,74)(H4,52,53,54)/b19-14+,28-23+/t29-,30-,31+,35-,36-,37+,38-,39+,40-,41-/m0/s1",JXIGYFDYIBIRMX-VODXBEFOSA-N,,no,Microcystis,aeruginosa,CYA548
CyanoMetDB_1986,[Ser7]MC-YR,,Microcystin,,C51H72N10O14,1048.522947,O=C(N[C@@H](CO)C(N[C@@H](C1=O)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C51H72N10O14/c1-27(23-28(2)40(75-6)25-32-11-8-7-9-12-32)14-19-35-29(3)43(65)59-37(49(71)72)20-21-41(64)56-39(26-62)48(70)55-31(5)45(67)60-38(24-33-15-17-34(63)18-16-33)47(69)61-42(50(73)74)30(4)44(66)58-36(46(68)57-35)13-10-22-54-51(52)53/h7-9,11-12,14-19,23,28-31,35-40,42,62-63H,10,13,20-22,24-26H2,1-6H3,(H,55,70)(H,56,64)(H,57,68)(H,58,66)(H,59,65)(H,60,67)(H,61,69)(H,71,72)(H,73,74)(H4,52,53,54)/b19-14+,27-23+/t28-,29-,30-,31+,35-,36-,37+,38-,39-,40-,42+/m0/s1",LDSNYTLQVHZIJF-SGAHCBCOSA-N,146683841,no,n.a.,n.a.,n.a.
CyanoMetDB_1987,MC-RA,,Microcystin,,C46H68N10O12,952.5018179,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C)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]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C46H68N10O12/c1-24(22-25(2)35(68-9)23-31-14-11-10-12-15-31)17-18-32-26(3)38(58)54-34(44(64)65)19-20-36(57)56(8)30(7)42(62)51-29(6)41(61)53-33(16-13-21-49-46(47)48)43(63)55-37(45(66)67)27(4)39(59)50-28(5)40(60)52-32/h10-12,14-15,17-18,22,25-29,32-35,37H,7,13,16,19-21,23H2,1-6,8-9H3,(H,50,59)(H,51,62)(H,52,60)(H,53,61)(H,54,58)(H,55,63)(H,64,65)(H,66,67)(H4,47,48,49)/b18-17+,24-22+/t25-,26-,27-,28-,29+,32-,33-,34+,35-,37+/m0/s1",RVBWUYJOJNTTSZ-CGZJSGPVSA-N,56928147,no,Microcystis,sp.,n.a.
CyanoMetDB_1988,[ADMAdda5]MC?HilHar,,Microcystin,,C52H78N10O13,1050.574983,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C[C@@H](C)CC)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C52H78N10O13/c1-11-28(2)26-40-49(70)61-43(51(73)74)32(6)45(66)58-38(19-15-16-24-55-52(53)54)48(69)57-37(21-20-29(3)25-30(4)41(75-35(9)63)27-36-17-13-12-14-18-36)31(5)44(65)59-39(50(71)72)22-23-42(64)62(10)34(8)47(68)56-33(7)46(67)60-40/h12-14,17-18,20-21,25,28,30-33,37-41,43H,8,11,15-16,19,22-24,26-27H2,1-7,9-10H3,(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)/b21-20+,29-25+/t28-,30-,31-,32-,33+,37-,38-,39+,40-,41-,43+/m0/s1",MDHSZZGVMIHVMT-FEKRJCKDSA-N,146684732,no,Nostoc,sp.,[Nostoc sp.]152
CyanoMetDB_1989,"[D-Leu1,D-Asp³,ADMAdda5]MC?LR",,Microcystin,,C52H78N10O13,1050.574983,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C52H78N10O13/c1-28(2)23-39-48(69)60-40(24-29(3)4)49(70)61-41(51(73)74)27-43(64)56-37(17-14-22-55-52(53)54)47(68)57-36(19-18-30(5)25-31(6)42(75-34(9)63)26-35-15-12-11-13-16-35)32(7)45(66)58-38(50(71)72)20-21-44(65)62(10)33(8)46(67)59-39/h11-13,15-16,18-19,25,28-29,31-32,36-42H,8,14,17,20-24,26-27H2,1-7,9-10H3,(H,56,64)(H,57,68)(H,58,66)(H,59,67)(H,60,69)(H,61,70)(H,71,72)(H,73,74)(H4,53,54,55)/b19-18+,30-25+/t31-,32-,36-,37-,38+,39+,40-,41+,42-/m0/s1",UJEVEFCMHNHXFQ-LIKYXQTASA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1990,"[D-Leu1,Adda(O)5]MC-LR","[D-Leu1,ketoAdda5]MC-LR",Microcystin,,C52H78N10O13,1050.575,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C=O)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C52H78N10O13/c1-28(2)23-39-48(69)60-40(24-29(3)4)49(70)61-43(51(73)74)32(7)45(66)57-37(17-14-22-55-52(53)54)47(68)56-36(19-18-35(27-63)25-30(5)41(75-10)26-34-15-12-11-13-16-34)31(6)44(65)58-38(50(71)72)20-21-42(64)62(9)33(8)46(67)59-39/h11-13,15-16,18-19,25,27-32,36-41,43H,8,14,17,20-24,26H2,1-7,9-10H3,(H,56,68)(H,57,66)(H,58,65)(H,59,67)(H,60,69)(H,61,70)(H,71,72)(H,73,74)(H4,53,54,55)/b19-18+,35-25-/t30-,31-,32-,36-,37-,38+,39+,40-,41-,43+/m0/s1",UHRXXXBMTGUEJZ-DWMFVRHXSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1991,[D-Leu1]MC?HilR,,Microcystin,,C53H82N10O12,1050.611368,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)C[C@@H](C)CC)=O)=O)=O)=O,"InChI=1S/C53H82N10O12/c1-12-30(4)27-41-50(70)62-44(52(73)74)34(8)46(66)58-38(19-16-24-56-53(54)55)48(68)57-37(21-20-31(5)26-32(6)42(75-11)28-36-17-14-13-15-18-36)33(7)45(65)59-39(51(71)72)22-23-43(64)63(10)35(9)47(67)60-40(25-29(2)3)49(69)61-41/h13-15,17-18,20-21,26,29-30,32-34,37-42,44H,9,12,16,19,22-25,27-28H2,1-8,10-11H3,(H,57,68)(H,58,66)(H,59,65)(H,60,67)(H,61,69)(H,62,70)(H,71,72)(H,73,74)(H4,54,55,56)/b21-20+,31-26+/t30-,32-,33-,34-,37-,38-,39+,40+,41-,42-,44+/m0/s1",YDQPVIVPYIKYPZ-FRZRWRADSA-N,146684768,no,Microcystis,sp.,[Microcystis sp.]RST9501
CyanoMetDB_1992,[D-Leu1]MC?LHar,,Microcystin,,C53H82N10O12,1050.611368,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C53H82N10O12/c1-29(2)25-40-49(69)61-41(26-30(3)4)50(70)62-44(52(73)74)34(8)46(66)58-38(19-15-16-24-56-53(54)55)48(68)57-37(21-20-31(5)27-32(6)42(75-11)28-36-17-13-12-14-18-36)33(7)45(65)59-39(51(71)72)22-23-43(64)63(10)35(9)47(67)60-40/h12-14,17-18,20-21,27,29-30,32-34,37-42,44H,9,15-16,19,22-26,28H2,1-8,10-11H3,(H,57,68)(H,58,66)(H,59,65)(H,60,67)(H,61,69)(H,62,70)(H,71,72)(H,73,74)(H4,54,55,56)/b21-20+,31-27+/t32-,33-,34-,37-,38-,39+,40+,41-,42-,44+/m0/s1",WZZBZIMDYIUNIJ-SGPOGQQTSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1993,"[D-Leu1,D-MeO-Glu6]MC-LR","[D-Leu1,D-Glu(OMe)6]MC-LR",Microcystin,,C53H82N10O12,1050.611368,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C53H82N10O12/c1-29(2)25-40-49(69)61-41(26-30(3)4)50(70)62-44(51(71)72)34(8)46(66)58-38(19-16-24-56-53(54)55)48(68)57-37(21-20-31(5)27-32(6)42(74-11)28-36-17-14-13-15-18-36)33(7)45(65)59-39(52(73)75-12)22-23-43(64)63(10)35(9)47(67)60-40/h13-15,17-18,20-21,27,29-30,32-34,37-42,44H,9,16,19,22-26,28H2,1-8,10-12H3,(H,57,68)(H,58,66)(H,59,65)(H,60,67)(H,61,69)(H,62,70)(H,71,72)(H4,54,55,56)/b21-20+,31-27+/t32-,33-,34-,37-,38-,39+,40+,41-,42-,44+/m0/s1",FDKBJUJOGLCGGN-SGPOGQQTSA-N,146683870,no,Microcystis,aeruginosa,[Microcystis aeruginosa] CAAT 2005-3
CyanoMetDB_1994,[D-Hil1]MC-LR,,Microcystin,,C53H82N10O12,1050.61137,O=C(N(C)C(C(N[C@@H](C1=O)C[C@@H](C)CC)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C53H82N10O12/c1-12-30(4)27-41-49(69)61-40(25-29(2)3)50(70)62-44(52(73)74)34(8)46(66)58-38(19-16-24-56-53(54)55)48(68)57-37(21-20-31(5)26-32(6)42(75-11)28-36-17-14-13-15-18-36)33(7)45(65)59-39(51(71)72)22-23-43(64)63(10)35(9)47(67)60-41/h13-15,17-18,20-21,26,29-30,32-34,37-42,44H,9,12,16,19,22-25,27-28H2,1-8,10-11H3,(H,57,68)(H,58,66)(H,59,65)(H,60,67)(H,61,69)(H,62,70)(H,71,72)(H,73,74)(H4,54,55,56)/b21-20+,31-26+/t30-,32-,33-,34-,37-,38-,39+,40-,41+,42-,44+/m0/s1",HVANFGKLTKFVDQ-GBHADRNMSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1995,"[D?Asp3,(E)-Dhb7]MC?HtyY",,Microcystin,,C55H69N7O14,1051.49025,O=C(N/C(C(N[C@@H](C1=O)C)=O)=C/C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC4=CC=C(O)C=C4)=O)=O)=O)=O,"InChI=1S/C55H69N7O14/c1-7-40-51(69)56-34(5)50(68)60-42(24-18-35-14-19-38(63)20-15-35)52(70)62-45(55(74)75)30-48(66)58-44(28-37-16-21-39(64)22-17-37)53(71)59-41(33(4)49(67)61-43(54(72)73)25-26-47(65)57-40)23-13-31(2)27-32(3)46(76-6)29-36-11-9-8-10-12-36/h7-17,19-23,27,32-34,41-46,63-64H,18,24-26,28-30H2,1-6H3,(H,56,69)(H,57,65)(H,58,66)(H,59,71)(H,60,68)(H,61,67)(H,62,70)(H,72,73)(H,74,75)/b23-13+,31-27+,40-7+/t32-,33-,34+,41-,42-,43+,44-,45+,46-/m0/s1",WIUASVUEJTVYML-YBHJWNOCSA-N,,yes,Planktothrix,rubescens,[Planktothrix rubescens]80
CyanoMetDB_1996,MC?YY,,Microcystin,,C55H69N7O14,1051.49025,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC4=CC=C(C=C4)O)=O)=O)=O)=O,"InChI=1S/C55H69N7O14/c1-30(26-31(2)45(76-8)29-36-12-10-9-11-13-36)14-23-41-32(3)48(66)58-42(54(72)73)24-25-46(65)62(7)35(6)51(69)56-34(5)50(68)60-44(28-38-17-21-40(64)22-18-38)53(71)61-47(55(74)75)33(4)49(67)59-43(52(70)57-41)27-37-15-19-39(63)20-16-37/h9-23,26,31-34,41-45,47,63-64H,6,24-25,27-29H2,1-5,7-8H3,(H,56,69)(H,57,70)(H,58,66)(H,59,67)(H,60,68)(H,61,71)(H,72,73)(H,74,75)/b23-14+,30-26+/t31-,32-,33-,34+,41-,42+,43-,44-,45-,47+/m0/s1",PGLPSVMYGXSNBK-KQTAPMBTSA-N,146684775,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]CBT 850
CyanoMetDB_1997,[D-Leu1]MC-LR,,Microcystin,,C52H80N10O12,1036.595718,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C52H80N10O12/c1-28(2)24-39-48(68)60-40(25-29(3)4)49(69)61-43(51(72)73)33(8)45(65)57-37(18-15-23-55-52(53)54)47(67)56-36(20-19-30(5)26-31(6)41(74-11)27-35-16-13-12-14-17-35)32(7)44(64)58-38(50(70)71)21-22-42(63)62(10)34(9)46(66)59-39/h12-14,16-17,19-20,26,28-29,31-33,36-41,43H,9,15,18,21-25,27H2,1-8,10-11H3,(H,56,67)(H,57,65)(H,58,64)(H,59,66)(H,60,68)(H,61,69)(H,70,71)(H,72,73)(H4,53,54,55)/b20-19+,30-26+/t31-,32-,33-,36-,37-,38+,39+,40-,41-,43+/m0/s1",PYRKYAINAPVHFV-OGPAHFFASA-N,636790,yes,Microcystis,sp.,RST 9501
CyanoMetDB_1998,"[D-Asp³,ADMAdda5]MC?RR",,Microcystin,,C49H73N13O13,1051.54508,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C49H73N13O13/c1-26(23-27(2)38(75-31(6)63)24-32-13-9-8-10-14-32)17-18-33-28(3)41(66)60-36(46(71)72)19-20-40(65)62(7)30(5)43(68)56-29(4)42(67)59-35(16-12-22-55-49(52)53)45(70)61-37(47(73)74)25-39(64)57-34(44(69)58-33)15-11-21-54-48(50)51/h8-10,13-14,17-18,23,27-29,33-38H,5,11-12,15-16,19-22,24-25H2,1-4,6-7H3,(H,56,68)(H,57,64)(H,58,69)(H,59,67)(H,60,66)(H,61,70)(H,71,72)(H,73,74)(H4,50,51,54)(H4,52,53,55)/b18-17+,26-23+/t27-,28-,29+,33-,34-,35-,36+,37+,38-/m0/s1",WFXCZYYAJSAVET-KZHDJXOLSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_1999,"[Gly1,D-Asp3,ADMAdda5,Dhb7]MC-RHar",,Microcystin,,C49H73N13O13,1051.54508,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@@H](NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)C(=CC)NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)CCCCNC(=N)N,"InChI=1S/C49H73N13O13/c1-6-32-43(68)56-26-41(66)59-35(16-12-22-55-49(52)53)45(70)62-37(47(73)74)25-40(65)58-34(15-10-11-21-54-48(50)51)44(69)60-33(29(4)42(67)61-36(46(71)72)19-20-39(64)57-32)18-17-27(2)23-28(3)38(75-30(5)63)24-31-13-8-7-9-14-31/h6-9,13-14,17-18,23,28-29,33-38H,10-12,15-16,19-22,24-26H2,1-5H3,(H,56,68)(H,57,64)(H,58,65)(H,59,66)(H,60,69)(H,61,67)(H,62,70)(H,71,72)(H,73,74)(H4,50,51,54)(H4,52,53,55)/b18-17+,27-23+,32-6?/t28-,29-,33-,34-,35-,36+,37+,38-/m0/s1",HCOCFOSTEQACBS-MUXJOVKDSA-N,146683806,no,n.a.,n.a.,n.a.
CyanoMetDB_2000,"[Gly1,D-Asp3,ADMAdda5]MC-RHar",,Microcystin,,C49H73N13O13,1051.5451,O=C(N(C)C(C(NCC1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C49H73N13O13/c1-27(23-28(2)38(75-31(5)63)24-32-13-8-7-9-14-32)17-18-33-29(3)42(67)60-36(46(71)72)19-20-41(66)62(6)30(4)43(68)56-26-40(65)58-35(16-12-22-55-49(52)53)45(70)61-37(47(73)74)25-39(64)57-34(44(69)59-33)15-10-11-21-54-48(50)51/h7-9,13-14,17-18,23,28-29,33-38H,4,10-12,15-16,19-22,24-26H2,1-3,5-6H3,(H,56,68)(H,57,64)(H,58,65)(H,59,69)(H,60,67)(H,61,70)(H,71,72)(H,73,74)(H4,50,51,54)(H4,52,53,55)/b18-17+,27-23+/t28-,29-,33-,34-,35-,36+,37+,38-/m0/s1",DXQGDFJSROTNES-RFXBWKCSSA-N,146683839,no,Nostoc,cyanobacterial mat,n.a.
CyanoMetDB_2001,"[D?Leu1,Adda(OH)5]MC?LR","[D?Leu1,hydroxyAdda5]MC?LR",Microcystin,,C52H80N10O13,1052.5906,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(CO)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C52H80N10O13/c1-28(2)23-39-48(69)60-40(24-29(3)4)49(70)61-43(51(73)74)32(7)45(66)57-37(17-14-22-55-52(53)54)47(68)56-36(19-18-35(27-63)25-30(5)41(75-10)26-34-15-12-11-13-16-34)31(6)44(65)58-38(50(71)72)20-21-42(64)62(9)33(8)46(67)59-39/h11-13,15-16,18-19,25,28-32,36-41,43,63H,8,14,17,20-24,26-27H2,1-7,9-10H3,(H,56,68)(H,57,66)(H,58,65)(H,59,67)(H,60,69)(H,61,70)(H,71,72)(H,73,74)(H4,53,54,55)/b19-18+,35-25-/t30-,31-,32-,36-,37-,38+,39+,40-,41-,43+/m0/s1",KUJGVALYAACNLY-DWMFVRHXSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2002,[D?Glu(OCH2CH(CH3)OH)6]MC?LR,[D?Glu(OC3H6O)6]MC?LR,Microcystin,,C52H80N10O13,1052.590633,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=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]1C)C(=O)OCC(C)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H80N10O13/c1-28(2)24-40-49(70)61-43(50(71)72)33(7)45(66)58-38(18-15-23-55-52(53)54)48(69)57-37(20-19-29(3)25-30(4)41(74-11)26-36-16-13-12-14-17-36)32(6)44(65)59-39(51(73)75-27-31(5)63)21-22-42(64)62(10)35(9)47(68)56-34(8)46(67)60-40/h12-14,16-17,19-20,25,28,30-34,37-41,43,63H,9,15,18,21-24,26-27H2,1-8,10-11H3,(H,56,68)(H,57,69)(H,58,66)(H,59,65)(H,60,67)(H,61,70)(H,71,72)(H4,53,54,55)/b20-19+,29-25+/t30-,31?,32-,33-,34+,37-,38-,39+,40-,41-,43+/m0/s1",BIPKFIXFAARAAI-GBMZIOTESA-N,10418620,yes,n.a.,n.a.,n.a.
CyanoMetDB_2003,[D-Asp3]MC-RW,,Microcystin,,C53H71N11O12,1053.528367,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CNC4=C3C=CC=C4)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C53H71N11O12/c1-29(24-30(2)43(76-7)25-34-14-9-8-10-15-34)19-20-37-31(3)46(67)62-40(51(72)73)21-22-45(66)64(6)33(5)48(69)58-32(4)47(68)61-39(18-13-23-56-53(54)55)49(70)63-42(52(74)75)27-44(65)59-41(50(71)60-37)26-35-28-57-38-17-12-11-16-36(35)38/h8-12,14-17,19-20,24,28,30-32,37,39-43,57H,5,13,18,21-23,25-27H2,1-4,6-7H3,(H,58,69)(H,59,65)(H,60,71)(H,61,68)(H,62,67)(H,63,70)(H,72,73)(H,74,75)(H4,54,55,56)/b20-19+,29-24+/t30-,31-,32+,37-,39-,40+,41-,42+,43-/m0/s1",XWXSIKQZRUZBPD-DUJZQNBCSA-N,146683814,no,Planktothrix,planktonica,NIVA-CYA 544
CyanoMetDB_2004,[Dha7]MC?WR,,Microcystin,,C53H71N11O12,1053.528367,O=C(NC(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CNC4=C3C=CC=C4)=O)=O)=O)=O,"InChI=1S/C53H71N11O12/c1-28(24-29(2)42(76-7)25-34-14-9-8-10-15-34)19-20-37-30(3)45(66)62-40(51(72)73)21-22-43(65)58-32(5)47(68)59-33(6)48(69)63-41(26-35-27-57-38-17-12-11-16-36(35)38)50(71)64-44(52(74)75)31(4)46(67)61-39(49(70)60-37)18-13-23-56-53(54)55/h8-12,14-17,19-20,24,27,29-31,33,37,39-42,44,57H,5,13,18,21-23,25-26H2,1-4,6-7H3,(H,58,65)(H,59,68)(H,60,70)(H,61,67)(H,62,66)(H,63,69)(H,64,71)(H,72,73)(H,74,75)(H4,54,55,56)/b20-19+,28-24+/t29-,30-,31-,33+,37-,39-,40+,41-,42-,44+/m0/s1",SPNMYMDESAVWLU-LSYLAYNUSA-N,,no,Microcystis,n.a.,AB2011/53
CyanoMetDB_2005,[D-Asp3]MC-WR,,Microcystin,,C53H71N11O12,1053.528367,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC3=CNC4=C3C=CC=C4)=O)=O)=O)=O,"InChI=1S/C53H71N11O12/c1-29(24-30(2)43(76-7)25-34-14-9-8-10-15-34)19-20-37-31(3)46(67)61-40(51(72)73)21-22-45(66)64(6)33(5)48(69)58-32(4)47(68)62-41(26-35-28-57-38-17-12-11-16-36(35)38)50(71)63-42(52(74)75)27-44(65)59-39(49(70)60-37)18-13-23-56-53(54)55/h8-12,14-17,19-20,24,28,30-32,37,39-43,57H,5,13,18,21-23,25-27H2,1-4,6-7H3,(H,58,69)(H,59,65)(H,60,70)(H,61,67)(H,62,68)(H,63,71)(H,72,73)(H,74,75)(H4,54,55,56)/b20-19+,29-24+/t30-,31-,32+,37-,39-,40+,41-,42+,43-/m0/s1",JFISXJSHBWUTGA-DUJZQNBCSA-N,139588249,no,Microcystis,n.a.,AB2011/53
CyanoMetDB_2006,[DMAdda5]MC?WR,,Microcystin,,C53H71N11O12,1053.528367,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CNC4=C3C=CC=C4)=O)=O)=O)=O,"InChI=1S/C53H71N11O12/c1-28(24-29(2)42(65)25-34-14-9-8-10-15-34)19-20-37-30(3)45(67)61-40(51(73)74)21-22-43(66)64(7)33(6)48(70)58-32(5)47(69)62-41(26-35-27-57-38-17-12-11-16-36(35)38)50(72)63-44(52(75)76)31(4)46(68)60-39(49(71)59-37)18-13-23-56-53(54)55/h8-12,14-17,19-20,24,27,29-32,37,39-42,44,57,65H,6,13,18,21-23,25-26H2,1-5,7H3,(H,58,70)(H,59,71)(H,60,68)(H,61,67)(H,62,69)(H,63,72)(H,73,74)(H,75,76)(H4,54,55,56)/b20-19+,28-24+/t29-,30-,31-,32+,37-,39-,40+,41-,42-,44+/m0/s1",OWWLLCNFDJJXQD-ODXYGVHRSA-N,,no,Microcystis,n.a.,AB2011/53
CyanoMetDB_2007,[D-Met1]MC-LR,,Microcystin,,C51H78N10O12S,1054.552139,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CCSC)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C51H78N10O12S/c1-28(2)25-39-48(68)60-42(50(71)72)32(6)44(64)56-36(17-14-23-54-51(52)53)46(66)55-35(19-18-29(3)26-30(4)40(73-9)27-34-15-12-11-13-16-34)31(5)43(63)58-38(49(69)70)20-21-41(62)61(8)33(7)45(65)57-37(22-24-74-10)47(67)59-39/h11-13,15-16,18-19,26,28,30-32,35-40,42H,7,14,17,20-25,27H2,1-6,8-10H3,(H,55,66)(H,56,64)(H,57,65)(H,58,63)(H,59,67)(H,60,68)(H,69,70)(H,71,72)(H4,52,53,54)/b19-18+,29-26+/t30-,31-,32-,35-,36-,37+,38+,39-,40-,42+/m0/s1",DURAMHGSEBPVJH-HIDJONPESA-N,146684769,no,Microcystis,sp.,[Microcystis sp.]RST9501
CyanoMetDB_2008,[D-Leu1]MC-MR,,Microcystin,,C51H78N10O12S,1054.552139,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCSC)=O)=O)=O)=O,"InChI=1S/C51H78N10O12S/c1-28(2)25-39-48(68)57-37(22-24-74-10)47(67)60-42(50(71)72)32(6)44(64)56-36(17-14-23-54-51(52)53)46(66)55-35(19-18-29(3)26-30(4)40(73-9)27-34-15-12-11-13-16-34)31(5)43(63)58-38(49(69)70)20-21-41(62)61(8)33(7)45(65)59-39/h11-13,15-16,18-19,26,28,30-32,35-40,42H,7,14,17,20-25,27H2,1-6,8-10H3,(H,55,66)(H,56,64)(H,57,68)(H,58,63)(H,59,65)(H,60,67)(H,69,70)(H,71,72)(H4,52,53,54)/b19-18+,29-26+/t30-,31-,32-,35-,36-,37-,38+,39+,40-,42+/m0/s1",FYIBLVGHTIMAGG-OIGYFXLDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2009,"[D-Leu1,NMe-Ser7]MC-LR",,Microcystin,,C52H82N10O13,1054.606283,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)CC(C)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C52H82N10O13/c1-28(2)23-38-47(68)59-39(24-29(3)4)48(69)61-43(51(73)74)33(8)45(66)57-36(17-14-22-55-52(53)54)46(67)56-35(19-18-30(5)25-31(6)41(75-10)26-34-15-12-11-13-16-34)32(7)44(65)58-37(50(71)72)20-21-42(64)62(9)40(27-63)49(70)60-38/h11-13,15-16,18-19,25,28-29,31-33,35-41,43,63H,14,17,20-24,26-27H2,1-10H3,(H,56,67)(H,57,66)(H,58,65)(H,59,68)(H,60,70)(H,61,69)(H,71,72)(H,73,74)(H4,53,54,55)/b19-18+,30-25+/t31-,32-,33-,35-,36-,37+,38+,39-,40-,41-,43+/m0/s1",ZRAAKZAFDBKKEG-WCHOLIGGSA-N,146683871,no,Microcystis,aeruginosa,[Microcystis aeruginosa] CAAT 2005-3
CyanoMetDB_2010,[Mser7]MC-RR,,Microcystin,,C49H77N13O13,1055.5764,O=C(N(C)[C@@H](CO)C(N[C@H](C)C1=O)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C49H77N13O13/c1-26(23-27(2)37(75-7)24-31-13-9-8-10-14-31)17-18-32-28(3)40(65)60-35(46(71)72)19-20-38(64)62(6)36(25-63)45(70)56-30(5)42(67)59-34(16-12-22-55-49(52)53)44(69)61-39(47(73)74)29(4)41(66)58-33(43(68)57-32)15-11-21-54-48(50)51/h8-10,13-14,17-18,23,27-30,32-37,39,63H,11-12,15-16,19-22,24-25H2,1-7H3,(H,56,70)(H,57,68)(H,58,66)(H,59,67)(H,60,65)(H,61,69)(H,71,72)(H,73,74)(H4,50,51,54)(H4,52,53,55)/b18-17+,26-23+/t27-,28-,29-,30+,32-,33-,34-,35+,36-,37-,39+/m0/s1",KHCVWMNMBLYWTO-UCXDALDESA-N,146683859,no,Microcystis,aeruginosa,AQUAMEB-24
CyanoMetDB_2011,MC-LNfk,,Microcystin,,C54H72N8O14,1056.516799,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC(C(C=CC=C3)=C3NC=O)=O)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C54H72N8O14/c1-29(2)24-41-52(71)61-46(54(74)75)33(6)48(67)59-42(27-43(64)37-18-14-15-19-39(37)55-28-63)51(70)57-38(21-20-30(3)25-31(4)44(76-10)26-36-16-12-11-13-17-36)32(5)47(66)58-40(53(72)73)22-23-45(65)62(9)35(8)50(69)56-34(7)49(68)60-41/h11-21,25,28-29,31-34,38,40-42,44,46H,8,22-24,26-27H2,1-7,9-10H3,(H,55,63)(H,56,69)(H,57,70)(H,58,66)(H,59,67)(H,60,68)(H,61,71)(H,72,73)(H,74,75)/b21-20+,30-25+/t31-,32-,33-,34+,38-,40+,41-,42-,44-,46+/m0/s1",OAOHFDVVSNPTDA-AGMMBEPNSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2012,[ADMAdda5]MC?FR,,Microcystin,,C53H72N10O13,1056.528033,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C53H72N10O13/c1-29(26-30(2)42(76-35(7)64)28-37-18-13-10-14-19-37)21-22-38-31(3)45(66)60-40(51(72)73)23-24-43(65)63(8)34(6)48(69)57-33(5)47(68)61-41(27-36-16-11-9-12-17-36)50(71)62-44(52(74)75)32(4)46(67)59-39(49(70)58-38)20-15-25-56-53(54)55/h9-14,16-19,21-22,26,30-33,38-42,44H,6,15,20,23-25,27-28H2,1-5,7-8H3,(H,57,69)(H,58,70)(H,59,67)(H,60,66)(H,61,68)(H,62,71)(H,72,73)(H,74,75)(H4,54,55,56)/b22-21+,29-26+/t30-,31-,32-,33+,38-,39-,40+,41-,42-,44+/m0/s1",OXDQKFXDBASUQU-BTFGLNETSA-N,146684740,no,Nostoc,sp.,[Nostoc sp.]UK18
CyanoMetDB_2013,"[D-Asp³,ADMAdda5]MC?HphR",,Microcystin,,C53H72N10O13,1056.528033,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C53H72N10O13/c1-30(27-31(2)43(76-35(6)64)28-37-17-12-9-13-18-37)20-22-38-32(3)46(67)61-41(51(72)73)24-25-45(66)63(7)34(5)48(69)57-33(4)47(68)60-40(23-21-36-15-10-8-11-16-36)50(71)62-42(52(74)75)29-44(65)58-39(49(70)59-38)19-14-26-56-53(54)55/h8-13,15-18,20,22,27,31-33,38-43H,5,14,19,21,23-26,28-29H2,1-4,6-7H3,(H,57,69)(H,58,65)(H,59,70)(H,60,68)(H,61,67)(H,62,71)(H,72,73)(H,74,75)(H4,54,55,56)/b22-20+,30-27+/t31-,32-,33+,38-,39-,40-,41+,42+,43-/m0/s1",ODKCYVGYQFUVCB-ISQUMXADSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2014,[D?MeO-Glu6]MC?YR,[D?Glu(OMe)6]MC?YR,Microcystin,,C53H74N10O13,1058.543683,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C53H74N10O13/c1-29(26-30(2)42(75-8)28-35-14-11-10-12-15-35)17-22-38-31(3)45(66)60-40(52(74)76-9)23-24-43(65)63(7)34(6)48(69)57-33(5)47(68)61-41(27-36-18-20-37(64)21-19-36)50(71)62-44(51(72)73)32(4)46(67)59-39(49(70)58-38)16-13-25-56-53(54)55/h10-12,14-15,17-22,26,30-33,38-42,44,64H,6,13,16,23-25,27-28H2,1-5,7-9H3,(H,57,69)(H,58,70)(H,59,67)(H,60,66)(H,61,68)(H,62,71)(H,72,73)(H4,54,55,56)/b22-17+,29-26+/t30-,31-,32-,33+,38-,39-,40+,41-,42-,44+/m0/s1",SVUNNHQOHLLNGA-OCQZQFOGSA-N,146683831,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]CBT 850
CyanoMetDB_2015,MC-HtyR,,Microcystin,,C53H74N10O13,1058.543683,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C53H74N10O13/c1-29(27-30(2)42(76-8)28-36-13-10-9-11-14-36)16-22-38-31(3)45(66)61-41(51(72)73)24-25-43(65)63(7)34(6)48(69)57-33(5)47(68)60-40(23-19-35-17-20-37(64)21-18-35)50(71)62-44(52(74)75)32(4)46(67)59-39(49(70)58-38)15-12-26-56-53(54)55/h9-11,13-14,16-18,20-22,27,30-33,38-42,44,64H,6,12,15,19,23-26,28H2,1-5,7-8H3,(H,57,69)(H,58,70)(H,59,67)(H,60,68)(H,61,66)(H,62,71)(H,72,73)(H,74,75)(H4,54,55,56)/b22-16+,29-27+/t30-,31-,32-,33+,38-,39-,40-,41+,42-,44+/m0/s1",YQFCSOPLXLDHPK-CWXGWYCISA-N,15160480,yes,Anabaena/Dolichospermum,flos aquae,NRC 525-17
CyanoMetDB_2016,"[D-Asp3,D-MeO-Glu6]MC-HtyR","[D-Asp³,D-Glu(OMe)6]MC?HtyR",Microcystin,,C53H74N10O13,1058.543683,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C53H74N10O13/c1-30(27-31(2)43(75-7)28-36-13-10-9-11-14-36)16-22-38-32(3)46(67)61-41(52(74)76-8)24-25-45(66)63(6)34(5)48(69)57-33(4)47(68)60-40(23-19-35-17-20-37(64)21-18-35)50(71)62-42(51(72)73)29-44(65)58-39(49(70)59-38)15-12-26-56-53(54)55/h9-11,13-14,16-18,20-22,27,31-33,38-43,64H,5,12,15,19,23-26,28-29H2,1-4,6-8H3,(H,57,69)(H,58,65)(H,59,70)(H,60,68)(H,61,67)(H,62,71)(H,72,73)(H4,54,55,56)/b22-16+,30-27+/t31-,32-,33+,38-,39-,40-,41+,42+,43-/m0/s1",QHVWVRZVAONQRC-IXKKHWRDSA-N,146684706,no,Planktothrix,sp.,"[Planktothrix sp.]Max06, [Planktothrix sp.]Max13"
CyanoMetDB_2017,"[D-Ser1,D-Asp³]MC?HtyR",,Microcystin,,C52H72N10O14,1060.522947,O=C(N(C)C(C(N[C@H](CO)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O14/c1-29(25-30(2)42(76-6)26-34-11-8-7-9-12-34)14-20-36-31(3)45(67)59-39(50(72)73)22-23-44(66)62(5)32(4)46(68)61-41(28-63)49(71)58-38(21-17-33-15-18-35(64)19-16-33)48(70)60-40(51(74)75)27-43(65)56-37(47(69)57-36)13-10-24-55-52(53)54/h7-9,11-12,14-16,18-20,25,30-31,36-42,63-64H,4,10,13,17,21-24,26-28H2,1-3,5-6H3,(H,56,65)(H,57,69)(H,58,71)(H,59,67)(H,60,70)(H,61,68)(H,72,73)(H,74,75)(H4,53,54,55)/b20-14+,29-25+/t30-,31-,36-,37-,38-,39+,40+,41+,42-/m0/s1",PCWWISFRULMTMQ-FEHBKQEESA-N,146684786,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_2018,[D?Asp³]MC?Y(OMe)R,"[MeO-Tyr2,D?Asp3]MC?Y(OMe)R",Microcystin,,C52H72N10O14,1060.522947,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C(OC)=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O14/c1-28(23-29(2)41(75-7)25-33-13-10-9-11-14-33)16-18-35-30(3)45(66)59-37(50(71)72)19-21-44(65)62(6)32(5)47(68)56-31(4)46(67)60-38(24-34-17-20-40(63)42(26-34)76-8)49(70)61-39(51(73)74)27-43(64)57-36(48(69)58-35)15-12-22-55-52(53)54/h9-11,13-14,16-18,20,23,26,29-31,35-39,41,63H,5,12,15,19,21-22,24-25,27H2,1-4,6-8H3,(H,56,68)(H,57,64)(H,58,69)(H,59,66)(H,60,67)(H,61,70)(H,71,72)(H,73,74)(H4,53,54,55)/b18-16+,28-23+/t29-,30-,31+,35-,36-,37+,38-,39+,41-/m0/s1",OTKAUTRTWSXHHC-QRQIOJMRSA-N,,no,Microcystis,n.a.,AB2011/53
CyanoMetDB_2019,[DMAdda5]MC?Y(OMe)R,,Microcystin,,C52H72N10O14,1060.522947,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C(OC)=C3)=O)=O)=O)=O,"InChI=1S/C52H72N10O14/c1-27(23-28(2)40(64)25-33-13-10-9-11-14-33)16-18-35-29(3)44(66)59-37(50(72)73)19-21-42(65)62(7)32(6)47(69)56-31(5)46(68)60-38(24-34-17-20-39(63)41(26-34)76-8)49(71)61-43(51(74)75)30(4)45(67)58-36(48(70)57-35)15-12-22-55-52(53)54/h9-11,13-14,16-18,20,23,26,28-31,35-38,40,43,63-64H,6,12,15,19,21-22,24-25H2,1-5,7-8H3,(H,56,69)(H,57,70)(H,58,67)(H,59,66)(H,60,68)(H,61,71)(H,72,73)(H,74,75)(H4,53,54,55)/b18-16+,27-23+/t28-,29-,30-,31+,35-,36-,37+,38-,40-,43+/m0/s1",PIKGDNSGBMJTRE-GQSKQMPZSA-N,,no,Microcystis,n.a.,AB2011/53
CyanoMetDB_2020,[Ser7]MC-HtyR,,Microcystin,,C52H74N10O14,1062.538597,O=C(N[C@@H](CO)C(N[C@H](C)C1=O)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H74N10O14/c1-28(25-29(2)41(76-6)26-34-11-8-7-9-12-34)14-20-36-30(3)44(66)61-39(50(72)73)22-23-42(65)57-40(27-63)49(71)56-32(5)46(68)60-38(21-17-33-15-18-35(64)19-16-33)48(70)62-43(51(74)75)31(4)45(67)59-37(47(69)58-36)13-10-24-55-52(53)54/h7-9,11-12,14-16,18-20,25,29-32,36-41,43,63-64H,10,13,17,21-24,26-27H2,1-6H3,(H,56,71)(H,57,65)(H,58,69)(H,59,67)(H,60,68)(H,61,66)(H,62,70)(H,72,73)(H,74,75)(H4,53,54,55)/b20-14+,28-25+/t29-,30-,31-,32+,36-,37-,38-,39+,40-,41-,43+/m0/s1",XDDLLCZTPLZHNO-ZOIKCHQHSA-N,101642109,no,Anabaena,n.a.,[Anabaena sp.]66
CyanoMetDB_2021,"[D-Asp3,Mser7]MC?HtyR",,Microcystin,,C52H74N10O14,1062.538597,O=C(N(C)[C@@H](CO)C(N[C@H](C)C1=O)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H74N10O14/c1-29(25-30(2)42(76-6)26-34-11-8-7-9-12-34)14-20-36-31(3)45(67)60-39(50(72)73)22-23-44(66)62(5)41(28-63)49(71)56-32(4)46(68)59-38(21-17-33-15-18-35(64)19-16-33)48(70)61-40(51(74)75)27-43(65)57-37(47(69)58-36)13-10-24-55-52(53)54/h7-9,11-12,14-16,18-20,25,30-32,36-42,63-64H,10,13,17,21-24,26-28H2,1-6H3,(H,56,71)(H,57,65)(H,58,69)(H,59,68)(H,60,67)(H,61,70)(H,72,73)(H,74,75)(H4,53,54,55)/b20-14+,29-25+/t30-,31-,32+,36-,37-,38-,39+,40+,41-,42-/m0/s1",ULIJDDFJIHXKGH-RPENZYNSSA-N,146683868,no,Planktothrix,sp.,[Planktothrix sp.]Max06
CyanoMetDB_2022,[seco?4/5][D-Asp³]MC?HtyR,,Microcystin,,C52H74N10O14,1062.538597,N[C@@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)[C@H](C)C(N[C@@H](C(O)=O)CCC(N(C)C(C(N[C@H](C)C(N[C@@H](CCC2=CC=C(O)C=C2)C(N[C@@H](C(O)=O)CC(N[C@@H](CCCNC(N)=N)C(O)=O)=O)=O)=O)=O)=C)=O)=O,"InChI=1S/C52H74N10O14/c1-29(26-30(2)42(76-7)27-35-12-9-8-10-13-35)15-21-37(53)31(3)45(66)60-40(50(72)73)23-24-44(65)62(6)33(5)47(68)57-32(4)46(67)59-38(22-18-34-16-19-36(63)20-17-34)48(69)61-41(51(74)75)28-43(64)58-39(49(70)71)14-11-25-56-52(54)55/h8-10,12-13,15-17,19-21,26,30-32,37-42,63H,5,11,14,18,22-25,27-28,53H2,1-4,6-7H3,(H,57,68)(H,58,64)(H,59,67)(H,60,66)(H,61,69)(H,70,71)(H,72,73)(H,74,75)(H4,54,55,56)/b21-15+,29-26+/t30-,31-,32+,37-,38-,39-,40+,41+,42-/m0/s1",AFXPXSUFDIMWIH-QDFQMAEMSA-N,146684787,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_2023,"[D?Asp³,ADMAdda5]MC?(H4)YR",,Microcystin,,C52H74N10O14,1062.538597,O=C(CC[C@@H](NC([C@H]([C@@H](NC([C@@H](NC(C[C@@H](NC([C@H](C[C@]1([H])CC[C@@H](O)C=C1)N2)=O)C(O)=O)=O)CCCNC(N)=N)=O)/C=C/C(C)=C/[C@@H]([C@H](CC3=CC=CC=C3)OC(C)=O)C)C)=O)C(O)=O)N(C(C(N[C@H](C)C2=O)=O)=C)C,"InChI=1S/C52H74N10O14/c1-28(24-29(2)42(76-33(6)63)26-34-12-9-8-10-13-34)15-20-37-30(3)45(67)59-39(50(72)73)21-22-44(66)62(7)32(5)47(69)56-31(4)46(68)60-40(25-35-16-18-36(64)19-17-35)49(71)61-41(51(74)75)27-43(65)57-38(48(70)58-37)14-11-23-55-52(53)54/h8-10,12-13,15-16,18,20,24,29-31,35-42,64H,5,11,14,17,19,21-23,25-27H2,1-4,6-7H3,(H,56,69)(H,57,65)(H,58,70)(H,59,67)(H,60,68)(H,61,71)(H,72,73)(H,74,75)(H4,53,54,55)/b20-15+,28-24+/t29-,30-,31+,35-,36-,37-,38-,39+,40-,41+,42-/m0/s1",XDSNSVDTHKUCHQ-PJNYSIOBSA-N,146684741,no,Nostoc,sp.,[Nostoc sp.]UK18
CyanoMetDB_2024,[NMe-Ser7]MC?RY,[Mser7]MC-RY,Microcystin,,C52H74N10O14,1062.538597,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C52H74N10O14/c1-28(24-29(2)41(76-7)26-33-12-9-8-10-13-33)15-20-36-30(3)44(66)59-38(50(72)73)21-22-42(65)62(6)40(27-63)49(71)56-32(5)46(68)58-37(14-11-23-55-52(53)54)47(69)61-43(51(74)75)31(4)45(67)60-39(48(70)57-36)25-34-16-18-35(64)19-17-34/h8-10,12-13,15-20,24,29-32,36-41,43,63-64H,11,14,21-23,25-27H2,1-7H3,(H,56,71)(H,57,70)(H,58,68)(H,59,66)(H,60,67)(H,61,69)(H,72,73)(H,74,75)(H4,53,54,55)/b20-15+,28-24+/t29-,30-,31-,32+,36-,37-,38+,39-,40-,41-,43+/m0/s1",FITCZJBNFWEOSI-SNPRYZSRSA-N,146684759,no,n.a.,n.a.,n.a.
CyanoMetDB_2025,"[D-Asp³,NMe-Ser7]MC?YHar","[D-Asp³,MSer7]MC?YHar",Microcystin,,C52H74N10O14,1062.538597,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C52H74N10O14/c1-29(24-30(2)42(76-6)26-33-12-8-7-9-13-33)15-20-36-31(3)45(67)59-38(50(72)73)21-22-44(66)62(5)41(28-63)49(71)56-32(4)46(68)60-39(25-34-16-18-35(64)19-17-34)48(70)61-40(51(74)75)27-43(65)57-37(47(69)58-36)14-10-11-23-55-52(53)54/h7-9,12-13,15-20,24,30-32,36-42,63-64H,10-11,14,21-23,25-28H2,1-6H3,(H,56,71)(H,57,65)(H,58,69)(H,59,67)(H,60,68)(H,61,70)(H,72,73)(H,74,75)(H4,53,54,55)/b20-15+,29-24+/t30-,31-,32+,36-,37-,38+,39-,40+,41-,42-/m0/s1",WNQSOLDTHYPGPX-XAJRVOSRSA-N,146684776,yes,Microcystis,aeruginosa,[Microcystis aeruginosa]CBT 850
CyanoMetDB_2026,[Mdha-Cys7]MC-RR,MC-RR-cysteine; Mcyst MC-RR-Cys,Microcystin,,C52H82N14O14S,1158.585564,O=C(N(C1([H])CSC[C@@H](C(O)=O)N)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C52H82N14O14S/c1-27(23-28(2)39(80-7)24-32-13-9-8-10-14-32)17-18-34-29(3)42(68)64-37(49(76)77)19-20-40(67)66(6)38(26-81-25-33(53)48(74)75)47(73)60-31(5)44(70)63-36(16-12-22-59-52(56)57)46(72)65-41(50(78)79)30(4)43(69)62-35(45(71)61-34)15-11-21-58-51(54)55/h8-10,13-14,17-18,23,28-31,33-39,41H,11-12,15-16,19-22,24-26,53H2,1-7H3,(H,60,73)(H,61,71)(H,62,69)(H,63,70)(H,64,68)(H,65,72)(H,74,75)(H,76,77)(H,78,79)(H4,54,55,58)(H4,56,57,59)/b18-17+,27-23+/t28-,29-,30-,31+,33-,34-,35-,36-,37+,38?,39-,41+/m0/s1",CIJTXBGCXWQIOD-GGAGTBMKSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_2027,[Mdha-GSH7]MC-RR,MC-RR-GSH,Microcystin,,C59H92N16O18S,1344.649621,O=C(N(C1([H])CSC[C@@H](C(NCC(O)=O)=O)NC(CC[C@H](N)C(O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C59H92N16O18S/c1-30(25-31(2)43(93-7)26-35-13-9-8-10-14-35)17-19-37-32(3)48(80)73-40(56(89)90)20-22-45(77)75(6)42(29-94-28-41(51(83)67-27-46(78)79)69-44(76)21-18-36(60)55(87)88)54(86)68-34(5)50(82)72-39(16-12-24-66-59(63)64)53(85)74-47(57(91)92)33(4)49(81)71-38(52(84)70-37)15-11-23-65-58(61)62/h8-10,13-14,17,19,25,31-34,36-43,47H,11-12,15-16,18,20-24,26-29,60H2,1-7H3,(H,67,83)(H,68,86)(H,69,76)(H,70,84)(H,71,81)(H,72,82)(H,73,80)(H,74,85)(H,78,79)(H,87,88)(H,89,90)(H,91,92)(H4,61,62,65)(H4,63,64,66)/b19-17+,30-25+/t31-,32-,33-,34+,36-,37-,38-,39-,40+,41-,42?,43-,47+/m0/s1",OWQLCSFYIFFJLC-YBCHMKSDSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_2028,"[D-Leu1,ADMAdda5]MC?LR",,Microcystin,,C53H80N10O13,1064.590633,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C53H80N10O13/c1-28(2)24-40-49(70)61-41(25-29(3)4)50(71)62-44(52(74)75)33(8)46(67)58-38(18-15-23-56-53(54)55)48(69)57-37(20-19-30(5)26-31(6)42(76-35(10)64)27-36-16-13-12-14-17-36)32(7)45(66)59-39(51(72)73)21-22-43(65)63(11)34(9)47(68)60-40/h12-14,16-17,19-20,26,28-29,31-33,37-42,44H,9,15,18,21-25,27H2,1-8,10-11H3,(H,57,69)(H,58,67)(H,59,66)(H,60,68)(H,61,70)(H,62,71)(H,72,73)(H,74,75)(H4,54,55,56)/b20-19+,30-26+/t31-,32-,33-,37-,38-,39+,40+,41-,42-,44+/m0/s1",AZENLJLWZGXBHX-IPELLMHFSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2029,"[Leu1,MeO-Glu6]MC?HilR","[D-Leu1,Glu(OMe)6]MC-HilR",Microcystin,,C54H84N10O12,1064.627019,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)C[C@@H](C)CC)=O)=O)=O)=O,"InChI=1S/C54H84N10O12/c1-13-31(4)28-42-51(71)63-45(52(72)73)35(8)47(67)59-39(20-17-25-57-54(55)56)49(69)58-38(22-21-32(5)27-33(6)43(75-11)29-37-18-15-14-16-19-37)34(7)46(66)60-40(53(74)76-12)23-24-44(65)64(10)36(9)48(68)61-41(26-30(2)3)50(70)62-42/h14-16,18-19,21-22,27,30-31,33-35,38-43,45H,9,13,17,20,23-26,28-29H2,1-8,10-12H3,(H,58,69)(H,59,67)(H,60,66)(H,61,68)(H,62,70)(H,63,71)(H,72,73)(H4,55,56,57)/b22-21+,32-27+/t31-,33-,34-,35-,38-,39-,40+,41+,42-,43-,45+/m0/s1",PZMFYRLMLBDWAA-SJELWDFNSA-N,146683872,no,Microcystis,aeruginosa,[Microcystis aeruginosa]CAAT 2005-3
CyanoMetDB_2030,"[D?Asp3,(E)?Dhb7]MC?HtyHty",,Microcystin,,C56H71N7O14,1065.5059,O=C(N/C(C(N[C@@H](C1=O)C)=O)=C/C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCC3=CC=C(O)C=C3)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC4=CC=C(O)C=C4)=O)=O)=O)=O,"InChI=1S/C56H71N7O14/c1-7-41-52(70)57-35(5)51(69)61-44(26-19-37-16-22-40(65)23-17-37)54(72)63-46(56(75)76)31-49(67)59-43(25-18-36-14-20-39(64)21-15-36)53(71)60-42(34(4)50(68)62-45(55(73)74)27-28-48(66)58-41)24-13-32(2)29-33(3)47(77-6)30-38-11-9-8-10-12-38/h7-17,20-24,29,33-35,42-47,64-65H,18-19,25-28,30-31H2,1-6H3,(H,57,70)(H,58,66)(H,59,67)(H,60,71)(H,61,69)(H,62,68)(H,63,72)(H,73,74)(H,75,76)/b24-13+,32-29+,41-7+/t33-,34-,35+,42-,43-,44-,45+,46+,47-/m0/s1",DGGUSUVUIGDKFF-VABYWWARSA-N,,yes,Planktothrix,rubescens,[Planktothrix rubescens]80
CyanoMetDB_2031,"[D-Asp3,ADMAdda5,(E/Z)-Dhb7]MC-RR","[D-Asp3,ADMAdda5,Dhb7]MC-RR",Microcystin,,C49H73N13O13,1051.54508,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)NC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C49H73N13O13/c1-7-32-43(68)56-29(5)42(67)60-35(16-12-22-55-49(52)53)45(70)62-37(47(73)74)25-40(65)58-34(15-11-21-54-48(50)51)44(69)59-33(28(4)41(66)61-36(46(71)72)19-20-39(64)57-32)18-17-26(2)23-27(3)38(75-30(6)63)24-31-13-9-8-10-14-31/h7-10,13-14,17-18,23,27-29,33-38H,11-12,15-16,19-22,24-25H2,1-6H3,(H,56,68)(H,57,64)(H,58,65)(H,59,69)(H,60,67)(H,61,66)(H,62,70)(H,71,72)(H,73,74)(H4,50,51,54)(H4,52,53,55)/b18-17+,26-23+,32-7?/t27-,28-,29+,33-,34-,35-,36+,37+,38-/m0/s1",XHKHVZRIQATICZ-RYPFVCKKSA-N,139583100,yes,Nostoc,sp.,[Nostoc sp.]DUN901
CyanoMetDB_2032,MC-HarHar,,Microcystin,,C51H79N13O12,1065.597115,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C51H79N13O12/c1-28(26-29(2)39(76-8)27-34-16-10-9-11-17-34)20-21-35-30(3)42(66)62-38(48(72)73)22-23-40(65)64(7)33(6)45(69)58-32(5)44(68)61-37(19-13-15-25-57-51(54)55)47(71)63-41(49(74)75)31(4)43(67)60-36(46(70)59-35)18-12-14-24-56-50(52)53/h9-11,16-17,20-21,26,29-32,35-39,41H,6,12-15,18-19,22-25,27H2,1-5,7-8H3,(H,58,69)(H,59,70)(H,60,67)(H,61,68)(H,62,66)(H,63,71)(H,72,73)(H,74,75)(H4,52,53,56)(H4,54,55,57)/b21-20+,28-26+/t29-,30-,31-,32+,35-,36-,37-,38+,39-,41+/m0/s1",FNBUXGYDJOQZPB-IBUOYHJBSA-N,146683866,no,n.a.,sp.,n.a.
CyanoMetDB_2033,"[D-Leu1,D-Asp3]MC-RR",,Microcystin,,C51H79N13O12,1065.597115,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C51H79N13O12/c1-28(2)24-38-47(71)60-36(17-13-23-57-51(54)55)46(70)63-39(49(74)75)27-41(65)58-35(16-12-22-56-50(52)53)45(69)59-34(19-18-29(3)25-30(4)40(76-8)26-33-14-10-9-11-15-33)31(5)43(67)61-37(48(72)73)20-21-42(66)64(7)32(6)44(68)62-38/h9-11,14-15,18-19,25,28,30-31,34-40H,6,12-13,16-17,20-24,26-27H2,1-5,7-8H3,(H,58,65)(H,59,69)(H,60,71)(H,61,67)(H,62,68)(H,63,70)(H,72,73)(H,74,75)(H4,52,53,56)(H4,54,55,57)/b19-18+,29-25+/t30-,31-,34-,35-,36-,37+,38+,39+,40-/m0/s1",UITNVKFCFUVOFG-JAQPLRKGSA-N,146684770,no,Phormidium,sp.,[Phormidium sp.]CENA270
CyanoMetDB_2034,MC-WR,,Microcystin,,C54H73N11O12,1067.544017,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CNC4=C3C=CC=C4)=O)=O)=O)=O,"InChI=1S/C54H73N11O12/c1-29(25-30(2)43(77-8)26-35-15-10-9-11-16-35)20-21-38-31(3)46(67)62-41(52(73)74)22-23-44(66)65(7)34(6)49(70)59-33(5)48(69)63-42(27-36-28-58-39-18-13-12-17-37(36)39)51(72)64-45(53(75)76)32(4)47(68)61-40(50(71)60-38)19-14-24-57-54(55)56/h9-13,15-18,20-21,25,28,30-33,38,40-43,45,58H,6,14,19,22-24,26-27H2,1-5,7-8H3,(H,59,70)(H,60,71)(H,61,68)(H,62,67)(H,63,69)(H,64,72)(H,73,74)(H,75,76)(H4,55,56,57)/b21-20+,29-25+/t30-,31-,32-,33+,38-,40-,41+,42-,43-,45+/m0/s1",UGNOHFGJSOFQHC-ZISXDMAXSA-N,101619976,yes,n.a.,n.a.,n.a.
CyanoMetDB_2035,"[D-Leu1,D-MeO-Glu6,NMe-Ser7]MC?LR","[D-Leu1,D-Glu(OMe)6,Mser7]MC-LR",Microcystin,,C53H84N10O13,1068.621933,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)CC(C)C)=O)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C53H84N10O13/c1-29(2)24-39-48(69)60-40(25-30(3)4)49(70)62-44(51(72)73)34(8)46(67)58-37(18-15-23-56-53(54)55)47(68)57-36(20-19-31(5)26-32(6)42(75-10)27-35-16-13-12-14-17-35)33(7)45(66)59-38(52(74)76-11)21-22-43(65)63(9)41(28-64)50(71)61-39/h12-14,16-17,19-20,26,29-30,32-34,36-42,44,64H,15,18,21-25,27-28H2,1-11H3,(H,57,68)(H,58,67)(H,59,66)(H,60,69)(H,61,71)(H,62,70)(H,72,73)(H4,54,55,56)/b20-19+,31-26+/t32-,33-,34-,36-,37-,38+,39+,40-,41-,42-,44+/m0/s1",CABXVCHSKOMXQY-OLDNHBKMSA-N,146683873,no,Microcystis,aeruginosa,[Microcystis aeruginosa] CAAT 2005-3
CyanoMetDB_2036,[D-Met(O)1]MC-LR,[M(O)1]MC?LR,Microcystin,,C51H78N10O13S,1070.547054,O=C(N(C)C(C(N[C@@H](C1=O)CCS(C)=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C51H78N10O13S/c1-28(2)25-39-48(68)60-42(50(71)72)32(6)44(64)56-36(17-14-23-54-51(52)53)46(66)55-35(19-18-29(3)26-30(4)40(74-9)27-34-15-12-11-13-16-34)31(5)43(63)58-38(49(69)70)20-21-41(62)61(8)33(7)45(65)57-37(47(67)59-39)22-24-75(10)73/h11-13,15-16,18-19,26,28,30-32,35-40,42H,7,14,17,20-25,27H2,1-6,8-10H3,(H,55,66)(H,56,64)(H,57,65)(H,58,63)(H,59,67)(H,60,68)(H,69,70)(H,71,72)(H4,52,53,54)/b19-18+,29-26+/t30-,31-,32-,35-,36-,37+,38+,39-,40-,42+,75?/m0/s1",FYGVSVGVTBXKSQ-ZKCOOUHSSA-N,146683874,no,Microcystis,aeruginosa,[Microcystis aeruginosa] CAAT 2005-3
CyanoMetDB_2037,[D-Leu1]MC?M(O)R,,Microcystin,,C51H78N10O13S,1070.547054,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCS(C)=O)=O)=O)=O)=O,"InChI=1S/C51H78N10O13S/c1-28(2)25-39-48(68)57-37(22-24-75(10)73)47(67)60-42(50(71)72)32(6)44(64)56-36(17-14-23-54-51(52)53)46(66)55-35(19-18-29(3)26-30(4)40(74-9)27-34-15-12-11-13-16-34)31(5)43(63)58-38(49(69)70)20-21-41(62)61(8)33(7)45(65)59-39/h11-13,15-16,18-19,26,28,30-32,35-40,42H,7,14,17,20-25,27H2,1-6,8-10H3,(H,55,66)(H,56,64)(H,57,68)(H,58,63)(H,59,65)(H,60,67)(H,69,70)(H,71,72)(H4,52,53,54)/b19-18+,29-26+/t30-,31-,32-,35-,36-,37-,38+,39+,40-,42+,75?/m0/s1",GFBBOSQXMYDYED-UNRDJFFOSA-N,,no,Microcystis,aeruginosa,bloom
CyanoMetDB_2038,"[D-Leu1,D-Asp³]MC?HphR",,Microcystin,,C55H78N10O12,1070.580068,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C55H78N10O12/c1-32(2)28-43-52(72)61-41(24-22-37-16-11-9-12-17-37)51(71)64-44(54(75)76)31-46(66)59-40(20-15-27-58-55(56)57)50(70)60-39(23-21-33(3)29-34(4)45(77-8)30-38-18-13-10-14-19-38)35(5)48(68)62-42(53(73)74)25-26-47(67)65(7)36(6)49(69)63-43/h9-14,16-19,21,23,29,32,34-35,39-45H,6,15,20,22,24-28,30-31H2,1-5,7-8H3,(H,59,66)(H,60,70)(H,61,72)(H,62,68)(H,63,69)(H,64,71)(H,73,74)(H,75,76)(H4,56,57,58)/b23-21+,33-29+/t34-,35-,39-,40-,41-,42+,43+,44+,45-/m0/s1",BXORURFXTQUPSQ-IEPLTTJDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2039,[D-Phe1]MC?LR,,Microcystin,,C55H78N10O12,1070.580068,O=C(N(C)C(C(N[C@@H](C1=O)CC2=CC=CC=C2)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC3=CC=CC=C3)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C55H78N10O12/c1-31(2)27-42-52(72)64-46(54(75)76)35(6)48(68)60-40(21-16-26-58-55(56)57)50(70)59-39(23-22-32(3)28-33(4)44(77-9)30-38-19-14-11-15-20-38)34(5)47(67)61-41(53(73)74)24-25-45(66)65(8)36(7)49(69)62-43(51(71)63-42)29-37-17-12-10-13-18-37/h10-15,17-20,22-23,28,31,33-35,39-44,46H,7,16,21,24-27,29-30H2,1-6,8-9H3,(H,59,70)(H,60,68)(H,61,67)(H,62,69)(H,63,71)(H,64,72)(H,73,74)(H,75,76)(H4,56,57,58)/b23-22+,32-28+/t33-,34-,35-,39-,40-,41+,42-,43+,44-,46+/m0/s1",WSMOZMQKQAHELG-LONBYMFTSA-N,146684771,no,Microcystis,aeruginosa,[Microcystis sp.]NPLJ-4
CyanoMetDB_2040,[D-Leu1]MC?FR,,Microcystin,,C55H78N10O12,1070.580068,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C55H78N10O12/c1-31(2)27-42-51(71)63-43(29-37-17-12-10-13-18-37)52(72)64-46(54(75)76)35(6)48(68)60-40(21-16-26-58-55(56)57)50(70)59-39(23-22-32(3)28-33(4)44(77-9)30-38-19-14-11-15-20-38)34(5)47(67)61-41(53(73)74)24-25-45(66)65(8)36(7)49(69)62-42/h10-15,17-20,22-23,28,31,33-35,39-44,46H,7,16,21,24-27,29-30H2,1-6,8-9H3,(H,59,70)(H,60,68)(H,61,67)(H,62,69)(H,63,71)(H,64,72)(H,73,74)(H,75,76)(H4,56,57,58)/b23-22+,32-28+/t33-,34-,35-,39-,40-,41+,42+,43-,44-,46+/m0/s1",OWZKCYUKKHQPDU-JCBPHERESA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2041,MC?KynR,MC?KynR (oxidised W),Microcystin,,C53H73N11O13,1071.538932,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C(C=CC=C3)=C3N)=O)=O)=O)=O)=O,"InChI=1S/C53H73N11O13/c1-28(25-29(2)42(77-8)26-34-15-10-9-11-16-34)20-21-37-30(3)45(67)61-39(51(73)74)22-23-43(66)64(7)33(6)48(70)58-32(5)47(69)62-40(27-41(65)35-17-12-13-18-36(35)54)50(72)63-44(52(75)76)31(4)46(68)60-38(49(71)59-37)19-14-24-57-53(55)56/h9-13,15-18,20-21,25,29-32,37-40,42,44H,6,14,19,22-24,26-27,54H2,1-5,7-8H3,(H,58,70)(H,59,71)(H,60,68)(H,61,67)(H,62,69)(H,63,72)(H,73,74)(H,75,76)(H4,55,56,57)/b21-20+,28-25+/t29-,30-,31-,32+,37-,38-,39+,40-,42-,44+/m0/s1",UGTOBXTXSTVUSN-UKFGIZBISA-N,146683827,no,Microcystis,n.a.,CAWBG11
CyanoMetDB_2042,"[D-Asp3,ADMAdda5]MC-HtyR",,Microcystin,,C53H72N10O14,1072.522947,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C53H72N10O14/c1-29(26-30(2)43(77-34(6)64)27-36-12-9-8-10-13-36)15-21-38-31(3)46(68)61-41(51(73)74)23-24-45(67)63(7)33(5)48(70)57-32(4)47(69)60-40(22-18-35-16-19-37(65)20-17-35)50(72)62-42(52(75)76)28-44(66)58-39(49(71)59-38)14-11-25-56-53(54)55/h8-10,12-13,15-17,19-21,26,30-32,38-43,65H,5,11,14,18,22-25,27-28H2,1-4,6-7H3,(H,57,70)(H,58,66)(H,59,71)(H,60,69)(H,61,68)(H,62,72)(H,73,74)(H,75,76)(H4,54,55,56)/b21-15+,29-26+/t30-,31-,32+,38-,39-,40-,41+,42+,43-/m0/s1",NHGHJQQZDIDSCY-SNWASLKVSA-N,146684700,no,Oscillatoria/Planktothrix,agardhii,[Oscillatoria/Planktothrix agardhii]PH-123
CyanoMetDB_2043,"[D-Asp3,ADMAdda5,(E/Z)-Dhb7]MC-HtyR",,Microcystin,,C53H72N10O14,1072.522947,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)C[C@@H](NC(=O)[C@H](CCc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C\C)\NC(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C53H72N10O14/c1-7-37-48(70)57-32(5)47(69)61-40(22-18-34-16-19-36(65)20-17-34)50(72)63-42(52(75)76)28-45(67)59-39(14-11-25-56-53(54)55)49(71)60-38(31(4)46(68)62-41(51(73)74)23-24-44(66)58-37)21-15-29(2)26-30(3)43(77-33(6)64)27-35-12-9-8-10-13-35/h7-10,12-13,15-17,19-21,26,30-32,38-43,65H,11,14,18,22-25,27-28H2,1-6H3,(H,57,70)(H,58,66)(H,59,67)(H,60,71)(H,61,69)(H,62,68)(H,63,72)(H,73,74)(H,75,76)(H4,54,55,56)/b21-15+,29-26+,37-7?/t30-,31-,32+,38-,39-,40-,41+,42+,43-/m0/s1",QOBIMFYINUFCSC-AKJAINAWSA-N,139587478,yes,Nostoc,sp.,[Nostoc sp.]DUN901
CyanoMetDB_2044,[ADMAdda5]MC?YR,,Microcystin,,C53H72N10O14,1072.522947,CC(=O)O[C@@H](Cc1ccccc1)[C@@H](C)\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O,"InChI=1S/C53H72N10O14/c1-28(25-29(2)42(77-34(7)64)27-35-13-10-9-11-14-35)16-21-38-30(3)45(67)60-40(51(73)74)22-23-43(66)63(8)33(6)48(70)57-32(5)47(69)61-41(26-36-17-19-37(65)20-18-36)50(72)62-44(52(75)76)31(4)46(68)59-39(49(71)58-38)15-12-24-56-53(54)55/h9-11,13-14,16-21,25,29-32,38-42,44,65H,6,12,15,22-24,26-27H2,1-5,7-8H3,(H,57,70)(H,58,71)(H,59,68)(H,60,67)(H,61,69)(H,62,72)(H,73,74)(H,75,76)(H4,54,55,56)/b21-16+,28-25+/t29-,30-,31-,32+,38-,39-,40+,41-,42-,44+/m0/s1",MWAORMUJMWTHOO-MIODMMCSSA-N,146684733,no,Nostoc,sp.,[Nostoc sp.]IO-102-I
CyanoMetDB_2045,MC?MhtyR,,Microcystin,,C54H76N10O13,1072.559333,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1C)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C54H76N10O13/c1-30(28-31(2)43(77-9)29-37-14-11-10-12-15-37)17-23-39-32(3)46(67)61-41(52(73)74)24-26-44(66)63(7)35(6)48(69)58-34(5)51(72)64(8)42(25-20-36-18-21-38(65)22-19-36)50(71)62-45(53(75)76)33(4)47(68)60-40(49(70)59-39)16-13-27-57-54(55)56/h10-12,14-15,17-19,21-23,28,31-34,39-43,45,65H,6,13,16,20,24-27,29H2,1-5,7-9H3,(H,58,69)(H,59,70)(H,60,68)(H,61,67)(H,62,71)(H,73,74)(H,75,76)(H4,55,56,57)/b23-17+,30-28+/t31-,32-,33-,34+,39-,40-,41+,42-,43-,45+/m0/s1",DRRSPCNUSAQJEE-IGXABBBVSA-N,146683851,no,n.a.,aeruginosa,[Microcystis aeruginosa]SEAGL14
CyanoMetDB_2046,"[D-Asp3,(E)?Dhb7]MC?HtyW","[D-Asp3,Dhb7]MC-HtyW",Microcystin,,C57H70N8O13,1074.506235,O=C(N/C(C(N[C@@H](C1=O)C)=O)=C/C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CNC4=C3C=CC=C4)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC5=CC=C(O)C=C5)=O)=O)=O)=O,"InChI=1S/C57H70N8O13/c1-7-41-53(71)59-35(5)52(70)63-44(24-20-36-18-21-39(66)22-19-36)54(72)65-47(57(76)77)30-50(68)61-46(29-38-31-58-43-16-12-11-15-40(38)43)55(73)62-42(34(4)51(69)64-45(56(74)75)25-26-49(67)60-41)23-17-32(2)27-33(3)48(78-6)28-37-13-9-8-10-14-37/h7-19,21-23,27,31,33-35,42,44-48,58,66H,20,24-26,28-30H2,1-6H3,(H,59,71)(H,60,67)(H,61,68)(H,62,73)(H,63,70)(H,64,69)(H,65,72)(H,74,75)(H,76,77)/b23-17+,32-27+,41-7+/t33-,34-,35+,42-,44-,45+,46-,47+,48-/m0/s1",AQBLNSUXUYUERE-KDEIUMRESA-N,146684778,yes,Oscillatoria/Planktothrix,rubescens,80
CyanoMetDB_2047,MC?RY(OMe),,Microcystin,,C53H74N10O14,1074.538597,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C(OC)=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C53H74N10O14/c1-28(24-29(2)41(76-8)26-34-14-11-10-12-15-34)17-19-36-30(3)45(66)60-38(51(72)73)20-22-43(65)63(7)33(6)48(69)57-32(5)47(68)59-37(16-13-23-56-53(54)55)49(70)62-44(52(74)75)31(4)46(67)61-39(50(71)58-36)25-35-18-21-40(64)42(27-35)77-9/h10-12,14-15,17-19,21,24,27,29-32,36-39,41,44,64H,6,13,16,20,22-23,25-26H2,1-5,7-9H3,(H,57,69)(H,58,71)(H,59,68)(H,60,66)(H,61,67)(H,62,70)(H,72,73)(H,74,75)(H4,54,55,56)/b19-17+,28-24+/t29-,30-,31-,32+,36-,37-,38+,39-,41-,44+/m0/s1",KVGCOYJJGOCUHW-IQEZPTFASA-N,146684760,no,n.a.,n.a.,n.a.
CyanoMetDB_2048,[D-Asp³]MC?Htyr(OMe)R,,Microcystin,,C53H74N10O14,1074.538597,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C(OC)=C3)=O)=O)=O)=O,"InChI=1S/C53H74N10O14/c1-29(25-30(2)42(76-7)26-34-13-10-9-11-14-34)16-19-36-31(3)46(67)61-39(51(72)73)21-23-45(66)63(6)33(5)48(69)57-32(4)47(68)60-38(20-17-35-18-22-41(64)43(27-35)77-8)50(71)62-40(52(74)75)28-44(65)58-37(49(70)59-36)15-12-24-56-53(54)55/h9-11,13-14,16,18-19,22,25,27,30-32,36-40,42,64H,5,12,15,17,20-21,23-24,26,28H2,1-4,6-8H3,(H,57,69)(H,58,65)(H,59,70)(H,60,68)(H,61,67)(H,62,71)(H,72,73)(H,74,75)(H4,54,55,56)/b19-16+,29-25+/t30-,31-,32+,36-,37-,38-,39+,40+,42-/m0/s1",ZPYMAPRFVXDPFZ-DNLKICPHSA-N,146684788,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_2049,MC?Y(OMe)R,,Microcystin,,C53H74N10O14,1074.538597,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=C(O)C(OC)=C3)=O)=O)=O)=O,"InChI=1S/C53H74N10O14/c1-28(24-29(2)41(76-8)26-34-14-11-10-12-15-34)17-19-36-30(3)45(66)60-38(51(72)73)20-22-43(65)63(7)33(6)48(69)57-32(5)47(68)61-39(25-35-18-21-40(64)42(27-35)77-9)50(71)62-44(52(74)75)31(4)46(67)59-37(49(70)58-36)16-13-23-56-53(54)55/h10-12,14-15,17-19,21,24,27,29-32,36-39,41,44,64H,6,13,16,20,22-23,25-26H2,1-5,7-9H3,(H,57,69)(H,58,70)(H,59,67)(H,60,66)(H,61,68)(H,62,71)(H,72,73)(H,74,75)(H4,54,55,56)/b19-17+,28-24+/t29-,30-,31-,32+,36-,37-,38+,39-,41-,44+/m0/s1",QKOFRVHIRGJZFD-IQEZPTFASA-N,,no,Microcystis,aeruginosa,AB2011/53 and AQUAMEB-24
CyanoMetDB_2050,[seco?4/5]MC?HtyR,,Microcystin,,C53H76N10O14,1076.554247,N[C@@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)[C@H](C)C(N[C@@H](C(O)=O)CCC(N(C)C(C(N[C@H](C)C(N[C@@H](CCC2=CC=C(O)C=C2)C(N[C@@H](C(O)=O)[C@H](C)C(N[C@@H](CCCNC(N)=N)C(O)=O)=O)=O)=O)=O)=C)=O)=O,"InChI=1S/C53H76N10O14/c1-29(27-30(2)42(77-8)28-36-13-10-9-11-14-36)16-22-38(54)31(3)45(66)61-41(51(73)74)24-25-43(65)63(7)34(6)48(69)58-33(5)47(68)59-39(23-19-35-17-20-37(64)21-18-35)49(70)62-44(52(75)76)32(4)46(67)60-40(50(71)72)15-12-26-57-53(55)56/h9-11,13-14,16-18,20-22,27,30-33,38-42,44,64H,6,12,15,19,23-26,28,54H2,1-5,7-8H3,(H,58,69)(H,59,68)(H,60,67)(H,61,66)(H,62,70)(H,71,72)(H,73,74)(H,75,76)(H4,55,56,57)/b22-16+,29-27+/t30-,31-,32-,33+,38-,39-,40-,41+,42-,44+/m0/s1",WTVAONJAVUUYCZ-CWXGWYCISA-N,146684789,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_2051,[ADMAdda5]MC?(H4)YR,,Microcystin,,C53H76N10O14,1076.554247,O=C(CC[C@@H](NC([C@H]([C@@H](NC([C@@H](NC([C@H]([C@@H](NC([C@H](C[C@]1([H])CC[C@@H](O)C=C1)N2)=O)C(O)=O)C)=O)CCCNC(N)=N)=O)/C=C/C(C)=C/[C@@H]([C@H](CC3=CC=CC=C3)OC(C)=O)C)C)=O)C(O)=O)N(C(C(N[C@H](C)C2=O)=O)=C)C,"InChI=1S/C53H76N10O14/c1-28(25-29(2)42(77-34(7)64)27-35-13-10-9-11-14-35)16-21-38-30(3)45(67)60-40(51(73)74)22-23-43(66)63(8)33(6)48(70)57-32(5)47(69)61-41(26-36-17-19-37(65)20-18-36)50(72)62-44(52(75)76)31(4)46(68)59-39(49(71)58-38)15-12-24-56-53(54)55/h9-11,13-14,16-17,19,21,25,29-32,36-42,44,65H,6,12,15,18,20,22-24,26-27H2,1-5,7-8H3,(H,57,70)(H,58,71)(H,59,68)(H,60,67)(H,61,69)(H,62,72)(H,73,74)(H,75,76)(H4,54,55,56)/b21-16+,28-25+/t29-,30-,31-,32+,36-,37-,38-,39-,40+,41-,42-,44+/m0/s1",QHOIFLBUBXSKFD-CVMCXGGVSA-N,146684742,no,Nostoc,sp.,[Nostoc sp.]UK18
CyanoMetDB_2052,[Mser7]MC?HtyR,,Microcystin,,C53H76N10O14,1076.554247,O=C(N(C)[C@@H](CO)C(N[C@H](C)C1=O)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C53H76N10O14/c1-29(26-30(2)42(77-7)27-35-12-9-8-10-13-35)15-21-37-31(3)45(67)61-40(51(73)74)23-24-43(66)63(6)41(28-64)50(72)57-33(5)47(69)60-39(22-18-34-16-19-36(65)20-17-34)49(71)62-44(52(75)76)32(4)46(68)59-38(48(70)58-37)14-11-25-56-53(54)55/h8-10,12-13,15-17,19-21,26,30-33,37-42,44,64-65H,11,14,18,22-25,27-28H2,1-7H3,(H,57,72)(H,58,70)(H,59,68)(H,60,69)(H,61,67)(H,62,71)(H,73,74)(H,75,76)(H4,54,55,56)/b21-15+,29-26+/t30-,31-,32-,33+,37-,38-,39-,40+,41-,42-,44+/m0/s1",NIQDHGDEFXYGRF-AHSSRTABSA-N,146684790,no,Anabaena/Dolichospermum,flos aquae,NIVA-CYA 656
CyanoMetDB_2053,"[D-Leu1,ADMAdda5]MC?LHar",,Microcystin,,C54H82N10O13,1078.606283,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C54H82N10O13/c1-29(2)25-41-50(71)62-42(26-30(3)4)51(72)63-45(53(75)76)34(8)47(68)59-39(19-15-16-24-57-54(55)56)49(70)58-38(21-20-31(5)27-32(6)43(77-36(10)65)28-37-17-13-12-14-18-37)33(7)46(67)60-40(52(73)74)22-23-44(66)64(11)35(9)48(69)61-41/h12-14,17-18,20-21,27,29-30,32-34,38-43,45H,9,15-16,19,22-26,28H2,1-8,10-11H3,(H,58,70)(H,59,68)(H,60,67)(H,61,69)(H,62,71)(H,63,72)(H,73,74)(H,75,76)(H4,55,56,57)/b21-20+,31-27+/t32-,33-,34-,38-,39-,40+,41+,42-,43-,45+/m0/s1",GZTFDRHWSWDGLX-COJYQKBUSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2054,[ADMAdda5]MC?RHar,,Microcystin,,C51H77N13O13,1079.57638,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C51H77N13O13/c1-27(25-28(2)39(77-33(7)65)26-34-15-10-9-11-16-34)19-20-35-29(3)42(67)62-38(48(73)74)21-22-40(66)64(8)32(6)45(70)58-31(5)44(69)61-37(18-14-24-57-51(54)55)47(72)63-41(49(75)76)30(4)43(68)60-36(46(71)59-35)17-12-13-23-56-50(52)53/h9-11,15-16,19-20,25,28-31,35-39,41H,6,12-14,17-18,21-24,26H2,1-5,7-8H3,(H,58,70)(H,59,71)(H,60,68)(H,61,69)(H,62,67)(H,63,72)(H,73,74)(H,75,76)(H4,52,53,56)(H4,54,55,57)/b20-19+,27-25+/t28-,29-,30-,31+,35-,36-,37-,38+,39-,41+/m0/s1",AJYXDJVURKMIBH-DBOZVMTDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2055,[D-Leu1]MC-RR,,Microcystin,,C52H81N13O12,1079.612765,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C52H81N13O12/c1-28(2)25-39-48(72)61-37(18-14-24-58-52(55)56)47(71)64-42(50(75)76)32(6)44(68)60-36(17-13-23-57-51(53)54)46(70)59-35(20-19-29(3)26-30(4)40(77-9)27-34-15-11-10-12-16-34)31(5)43(67)62-38(49(73)74)21-22-41(66)65(8)33(7)45(69)63-39/h10-12,15-16,19-20,26,28,30-32,35-40,42H,7,13-14,17-18,21-25,27H2,1-6,8-9H3,(H,59,70)(H,60,68)(H,61,72)(H,62,67)(H,63,69)(H,64,71)(H,73,74)(H,75,76)(H4,53,54,57)(H4,55,56,58)/b20-19+,29-26+/t30-,31-,32-,35-,36-,37-,38+,39+,40-,42+/m0/s1",BMULUGRVOLWIKI-AHYMVQLDSA-N,146684772,no,Phormidium,sp.,[Phormidium sp.]CENA270
CyanoMetDB_2056,MC?OiaR,MC?OiaR (oxidised W),Microcystin,,C54H73N11O13,1083.538932,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3C(C=CC=C4)=C4NC3=O)=O)=O)=O)=O,"InChI=1S/C54H73N11O13/c1-28(25-29(2)42(78-8)26-34-15-10-9-11-16-34)20-21-37-30(3)45(67)62-40(52(74)75)22-23-43(66)65(7)33(6)48(70)58-32(5)47(69)63-41(27-36-35-17-12-13-18-38(35)60-49(36)71)51(73)64-44(53(76)77)31(4)46(68)61-39(50(72)59-37)19-14-24-57-54(55)56/h9-13,15-18,20-21,25,29-32,36-37,39-42,44H,6,14,19,22-24,26-27H2,1-5,7-8H3,(H,58,70)(H,59,72)(H,60,71)(H,61,68)(H,62,67)(H,63,69)(H,64,73)(H,74,75)(H,76,77)(H4,55,56,57)/b21-20+,28-25+/t29-,30-,31-,32+,36?,37-,39-,40+,41-,42-,44+/m0/s1",RTWKALOUNJLWMT-JFXBHVICSA-N,146683828,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_2057,"[D-Met(O)1,D-MeO-Glu6]MC?LR","[D-Met(O)1,Glu(OMe)6]MC?LR",Microcystin,,C52H80N10O13S,1084.562704,O=C(N(C)C(C(N[C@@H](C1=O)CCS(C)=O)=O)=C)CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C52H80N10O13S/c1-29(2)26-40-49(69)61-43(50(70)71)33(6)45(65)57-37(18-15-24-55-52(53)54)47(67)56-36(20-19-30(3)27-31(4)41(74-9)28-35-16-13-12-14-17-35)32(5)44(64)59-39(51(72)75-10)21-22-42(63)62(8)34(7)46(66)58-38(48(68)60-40)23-25-76(11)73/h12-14,16-17,19-20,27,29,31-33,36-41,43H,7,15,18,21-26,28H2,1-6,8-11H3,(H,56,67)(H,57,65)(H,58,66)(H,59,64)(H,60,68)(H,61,69)(H,70,71)(H4,53,54,55)/b20-19+,30-27+/t31-,32-,33-,36-,37-,38+,39+,40-,41-,43+,76?/m0/s1",RHTINHKLEAGZRI-MPCZMROASA-N,146683875,no,Microcystis,aeruginosa,[Microcystis aeruginosa] CAAT 2005-3
CyanoMetDB_2058,[D-Leu1]MC-HphR,,Microcystin,,C56H80N10O12,1084.595718,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C56H80N10O12/c1-32(2)29-44-53(73)62-42(25-23-38-17-12-10-13-18-38)52(72)65-47(55(76)77)36(6)49(69)61-41(21-16-28-59-56(57)58)51(71)60-40(24-22-33(3)30-34(4)45(78-9)31-39-19-14-11-15-20-39)35(5)48(68)63-43(54(74)75)26-27-46(67)66(8)37(7)50(70)64-44/h10-15,17-20,22,24,30,32,34-36,40-45,47H,7,16,21,23,25-29,31H2,1-6,8-9H3,(H,60,71)(H,61,69)(H,62,73)(H,63,68)(H,64,70)(H,65,72)(H,74,75)(H,76,77)(H4,57,58,59)/b24-22+,33-30+/t34-,35-,36-,40-,41-,42-,43+,44+,45-,47+/m0/s1",ZDUORUGJYRAXQK-AWTKRBTQSA-N,146684773,no,Microcystis,sp.,RST9501
CyanoMetDB_2059,[D-Leu1]MC-M(O2)R,,Microcystin,,C51H78N10O14S,1086.54197,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCS(C)(=O)=O)=O)=O)=O)=O,"InChI=1S/C51H78N10O14S/c1-28(2)25-39-48(68)57-37(22-24-76(10,73)74)47(67)60-42(50(71)72)32(6)44(64)56-36(17-14-23-54-51(52)53)46(66)55-35(19-18-29(3)26-30(4)40(75-9)27-34-15-12-11-13-16-34)31(5)43(63)58-38(49(69)70)20-21-41(62)61(8)33(7)45(65)59-39/h11-13,15-16,18-19,26,28,30-32,35-40,42H,7,14,17,20-25,27H2,1-6,8-10H3,(H,55,66)(H,56,64)(H,57,68)(H,58,63)(H,59,65)(H,60,67)(H,69,70)(H,71,72)(H4,52,53,54)/b19-18+,29-26+/t30-,31-,32-,35-,36-,37-,38+,39+,40-,42+/m0/s1",PSBIEJGKICVXRC-OIGYFXLDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2060,[ADMAdda5]MC?(H4)YHar,,Microcystin,,C54H78N10O14,1090.569898,O=C(CC[C@@H](NC([C@H]([C@@H](NC([C@@H](NC([C@H]([C@@H](NC([C@H](C[C@]1([H])CC[C@@H](O)C=C1)N2)=O)C(O)=O)C)=O)CCCCNC(N)=N)=O)/C=C/C(C)=C/[C@@H]([C@H](CC3=CC=CC=C3)OC(C)=O)C)C)=O)C(O)=O)N(C(C(N[C@H](C)C2=O)=O)=C)C,"InChI=1S/C54H78N10O14/c1-29(26-30(2)43(78-35(7)65)28-36-14-10-9-11-15-36)17-22-39-31(3)46(68)61-41(52(74)75)23-24-44(67)64(8)34(6)49(71)58-33(5)48(70)62-42(27-37-18-20-38(66)21-19-37)51(73)63-45(53(76)77)32(4)47(69)60-40(50(72)59-39)16-12-13-25-57-54(55)56/h9-11,14-15,17-18,20,22,26,30-33,37-43,45,66H,6,12-13,16,19,21,23-25,27-28H2,1-5,7-8H3,(H,58,71)(H,59,72)(H,60,69)(H,61,68)(H,62,70)(H,63,73)(H,74,75)(H,76,77)(H4,55,56,57)/b22-17+,29-26+/t30-,31-,32-,33+,37-,38-,39-,40-,41+,42-,43-,45+/m0/s1",OCQCDEXNHUNYCY-BPLSHEKDSA-N,146684743,no,Nostoc,sp.,[Nostoc sp.]UK18
CyanoMetDB_2061,MC?NfkR,MC?NfkR (oxidised W),Microcystin,,C54H73N11O14,1099.533846,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C(C=CC=C3)=C3NC=O)=O)=O)=O)=O)=O,"InChI=1S/C54H73N11O14/c1-29(25-30(2)43(79-8)26-35-15-10-9-11-16-35)20-21-37-31(3)46(69)62-40(52(75)76)22-23-44(68)65(7)34(6)49(72)59-33(5)48(71)63-41(27-42(67)36-17-12-13-18-38(36)58-28-66)51(74)64-45(53(77)78)32(4)47(70)61-39(50(73)60-37)19-14-24-57-54(55)56/h9-13,15-18,20-21,25,28,30-33,37,39-41,43,45H,6,14,19,22-24,26-27H2,1-5,7-8H3,(H,58,66)(H,59,72)(H,60,73)(H,61,70)(H,62,69)(H,63,71)(H,64,74)(H,75,76)(H,77,78)(H4,55,56,57)/b21-20+,29-25+/t30-,31-,32-,33+,37-,39-,40+,41-,43-,45+/m0/s1",SFEHDORCXZBIOU-CFJCUTGNSA-N,146683829,no,Microcystis,sp.,[Microcystis sp.]CAWBG11
CyanoMetDB_2062,[D-Leu1]MC?HtyR,,Microcystin,,C56H80N10O13,1100.590633,O=C(N(C)C(C(N[C@@H](C1=O)CC(C)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C56H80N10O13/c1-31(2)28-44-53(74)62-42(24-20-37-18-21-39(67)22-19-37)52(73)65-47(55(77)78)35(6)49(70)61-41(16-13-27-59-56(57)58)51(72)60-40(23-17-32(3)29-33(4)45(79-9)30-38-14-11-10-12-15-38)34(5)48(69)63-43(54(75)76)25-26-46(68)66(8)36(7)50(71)64-44/h10-12,14-15,17-19,21-23,29,31,33-35,40-45,47,67H,7,13,16,20,24-28,30H2,1-6,8-9H3,(H,60,72)(H,61,70)(H,62,74)(H,63,69)(H,64,71)(H,65,73)(H,75,76)(H,77,78)(H4,57,58,59)/b23-17+,32-29+/t33-,34-,35-,40-,41-,42-,43+,44+,45-,47+/m0/s1",NIUNWCDFPXGJEK-QXTGSMIGSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2063,"[D-Leu1,Ser7]MC-HtyR","[D-Leu1,L-Ser7]MC-HtyR",Microcystin,,C55H80N10O14,1104.585547,O=C(N[C@@H](CO)C(N[C@@H](C1=O)CC(C)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C55H80N10O14/c1-30(2)26-42-51(73)62-40(22-18-35-16-19-37(67)20-17-35)50(72)65-46(54(77)78)34(6)48(70)61-39(14-11-25-58-55(56)57)49(71)60-38(21-15-31(3)27-32(4)44(79-7)28-36-12-9-8-10-13-36)33(5)47(69)63-41(53(75)76)23-24-45(68)59-43(29-66)52(74)64-42/h8-10,12-13,15-17,19-21,27,30,32-34,38-44,46,66-67H,11,14,18,22-26,28-29H2,1-7H3,(H,59,68)(H,60,71)(H,61,70)(H,62,73)(H,63,69)(H,64,74)(H,65,72)(H,75,76)(H,77,78)(H4,56,57,58)/b21-15+,31-27+/t32-,33-,34-,38-,39-,40-,41+,42+,43-,44-,46+/m0/s1",LPFSGSMIIHIZHU-HRPRKDRMSA-N,146683808,no,n.a.,n.a.,n.a.
CyanoMetDB_2064,[Mdha-Cys7]MC-LR,"[L?MeLan7]MC?LR, MC-LR-Cys",Microcystin,,C52H81N11O14S,1115.568517,O=C(N(C1([H])CSC[C@@H](C(O)=O)N)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C52H81N11O14S/c1-27(2)22-38-47(69)62-42(51(75)76)31(6)44(66)59-36(16-13-21-56-52(54)55)46(68)58-35(18-17-28(3)23-29(4)40(77-9)24-33-14-11-10-12-15-33)30(5)43(65)60-37(50(73)74)19-20-41(64)63(8)39(26-78-25-34(53)49(71)72)48(70)57-32(7)45(67)61-38/h10-12,14-15,17-18,23,27,29-32,34-40,42H,13,16,19-22,24-26,53H2,1-9H3,(H,57,70)(H,58,68)(H,59,66)(H,60,65)(H,61,67)(H,62,69)(H,71,72)(H,73,74)(H,75,76)(H4,54,55,56)/b18-17+,28-23+/t29-,30-,31-,32+,34-,35-,36-,37+,38-,39?,40-,42+/m0/s1",VXYRNKOTKQZSDD-SZEQAKQOSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_2065,"[D-Leu1,Mdha-Cys7]MC-LR",,Microcystin,,C55H87N11O14S,1157.61547,O=C(N(C1([H])CSC[C@@H](C(O)=O)N)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](CC(C)C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C55H87N11O14S/c1-29(2)23-40-49(71)63-41(24-30(3)4)50(72)65-45(54(78)79)34(8)47(69)61-38(17-14-22-59-55(57)58)48(70)60-37(19-18-31(5)25-32(6)43(80-10)26-35-15-12-11-13-16-35)33(7)46(68)62-39(53(76)77)20-21-44(67)66(9)42(51(73)64-40)28-81-27-36(56)52(74)75/h11-13,15-16,18-19,25,29-30,32-34,36-43,45H,14,17,20-24,26-28,56H2,1-10H3,(H,60,70)(H,61,69)(H,62,68)(H,63,71)(H,64,73)(H,65,72)(H,74,75)(H,76,77)(H,78,79)(H4,57,58,59)/b19-18+,31-25+/t32-,33-,34-,36-,37-,38-,39+,40+,41-,42?,43-,45+/m0/s1",CMGBBWNITZBJCW-QRELNUNZSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2066,MC?RY,,Microcystin,,C52H72N10O13,1044.528033,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC3=CC=C(O)C=C3)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=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)58-38(15-12-24-55-52(53)54)48(69)61-43(51(73)74)31(4)45(66)60-40(49(70)57-37)26-35-17-19-36(63)20-18-35/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,57,70)(H,58,67)(H,59,65)(H,60,66)(H,61,69)(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",YCVNLMLOLNNEKI-GJRPNUFSSA-N,139597972,yes,n.a.,n.a.,n.a.
CyanoMetDB_2067,[Mdha-Cys7]MC-YR,,Microcystin,,C55H79N11O15S,1165.547782,O=C(N(C1([H])CSC[C@@H](C(O)=O)N)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C55H79N11O15S/c1-29(24-30(2)43(81-7)26-34-12-9-8-10-13-34)15-20-38-31(3)46(69)63-40(53(77)78)21-22-44(68)66(6)42(28-82-27-37(56)52(75)76)51(74)60-33(5)48(71)64-41(25-35-16-18-36(67)19-17-35)50(73)65-45(54(79)80)32(4)47(70)62-39(49(72)61-38)14-11-23-59-55(57)58/h8-10,12-13,15-20,24,30-33,37-43,45,67H,11,14,21-23,25-28,56H2,1-7H3,(H,60,74)(H,61,72)(H,62,70)(H,63,69)(H,64,71)(H,65,73)(H,75,76)(H,77,78)(H,79,80)(H4,57,58,59)/b20-15+,29-24+/t30-,31-,32-,33+,37-,38-,39-,40+,41-,42?,43-,45+/m0/s1",GCAHWPNUAYNFOD-PJRXKZDCSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_2068,"[D-Leu1,Mdha-Cys(O)7]MC-LR",,Microcystin,,C55H87N11O15S,1173.61038,O=C(N(C1([H])CS(C[C@@H](C(O)=O)N)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](CC(C)C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C55H87N11O15S/c1-29(2)23-40-49(71)63-41(24-30(3)4)50(72)65-45(54(78)79)34(8)47(69)61-38(17-14-22-59-55(57)58)48(70)60-37(19-18-31(5)25-32(6)43(81-10)26-35-15-12-11-13-16-35)33(7)46(68)62-39(53(76)77)20-21-44(67)66(9)42(51(73)64-40)28-82(80)27-36(56)52(74)75/h11-13,15-16,18-19,25,29-30,32-34,36-43,45H,14,17,20-24,26-28,56H2,1-10H3,(H,60,70)(H,61,69)(H,62,68)(H,63,71)(H,64,73)(H,65,72)(H,74,75)(H,76,77)(H,78,79)(H4,57,58,59)/b19-18+,31-25+/t32-,33-,34-,36-,37-,38-,39+,40+,41-,42?,43-,45+,82?/m0/s1",MTXIGOBZSPZTQX-CMHNIRSYSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2069,[Mdha-NAcCys7]MC-RR,,Microcystin,,C54H84N14O15S,1200.596129,O=C(N(C1([H])CSC[C@@H](C(O)=O)NC(C)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C54H84N14O15S/c1-28(24-29(2)41(83-8)25-34-14-10-9-11-15-34)18-19-35-30(3)44(71)66-38(50(77)78)20-21-42(70)68(7)40(27-84-26-39(51(79)80)62-33(6)69)49(76)61-32(5)46(73)65-37(17-13-23-60-54(57)58)48(75)67-43(52(81)82)31(4)45(72)64-36(47(74)63-35)16-12-22-59-53(55)56/h9-11,14-15,18-19,24,29-32,35-41,43H,12-13,16-17,20-23,25-27H2,1-8H3,(H,61,76)(H,62,69)(H,63,74)(H,64,72)(H,65,73)(H,66,71)(H,67,75)(H,77,78)(H,79,80)(H,81,82)(H4,55,56,59)(H4,57,58,60)/b19-18+,28-24+/t29-,30-,31-,32+,35-,36-,37-,38+,39-,40?,41-,43+/m0/s1",DNHZIEKBSAAFQR-KRMQMZFJSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2070,"[D-Leu1,Mdha-GluCys7]MC-LR",,Microcystin,,C60H94N12O17S,1286.65806,O=C(N(C1([H])CSC[C@@H](C(O)=O)NC(CC[C@H](N)C(O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](CC(C)C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C60H94N12O17S/c1-31(2)25-42-53(78)69-43(26-32(3)4)54(79)71-49(59(87)88)36(8)51(76)67-40(17-14-24-64-60(62)63)52(77)66-39(20-18-33(5)27-34(6)46(89-10)28-37-15-12-11-13-16-37)35(7)50(75)68-41(57(83)84)21-23-48(74)72(9)45(55(80)70-42)30-90-29-44(58(85)86)65-47(73)22-19-38(61)56(81)82/h11-13,15-16,18,20,27,31-32,34-36,38-46,49H,14,17,19,21-26,28-30,61H2,1-10H3,(H,65,73)(H,66,77)(H,67,76)(H,68,75)(H,69,78)(H,70,80)(H,71,79)(H,81,82)(H,83,84)(H,85,86)(H,87,88)(H4,62,63,64)/b20-18+,33-27+/t34-,35-,36-,38-,39-,40-,41+,42+,43-,44-,45?,46-,49+/m0/s1",WRJSBJQBDKYVCM-STYWWRLESA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2071,[Mdha-GSH7]MC-LR,MC-LR-GSH,Microcystin,,C59H91N13O18S,1301.632574,O=C(N(C1([H])CSC[C@@H](C(NCC(O)=O)=O)NC(CC[C@H](N)C(O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C59H91N13O18S/c1-30(2)24-41-54(82)71-48(58(88)89)34(6)50(78)68-39(16-13-23-63-59(61)62)53(81)67-38(19-17-31(3)25-32(4)44(90-9)26-36-14-11-10-12-15-36)33(5)49(77)69-40(57(86)87)20-22-46(74)72(8)43(55(83)65-35(7)51(79)70-41)29-91-28-42(52(80)64-27-47(75)76)66-45(73)21-18-37(60)56(84)85/h10-12,14-15,17,19,25,30,32-35,37-44,48H,13,16,18,20-24,26-29,60H2,1-9H3,(H,64,80)(H,65,83)(H,66,73)(H,67,81)(H,68,78)(H,69,77)(H,70,79)(H,71,82)(H,75,76)(H,84,85)(H,86,87)(H,88,89)(H4,61,62,63)/b19-17+,31-25+/t32-,33-,34-,35+,37-,38-,39-,40+,41-,42-,43?,44-,48+/m0/s1",VLOIKSDQZCUMEK-XUMORHROSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_2072,"[D-Leu1,Mdha-GluCys(O)7]MC-LR",,Microcystin,,C60H94N12O18S,1302.65297,O=C(N(C1([H])CS(C[C@@H](C(O)=O)NC(CC[C@H](N)C(O)=O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](CC(C)C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C60H94N12O18S/c1-31(2)25-42-53(78)69-43(26-32(3)4)54(79)71-49(59(87)88)36(8)51(76)67-40(17-14-24-64-60(62)63)52(77)66-39(20-18-33(5)27-34(6)46(90-10)28-37-15-12-11-13-16-37)35(7)50(75)68-41(57(83)84)21-23-48(74)72(9)45(55(80)70-42)30-91(89)29-44(58(85)86)65-47(73)22-19-38(61)56(81)82/h11-13,15-16,18,20,27,31-32,34-36,38-46,49H,14,17,19,21-26,28-30,61H2,1-10H3,(H,65,73)(H,66,77)(H,67,76)(H,68,75)(H,69,78)(H,70,80)(H,71,79)(H,81,82)(H,83,84)(H,85,86)(H,87,88)(H4,62,63,64)/b20-18+,33-27+/t34-,35-,36-,38-,39-,40-,41+,42+,43-,44-,45?,46-,49+,91?/m0/s1",KMKFAGRMGIMMRM-ZJDQKBGBSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2073,"[D-Asp3,Mdha-GSH7]MC-RR",[D-Asp3]MC-RR-GSH,Microcystin,,C58H90N16O18S,1330.633971,O=C(N(C1([H])CSC[C@@H](C(NCC(O)=O)=O)NC(CC[C@H](N)C(O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC(C[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C58H90N16O18S/c1-30(24-31(2)43(92-6)25-34-12-8-7-9-13-34)16-18-36-32(3)48(80)72-39(55(88)89)19-21-46(77)74(5)42(29-93-28-41(50(82)66-27-47(78)79)69-44(75)20-17-35(59)54(86)87)53(85)67-33(4)49(81)71-38(15-11-23-65-58(62)63)52(84)73-40(56(90)91)26-45(76)68-37(51(83)70-36)14-10-22-64-57(60)61/h7-9,12-13,16,18,24,31-33,35-43H,10-11,14-15,17,19-23,25-29,59H2,1-6H3,(H,66,82)(H,67,85)(H,68,76)(H,69,75)(H,70,83)(H,71,81)(H,72,80)(H,73,84)(H,78,79)(H,86,87)(H,88,89)(H,90,91)(H4,60,61,64)(H4,62,63,65)/b18-16+,30-24+/t31-,32-,33+,35-,36-,37-,38-,39+,40+,41-,42?,43-/m0/s1",PXEOFGCLNPSOIR-AJXKSCHMSA-N,146684920,no,Planktothrix,prolifica,NIVA-CYA 544
CyanoMetDB_2074,"[D-Leu1,Mdha-GSH7]MC-LR",,Microcystin,,C62H97N13O18S,1343.67952,O=C(N(C1([H])CSC[C@@H](C(NCC(O)=O)=O)NC(CC[C@H](N)C(O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](CC(C)C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C62H97N13O18S/c1-32(2)25-43-56(84)72-44(26-33(3)4)57(85)74-51(61(91)92)37(8)53(81)70-41(17-14-24-66-62(64)65)55(83)69-40(20-18-34(5)27-35(6)47(93-10)28-38-15-12-11-13-16-38)36(7)52(80)71-42(60(89)90)21-23-49(77)75(9)46(58(86)73-43)31-94-30-45(54(82)67-29-50(78)79)68-48(76)22-19-39(63)59(87)88/h11-13,15-16,18,20,27,32-33,35-37,39-47,51H,14,17,19,21-26,28-31,63H2,1-10H3,(H,67,82)(H,68,76)(H,69,83)(H,70,81)(H,71,80)(H,72,84)(H,73,86)(H,74,85)(H,78,79)(H,87,88)(H,89,90)(H,91,92)(H4,64,65,66)/b20-18+,34-27+/t35-,36-,37-,39-,40-,41-,42+,43+,44-,45-,46?,47-,51+/m0/s1",MVFPUYGZNZXUAN-HSROGDTGSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2075,[ADMAdda5]MC?RR,,Microcystin,,C50H75N13O13,1065.5607,O=C(N(C)C(C(N[C@H](C)C1=O)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC(C)=O)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C50H75N13O13/c1-26(24-27(2)38(76-32(7)64)25-33-14-10-9-11-15-33)18-19-34-28(3)41(66)61-37(47(72)73)20-21-39(65)63(8)31(6)44(69)57-30(5)43(68)60-36(17-13-23-56-50(53)54)46(71)62-40(48(74)75)29(4)42(67)59-35(45(70)58-34)16-12-22-55-49(51)52/h9-11,14-15,18-19,24,27-30,34-38,40H,6,12-13,16-17,20-23,25H2,1-5,7-8H3,(H,57,69)(H,58,70)(H,59,67)(H,60,68)(H,61,66)(H,62,71)(H,72,73)(H,74,75)(H4,51,52,55)(H4,53,54,56)/b19-18+,26-24+/t27-,28-,29-,30+,34-,35-,36-,37+,38-,40+/m0/s1",XRUQQFIWAFYUJA-SXWZSMJNSA-N,146684855,no,n.a.,n.a.,n.a.
CyanoMetDB_2076,[Mdha-GSH7]MC-YR,MC-YR-GSH,Microcystin,,C62H89N13O19S,1351.611839,O=C(N(C1([H])CSC[C@@H](C(NCC(O)=O)=O)NC(CC[C@H](N)C(O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](C)NC1=O)=O)CC3=CC=C(O)C=C3)=O)=O)=O)=O,"InChI=1S/C62H89N13O19S/c1-32(26-33(2)47(94-7)28-37-12-9-8-10-13-37)15-21-41-34(3)52(81)72-43(60(90)91)22-24-49(78)75(6)46(31-95-30-45(55(84)67-29-50(79)80)69-48(77)23-20-40(63)59(88)89)58(87)68-36(5)54(83)73-44(27-38-16-18-39(76)19-17-38)57(86)74-51(61(92)93)35(4)53(82)71-42(56(85)70-41)14-11-25-66-62(64)65/h8-10,12-13,15-19,21,26,33-36,40-47,51,76H,11,14,20,22-25,27-31,63H2,1-7H3,(H,67,84)(H,68,87)(H,69,77)(H,70,85)(H,71,82)(H,72,81)(H,73,83)(H,74,86)(H,79,80)(H,88,89)(H,90,91)(H,92,93)(H4,64,65,66)/b21-15+,32-26+/t33-,34-,35-,36+,40-,41-,42-,43+,44-,45-,46?,47-,51+/m0/s1",CKZRRTHAVWEPNI-ZXQDSRFFSA-N,,yes,n.a.,n.a.,n.a.
CyanoMetDB_2077,"[D-Leu1,Mdha-GS(O)H7]MC-LR",,Microcystin,,C62H97N13O19S,1359.67444,O=C(N(C1([H])CS(C[C@@H](C(NCC(O)=O)=O)NC(CC[C@H](N)C(O)=O)=O)=O)C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC([C@@H](CC(C)C)NC1=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C62H97N13O19S/c1-32(2)25-43-56(84)72-44(26-33(3)4)57(85)74-51(61(91)92)37(8)53(81)70-41(17-14-24-66-62(64)65)55(83)69-40(20-18-34(5)27-35(6)47(94-10)28-38-15-12-11-13-16-38)36(7)52(80)71-42(60(89)90)21-23-49(77)75(9)46(58(86)73-43)31-95(93)30-45(54(82)67-29-50(78)79)68-48(76)22-19-39(63)59(87)88/h11-13,15-16,18,20,27,32-33,35-37,39-47,51H,14,17,19,21-26,28-31,63H2,1-10H3,(H,67,82)(H,68,76)(H,69,83)(H,70,81)(H,71,80)(H,72,84)(H,73,86)(H,74,85)(H,78,79)(H,87,88)(H,89,90)(H,91,92)(H4,64,65,66)/b20-18+,34-27+/t35-,36-,37-,39-,40-,41-,42+,43+,44-,45-,46?,47-,51+,95?/m0/s1",BHNCNWZXUZEONF-YNKVSUOUSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2078,[D-Asp3]MC-RE,,Microcystin,,C47H68N10O14,996.4916469,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCC(O)=O)NC(C[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C47H68N10O14/c1-25(22-26(2)36(71-7)23-30-12-9-8-10-13-30)15-16-31-27(3)40(62)55-34(45(67)68)17-19-38(59)57(6)29(5)42(64)51-28(4)41(63)54-32(14-11-21-50-47(48)49)43(65)56-35(46(69)70)24-37(58)52-33(44(66)53-31)18-20-39(60)61/h8-10,12-13,15-16,22,26-28,31-36H,5,11,14,17-21,23-24H2,1-4,6-7H3,(H,51,64)(H,52,58)(H,53,66)(H,54,63)(H,55,62)(H,56,65)(H,60,61)(H,67,68)(H,69,70)(H4,48,49,50)/b16-15+,25-22+/t26-,27-,28+,31-,32-,33-,34+,35+,36-/m0/s1",UPXKDXCMCOZZFB-KAXOOBBASA-N,146684957,no,Microcystis,n.a.,AB2017/15
CyanoMetDB_2079,MC-RE,,Microcystin,,C48H70N10O14,1010.507297,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCC(O)=O)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C48H70N10O14/c1-25(23-26(2)36(72-8)24-31-13-10-9-11-14-31)16-17-32-27(3)40(62)56-35(46(68)69)18-20-37(59)58(7)30(6)43(65)52-29(5)42(64)55-33(15-12-22-51-48(49)50)45(67)57-39(47(70)71)28(4)41(63)54-34(44(66)53-32)19-21-38(60)61/h9-11,13-14,16-17,23,26-29,32-36,39H,6,12,15,18-22,24H2,1-5,7-8H3,(H,52,65)(H,53,66)(H,54,63)(H,55,64)(H,56,62)(H,57,67)(H,60,61)(H,68,69)(H,70,71)(H4,49,50,51)/b17-16+,25-23+/t26-,27-,28-,29+,32-,33-,34-,35+,36-,39+/m0/s1",KGCDSBLLONXKBZ-CGABAVKJSA-N,146684958,no,Microcystis,n.a.,"AB2017/14, AB2017/15"
CyanoMetDB_2080,MC-(H2)YG,,Microcystin,,C48H65N7O13,947.4640352,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC(CNC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC[C@@H](O)C=C3)=O)=O)=O)=O,"InChI=1S/C48H65N7O13/c1-26(22-27(2)38(68-8)24-32-12-10-9-11-13-32)14-19-35-28(3)43(60)52-36(47(64)65)20-21-40(58)55(7)31(6)45(62)50-30(5)44(61)53-37(23-33-15-17-34(56)18-16-33)46(63)54-41(48(66)67)29(4)42(59)49-25-39(57)51-35/h9-17,19,22,27-30,34-38,41,56H,6,18,20-21,23-25H2,1-5,7-8H3,(H,49,59)(H,50,62)(H,51,57)(H,52,60)(H,53,61)(H,54,63)(H,64,65)(H,66,67)/b19-14+,26-22+/t27-,28-,29-,30+,34-,35-,36+,37-,38-,41+/m0/s1",ZZJCPJLRGNEYDX-DELIWHFPSA-N,146684959,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_2081,MC-RM,,Microcystin,,C48H72N10O12S,1012.505189,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCSC)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C48H72N10O12S/c1-26(24-27(2)37(70-8)25-32-14-11-10-12-15-32)17-18-33-28(3)40(60)56-36(46(66)67)19-20-38(59)58(7)31(6)43(63)52-30(5)42(62)55-34(16-13-22-51-48(49)50)45(65)57-39(47(68)69)29(4)41(61)54-35(21-23-71-9)44(64)53-33/h10-12,14-15,17-18,24,27-30,33-37,39H,6,13,16,19-23,25H2,1-5,7-9H3,(H,52,63)(H,53,64)(H,54,61)(H,55,62)(H,56,60)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,26-24+/t27-,28-,29-,30+,33-,34-,35-,36+,37-,39+/m0/s1",GCIDJNJNMDMVFQ-MCUDKQGFSA-N,146684960,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_2082,MC-(H2)YA,,Microcystin,,C49H67N7O13,961.4796852,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC[C@@H](O)C=C3)=O)=O)=O)=O,"InChI=1S/C49H67N7O13/c1-26(23-27(2)39(69-9)25-33-13-11-10-12-14-33)15-20-36-28(3)42(59)53-37(48(65)66)21-22-40(58)56(8)32(7)46(63)51-31(6)45(62)54-38(24-34-16-18-35(57)19-17-34)47(64)55-41(49(67)68)29(4)43(60)50-30(5)44(61)52-36/h10-18,20,23,27-31,35-39,41,57H,7,19,21-22,24-25H2,1-6,8-9H3,(H,50,60)(H,51,63)(H,52,61)(H,53,59)(H,54,62)(H,55,64)(H,65,66)(H,67,68)/b20-15+,26-23+/t27-,28-,29-,30-,31+,35-,36-,37+,38-,39-,41+/m0/s1",YEHMHZLOSXGLLR-NMBLAQOHSA-N,146684961,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_2083,MC-EE,,Microcystin,,C47H65N7O16,983.448779,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCC(O)=O)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCC(O)=O)=O)=O)=O)=O,"InChI=1S/C47H65N7O16/c1-24(22-25(2)35(70-8)23-30-12-10-9-11-13-30)14-15-31-26(3)40(60)52-34(46(66)67)16-19-36(55)54(7)29(6)43(63)48-28(5)42(62)51-33(18-21-38(58)59)45(65)53-39(47(68)69)27(4)41(61)50-32(44(64)49-31)17-20-37(56)57/h9-15,22,25-28,31-35,39H,6,16-21,23H2,1-5,7-8H3,(H,48,63)(H,49,64)(H,50,61)(H,51,62)(H,52,60)(H,53,65)(H,56,57)(H,58,59)(H,66,67)(H,68,69)/b15-14+,24-22+/t25-,26-,27-,28+,31-,32-,33-,34+,35-,39+/m0/s1",DRSTXSHKTFWNFL-CUTXYPRISA-N,146684962,no,Microcystis,n.a.,"AB2017/14, AB2017/15"
CyanoMetDB_2084,[Asp3]MC-LE,,Microcystin,,C47H67N7O14,953.4745999,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCC(O)=O)NC(C[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C47H67N7O14/c1-25(2)21-35-45(63)53-36(47(66)67)24-38(55)49-33(18-20-40(57)58)44(62)50-32(16-15-26(3)22-27(4)37(68-9)23-31-13-11-10-12-14-31)28(5)41(59)51-34(46(64)65)17-19-39(56)54(8)30(7)43(61)48-29(6)42(60)52-35/h10-16,22,25,27-29,32-37H,7,17-21,23-24H2,1-6,8-9H3,(H,48,61)(H,49,55)(H,50,62)(H,51,59)(H,52,60)(H,53,63)(H,57,58)(H,64,65)(H,66,67)/b16-15+,26-22+/t27-,28-,29+,32-,33-,34+,35-,36+,37-/m0/s1",HQMYLLJIOJVPHJ-DLGNEXPNSA-N,146684963,no,Microcystis,n.a.,"AB2017/14, AB2017/15"
CyanoMetDB_2085,MC-LE,,Microcystin,,C48H69N7O14,967.4902499,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCC(O)=O)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C48H69N7O14/c1-25(2)22-36-46(64)54-40(48(67)68)29(6)42(60)51-34(19-21-39(57)58)45(63)50-33(17-16-26(3)23-27(4)37(69-10)24-32-14-12-11-13-15-32)28(5)41(59)52-35(47(65)66)18-20-38(56)55(9)31(8)44(62)49-30(7)43(61)53-36/h11-17,23,25,27-30,33-37,40H,8,18-22,24H2,1-7,9-10H3,(H,49,62)(H,50,63)(H,51,60)(H,52,59)(H,53,61)(H,54,64)(H,57,58)(H,65,66)(H,67,68)/b17-16+,26-23+/t27-,28-,29-,30+,33-,34-,35+,36-,37-,40+/m0/s1",OYGLUIQXUNEURB-BRMCJMJMSA-N,146684964,no,Microcystis,n.a.,"AB2017/14, AB2017/15"
CyanoMetDB_2086,MC-HilA,,Microcystin,,C47H69N7O12,923.5004207,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)C[C@@H](C)CC)=O)=O)=O)=O,"InChI=1S/C47H69N7O12/c1-12-25(2)23-36-45(61)53-39(47(64)65)29(6)41(57)48-30(7)42(58)50-34(19-18-26(3)22-27(4)37(66-11)24-33-16-14-13-15-17-33)28(5)40(56)51-35(46(62)63)20-21-38(55)54(10)32(9)44(60)49-31(8)43(59)52-36/h13-19,22,25,27-31,34-37,39H,9,12,20-21,23-24H2,1-8,10-11H3,(H,48,57)(H,49,60)(H,50,58)(H,51,56)(H,52,59)(H,53,61)(H,62,63)(H,64,65)/b19-18+,26-22+/t25-,27-,28-,29-,30-,31+,34-,35+,36-,37-,39+/m0/s1",WWIGXTSAJMYWND-JSIJJRETSA-N,146684965,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_2087,MC-HilAba,MC-HilAbu,Microcystin,,C48H71N7O12,937.5160707,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CC)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)C[C@@H](C)CC)=O)=O)=O)=O,"InChI=1S/C48H71N7O12/c1-12-26(3)24-37-46(62)54-40(48(65)66)30(7)42(58)50-34(13-2)45(61)51-35(20-19-27(4)23-28(5)38(67-11)25-33-17-15-14-16-18-33)29(6)41(57)52-36(47(63)64)21-22-39(56)55(10)32(9)44(60)49-31(8)43(59)53-37/h14-20,23,26,28-31,34-38,40H,9,12-13,21-22,24-25H2,1-8,10-11H3,(H,49,60)(H,50,58)(H,51,61)(H,52,57)(H,53,59)(H,54,62)(H,63,64)(H,65,66)/b20-19+,27-23+/t26-,28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1",RHSLRMNOYRZULY-LKKIUZQFSA-N,146684966,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_2088,MC-FV,,Microcystin,,C51H69N7O12,971.5004207,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](C(C)C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CC=CC=C3)=O)=O)=O)=O,"InChI=1S/C51H69N7O12/c1-28(2)42-49(65)53-37(22-21-29(3)25-30(4)40(70-10)27-36-19-15-12-16-20-36)31(5)44(60)54-38(50(66)67)23-24-41(59)58(9)34(8)47(63)52-33(7)46(62)55-39(26-35-17-13-11-14-18-35)48(64)57-43(51(68)69)32(6)45(61)56-42/h11-22,25,28,30-33,37-40,42-43H,8,23-24,26-27H2,1-7,9-10H3,(H,52,63)(H,53,65)(H,54,60)(H,55,62)(H,56,61)(H,57,64)(H,66,67)(H,68,69)/b22-21+,29-25+/t30-,31-,32-,33+,37-,38+,39-,40-,42-,43+/m0/s1",WUWYXSBHLMCHEO-LKCZJABDSA-N,146684967,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_2089,MC-WV,,Microcystin,,C53H70N8O12,1010.51132,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](C(C)C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC3=CNC4=C3C=CC=C4)=O)=O)=O)=O,"InChI=1S/C53H70N8O12/c1-28(2)44-51(68)56-38(21-20-29(3)24-30(4)42(73-10)25-35-16-12-11-13-17-35)31(5)46(63)57-40(52(69)70)22-23-43(62)61(9)34(8)49(66)55-33(7)48(65)58-41(26-36-27-54-39-19-15-14-18-37(36)39)50(67)60-45(53(71)72)32(6)47(64)59-44/h11-21,24,27-28,30-33,38,40-42,44-45,54H,8,22-23,25-26H2,1-7,9-10H3,(H,55,66)(H,56,68)(H,57,63)(H,58,65)(H,59,64)(H,60,67)(H,69,70)(H,71,72)/b21-20+,29-24+/t30-,31-,32-,33+,38-,40+,41-,42-,44-,45+/m0/s1",UFZRCMUIGPFEPT-CGEDUOAOSA-N,146684968,no,Microcystis,n.a.,AB2017/14
CyanoMetDB_2092,Anabaenopeptin SA3,,Anabaenopeptin,,C42H62N8O9,822.4639756,C[C@H]1C(N[C@@H](CC2=CC=CC=C2)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CCCCN)=O)C(N[C@H]([C@H](CC)C)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N1C)=O)=O)=O)=O)=O,"InChI=1S/C42H62N8O9/c1-5-26(2)35-39(55)45-32(22-19-28-17-20-30(51)21-18-28)40(56)50(4)27(3)36(52)46-34(25-29-13-7-6-8-14-29)37(53)44-24-12-10-15-31(38(54)49-35)47-42(59)48-33(41(57)58)16-9-11-23-43/h6-8,13-14,17-18,20-21,26-27,31-35,51H,5,9-12,15-16,19,22-25,43H2,1-4H3,(H,44,53)(H,45,55)(H,46,52)(H,49,54)(H,57,58)(H2,47,48,59)/t26-,27-,31+,32-,33-,34-,35+/m0/s1",VXDTUDXDNVURTN-RXEGNQFLSA-N,146684910,yes,Planktothrix,rubescens,CBT344
CyanoMetDB_2093,Anabaenopeptin SA5,,Anabaenopeptin,,C43H62N8O9,834.4639756,O=C(N[C@@H](CC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)[C@H](C)CC)=O)C(N[C@@H](C(C)C)C(N[C@H]2CCCC3=CC=CC=C3)=O)=O)=O)[C@H](CC(N)=O)N(C)C2=O,"InChI=1S/C43H62N8O9/c1-6-27(4)36(42(58)59)50-43(60)48-30-21-13-14-23-45-37(53)32(24-29-18-11-8-12-19-29)47-39(55)33(25-34(44)52)51(5)41(57)31(22-15-20-28-16-9-7-10-17-28)46-40(56)35(26(2)3)49-38(30)54/h7-12,16-19,26-27,30-33,35-36H,6,13-15,20-25H2,1-5H3,(H2,44,52)(H,45,53)(H,46,56)(H,47,55)(H,49,54)(H,58,59)(H2,48,50,60)/t27-,30-,31+,32+,33+,35+,36+/m1/s1",KVYLYUVJJLXIHV-VHLFBZMTSA-N,146684912,yes,Nostoc,insulare,CBT163
CyanoMetDB_2094,Anabaenopeptin SA6,,Anabaenopeptin,,C43H62N8O9,834.4639756,O=C(N[C@@H](CC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)[C@H](C)CC)=O)C(N[C@@H]([C@@H](CC)C)C(N[C@H]2CCC3=CC=CC=C3)=O)=O)=O)[C@H](CC(N)=O)N(C)C2=O,"InChI=1S/C43H62N8O9/c1-6-26(3)35-40(56)46-31(22-21-28-16-10-8-11-17-28)41(57)51(5)33(25-34(44)52)39(55)47-32(24-29-18-12-9-13-19-29)37(53)45-23-15-14-20-30(38(54)49-35)48-43(60)50-36(42(58)59)27(4)7-2/h8-13,16-19,26-27,30-33,35-36H,6-7,14-15,20-25H2,1-5H3,(H2,44,52)(H,45,53)(H,46,56)(H,47,55)(H,49,54)(H,58,59)(H2,48,50,60)/t26-,27-,30-,31+,32+,33+,35+,36+/m1/s1",CSCVQSXGGVJLJI-KEXVFTQYSA-N,146684913,yes,Nostoc,n.a.,CBT599
CyanoMetDB_2095,Anabaenopeptin SA12,,Anabaenopeptin,,C44H57N7O10,843.4166911,O=C(N[C@@H](CCC1=CC=C(O)C=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC2=CC=CC=C2)=O)C(N[C@@H](C(C)C)C(N[C@H]3CCC4=CC=C(O)C=C4)=O)=O)=O)CN(C)C3=O,"InChI=1S/C44H57N7O10/c1-27(2)38-41(57)47-35(23-17-29-14-20-32(53)21-15-29)42(58)51(3)26-37(54)46-34(22-16-28-12-18-31(52)19-13-28)39(55)45-24-8-7-11-33(40(56)50-38)48-44(61)49-36(43(59)60)25-30-9-5-4-6-10-30/h4-6,9-10,12-15,18-21,27,33-36,38,52-53H,7-8,11,16-17,22-26H2,1-3H3,(H,45,55)(H,46,54)(H,47,57)(H,50,56)(H,59,60)(H2,48,49,61)/t33-,34+,35+,36+,38+/m1/s1",AKTQIVLQGNQCFP-BEJGRMFCSA-N,146684907,yes,Nostoc ,n.a.,ATCC 53789
CyanoMetDB_2096,Anabaenopeptin SA13,,Anabaenopeptin,,C44H57N7O11,859.4116057,O=C(N[C@@H](CC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC2=CC=C(O)C=C2)=O)C(N[C@H](C(C)C)C(N[C@@H](CCC3=CC=C(O)C=C3)C(N4C)=O)=O)=O)=O)[C@@H]4CO,"InChI=1S/C44H57N7O11/c1-26(2)37-41(58)46-33(21-16-27-12-17-30(53)18-13-27)42(59)51(3)36(25-52)40(57)47-34(23-28-9-5-4-6-10-28)38(55)45-22-8-7-11-32(39(56)50-37)48-44(62)49-35(43(60)61)24-29-14-19-31(54)20-15-29/h4-6,9-10,12-15,17-20,26,32-37,52-54H,7-8,11,16,21-25H2,1-3H3,(H,45,55)(H,46,58)(H,47,57)(H,50,56)(H,60,61)(H2,48,49,62)/t32-,33+,34+,35+,36+,37-/",CLWDXSBJHCGWOQ-OBWIRWOGSA-N,146684908,yes,Planktothrix,rubescens,CBT344
CyanoMetDB_2097,Anabaenopeptin SA7,,Anabaenopeptin,,C44H64N8O9,848.4796257,O=C(N[C@@H](CC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)[C@H](C)CC)=O)C(N[C@H]([C@H](CC)C)C(N[C@@H](CCCC2=CC=CC=C2)C(N3C)=O)=O)=O)=O)[C@@H]3CC(N)=O,"InChI=1S/C44H64N8O9/c1-6-27(3)36-41(57)47-32(23-16-21-29-17-10-8-11-18-29)42(58)52(5)34(26-35(45)53)40(56)48-33(25-30-19-12-9-13-20-30)38(54)46-24-15-14-22-31(39(55)50-36)49-44(61)51-37(43(59)60)28(4)7-2/h8-13,17-20,27-28,31-34,36-37H,6-7,14-16,21-26H2,1-5H3,(H2,45,53)(H,46,54)(H,47,57)(H,48,56)(H,50,55)(H,59,60)(H2,49,51,61)/t27-,28+,31+,32-,33-,34-,36+,37-/m0/s1",XFZXMMBSPZFCNM-CQRCMTKCSA-N,146684914,yes,Nostoc ,calcicola ,CBT158
CyanoMetDB_2098,Anabaenopeptin SA1,,Anabaenopeptin,,C44H65N11O9,891.4966728,O=C(N[C@@H](CC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CCCNC(N)=N)=O)C(N[C@H]([C@H](CC)C)C(N[C@@H](CCCC2=CC=CC=C2)C(N3C)=O)=O)=O)=O)[C@@H]3CC(N)=O,"InChI=1S/C44H65N11O9/c1-4-27(2)36-40(60)50-31(21-13-19-28-15-7-5-8-16-28)41(61)55(3)34(26-35(45)56)39(59)51-33(25-29-17-9-6-10-18-29)37(57)48-23-12-11-20-30(38(58)54-36)52-44(64)53-32(42(62)63)22-14-24-49-43(46)47/h5-10,15-18,27,30-34,36H,4,11-14,19-26H2,1-3H3,(H2,45,56)(H,48,57)(H,50,60)(H,51,59)(H,54,58)(H,62,63)(H4,46,47,49)(H2,52,53,64)/t27-,30+,31-,32-,33-,34-,36+/m0/s1",VZGKHWSNGYZZFL-CFRIRIKTSA-N,146684904,yes,Nostoc ,calcicola ,CBT158
CyanoMetDB_2099,Anabaenopeptin SA4,,Anabaenopeptin,,C44H65N9O9,863.4905247,O=C(N[C@@H](CC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CCCCN)=O)C(N[C@@H](C(CC)C)C(N[C@H]2CCCC3=CC=CC=C3)=O)=O)=O)[C@H](CC(N)=O)N(C)C2=O,"InChI=1S/C44H65N9O9/c1-4-28(2)37-41(58)48-32(23-15-20-29-16-7-5-8-17-29)42(59)53(3)35(27-36(46)54)40(57)49-34(26-30-18-9-6-10-19-30)38(55)47-25-14-12-21-31(39(56)52-37)50-44(62)51-33(43(60)61)22-11-13-24-45/h5-10,16-19,28,31-35,37H,4,11-15,20-27,45H2,1-3H3,(H2,46,54)(H,47,55)(H,48,58)(H,49,57)(H,52,56)(H,60,61)(H2,50,51,62)/t28?,31-,32+,33+,34+,35+,37+/m1/s1",JSOIQLMWACYOFN-UFKBWYCDSA-N,146684911,yes,Nostoc,insulare,CBT163
CyanoMetDB_2100,Anabaenopeptin SA10,,Anabaenopeptin,,C45H56ClN7O10,889.3777188,O=C(N[C@@H](CCC1=CC(Cl)=C(O)C=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC2=CC=CC=C2)=O)C(N[C@H](C(C)C)C(N[C@H]3CCC4=CC=C(O)C=C4)=O)=O)=O)CN(C)C3=O,"InChI=1S/C44H56ClN7O10/c1-26(2)38-41(58)48-34(20-14-27-12-17-30(53)18-13-27)42(59)52(3)25-37(55)47-33(19-15-29-16-21-36(54)31(45)23-29)39(56)46-22-8-7-11-32(40(57)51-38)49-44(62)50-35(43(60)61)24-28-9-5-4-6-10-28/h4-6,9-10,12-13,16-18,21,23,26,32-35,38,53-54H,7-8,11,14-15,19-20,22,24-25H2,1-3H3,(H,46,56)(H,47,55)(H,48,58)(H,51,57)(H,60,61)(H2,49,50,62)/t32-,33+,34+,35+,38-/m1/s1",WOIGHBADSHJGAI-JVCFYIMBSA-N,146684905,yes,Nostoc ,n.a.,ATCC 53789
CyanoMetDB_2101,Anabaenopeptin SA11,,Anabaenopeptin,,C45H58ClN7O10,891.3933688,O=C(N[C@@H](CCC1=CC(Cl)=C(O)C=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC2=CC=CC=C2)=O)C(NC([C@@H](CC)C)C(N[C@H]3CCC4=CC=C(O)C=C4)=O)=O)=O)CN(C)C3=O,"InChI=1S/C45H58ClN7O10/c1-4-27(2)39-42(59)49-35(21-15-28-13-18-31(54)19-14-28)43(60)53(3)26-38(56)48-34(20-16-30-17-22-37(55)32(46)24-30)40(57)47-23-9-8-12-33(41(58)52-39)50-45(63)51-36(44(61)62)25-29-10-6-5-7-11-29/h5-7,10-11,13-14,17-19,22,24,27,33-36,39,54-55H,4,8-9,12,15-16,20-21,23,25-26H2,1-3H3,(H,47,57)(H,48,56)(H,49,59)(H,52,58)(H,61,62)(H2,50,51,63)/t27-,33-,34+,35+,36+,39?/m1/s1",UXQIEZUCKOUNCO-ADGXWODGSA-N,146684906,yes,Nostoc ,n.a.,ATCC 53789
CyanoMetDB_2102,Anabaenopeptin SA9,,Anabaenopeptin,,C45H58ClN7O9,875.3984542,O=C(N[C@@H](CCC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)CC2=CC=CC=C2)=O)C(NC([C@@H](CC)C)C(N[C@H]3CCC4=CC=C(O)C(Cl)=C4)=O)=O)=O)CN(C)C3=O,"InChI=1S/C45H58ClN7O9/c1-4-28(2)39-42(58)49-35(22-19-31-20-23-37(54)32(46)25-31)43(59)53(3)27-38(55)48-34(21-18-29-13-7-5-8-14-29)40(56)47-24-12-11-17-33(41(57)52-39)50-45(62)51-36(44(60)61)26-30-15-9-6-10-16-30/h5-10,13-16,20,23,25,28,33-36,39,54H,4,11-12,17-19,21-22,24,26-27H2,1-3H3,(H,47,56)(H,48,55)(H,49,58)(H,52,57)(H,60,61)(H2,50,51,62)/t28-,33-,34+,35+,36+,39?/m1/s1",LUFQICSUKUWVRP-MNARVTDESA-N,146684916,yes,Nostoc ,n.a.,ATCC 53789
CyanoMetDB_2103,Anabaenopeptin SA8,,Anabaenopeptin,,C45H66N8O9,862.4952758,O=C(N[C@@H](CC1=CC=CC=C1)C(NCCCC[C@@H](NC(N[C@H](C(O)=O)[C@H](C)CC)=O)C(N[C@H]([C@H](CC)C)C(N[C@@H](CCCCC2=CC=CC=C2)C(N3C)=O)=O)=O)=O)[C@@H]3CC(N)=O,"InChI=1S/C45H66N8O9/c1-6-28(3)37-42(58)48-33(24-15-14-20-30-18-10-8-11-19-30)43(59)53(5)35(27-36(46)54)41(57)49-34(26-31-21-12-9-13-22-31)39(55)47-25-17-16-23-32(40(56)51-37)50-45(62)52-38(44(60)61)29(4)7-2/h8-13,18-19,21-22,28-29,32-35,37-38H,6-7,14-17,20,23-27H2,1-5H3,(H2,46,54)(H,47,55)(H,48,58)(H,49,57)(H,51,56)(H,60,61)(H2,50,52,62)/t28-,29+,32+,33-,34-,35-,37+,38-/m0/s1",JLWBGMDBXPZRMZ-USASGOJWSA-N,146684915,yes,Nostoc ,calcicola ,CBT158
CyanoMetDB_2104,trans-Dihydroanatoxin-a,"2,3-Dihydroanatoxin-a, H2-ATX",Anatoxin-a,,C10H17NO,167.131,CC([C@H]1[C@H]2CC[C@H](N2)CCC1)=O,"InChI=1S/C10H17NO/c1-7(12)9-4-2-3-8-5-6-10(9)11-8/h8-11H,2-6H2,1H3/t8-,9+,10-/m1/s1",MBXOLPUMNTXLOV-KXUCPTDWSA-N,93498895,yes,n.a.,n.a.,n.a.
CyanoMetDB_2105,trans-Dihydrohomoanatoxin-a,"2,3-Dihydrohomoanatoxin-a, H2-hATX",Anatoxin-a,,C11H19NO,181.1467,O=C(CC)[C@H]1[C@H]2CC[C@H](N2)CCC1,"InChI=1S/C11H19NO/c1-2-11(13)9-5-3-4-8-6-7-10(9)12-8/h8-10,12H,2-7H2,1H3/t8-,9-,10-/m1/s1",MVXJVRNMGNXROR-OPRDCNLKSA-N,146684746,yes,n.a.,n.a.,n.a.
CyanoMetDB_2106,Cyanopeptolin 911,,Cyanopeptolin,,C39H61N9O14S,911.4058685,O=C(C(NC(C(O)COS(=O)(O)=O)=O)C(C)OC1=O)NC(C(NC2C(N(C(CC2)O)C(CC(C)C)C(N(C)C(CC3=CC=CC=C3)C(NC1C(C)C)=O)=O)=O)=O)CCCNC(N)=N,"InChI=1S/C39H61N9O14S/c1-20(2)17-27-37(56)47(6)26(18-23-11-8-7-9-12-23)33(52)45-30(21(3)4)38(57)62-22(5)31(46-34(53)28(49)19-61-63(58,59)60)35(54)43-24(13-10-16-42-39(40)41)32(51)44-25-14-15-29(50)48(27)36(25)55/h7-9,11-12,20-22,24-31,49-50H,10,13-19H2,1-6H3,(H,43,54)(H,44,51)(H,45,52)(H,46,53)(H4,40,41,42)(H,58,59,60)",VEXSXZZUUJNXII-UHFFFAOYSA-N,146684711,no,n.a.,n.a.,n.a.
CyanoMetDB_2107,Cyanopeptolin 1032,,Cyanopeptolin,,C49H74ClN9O13,1031.509461,O=C1N2C(CCC1NC(C(NC(C(C(C)OC(C(NC(C(N(C(C2CC(C)C)=O)C)CC3=CC=C(C(Cl)=C3)O)=O)CC(C)C)=O)NC(C(CCC(N)=O)NC(C4N(CCC4)C(C)=O)=O)=O)=O)CC(C)C)=O)O,"InChI=1S/C49H74ClN9O13/c1-24(2)19-33-43(65)53-32-14-17-40(63)59(47(32)69)37(21-26(5)6)48(70)57(9)36(23-29-12-15-38(61)30(50)22-29)45(67)55-34(20-25(3)4)49(71)72-27(7)41(46(68)54-33)56-42(64)31(13-16-39(51)62)52-44(66)35-11-10-18-58(35)28(8)60/h12,15,22,24-27,31-37,40-41,61,63H,10-11,13-14,16-21,23H2,1-9H3,(H2,51,62)(H,52,66)(H,53,65)(H,54,68)(H,55,67)(H,56,64)",KCIPOWIHXZMDTK-UHFFFAOYSA-N,146684822,no,n.a.,n.a.,n.a.
CyanoMetDB_2108,Grassystatin F,,other linear peptide,linear depsipeptide,C59H91N9O13,1133.6736,CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)OC(=O)[C@H](CC3=CC=CC=C3)N(C)C)O,"InChI=1S/C59H91N9O13/c1-14-37(6)51(54(74)61-38(7)55(75)67(12)46(32-40-22-17-15-18-23-40)57(77)68-29-21-26-45(68)58(78)80-13)64-50(71)34-48(69)42(30-35(2)3)62-53(73)44(27-28-49(60)70)66(11)56(76)43(31-36(4)5)63-52(72)39(8)81-59(79)47(65(9)10)33-41-24-19-16-20-25-41/h15-20,22-25,35-39,42-48,51,69H,14,21,26-34H2,1-13H3,(H2,60,70)(H,61,74)(H,62,73)(H,63,72)(H,64,71)/t37-,38-,39-,42-,43-,44-,45-,46+,47-,48-,51-/m0/s1",FVCUETVFTFPUEO-CHLGYZHBSA-N,139589856,yes,n.a.,n.a.,n.a.
CyanoMetDB_2109,Microviridin N1,,Microviridin,Depsipeptide,C70H89N13O22,1463.624512,CC1C(C(=O)NC(C(=O)NC2CCCCNC(=O)CCC(NC(=O)C(NC(=O)C(NC(=O)C(CC(=O)O1)NC(=O)C(NC(=O)C3CCCN3C(=O)C(NC2=O)CC4=CNC5=CC=CC=C54)CO)CC6=CNC7=CC=CC=C76)CCC(=O)OC)C(=O)NC(CC8=CC=C(C=C8)O)C(=O)O)CC(C)C)NC(=O)C(C)NC(=O)C9CCCN9C(=O)C1CCCN1C(=O)C(C)NC(=O)C,"InChI=1S/C88H116N18O24/c1-45(2)37-61-78(117)94-58-21-12-13-33-89-70(110)31-29-59(77(116)101-65(88(127)128)38-50-25-27-53(109)28-26-50)95-76(115)60(30-32-71(111)129-7)96-79(118)62(39-51-42-90-56-19-10-8-17-54(51)56)97-80(119)63(98-81(120)66(44-107)102-83(122)68-23-14-34-104(68)86(125)64(100-75(58)114)40-52-43-91-57-20-11-9-18-55(52)57)41-72(112)130-48(5)73(84(123)99-61)103-74(113)46(3)93-82(121)67-22-15-35-105(67)87(126)69-24-16-36-106(69)85(124)47(4)92-49(6)108/h8-11,17-20,25-28,42-43,45-48,58-69,73,90-91,107,109H,12-16,21-24,29-41,44H2,1-7H3,(H,89,110)(H,92,108)(H,93,121)(H,94,117)(H,95,115)(H,96,118)(H,97,119)(H,98,120)(H,99,123)(H,100,114)(H,101,116)(H,102,122)(H,103,113)(H,127,128)",BCGKTBJHEZXJFM-UHFFFAOYSA-N,60159565,no,n.a.,n.a.,n.a.
CyanoMetDB_2110,Nostocyclophane A,,other cyclic non-peptide,,C48H74Cl2O16,976.4353917,CCCC[C@@H]1CCC[C@H](Cl)C[C@H](OC)C2=CC(O[C@H]3C(O)[C@@H](O)C(O)C(CO)O3)=C(C(O)=C2)[C@H](CCCC)CCC[C@H](Cl)C[C@H](OC)C4=CC(O)=C1C(OC5O[C@H](CO)C(O)[C@@H](O)[C@H]5O)=C4,"InChI=1S/C48H74Cl2O16/c1-5-7-11-25-13-9-15-29(49)21-34(62-4)28-18-32(54)40(36(20-28)64-48-46(60)44(58)42(56)38(24-52)66-48)26(12-8-6-2)14-10-16-30(50)22-33(61-3)27-17-31(53)39(25)35(19-27)63-47-45(59)43(57)41(55)37(23-51)65-47/h17-20,25-26,29-30,33-34,37-38,41-48,51-60H,5-16,21-24H2,1-4H3/t25-,26-,29+,30+,33+,34+,37?,38?,41?,42?,43-,44+,45-,46?,47?,48-/m1/s1",ZYGXVSICEXXAKB-KSRWYYLUSA-N,,yes,Nostoc,linckia (Roth) Bornet,UTEX B1932
CyanoMetDB_2111,Nostocyclophane B,,other cyclic non-peptide,,C42H64Cl2O11,814.3825683,CCCC[C@@H]1CCC[C@H](Cl)C[C@H](OC)C2=CC(O[C@H]3C(O)[C@@H](O)C(O)C(CO)O3)=C(C(O)=C2)[C@H](CCCC)CCC[C@H](Cl)C[C@H](OC)C4=CC(O)=C1C(O)=C4,"InChI=1S/C42H64Cl2O11/c1-5-7-11-24-13-9-15-29(44)22-34(53-4)27-19-32(48)38(35(20-27)54-42-41(51)40(50)39(49)36(23-45)55-42)25(12-8-6-2)14-10-16-28(43)21-33(52-3)26-17-30(46)37(24)31(47)18-26/h17-20,24-25,28-29,33-34,36,39-42,45-51H,5-16,21-23H2,1-4H3/t24-,25-,28+,29+,33+,34+,36?,39?,40+,41?,42-/m1/s1",QSSPVYZUPDQNSI-VDCRSBPBSA-N,,yes,Nostoc,linckia (Roth) Bornet,UTEX B1932
CyanoMetDB_2112,Nostocyclophane C,,other cyclic non-peptide,,C35H52Cl2O6,638.3140948,CCCC[C@@H]1CCC[C@H](Cl)C[C@H](OC)C2=CC(O)=C(C(O)=C2)[C@H](CCCC)CCC[C@H](Cl)C[C@H](O)C3=CC(O)=C1C(O)=C3,"InChI=1S/C35H52Cl2O6/c1-4-6-10-22-13-9-15-27(37)21-33(43-3)25-18-31(41)35(32(42)19-25)23(11-7-5-2)12-8-14-26(36)20-28(38)24-16-29(39)34(22)30(40)17-24/h16-19,22-23,26-28,33,38-42H,4-15,20-21H2,1-3H3/t22-,23-,26+,27+,28+,33+/m1/s1",DGYVKJRGCRBJLQ-CIUWSWHZSA-N,,yes,Nostoc,linckia (Roth) Bornet,UTEX B1932
CyanoMetDB_2113,Cylindrocyclophane A,,other cyclic non-peptide,,C38H56O6,608.4076895,CCCC[C@@H]1CCCC[C@@H](C)[C@H](O)C2=CC(O)=C(C(O)=C2)[C@H](CCCC)CCCC[C@@H](C)[C@H](O)C3=CC(O)=C1C(O)=C3,"InChI=1S/C36H56O6/c1-5-7-15-25-17-11-9-13-23(3)36(42)28-21-31(39)34(32(40)22-28)26(16-8-6-2)18-12-10-14-24(4)35(41)27-19-29(37)33(25)30(38)20-27/h19-26,35-42H,5-18H2,1-4H3/t23-,24-,25-,26-,35+,36+/m1/s1",JCKOOZUMKBNWSJ-ZLCROBAWSA-N,44245032,yes,Cylindrospermopsis,licheniforme Kutzing,ATCC 29204
CyanoMetDB_2114,17-bromo-30-methyloscillatoxin D,,other linear non-peptide,,C32H43BrO8,634.2141312,C[C@@H]1CC(C)(C)[C@]2(C=C[C@H](C)[C@@H]([C@H](CC[C@@H](C3=CC(O)=CC=C3Br)OC)C)O2)[C@H](C(O[C@H]4[C@@H](C)OC(C4)=O)=O)C1=O,"InChI=1S/C32H43BrO8/c1-17(8-11-24(38-7)22-14-21(34)9-10-23(22)33)29-18(2)12-13-32(41-29)27(28(36)19(3)16-31(32,5)6)30(37)40-25-15-26(35)39-20(25)4/h9-10,12-14,17-20,24-25,27,29,34H,8,11,15-16H2,1-7H3/t17-,18-,19+,20+,24?,25+,27-,29+,32-/m0/s1",UVDRDDDMNZUIPA-AKBBYZLVSA-N,,yes,Moorea, producens,n.a.
CyanoMetDB_2115,Oscillatoxin I,,other linear non-peptide,,C32H43BrO8,634.2141312,CC1(C)C(/C=C/[C@H](C)[C@H](O)[C@@H](C)CC[C@H](OC)C2=CC(O)=CC=C2Br)=C(C(O[C@H]3[C@@H](C)OC(C3)=O)=O)C([C@H](C)C1)=O,"InChI=1S/C32H43BrO8/c1-17(29(36)18(2)9-13-25(39-7)22-14-21(34)10-12-24(22)33)8-11-23-28(30(37)19(3)16-32(23,5)6)31(38)41-26-15-27(35)40-20(26)4/h8,10-12,14,17-20,25-26,29,34,36H,9,13,15-16H2,1-7H3/b11-8+/t17-,18-,19+,20+,25?,26+,29-/m0/s1",QKLWRXPNVSGLOD-YIPAWKTQSA-N,,yes,Moorea, producens,n.a.
CyanoMetDB_2116,Oscillatoxin G,,other linear non-peptide,,C33H45BrO8,648.2297813,O=C1C[C@@H](OC(/C=C2C3=C(O[C@H]([C@H](CC[C@@H](C4=CC(O)=CC=C4Br)OC)C)[C@@H](C)[C@H]3OC)C(C)(C)C[C@H]/2C)=O)[C@@H](C)O1,"InChI=1S/C33H45BrO8/c1-17(9-12-25(38-7)23-13-21(35)10-11-24(23)34)30-19(3)31(39-8)29-22(18(2)16-33(5,6)32(29)42-30)14-27(36)41-26-15-28(37)40-20(26)4/h10-11,13-14,17-20,25-26,30-31,35H,9,12,15-16H2,1-8H3/b22-14+/t17-,18+,19+,20+,25?,26+,30+,31?/m0/s1",SXZAPDMYMYDYSU-QSIGUHELSA-N,,yes,Moorea, producens,n.a.
CyanoMetDB_2117,Oscillatoxin H,,other linear non-peptide,,C33H47BrO9,666.240346,CC1=C(CC(O[C@H]2[C@@H](C)OC(C2)=O)=O)O[C@]3(C[C@@H](OC)[C@@H]([C@H]([C@H](CC[C@@H](C4=CC(O)=CC=C4Br)OC)C)O3)C)C(C)(C)C1,"InChI=1S/C33H47BrO9/c1-18(9-12-25(38-7)23-13-22(35)10-11-24(23)34)31-20(3)28(39-8)17-33(43-31)32(5,6)16-19(2)26(42-33)14-30(37)41-27-15-29(36)40-21(27)4/h10-11,13,18,20-21,25,27-28,31,35H,9,12,14-17H2,1-8H3/t18-,20-,21+,25?,27+,28?,31-,33-/m0/s1",OOIYWHWKLPEPEA-GCZLDPMSSA-N,,yes,Moorea, producens,n.a.
CyanoMetDB_2118,Grassystatin D,,other linear peptide,,C48H78N8O12,958.5739,CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)O)O,"InChI=1S/C48H78N8O12/c1-12-29(6)41(44(63)50-30(7)45(64)55(10)37(25-32-17-14-13-15-18-32)47(66)56-22-16-19-36(56)48(67)68-11)53-40(60)26-38(58)33(23-27(2)3)51-43(62)35(20-21-39(49)59)54(9)46(65)34(24-28(4)5)52-42(61)31(8)57/h13-15,17-18,27-31,33-38,41,57-58H,12,16,19-26H2,1-11H3,(H2,49,59)(H,50,63)(H,51,62)(H,52,61)(H,53,60)/t29-,30-,31-,33-,34-,35-,36-,37+,38-,41-/m0/s1",LRAVCRYIDZOXGD-YACSFGTRSA-N,139589854,yes,n.a.,n.a.,n.a.
CyanoMetDB_2119,Grassystatin E,,other linear peptide,,C47H76N8O12,944.5583,CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC)NC(=O)C[C@@H]([C@H](CC(C)C)NC(=O)[C@H](CCC(=O)N)N(C)C(=O)[C@H](CC(C)C)NC(=O)[C@H](C)O)O,"InChI=1S/C47H76N8O12/c1-11-28(6)40(44(63)49-29(7)41(60)51-34(24-31-16-13-12-14-17-31)46(65)55-21-15-18-36(55)47(66)67-10)53-39(59)25-37(57)32(22-26(2)3)50-43(62)35(19-20-38(48)58)54(9)45(64)33(23-27(4)5)52-42(61)30(8)56/h12-14,16-17,26-30,32-37,40,56-57H,11,15,18-25H2,1-10H3,(H2,48,58)(H,49,63)(H,50,62)(H,51,60)(H,52,61)(H,53,59)/t28-,29-,30-,32-,33-,34+,35-,36-,37-,40-/m0/s1",LWDPHBQVPKIFQR-WBGBVLSYSA-N,139589855,yes,n.a.,n.a.,n.a.
CyanoMetDB_2120,Palytoxin,,other linear non-peptide,palytoxin,C129H223N3O54,2678.47959,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)O[C@H](C[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H](O)[C@H](O)/C(C)=C/[C@H](O)C[C@@H](C)[C@H](O)C(N/C=C/C(NCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)[C@H](O)[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C129H223N3O54/c1-62(29-33-81(143)108(158)103(153)68(7)47-93-111(161)117(167)110(160)91(180-93)36-35-76(138)82(144)51-73-50-74-53-92(178-73)90(177-74)38-37-89-85(147)52-75(61-130)179-89)23-20-28-78(140)105(155)77(139)26-18-13-16-25-70(135)48-94-112(162)118(168)113(163)97(181-94)55-84(146)83(145)54-95-107(157)87(149)57-96(182-95)106(156)80(142)34-32-69(134)31-30-65(4)88(150)60-129(176)125(174)123(173)115(165)99(184-129)49-71(136)24-15-10-9-11-19-40-128-59-64(3)58-127(8,186-128)100(185-128)44-63(2)22-14-12-17-27-79(141)109(159)116(166)120(170)122(172)124-121(171)119(169)114(164)98(183-124)56-86(148)102(152)66(5)45-72(137)46-67(6)104(154)126(175)132-42-39-101(151)131-41-21-43-133/h13,16,18,20,23,25,30-31,35-36,39,42,45,63-65,67-100,102-125,133-150,152-174,176H,1,9-12,14-15,17,19,21-22,24,26-29,32-34,37-38,40-41,43-44,46-61,130H2,2-8H3,(H,131,151)(H,132,175)/b18-13+,23-20-,25-16-,31-30+,36-35-,42-39+,66-45+/t63-,64-,65-,67+,68+,69+,70+,71-,72-,73-,74+,75-,76+,77+,78+,79+,80+,81-,82+,83+,84+,85+,86-,87+,88-,89+,90+,91+,92-,93+,94-,95+,96-,97+,98+,99+,100+,102+,103+,104-,105-,106+,107-,108+,109-,110+,111-,112-,113+,114-,115-,116-,117-,118+,119+,120+,121-,122-,123+,124-,125+,127+,128-,129-/m0/s1",CWODDUGJZSCNGB-HQNRRURTSA-N,11105289,yes,Palythoa; Trichodesmium/Oscillatoriales,[Palythoa]tuberculosa; [Trichodesmium]toxica,n.a.
CyanoMetDB_2121,(42S-50R)42-hydroxypalytoxin,,other linear non-peptide,palytoxin,C129H223N3O55,2694.474508,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)O[C@@]([C@@H](O)[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H](O)[C@H](O)/C(C)=C/[C@H](O)C[C@@H](C)[C@H](O)C(N/C=C/C(NCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)([H])[C@H](O)[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C129H223N3O55/c1-61(29-33-80(143)106(158)101(153)67(7)47-92-110(162)115(167)109(161)90(181-92)36-35-74(137)81(144)50-71-49-72-52-91(179-71)89(178-72)38-37-88-84(147)51-73(60-130)180-88)23-20-28-76(139)103(155)75(138)25-18-13-15-24-69(135)48-93-111(163)116(168)112(164)96(182-93)54-83(146)82(145)53-94-105(157)86(149)56-95(183-94)104(156)79(142)34-32-68(134)31-30-64(4)87(150)59-129(177)125(175)122(174)121(173)124(186-129)108(160)78(141)27-16-10-9-11-19-40-128-58-63(3)57-127(8,187-128)98(185-128)44-62(2)22-14-12-17-26-77(140)107(159)114(166)118(170)120(172)123-119(171)117(169)113(165)97(184-123)55-85(148)100(152)65(5)45-70(136)46-66(6)102(154)126(176)132-42-39-99(151)131-41-21-43-133/h13,15,18,20,23-24,30-31,35-36,39,42,45,62-64,66-98,100-125,133-150,152-175,177H,1,9-12,14,16-17,19,21-22,25-29,32-34,37-38,40-41,43-44,46-60,130H2,2-8H3,(H,131,151)(H,132,176)/b18-13+,23-20-,24-15-,31-30+,36-35-,42-39+,65-45+/t62-,63-,64-,66+,67+,68+,69+,70-,71-,72+,73-,74+,75+,76+,77+,78-,79+,80-,81+,82+,83+,84+,85-,86+,87-,88+,89+,90+,91-,92+,93-,94+,95-,96+,97+,98+,100+,101+,102-,103-,104+,105-,106+,107-,108-,109+,110-,111-,112+,113-,114-,115-,116+,117+,118+,119-,120-,121+,122+,123-,124+,125+,127+,128-,129-/m0/s1",AFGYWOQMAMWZKR-AXGWGWBPSA-N,90479398,yes,Palythoa; Trichodesmium/Oscillatoriales,[Palythoa]tuberculosa; [Trichodesmium]toxica,n.a.
CyanoMetDB_2122,(42S-50S)42-hydroxypalytoxin,,other linear non-peptide,palytoxin,C129H223N3O55,2694.474508,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@H]([C@@H](O)C[C@]7(O)O[C@@]([C@@H](O)[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H](O)[C@H](O)/C(C)=C/[C@H](O)C[C@@H](C)[C@H](O)C(N/C=C/C(NCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)([H])[C@H](O)[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C129H223N3O55/c1-61(29-33-80(143)106(158)101(153)67(7)47-92-110(162)115(167)109(161)90(181-92)36-35-74(137)81(144)50-71-49-72-52-91(179-71)89(178-72)38-37-88-84(147)51-73(60-130)180-88)23-20-28-76(139)103(155)75(138)25-18-13-15-24-69(135)48-93-111(163)116(168)112(164)96(182-93)54-83(146)82(145)53-94-105(157)86(149)56-95(183-94)104(156)79(142)34-32-68(134)31-30-64(4)87(150)59-129(177)125(175)122(174)121(173)124(186-129)108(160)78(141)27-16-10-9-11-19-40-128-58-63(3)57-127(8,187-128)98(185-128)44-62(2)22-14-12-17-26-77(140)107(159)114(166)118(170)120(172)123-119(171)117(169)113(165)97(184-123)55-85(148)100(152)65(5)45-70(136)46-66(6)102(154)126(176)132-42-39-99(151)131-41-21-43-133/h13,15,18,20,23-24,30-31,35-36,39,42,45,62-64,66-98,100-125,133-150,152-175,177H,1,9-12,14,16-17,19,21-22,25-29,32-34,37-38,40-41,43-44,46-60,130H2,2-8H3,(H,131,151)(H,132,176)/b18-13+,23-20-,24-15-,31-30+,36-35-,42-39+,65-45+/t62-,63-,64+,66+,67+,68+,69+,70-,71-,72+,73-,74+,75+,76+,77+,78-,79+,80-,81+,82+,83+,84+,85-,86+,87-,88+,89+,90+,91-,92+,93-,94+,95-,96+,97+,98+,100+,101+,102-,103-,104+,105-,106+,107-,108-,109+,110-,111-,112+,113-,114-,115-,116+,117+,118+,119-,120-,121+,122+,123-,124+,125+,127+,128-,129-/m0/s1",AFGYWOQMAMWZKR-GZTLPNEXSA-N,146684745,yes,Palythoa; Trichodesmium/Oscillatoriales,[Palythoa]tuberculosa; [Trichodesmium]toxica,n.a.
CyanoMetDB_2123,Deoxypalytoxin,,other linear non-peptide,palytoxin,C129H223N3O53,2662.48468,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\CC[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)O[C@H](C[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H](O)[C@H](O)/C(C)=C/[C@H](O)C[C@@H](C)[C@H](O)C(N/C=C/C(NCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)[C@H](O)[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C129H223N3O53/c1-63(31-35-81(142)108(157)103(152)69(7)49-94-112(161)118(167)111(160)92(180-94)38-37-76(137)82(143)52-73-51-74-54-93(177-73)90(176-74)40-39-89-85(146)53-75(62-130)178-89)25-22-29-78(139)105(154)77(138)27-18-12-9-13-20-30-91-110(159)117(166)113(162)97(179-91)56-84(145)83(144)55-95-107(156)87(148)58-96(181-95)106(155)80(141)36-34-70(134)33-32-66(4)88(149)61-129(175)125(173)123(172)115(164)99(183-129)50-71(135)26-17-11-10-14-21-42-128-60-65(3)59-127(8,185-128)100(184-128)46-64(2)24-16-15-19-28-79(140)109(158)116(165)120(169)122(171)124-121(170)119(168)114(163)98(182-124)57-86(147)102(151)67(5)47-72(136)48-68(6)104(153)126(174)132-44-41-101(150)131-43-23-45-133/h9,12-13,18,22,25,32-33,37-38,41,44,47,64-66,68-100,102-125,133-149,151-173,175H,1,10-11,14-17,19-21,23-24,26-31,34-36,39-40,42-43,45-46,48-62,130H2,2-8H3,(H,131,150)(H,132,174)/b13-9-,18-12+,25-22-,33-32+,38-37-,44-41+,67-47+/t64-,65-,66-,68+,69+,70+,71-,72-,73-,74+,75-,76+,77+,78+,79+,80+,81-,82+,83+,84+,85+,86-,87+,88-,89+,90+,91-,92+,93-,94+,95+,96-,97+,98+,99+,100+,102+,103+,104-,105-,106+,107-,108+,109-,110-,111+,112-,113+,114-,115-,116-,117+,118-,119+,120+,121-,122-,123+,124-,125+,127+,128-,129-/m0/s1",GNUXTROKUYRQMR-DJTXWYTBSA-N,138453968,yes,Palythoa; Trichodesmium/Oscillatoriales,[Palythoa]tuberculosa; [Trichodesmium]toxica,n.a.
CyanoMetDB_2124,Homopalytoxin,,other linear non-peptide,palytoxin,C130H225N3O54,2692.495244,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)O[C@H](C[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H](O)[C@H](O)/C(C)=C/[C@H](O)C[C@@H](C)[C@H](O)C(N/C=C/C(NCCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)[C@H](O)[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C130H225N3O54/c1-63(30-34-82(144)109(159)104(154)69(7)48-94-112(162)118(168)111(161)92(181-94)37-36-77(139)83(145)52-74-51-75-54-93(179-74)91(178-75)39-38-90-86(148)53-76(62-131)180-90)24-22-29-79(141)106(156)78(140)27-18-13-16-26-71(136)49-95-113(163)119(169)114(164)98(182-95)56-85(147)84(146)55-96-108(158)88(150)58-97(183-96)107(157)81(143)35-33-70(135)32-31-66(4)89(151)61-130(177)126(175)124(174)116(166)100(185-130)50-72(137)25-15-10-9-11-19-41-129-60-65(3)59-128(8,187-129)101(186-129)45-64(2)23-14-12-17-28-80(142)110(160)117(167)121(171)123(173)125-122(172)120(170)115(165)99(184-125)57-87(149)103(153)67(5)46-73(138)47-68(6)105(155)127(176)133-43-40-102(152)132-42-20-21-44-134/h13,16,18,22,24,26,31-32,36-37,40,43,46,64-66,68-101,103-126,134-151,153-175,177H,1,9-12,14-15,17,19-21,23,25,27-30,33-35,38-39,41-42,44-45,47-62,131H2,2-8H3,(H,132,152)(H,133,176)/b18-13+,24-22-,26-16-,32-31+,37-36-,43-40+,67-46+/t64-,65-,66-,68+,69+,70+,71+,72-,73-,74-,75+,76-,77+,78+,79+,80+,81+,82-,83+,84+,85+,86+,87-,88+,89-,90+,91+,92+,93-,94+,95-,96+,97-,98+,99+,100+,101+,103+,104+,105-,106-,107+,108-,109+,110-,111+,112-,113-,114+,115-,116-,117-,118-,119+,120+,121+,122-,123-,124+,125-,126+,128+,129-,130-/m0/s1",GDKFXCQRNWUOIE-LKMPUFGSSA-N,138453969,yes,Palythoa; Trichodesmium/Oscillatoriales,[Palythoa]tuberculosa; [Trichodesmium]toxica,n.a.
CyanoMetDB_2125,Bishomopalytoxin,,other linear non-peptide,palytoxin,C131H227N3O54,2706.510894,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)O[C@H](C[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H](O)[C@H](O)/C(C)=C/[C@H](O)C[C@@H](C)[C@H](O)C(N/C=C/C(NCCCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)[C@H](O)[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C131H227N3O54/c1-64(31-35-83(145)110(160)105(155)70(7)49-95-113(163)119(169)112(162)93(182-95)38-37-78(140)84(146)53-75-52-76-55-94(180-75)92(179-76)40-39-91-87(149)54-77(63-132)181-91)25-23-30-80(142)107(157)79(141)28-19-13-17-27-72(137)50-96-114(164)120(170)115(165)99(183-96)57-86(148)85(147)56-97-109(159)89(151)59-98(184-97)108(158)82(144)36-34-71(136)33-32-67(4)90(152)62-131(178)127(176)125(175)117(167)101(186-131)51-73(138)26-16-10-9-11-20-42-130-61-66(3)60-129(8,188-130)102(187-130)46-65(2)24-15-12-18-29-81(143)111(161)118(168)122(172)124(174)126-123(173)121(171)116(166)100(185-126)58-88(150)104(154)68(5)47-74(139)48-69(6)106(156)128(177)134-44-41-103(153)133-43-21-14-22-45-135/h13,17,19,23,25,27,32-33,37-38,41,44,47,65-67,69-102,104-127,135-152,154-176,178H,1,9-12,14-16,18,20-22,24,26,28-31,34-36,39-40,42-43,45-46,48-63,132H2,2-8H3,(H,133,153)(H,134,177)/b19-13+,25-23-,27-17-,33-32+,38-37-,44-41+,68-47+/t65-,66-,67-,69+,70+,71+,72+,73-,74-,75-,76+,77-,78+,79+,80+,81+,82+,83-,84+,85+,86+,87+,88-,89+,90-,91+,92+,93+,94-,95+,96-,97+,98-,99+,100+,101+,102+,104+,105+,106-,107-,108+,109-,110+,111-,112+,113-,114-,115+,116-,117-,118-,119-,120+,121+,122+,123-,124-,125+,126-,127+,129+,130-,131-/m0/s1",LJQIHGIMMFWMEN-VXCGPZBCSA-N,138453970,yes,Palythoa; Trichodesmium/Oscillatoriales,[Palythoa]tuberculosa; [Trichodesmium]toxica,n.a.
CyanoMetDB_2126,Neopalytoxin,,other linear non-peptide,palytoxin,C129H221N3O53,2660.46903,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)O[C@H](C[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@@H]([C@H](O)/C(C)=C/C(O%11)CC(C)C%11C(N/C=C/C(NCCCO)=O)=O)O)O%10)[C@@]9(C)C[C@H](C)C8)[C@H](O)[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C129H221N3O53/c1-62(29-33-81(142)107(156)103(152)67(6)47-93-110(159)116(165)109(158)91(179-93)36-35-76(137)82(143)51-73-50-74-53-92(176-73)90(175-74)38-37-89-85(146)52-75(61-130)177-89)23-20-28-78(139)104(153)77(138)26-18-13-16-25-70(135)48-94-111(160)117(166)112(161)97(180-94)55-84(145)83(144)54-95-106(155)87(148)57-96(181-95)105(154)80(141)34-32-69(134)31-30-65(4)88(149)60-129(174)125(172)122(171)114(163)99(183-129)49-71(136)24-15-10-9-11-19-40-128-59-64(3)58-127(8,185-128)100(184-128)44-63(2)22-14-12-17-27-79(140)108(157)115(164)119(168)121(170)124-120(169)118(167)113(162)98(182-124)56-86(147)102(151)66(5)45-72-46-68(7)123(178-72)126(173)132-42-39-101(150)131-41-21-43-133/h13,16,18,20,23,25,30-31,35-36,39,42,45,63-65,67-100,102-125,133-149,151-172,174H,1,9-12,14-15,17,19,21-22,24,26-29,32-34,37-38,40-41,43-44,46-61,130H2,2-8H3,(H,131,150)(H,132,173)/b18-13+,23-20-,25-16-,31-30+,36-35-,42-39+,66-45+/t63-,64-,65-,67+,68?,69+,70+,71-,72?,73-,74+,75-,76+,77+,78+,79+,80+,81-,82+,83+,84+,85+,86-,87+,88-,89+,90+,91+,92-,93+,94-,95+,96-,97+,98+,99+,100+,102+,103+,104-,105+,106-,107+,108-,109+,110-,111-,112+,113-,114-,115-,116-,117+,118+,119+,120-,121-,122+,123?,124-,125+,127+,128-,129-/m0/s1",RTVMXMYSQQSLGF-NGURBKPLSA-N,146684854,yes,Palythoa; Trichodesmium/Oscillatoriales,[Palythoa]tuberculosa; [Trichodesmium]toxica,n.a.
CyanoMetDB_2127,Ovatoxin-a,,other linear non-peptide,palytoxin,C129H223N3O52,2646.48976,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)CC[C@H]6O[C@@]([C@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)OC([C@@H](O)[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](C[C@H](C)CCCCC[C@@H](O)[C@H](O)[C@H](O)C[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@@H](O)[C@H](O)/C(C)=C/[C@H](O)C[C@@H](C)[C@H](O)C(N/C=C/C(NCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)C[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C129H223N3O52/c1-64(29-34-84(144)114(162)107(155)70(7)49-98-116(164)120(168)115(163)96(179-98)38-36-78(138)85(145)53-75-52-76-55-97(176-75)94(175-76)40-39-93-86(146)54-77(63-130)177-93)23-20-28-81(141)109(157)79(139)25-18-13-15-24-72(135)50-99-117(165)121(169)118(166)100(180-99)51-73(136)33-37-95-113(161)89(149)58-101(178-95)111(159)83(143)35-32-71(134)31-30-67(4)92(152)62-129(174)125(172)91(151)59-103(182-129)112(160)82(142)27-16-10-9-11-19-42-128-61-66(3)60-127(8,184-128)104(183-128)46-65(2)22-14-12-17-26-80(140)110(158)87(147)56-90(150)124-123(171)122(170)119(167)102(181-124)57-88(148)106(154)68(5)47-74(137)48-69(6)108(156)126(173)132-44-41-105(153)131-43-21-45-133/h13,15,18,20,23-24,30-31,36,38,41,44,47,65-67,69-104,106-125,133-152,154-172,174H,1,9-12,14,16-17,19,21-22,25-29,32-35,37,39-40,42-43,45-46,48-63,130H2,2-8H3,(H,131,153)(H,132,173)/b18-13+,23-20-,24-15-,31-30+,38-36-,44-41+,68-47+/t65-,66+,67+,69-,70-,71-,72-,73+,74+,75+,76-,77+,78-,79-,80-,81-,82+,83-,84+,85-,86-,87-,88-,89-,90+,91-,92+,93-,94-,95-,96-,97+,98-,99+,100-,101+,102-,103?,104-,106-,107-,108+,109+,110+,111+,112+,113+,114-,115-,116+,117+,118-,119+,120+,121-,122-,123+,124-,125-,127-,128+,129+/m1/s1",RZASWFCAHPACCD-TVAUHDMXSA-N,,yes,Ostreopsis,ovata,n.a.
CyanoMetDB_2128,Ostreocin-D,,other linear non-peptide,palytoxin,C127H219N3O53,2634.45338,O[C@H]1[C@@H](CC[C@@H]2[C@H]3O[C@H](C[C@H]([C@H](O)/C=C\[C@@H]4[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H]([C@@H](O)[C@H](O)[C@@H](O)CCC(/C=C\C[C@@H](O)[C@@H](O)[C@H](O)C/C=C/C=C\[C@@H](O)C[C@@H]5O[C@H](C[C@@H](O)[C@H](O)C[C@H]6O[C@@]([C@@H]([C@H](O)CC[C@H](O)/C=C/[C@@H]([C@@H](O)C[C@]7(O)O[C@H]([C@@H](O)[C@@H](O)CCCCCCC[C@@]8(O9)O[C@H](CCCCCCC[C@@H](O)C[C@H](O)[C@@H](O)[C@H](O)[C@]%10([H])[C@@H](O)[C@H](O)[C@@H](O)[C@@H](C[C@H](O)[C@H](O)/C(C)=C/[C@H](O)CC[C@H](O)C(N/C=C/C(NCCCO)=O)=O)O%10)[C@@]9(C)C[C@H](C)C8)C[C@@H](O)[C@H]7O)C)O)([H])C[C@@H](O)[C@@H]6O)[C@@H](O)[C@H](O)[C@H]5O)=C)C)O4)O)C[C@H](C3)O2)O[C@H](CN)C1,"InChI=1S/C127H219N3O53/c1-63(29-34-80(141)110(159)105(154)67(5)47-95-113(162)117(166)112(161)93(177-95)38-37-75(136)82(143)51-72-50-73-53-94(175-72)92(174-73)40-39-91-85(146)52-74(62-128)176-91)22-20-27-77(138)106(155)76(137)25-17-13-15-24-70(134)49-96-114(163)118(167)115(164)99(178-96)55-84(145)83(144)54-97-109(158)88(149)57-98(179-97)107(156)79(140)35-32-68(132)31-30-65(3)90(151)61-127(173)123(171)89(150)58-101(181-127)108(157)78(139)26-16-10-8-12-19-42-126-60-64(2)59-125(6,183-126)102(182-126)28-18-11-7-9-14-23-69(133)48-86(147)111(160)120(169)122-121(170)119(168)116(165)100(180-122)56-87(148)104(153)66(4)46-71(135)33-36-81(142)124(172)130-44-41-103(152)129-43-21-45-131/h13,15,17,20,22,24,30-31,37-38,41,44,46,64-65,67-102,104-123,131-151,153-171,173H,1,7-12,14,16,18-19,21,23,25-29,32-36,39-40,42-43,45,47-62,128H2,2-6H3,(H,129,152)(H,130,172)/b17-13+,22-20-,24-15-,31-30+,38-37-,44-41+,66-46+/t64-,65-,67+,68+,69+,70+,71+,72-,73+,74-,75+,76+,77+,78-,79+,80-,81-,82+,83+,84+,85+,86-,87-,88+,89+,90-,91+,92+,93+,94-,95+,96-,97+,98-,99+,100+,101-,102+,104+,105+,106-,107+,108-,109-,110+,111+,112+,113-,114-,115+,116-,117-,118+,119+,120-,121-,122+,123+,125+,126-,127-/m0/s1",QJZSVGZHSZCZHY-GLWSCBSRSA-N,,yes,Ostreopsis,siamensis,n.a.
CyanoMetDB_2129,Palytoxin carboxylic acid,CA-I,other linear non-peptide,palytoxin,C123H213NO53,2552.400281,OC1C(CCC2C3OC(CC(C(O)/C=C\C4C(O)C(O)C(O)C(CC(C(O)C(O)C(O)CCC(/C=C\CC(O)C(O)C(O)C/C=C/C=C\C(O)CC5OC(CC(O)C(O)CC6OC(C(C(O)CCC(O)/C=C/C(C(O)CC7(O)OC(CC(O)CCCCCCCC8(O9)OC(CC(C)CCCCCC(O)C(O)C(O)C(O)C(O)C%10C(O)C(O)C(O)C(CC(O)C(O)/C(C)=C/C(O)CC(C)C(O)C(O)=O)O%10)C9(C)CC(C)C8)C(O)C(O)C7O)C)O)CC(O)C6O)C(O)C(O)C5O)=C)C)O4)O)CC(C3)O2)OC(CN)C1,"InChI=1S/C123H213NO53/c1-57(28-32-76(134)102(148)97(143)63(7)42-88-105(151)111(157)104(150)86(171-88)35-34-71(129)77(135)46-68-45-69-48-87(169-68)85(168-69)37-36-84-80(138)47-70(56-124)170-84)22-20-27-73(131)99(145)72(130)25-18-13-16-24-65(126)43-89-106(152)112(158)107(153)92(172-89)50-79(137)78(136)49-90-101(147)82(140)52-91(173-90)100(146)75(133)33-31-64(125)30-29-60(4)83(141)55-123(167)119(164)117(163)109(155)94(175-123)44-66(127)23-15-10-9-11-19-38-122-54-59(3)53-121(8,177-122)95(176-122)39-58(2)21-14-12-17-26-74(132)103(149)110(156)114(160)116(162)118-115(161)113(159)108(154)93(174-118)51-81(139)96(142)61(5)40-67(128)41-62(6)98(144)120(165)166/h13,16,18,20,22,24,29-30,34-35,40,58-60,62-119,125-164,167H,1,9-12,14-15,17,19,21,23,25-28,31-33,36-39,41-56,124H2,2-8H3,(H,165,166)/b18-13+,22-20-,24-16-,30-29+,35-34-,61-40+",CORITNKDDOOMSL-BDZOGBLZSA-N,,yes,Chondria  ,armata,n.a.
CyanoMetDB_2130,12?-Deoxydecarbamoylsaxitoxin,12?-do-dcSTX,Saxitoxin,Paralytic Shellfish Toxins,C9H16N6O2,240.1335,O[C@@H]1[C@@]2(NC(N[C@]2([C@@H](NC3=N)CO)[H])=N)N3CC1,"InChI=1S/C9H16N6O2/c10-7-13-6-4(3-16)12-8(11)15-2-1-5(17)9(6,15)14-7/h4-6,16-17H,1-3H2,(H2,11,12)(H3,10,13,14)/t4-,5-,6-,9+/m0/s1",AIOWIOMRQZYDEM-WWSLTDMBSA-N,146683902,no,n.a.,n.a.,n.a.
CyanoMetDB_2131,Decarbamoyloxysaxitoxin,doSTX,Saxitoxin,,C9H16N6O2,240.1335,C[C@H]1[C@@]2([H])[C@]3(NC(N2)=N)N(CCC(O)3O)C(N1)=N,"InChI=1S/C9H16N6O2/c1-4-5-9(14-6(10)13-5)8(16,17)2-3-15(9)7(11)12-4/h4-5,16-17H,2-3H2,1H3,(H2,11,12)(H3,10,13,14)/t4-,5-,9-/m0/s1",ICEQSJLPASDDEC-PJPYAQQDSA-N,101630837,no,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_2134,"11,11-Dihydroxy-N-sulfocarbamoylsaxitoxin",M3,Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O9S,411.0809,[H][C@@]12[C@]3(NC(N2)=N)N(CC(O)(O)C3(O)O)C(N[C@H]1COC(NS(=O)(O)=O)=O)=N,"InChI=1S/C10H17N7O9S/c11-5-14-4-3(1-26-7(18)16-27(23,24)25)13-6(12)17-2-8(19,20)10(21,22)9(4,17)15-5/h3-4,19-22H,1-2H2,(H2,12,13)(H,16,18)(H3,11,14,15)(H,23,24,25)/t3-,4-,9-/m0/s1",GEQVLVSQKTUBFK-GWWBTZNMSA-N,136704198,yes,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_2135,"11,11-Dihydroxysaxitoxin",M4,Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O6,331.124,[H][C@@]12[C@]3(NC(N2)=N)N(CC(O)(O)C3(O)O)C(N[C@H]1COC(N)=O)=N,"InChI=1S/C10H17N7O6/c11-5-15-4-3(1-23-7(13)18)14-6(12)17-2-8(19,20)10(21,22)9(4,17)16-5/h3-4,19-22H,1-2H2,(H2,12,14)(H2,13,18)(H3,11,15,16)/t3-,4-,9-/m0/s1",AYQBNFCPVJEXBA-GWWBTZNMSA-N,102411284,yes,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_2136,"12,12-Dideoxydecarbamoylsaxitoxin","12, 12-dido-dcSTX",Saxitoxin,,C9H16N6O,224.1386,[H][C@@]12[C@]3(NC(N2)=N)N(CCC3)C(N[C@H]1CO)=N,"InChI=1S/C9H16N6O/c10-7-13-6-5(4-16)12-8(11)15-3-1-2-9(6,15)14-7/h5-6,16H,1-4H2,(H2,11,12)(H3,10,13,14)/t5-,6-,9+/m0/s1",JFYZIJPKLXIKLJ-ATVXKPNKSA-N,146684917,no,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_2137,12?-Deoxydecarbamoyloxygonyautoxin-3,12?do-doGTX3,Saxitoxin,Paralytic Shellfish Toxins,C10H17N7O7S,379.091,[H][C@@]12[C@]3(NC(N2)=N)N(C[C@H](OS(=O)(O)=O)[C@]([H])3O)C(N[C@H]1COC(N)=O)=N,"InChI=1S/C10H17N7O7S/c11-7-15-5-3(2-23-9(13)19)14-8(12)17-1-4(24-25(20,21)22)6(18)10(5,17)16-7/h3-6,18H,1-2H2,(H2,12,14)(H2,13,19)(H3,11,15,16)(H,20,21,22)/t3-,4?,5-,6+,10-/m0/s1",BFDNPPUGEPOHCK-UGZAFNLISA-N,,yes,Anabaena,circinalis,TA04
CyanoMetDB_2138,"4,9-Seco-11,11-dihydroxy-N-sulfocarbamoylsaxitoxin",M5,Saxitoxin,Paralytic Shellfish Toxins,C10H19N7O9S,413.0965,NC(N[C@]1([H])C2N(CC(O)(O)C2(O)O)C(N[C@H]1COC([NH2+]S(=O)(O)=O)=O)=N)=N,"InChI=1S/C10H19N7O9S/c11-6(12)15-4-3(1-26-8(18)16-27(23,24)25)14-7(13)17-2-9(19,20)10(21,22)5(4)17/h3-5,19-22H,1-2H2,(H2,13,14)(H,16,18)(H4,11,12,15)(H,23,24,25)/t3-,4-,5?/m0/s1",CBIAWVDAJZVDSQ-QRHDOFTISA-N,,yes,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_2139,11-Hydroxydecarbamoylsaxitoxin,"11-OH-dcSTX, dcM2",Saxitoxin,,C9H16N6O4,272.1233,[H][C@@]12[C@]3(NC(N2)=N)N(CC(O)C3(O)O)C(N[C@H]1CO)=N,"InChI=1S/C9H16N6O4/c10-6-13-5-3(2-16)12-7(11)15-1-4(17)9(18,19)8(5,15)14-6/h3-5,16-19H,1-2H2,(H2,11,12)(H3,10,13,14)/t3-,4?,5-,8-/m0/s1",VPQKXWCXDNGXQB-LIIKNNTCSA-N,146684918,no,Dolichospermum,circinale,AWQC 131C
CyanoMetDB_2140,[D-Ser1]MC-LA,,Microcystin,,C46H67N7O13,925.479685,O=C(N(C)C(C(N[C@@H](C1=O)CO)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C46H67N7O13/c1-24(2)20-34-43(60)52-38(46(64)65)28(6)40(57)47-29(7)41(58)48-32(17-16-25(3)21-26(4)36(66-10)22-31-14-12-11-13-15-31)27(5)39(56)49-33(45(62)63)18-19-37(55)53(9)30(8)42(59)51-35(23-54)44(61)50-34/h11-17,21,24,26-29,32-36,38,54H,8,18-20,22-23H2,1-7,9-10H3,(H,47,57)(H,48,58)(H,49,56)(H,50,61)(H,51,59)(H,52,60)(H,62,63)(H,64,65)/b17-16+,25-21+/t26-,27-,28-,29-,32-,33+,34-,35+,36-,38+/m0/s1",PDWZTSUQEQIELX-VSFOPFNBSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2141,[NMe-Ser7]MC-LA,[Mser7]MC-LA,Microcystin,,C46H69N7O13,927.4953353,O=C(N(C)[C@@H](CO)C(N[C@@H](C1=O)C)=O)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C46H69N7O13/c1-24(2)20-34-43(60)52-38(46(64)65)28(6)40(57)47-29(7)41(58)49-32(17-16-25(3)21-26(4)36(66-10)22-31-14-12-11-13-15-31)27(5)39(56)50-33(45(62)63)18-19-37(55)53(9)35(23-54)44(61)48-30(8)42(59)51-34/h11-17,21,24,26-30,32-36,38,54H,18-20,22-23H2,1-10H3,(H,47,57)(H,48,61)(H,49,58)(H,50,56)(H,51,59)(H,52,60)(H,62,63)(H,64,65)/b17-16+,25-21+/t26-,27-,28-,29-,30+,32-,33+,34-,35-,36-,38+/m0/s1",XJANOPPLSDSWNH-XEBJKPBESA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2142,[dm(1)Adda5]MC-LR,[8-desmethylAdda5]MC-LR,Microcystin,,C48H72N10O12,980.5331181,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/C[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CC(C)C)=O)=O)=O)=O,"InChI=1S/C48H72N10O12/c1-26(2)24-37-45(65)57-39(47(68)69)29(5)41(61)54-35(16-13-23-51-48(49)50)44(64)53-34(20-18-27(3)17-19-33(70-9)25-32-14-11-10-12-15-32)28(4)40(60)55-36(46(66)67)21-22-38(59)58(8)31(7)43(63)52-30(6)42(62)56-37/h10-12,14-15,17-18,20,26,28-30,33-37,39H,7,13,16,19,21-25H2,1-6,8-9H3,(H,52,63)(H,53,64)(H,54,61)(H,55,60)(H,56,62)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b20-18+,27-17+/t28-,29-,30+,33+,34-,35-,36+,37-,39+/m0/s1",IPPFKMQSFNLDEL-WCJDNOPASA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2143,[dm(2)Adda5]MC-LR,[(6-desmethyl)-Adda5]MC-LR,Microcystin,,C48H72N10O12,980.5331181,CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@H](\C=C\C=C\[C@H](C)[C@H](Cc2ccccc2)OC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC1=O)C(=O)O)C(=O)O,"InChI=1S/C48H72N10O12/c1-26(2)24-36-45(65)57-39(47(68)69)29(5)41(61)54-34(20-15-23-51-48(49)50)44(64)53-33(19-14-13-16-27(3)37(70-9)25-32-17-11-10-12-18-32)28(4)40(60)55-35(46(66)67)21-22-38(59)58(8)31(7)43(63)52-30(6)42(62)56-36/h10-14,16-19,26-30,33-37,39H,7,15,20-25H2,1-6,8-9H3,(H,52,63)(H,53,64)(H,54,61)(H,55,60)(H,56,62)(H,57,65)(H,66,67)(H,68,69)(H4,49,50,51)/b16-13+,19-14+/t27-,28-,29-,30+,33-,34-,35+,36-,37-,39+/m0/s1",XOMCQYCXQBXGJI-JHGSTUCVSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2144,[D-Aba1]MC-LR,[D-Abu1]MC-LR,Microcystin,,C50H76N10O12,1008.564418,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C50H76N10O12/c1-11-34-45(65)58-38(24-27(2)3)47(67)59-41(49(70)71)31(7)43(63)56-36(18-15-23-53-50(51)52)46(66)55-35(20-19-28(4)25-29(5)39(72-10)26-33-16-13-12-14-17-33)30(6)42(62)57-37(48(68)69)21-22-40(61)60(9)32(8)44(64)54-34/h12-14,16-17,19-20,25,27,29-31,34-39,41H,8,11,15,18,21-24,26H2,1-7,9-10H3,(H,54,64)(H,55,66)(H,56,63)(H,57,62)(H,58,65)(H,59,67)(H,68,69)(H,70,71)(H4,51,52,53)/b20-19+,28-25+/t29-,30-,31-,34+,35-,36-,37+,38-,39-,41+/m0/s1",HZMZGNIOSQSPQA-PTZXCAQDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2145,[D-Ser1]MC-LR,,Microcystin,,C49H74N10O13,1010.543682,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C49H74N10O13/c1-26(2)22-36-45(66)58-40(48(70)71)30(6)42(63)54-34(16-13-21-52-49(50)51)44(65)53-33(18-17-27(3)23-28(4)38(72-9)24-32-14-11-10-12-15-32)29(5)41(62)55-35(47(68)69)19-20-39(61)59(8)31(7)43(64)57-37(25-60)46(67)56-36/h10-12,14-15,17-18,23,26,28-30,33-38,40,60H,7,13,16,19-22,24-25H2,1-6,8-9H3,(H,53,65)(H,54,63)(H,55,62)(H,56,67)(H,57,64)(H,58,66)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,27-23+/t28-,29-,30-,33-,34-,35+,36-,37+,38-,40+/m0/s1",ILNAPLHZKJXPGS-GLDHPBRASA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2146,[dm(1)Adda5]MC-(H4)YR (isomer 1),[8-desmethylAdda5]MC-(H4)YR,Microcystin,,C51H74N10O13,1034.543682,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/C[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)C[C@]3(C=C[C@@H](CC3)O)[H])=O)=O)=O)=O,"InChI=1S/C51H74N10O13/c1-28(15-21-36(74-7)26-33-12-9-8-10-13-33)16-22-37-29(2)43(64)58-39(49(70)71)23-24-41(63)61(6)32(5)46(67)55-31(4)45(66)59-40(27-34-17-19-35(62)20-18-34)48(69)60-42(50(72)73)30(3)44(65)57-38(47(68)56-37)14-11-25-54-51(52)53/h8-10,12-13,15-17,19,22,29-31,34-40,42,62H,5,11,14,18,20-21,23-27H2,1-4,6-7H3,(H,55,67)(H,56,68)(H,57,65)(H,58,64)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b22-16+,28-15+/t29-,30-,31+,34-,35-,36+,37-,38-,39+,40-,42+/m0/s1",XTXGUDSXHCIBAB-ZAKJOZQWSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2147,[dm(1)Adda5]MC-(H4)YR (isomer 2),[8-desmethylAdda5]MC-(H4)YR,Microcystin,,C51H74N10O13,1034.543682,O[C@H]1C=C[C@@H](CC1)C[C@@H]1NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@@H](C)[C@H](\C=C\C=C\[C@H](C)[C@H](Cc2ccccc2)OC)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC1=O)C(=O)O)C(=O)O,"InChI=1S/C51H74N10O13/c1-28(40(74-7)27-33-15-9-8-10-16-33)14-11-12-17-36-29(2)43(64)58-38(49(70)71)23-24-41(63)61(6)32(5)46(67)55-31(4)45(66)59-39(26-34-19-21-35(62)22-20-34)48(69)60-42(50(72)73)30(3)44(65)57-37(47(68)56-36)18-13-25-54-51(52)53/h8-12,14-17,19,21,28-31,34-40,42,62H,5,13,18,20,22-27H2,1-4,6-7H3,(H,55,67)(H,56,68)(H,57,65)(H,58,64)(H,59,66)(H,60,69)(H,70,71)(H,72,73)(H4,52,53,54)/b14-11+,17-12+/t28-,29-,30-,31+,34-,35-,36-,37-,38+,39-,40-,42+/m0/s1",UHJPJYAHOVURPB-AGUNYHBDSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2148,MC-(H4)Y(H4)Y,,Microcystin,,C55H77N7O14,1059.55285,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](C[C@H]2C=C[C@H](O)CC2)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@H](C[C@H]2C=C[C@H](O)CC2)NC(=O)[C@@H](C)NC(=O)C(=C)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C55H77N7O14/c1-30(26-31(2)45(76-8)29-36-12-10-9-11-13-36)14-23-41-32(3)48(66)58-42(54(72)73)24-25-46(65)62(7)35(6)51(69)56-34(5)50(68)60-44(28-38-17-21-40(64)22-18-38)53(71)61-47(55(74)75)33(4)49(67)59-43(52(70)57-41)27-37-15-19-39(63)20-16-37/h9-15,17,19,21,23,26,31-34,37-45,47,63-64H,6,16,18,20,22,24-25,27-29H2,1-5,7-8H3,(H,56,69)(H,57,70)(H,58,66)(H,59,67)(H,60,68)(H,61,71)(H,72,73)(H,74,75)/b23-14+,30-26+/t31-,32-,33-,34+,37-,38-,39-,40-,41-,42+,43-,44-,45-,47+/m0/s1",IGYARPDFSSTKEZ-BQADBAKWSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2149,[NMe-Ser7]MC-(H4)YR,[Mser7]MC-(H4)YR,Microcystin,,C52H78N10O14,1066.569897,C[C@@H](\C=C(/C)\C=C\[C@@H]1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CO)N(C)C(=O)CC[C@@H](NC(=O)[C@H]1C)C(=O)O)C[C@H]1C=C[C@H](O)CC1)C(=O)O)[C@H](Cc1ccccc1)OC,"InChI=1S/C52H78N10O14/c1-28(24-29(2)41(76-7)26-33-12-9-8-10-13-33)15-20-36-30(3)44(66)59-38(50(72)73)21-22-42(65)62(6)40(27-63)49(71)56-32(5)46(68)60-39(25-34-16-18-35(64)19-17-34)48(70)61-43(51(74)75)31(4)45(67)58-37(47(69)57-36)14-11-23-55-52(53)54/h8-10,12-13,15-16,18,20,24,29-32,34-41,43,63-64H,11,14,17,19,21-23,25-27H2,1-7H3,(H,56,71)(H,57,69)(H,58,67)(H,59,66)(H,60,68)(H,61,70)(H,72,73)(H,74,75)(H4,53,54,55)/b20-15+,28-24+/t29-,30-,31-,32+,34-,35-,36-,37-,38+,39-,40-,41-,43+/m0/s1",DUDXLMLOMGZROM-KMPCJAIMSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2150,Aeruginozamide AEG571,,other linear peptide,cyanobactins,C28H37N5O6S,571.24645,NC(C(NC(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)C(C)C)=O)CC4=CC=C(O)C=C4,"InChI=1S/C28H37N5O6S/c1-16(2)23(31-24(35)19(29)14-17-8-10-18(34)11-9-17)27(37)33-13-5-7-22(33)26(36)32-12-4-6-21(32)25-30-20(15-40-25)28(38)39-3/h8-11,15-16,19,21-23,34H,4-7,12-14,29H2,1-3H3,(H,31,35)",QJKMKBMIOMCHCY-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2151,Aeruginozamide AEG603,,other linear peptide,cyanobactins,C32H37N5O5S,603.25154,NC(C(NC(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)CC4=CC=CC=C4)=O)CC5=CC=CC=C5,"InChI=1S/C32H37N5O5S/c1-42-32(41)25-20-43-29(35-25)26-14-8-16-36(26)31(40)27-15-9-17-37(27)30(39)24(19-22-12-6-3-7-13-22)34-28(38)23(33)18-21-10-4-2-5-11-21/h2-7,10-13,20,23-24,26-27H,8-9,14-19,33H2,1H3,(H,34,38)",TZNIBGQYCJEGKB-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2152,Aeruginozamide AEG625,,other linear peptide,cyanobactins,C32H43N5O6S,625.2934,O=C(NC(C(N1CCCC1C(N2C(C3=NC(C(O)=O)=CS3)CCC2)=O)=O)C(C)C)C(NC(C=C)(C)C)CC4=CC=C(O)C=C4,"InChI=1S/C32H43N5O6S/c1-6-32(4,5)35-22(17-20-11-13-21(38)14-12-20)27(39)34-26(19(2)3)30(41)37-16-8-10-25(37)29(40)36-15-7-9-24(36)28-33-23(18-44-28)31(42)43/h6,11-14,18-19,22,24-26,35,38H,1,7-10,15-17H2,2-5H3,(H,34,39)(H,42,43)",RLWFESLDAGBKSF-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2153,Aeruginozamide AEG639,,other linear peptide,cyanobactins,C33H45N5O6S,639.30905,O=C(NC(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)C(C)C)C(NC(C=C)(C)C)CC4=CC=C(O)C=C4,"InChI=1S/C33H45N5O6S/c1-7-33(4,5)36-23(18-21-12-14-22(39)15-13-21)28(40)35-27(20(2)3)31(42)38-17-9-11-26(38)30(41)37-16-8-10-25(37)29-34-24(19-45-29)32(43)44-6/h7,12-15,19-20,23,25-27,36,39H,1,8-11,16-18H2,2-6H3,(H,35,40)",SGQDBLJQURGTKN-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2154,Aeruginozamide AEG657,,other linear peptide,cyanobactins,C36H43N5O5S,657.29849,O=C(NC(C(N1CCCC1C(N2C(C3=NC(C(O)=O)=CS3)CCC2)=O)=O)CC4=CC=CC=C4)C(NC(C=C)(C)C)CC5=CC=CC=C5,"InChI=1S/C36H43N5O5S/c1-4-36(2,3)39-26(21-24-13-7-5-8-14-24)31(42)37-27(22-25-15-9-6-10-16-25)33(43)41-20-12-18-30(41)34(44)40-19-11-17-29(40)32-38-28(23-47-32)35(45)46/h4-10,13-16,23,26-27,29-30,39H,1,11-12,17-22H2,2-3H3,(H,37,42)(H,45,46)",LPWPMGUNOGYLFZ-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2155,Aeruginozamide AEG667,,other linear peptide,cyanobactins,C35H49N5O6S,667.34036,O=C(C(C(C)C)NC(C(N(C(C)(C)C=C)C)CCC1=CC=C(O)C=C1)=O)N2CCCC2C(N3C(C4=NC(C(OC)=O)=CS4)CCC3)=O,"InChI=1S/C35H49N5O6S/c1-8-35(4,5)38(6)26(18-15-23-13-16-24(41)17-14-23)30(42)37-29(22(2)3)33(44)40-20-10-12-28(40)32(43)39-19-9-11-27(39)31-36-25(21-47-31)34(45)46-7/h8,13-14,16-17,21-22,26-29,41H,1,9-12,15,18-20H2,2-7H3,(H,37,42)",SYTOPCOPUFZYMK-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2156,Aeruginozamide AEG671,,other linear peptide,cyanobactins,C37H45N5O5S,671.31414,O=C(NC(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)CC4=CC=CC=C4)C(NC(C=C)(C)C)CC5=CC=CC=C5,"InChI=1S/C37H45N5O5S/c1-5-37(2,3)40-27(22-25-14-8-6-9-15-25)32(43)38-28(23-26-16-10-7-11-17-26)34(44)42-21-13-19-31(42)35(45)41-20-12-18-30(41)33-39-29(24-48-33)36(46)47-4/h5-11,14-17,24,27-28,30-31,40H,1,12-13,18-23H2,2-4H3,(H,38,43)",IIMKUAKIRYOISV-UHFFFAOYSA-N,,yes,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2157,Aeruginozamide AEG685,,other linear peptide,cyanobactins,C38H47N5O5S,685.32979,O=C(N(C)C(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)CC4=CC=CC=C4)C(NC(C=C)(C)C)CC5=CC=CC=C5,"InChI=1S/C38H47N5O5S/c1-6-38(2,3)40-28(23-26-15-9-7-10-16-26)34(44)41(4)32(24-27-17-11-8-12-18-27)36(46)43-22-14-20-31(43)35(45)42-21-13-19-30(42)33-39-29(25-49-33)37(47)48-5/h6-12,15-18,25,28,30-32,40H,1,13-14,19-24H2,2-5H3",SVLMVIDEAOMUDJ-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2158,Aeruginozamide AEG693,,other linear peptide,cyanobactins,C37H51N5O6S,693.35601,O=C(NC(C(C)C)C(N1CCCC1C(N2C(C3=NC(C(O)=O)=CS3)CCC2)=O)=O)C(N(C(C)(C)C=C)C(C=C)(C)C)CC4=CC=C(O)C=C4,"InChI=1S/C37H51N5O6S/c1-9-36(5,6)42(37(7,8)10-2)29(21-24-15-17-25(43)18-16-24)31(44)39-30(23(3)4)34(46)41-20-12-14-28(41)33(45)40-19-11-13-27(40)32-38-26(22-49-32)35(47)48/h9-10,15-18,22-23,27-30,43H,1-2,11-14,19-21H2,3-8H3,(H,39,44)(H,47,48)",QESRUPWPSXDHTM-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2159,Aeruginozamide AEG705,,other linear peptide,cyanobactins,C39H55N5O5S,705.39239,O=C(NC(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)C(C)C)C(CCC4=CC=CC=C4)N(C(C)(C)C=C)C(C=C)(C)C,"InChI=1S/C39H55N5O5S/c1-10-38(5,6)44(39(7,8)11-2)29(22-21-27-17-13-12-14-18-27)33(45)41-32(26(3)4)36(47)43-24-16-20-31(43)35(46)42-23-15-19-30(42)34-40-28(25-50-34)37(48)49-9/h10-14,17-18,25-26,29-32H,1-2,15-16,19-24H2,3-9H3,(H,41,45)",OQQYLYGWYGQLMT-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2160,Aeruginozamide AEG707,,other linear peptide,cyanobactins,C38H53N5O6S,707.37166,O=C(NC(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)C(C)C)C(N(C(C)(C)C=C)C(C=C)(C)C)CC4=CC=C(O)C=C4,"InChI=1S/C38H53N5O6S/c1-10-37(5,6)43(38(7,8)11-2)30(22-25-16-18-26(44)19-17-25)32(45)40-31(24(3)4)35(47)42-21-13-15-29(42)34(46)41-20-12-14-28(41)33-39-27(23-50-33)36(48)49-9/h10-11,16-19,23-24,28-31,44H,1-2,12-15,20-22H2,3-9H3,(H,40,45)",ULYATEVPOLNFPJ-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2161,Aeruginozamide AEG721,,other linear peptide,cyanobactins,C39H55N5O6S,721.38731,O=C(NC(C(N1CCCC1C(N2C(C3=NC(C(OC)=O)=CS3)CCC2)=O)=O)C(CC)C)C(N(C(C)(C)C=C)C(C=C)(C)C)CC4=CC=C(O)C=C4,"InChI=1S/C39H55N5O6S/c1-10-25(4)32(41-33(46)31(23-26-17-19-27(45)20-18-26)44(38(5,6)11-2)39(7,8)12-3)36(48)43-22-14-16-30(43)35(47)42-21-13-15-29(42)34-40-28(24-51-34)37(49)50-9/h11-12,17-20,24-25,29-32,45H,2-3,10,13-16,21-23H2,1,4-9H3,(H,41,46)",QZWORURHRWVEJE-UHFFFAOYSA-N,,no,Limnoraphis,sp.,CCNP 1324
CyanoMetDB_2162,Nostocyclopeptide Ncp-E1,,other cyclic peptide,nostocyclopeptide,C39H52N8O9,776.38573,O=C(N1)CNC(C(CC2=CC=C(O)C=C2)/N=C/C(CC3=CC=CC=C3)NC(C(CCC4)N4C(C(CO)NC(C(C(C)CC)NC(C1CCC(N)=O)=O)=O)=O)=O)=O,"InChI=1S/C39H52N8O9/c1-3-23(2)34-38(55)45-30(22-48)39(56)47-17-7-10-31(47)37(54)43-26(18-24-8-5-4-6-9-24)20-41-29(19-25-11-13-27(49)14-12-25)35(52)42-21-33(51)44-28(36(53)46-34)15-16-32(40)50/h4-6,8-9,11-14,20,23,26,28-31,34,48-49H,3,7,10,15-19,21-22H2,1-2H3,(H2,40,50)(H,42,52)(H,43,54)(H,44,51)(H,45,55)(H,46,53)/b41-20+",HQOVNNILDNLNSB-ZLNXIQNYSA-N,,no,Nostoc ,edaphicum,CCNP 1411
CyanoMetDB_2163,Nostocyclopeptide Ncp-E1-L,,other linear peptide,nostocyclopeptide,C39H54N8O10,794.39629,O=C(NC(C(NC(C(NC(C(N1C(C(NC(CC2=CC=CC=C2)C([H])=O)=O)CCC1)=O)CO)=O)C(C)CC)=O)CCC(N)=O)CNC(C(CC3=CC=C(O)C=C3)N)=O,"InChI=1S/C39H54N8O10/c1-3-23(2)34(46-36(54)29(15-16-32(41)51)44-33(52)20-42-35(53)28(40)19-25-11-13-27(50)14-12-25)38(56)45-30(22-49)39(57)47-17-7-10-31(47)37(55)43-26(21-48)18-24-8-5-4-6-9-24/h4-6,8-9,11-14,21,23,26,28-31,34,49-50H,3,7,10,15-20,22,40H2,1-2H3,(H2,41,51)(H,42,53)(H,43,55)(H,44,52)(H,45,56)(H,46,54)",XFONTJUFZVROJR-UHFFFAOYSA-N,,no,Nostoc ,edaphicum,CCNP 1411
CyanoMetDB_2164,Nostocyclopeptide Ncp-E2,,other cyclic peptide,nostocyclopeptide,C36H54N8O9,742.40138,O=C(CNC(C(/N=C/C(NC(C1CCCN1C(C(NC(C(N2)C(CC)C)=O)CO)=O)=O)CC(C)C)CC3=CC=C(C=C3)O)=O)NC(CCC(N)=O)C2=O,"InChI=1S/C36H54N8O9/c1-5-21(4)31-35(52)42-27(19-45)36(53)44-14-6-7-28(44)34(51)40-23(15-20(2)3)17-38-26(16-22-8-10-24(46)11-9-22)32(49)39-18-30(48)41-25(33(50)43-31)12-13-29(37)47/h8-11,17,20-21,23,25-28,31,45-46H,5-7,12-16,18-19H2,1-4H3,(H2,37,47)(H,39,49)(H,40,51)(H,41,48)(H,42,52)(H,43,50)/b38-17+",RDSXOMRMGOPDCR-OAQMXIGCSA-N,,no,Nostoc ,edaphicum,CCNP 1411
CyanoMetDB_2165,Nostocyclopeptide Ncp-E2-L,,other linear peptide,nostocyclopeptide,C36H56N8O10,760.41194,O=C(NC(C(NC(C(NC(C(N1C(C(NC(CC(C)C)C([H])=O)=O)CCC1)=O)CO)=O)C(C)CC)=O)CCC(N)=O)CNC(C(CC2=CC=C(O)C=C2)N)=O,"InChI=1S/C36H56N8O10/c1-5-21(4)31(35(53)42-27(19-46)36(54)44-14-6-7-28(44)34(52)40-23(18-45)15-20(2)3)43-33(51)26(12-13-29(38)48)41-30(49)17-39-32(50)25(37)16-22-8-10-24(47)11-9-22/h8-11,18,20-21,23,25-28,31,46-47H,5-7,12-17,19,37H2,1-4H3,(H2,38,48)(H,39,50)(H,40,52)(H,41,49)(H,42,53)(H,43,51)",CLSDHBVHQKWEJR-UHFFFAOYSA-N,,no,Nostoc ,edaphicum,CCNP 1411
CyanoMetDB_2166,Nostocyclopeptide Ncp-E3,,other cyclic peptide,nostocyclopeptide,C36H54N8O9,742.40138,O=C(CNC(C(/N=C/C(NC(C1CC(C)CN1C(C(NC(C(N2)C(C)C)=O)CO)=O)=O)CC(C)C)CC3=CC=C(C=C3)O)=O)NC(CCC(N)=O)C2=O,"InChI=1S/C36H54N8O9/c1-19(2)12-23-15-38-26(14-22-6-8-24(46)9-7-22)32(49)39-16-30(48)41-25(10-11-29(37)47)33(50)43-31(20(3)4)35(52)42-27(18-45)36(53)44-17-21(5)13-28(44)34(51)40-23/h6-9,15,19-21,23,25-28,31,45-46H,10-14,16-18H2,1-5H3,(H2,37,47)(H,39,49)(H,40,51)(H,41,48)(H,42,52)(H,43,50)/b38-15+",LIIVFSHVCGATJG-DVRIZHICSA-N,,no,Nostoc ,edaphicum,CCNP 1411
CyanoMetDB_2167,Microviridin 1777,,Microviridin,,C87H111N17O24,1777.798788,O=C([C@H](CC1=CC=C(C=C1)O)NC(C)=O)N[C@H](C(N[C@H](C(N[C@@H]2C(N[C@H](C(N[C@H](C(N[C@H](C(N3CCC[C@H]3C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](CC4)C(N[C@@H](CC5)C(N[C@H](C(O)=O)CC6=CC=CC=C6)=O)=O)=O)CC7=CNC8=C7C=CC=C8)=O)CC(O[C@@H]2C)=O)=O)COC4=O)=O)=O)CC9=CC=C(C=C9)O)=O)CCCCNC5=O)=O)CC(C)C)=O)=O)C(C)C)=O)CC(N)=O,"InChI=1S/C87H111N17O24/c1-44(2)35-59-77(115)92-56-19-12-13-33-89-69(109)31-29-57(76(114)100-65(87(125)126)38-48-15-8-7-9-16-48)93-75(113)58-30-32-70(110)127-43-66(101-83(121)67-20-14-34-104(67)86(124)64(99-74(56)112)37-50-23-27-53(107)28-24-50)82(120)97-63(80(118)95-61(79(117)94-58)39-51-42-90-55-18-11-10-17-54(51)55)41-71(111)128-46(5)73(85(123)98-59)103-84(122)72(45(3)4)102-81(119)62(40-68(88)108)96-78(116)60(91-47(6)105)36-49-21-25-52(106)26-22-49/h7-11,15-18,21-28,42,44-46,56-67,72-73,90,106-107H,12-14,19-20,29-41,43H2,1-6H3,(H2,88,108)(H,89,109)(H,91,105)(H,92,115)(H,93,113)(H,94,117)(H,95,118)(H,96,116)(H,97,120)(H,98,123)(H,99,112)(H,100,114)(H,101,121)(H,102,119)(H,103,122)(H,125,126)/t46-,56+,57+,58-,59+,60+,61+,62+,63+,64+,65+,66+,67+,72+,73+/m1/s1",KVBFNKBNLKILGD-OIUGJICQSA-N,,yes,Microcystis ,aeruginosa ,EAWAG 127a
CyanoMetDB_2168,Microviridin N9,,Microviridin,,C105H147N25O33,2286.059312,O=C1C[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CC(NCCCC2)=O)=O)CCC(OC3)=O)=O)=O)NC([C@H]3NC([C@H]4N(CCC4)C([C@H](CC5=CC=CC=C5)NC([C@H]2NC([C@H](CC6=CC=C(O)C=C6)NC([C@@H](NC([C@H](CC7=CNC8=C7C=CC=C8)NC([C@H]9N(C([C@H](C(C)C)NC([C@H](CCC(O)=O)NC([C@](NC(CNC([C@@H](NC([C@](NC([C@@H](N)C)=O)([H])[C@H](O)C)=O)CCC(O)=O)=O)=O)([H])[C@@H](C)O)=O)=O)=O)CCC9)=O)=O)[C@@H](C)O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C105H147N25O33/c1-50(2)41-67-91(147)114-65-33-36-80(140)162-49-73-96(152)120-71(94(150)118-67)46-81(141)163-55(8)85(101(157)122-68(42-57-27-29-59(133)30-28-57)92(148)113-62(88(144)123-72(43-56-19-10-9-11-20-56)102(158)129-39-17-25-74(129)98(154)124-73)23-14-15-37-109-76(134)45-70(119-89(65)145)93(149)117-66(104(160)161)24-16-38-110-105(107)108)128-95(151)69(44-58-47-111-61-22-13-12-21-60(58)61)121-97(153)75-26-18-40-130(75)103(159)82(51(3)4)126-90(146)64(32-35-79(138)139)116-99(155)83(53(6)131)125-77(135)48-112-87(143)63(31-34-78(136)137)115-100(156)84(54(7)132)127-86(142)52(5)106/h9-13,19-22,27-30,47,50-55,62-75,82-85,111,131-133H,14-18,23-26,31-46,48-49,106H2,1-8H3,(H,109,134)(H,112,143)(H,113,148)(H,114,147)(H,115,156)(H,116,155)(H,117,149)(H,118,150)(H,119,145)(H,120,152)(H,121,153)(H,122,157)(H,123,144)(H,124,154)(H,125,135)(H,126,146)(H,127,142)(H,128,151)(H,136,137)(H,138,139)(H,160,161)(H4,107,108,110)/t52-,53+,54+,55+,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,82-,83-,84-,85-/m0/s1",BUCFGLPCTVELLO-YNVQRWCBSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2169,Microviridin N8,,Microviridin,,C102H142N24O32,2215.022199,O=C1C[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CC(NCCCC2)=O)=O)CCC(OC3)=O)=O)=O)NC([C@H]3NC([C@H]4N(CCC4)C([C@H](CC5=CC=CC=C5)NC([C@H]2NC([C@H](CC6=CC=C(O)C=C6)NC([C@@H](NC([C@H](CC7=CNC8=C7C=CC=C8)NC([C@H]9N(C([C@H](C(C)C)NC([C@H](CCC(O)=O)NC([C@](NC(CNC([C@@H](NC([C@](N)([H])[C@H](O)C)=O)CCC(O)=O)=O)=O)([H])[C@@H](C)O)=O)=O)=O)CCC9)=O)=O)[C@@H](C)O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C102H142N24O32/c1-49(2)40-65-88(142)111-63-32-35-78(136)157-48-71-93(147)117-69(91(145)115-65)45-79(137)158-53(7)83(98(152)119-66(41-55-26-28-57(129)29-27-55)89(143)110-60(85(139)120-70(42-54-18-9-8-10-19-54)99(153)125-38-16-24-72(125)95(149)121-71)22-13-14-36-106-74(130)44-68(116-86(63)140)90(144)114-64(101(155)156)23-15-37-107-102(104)105)124-92(146)67(43-56-46-108-59-21-12-11-20-58(56)59)118-94(148)73-25-17-39-126(73)100(154)81(50(3)4)123-87(141)62(31-34-77(134)135)113-97(151)82(52(6)128)122-75(131)47-109-84(138)61(30-33-76(132)133)112-96(150)80(103)51(5)127/h8-12,18-21,26-29,46,49-53,60-73,80-83,108,127-129H,13-17,22-25,30-45,47-48,103H2,1-7H3,(H,106,130)(H,109,138)(H,110,143)(H,111,142)(H,112,150)(H,113,151)(H,114,144)(H,115,145)(H,116,140)(H,117,147)(H,118,148)(H,119,152)(H,120,139)(H,121,149)(H,122,131)(H,123,141)(H,124,146)(H,132,133)(H,134,135)(H,155,156)(H4,104,105,107)/t51-,52-,53-,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,70+,71+,72+,73+,80+,81+,82+,83+/m1/s1",XBTJRTITHOCUBJ-RTESABESSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2170,Microviridin N7,,Microviridin,,C98H135N23O30,2113.97452,O=C1C[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CC(NCCCC2)=O)=O)CCC(OC3)=O)=O)=O)NC([C@H]3NC([C@H]4N(CCC4)C([C@H](CC5=CC=CC=C5)NC([C@H]2NC([C@H](CC6=CC=C(O)C=C6)NC([C@@H](NC([C@H](CC7=CNC8=C7C=CC=C8)NC([C@H]9N(C([C@H](C(C)C)NC([C@H](CCC(O)=O)NC([C@](NC(CNC([C@@H](N)CCC(O)=O)=O)=O)([H])[C@@H](C)O)=O)=O)=O)CCC9)=O)=O)[C@@H](C)O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C97H133N23O30/c1-6-17-58-81(132)107-61-32-35-75(129)149-47-68-89(140)111-66(87(138)105-58)44-76(130)150-50(5)79(118-88(139)64(42-53-45-103-57-21-11-10-20-55(53)57)112-90(141)70-25-16-39-120(70)95(146)77(48(2)3)117-84(135)60(31-34-74(127)128)108-92(143)78(49(4)121)116-72(124)46-104-80(131)56(98)30-33-73(125)126)93(144)113-63(40-52-26-28-54(122)29-27-52)85(136)106-59(82(133)114-67(41-51-18-8-7-9-19-51)94(145)119-38-15-24-69(119)91(142)115-68)22-12-13-36-101-71(123)43-65(110-83(61)134)86(137)109-62(96(147)148)23-14-37-102-97(99)100/h7-11,18-21,26-29,45,48-50,56,58-70,77-79,103,121-122H,6,12-17,22-25,30-44,46-47,98H2,1-5H3,(H,101,123)(H,104,131)(H,105,138)(H,106,136)(H,107,132)(H,108,143)(H,109,137)(H,110,134)(H,111,140)(H,112,141)(H,113,144)(H,114,133)(H,115,142)(H,116,124)(H,117,135)(H,118,139)(H,125,126)(H,127,128)(H,147,148)(H4,99,100,102)/t49-,50-,56+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,69+,70+,77+,78+,79+/m1/s1",VDWWUCVWSORVCV-ZXKPROITSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2171,Microviridin N6,,Microviridin,,C93H128N22O27,1984.931927,O=C1C[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CC(NCCCC2)=O)=O)CCC(OC3)=O)=O)=O)NC([C@H]3NC([C@H]4N(CCC4)C([C@H](CC5=CC=CC=C5)NC([C@H]2NC([C@H](CC6=CC=C(O)C=C6)NC([C@@H](NC([C@H](CC7=CNC8=C7C=CC=C8)NC([C@H]9N(C([C@H](C(C)C)NC([C@H](CCC(O)=O)NC([C@](NC(CN)=O)([H])[C@@H](C)O)=O)=O)=O)CCC9)=O)=O)[C@@H](C)O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C93H128N22O27/c1-46(2)37-60-80(127)101-58-30-32-72(122)141-45-66-85(132)106-64(83(130)104-60)42-73(123)142-49(6)76(113-84(131)62(40-52-44-99-55-20-11-10-19-54(52)55)107-86(133)68-24-16-36-115(68)91(138)74(47(3)4)112-79(126)57(29-31-71(120)121)102-88(135)75(48(5)116)111-70(119)43-94)89(136)108-61(38-51-25-27-53(117)28-26-51)81(128)100-56(77(124)109-65(39-50-17-8-7-9-18-50)90(137)114-35-15-23-67(114)87(134)110-66)21-12-13-33-97-69(118)41-63(105-78(58)125)82(129)103-59(92(139)140)22-14-34-98-93(95)96/h7-11,17-20,25-28,44,46-49,56-68,74-76,99,116-117H,12-16,21-24,29-43,45,94H2,1-6H3,(H,97,118)(H,100,128)(H,101,127)(H,102,135)(H,103,129)(H,104,130)(H,105,125)(H,106,132)(H,107,133)(H,108,136)(H,109,124)(H,110,134)(H,111,119)(H,112,126)(H,113,131)(H,120,121)(H,139,140)(H4,95,96,98)/t48-,49-,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,68+,74+,75+,76+/m1/s1",NHBPCOSRFMASCI-AJDAMCSJSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2172,Microviridin N5,,Microviridin,,C91H125N21O26,1927.91,O=C1C[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CC(NCCCC2)=O)=O)CCC(OC3)=O)=O)=O)NC([C@H]3NC([C@H]4N(CCC4)C([C@H](CC5=CC=CC=C5)NC([C@H]2NC([C@H](CC6=CC=C(O)C=C6)NC([C@@H](NC([C@H](CC7=CNC8=C7C=CC=C8)NC([C@H]9N(C([C@H](C(C)C)NC([C@H](CCC(O)=O)NC([C@](N)([H])[C@@H](C)O)=O)=O)=O)CCC9)=O)=O)[C@@H](C)O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C91H125N21O26/c1-45(2)37-59-78(123)99-57-30-32-70(118)137-44-65-83(128)104-63(81(126)102-59)42-71(119)138-48(6)74(110-82(127)61(40-51-43-97-54-20-11-10-19-53(51)54)105-84(129)67-24-16-36-112(67)89(134)73(46(3)4)109-77(122)56(29-31-69(116)117)100-86(131)72(92)47(5)113)87(132)106-60(38-50-25-27-52(114)28-26-50)79(124)98-55(75(120)107-64(39-49-17-8-7-9-18-49)88(133)111-35-15-23-66(111)85(130)108-65)21-12-13-33-95-68(115)41-62(103-76(57)121)80(125)101-58(90(135)136)22-14-34-96-91(93)94/h7-11,17-20,25-28,43,45-48,55-67,72-74,97,113-114H,12-16,21-24,29-42,44,92H2,1-6H3,(H,95,115)(H,98,124)(H,99,123)(H,100,131)(H,101,125)(H,102,126)(H,103,121)(H,104,128)(H,105,129)(H,106,132)(H,107,120)(H,108,130)(H,109,122)(H,110,127)(H,116,117)(H,135,136)(H4,93,94,96)/t47-,48-,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,66+,67+,72+,73+,74+/m1/s1",UXTWYEYETQOGND-KTRRIIGVSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2173,Microviridin N4,,Microviridin,,C87H118N20O24,1826.862785,O=C1C[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CC(NCCCC2)=O)=O)CCC(OC3)=O)=O)=O)NC([C@H]3NC([C@H]4N(CCC4)C([C@H](CC5=CC=CC=C5)NC([C@H]2NC([C@H](CC6=CC=C(O)C=C6)NC([C@@H](NC([C@H](CC7=CNC8=C7C=CC=C8)NC([C@H]9N(C([C@H](C(C)C)NC([C@H](CCC(O)=O)N)=O)=O)CCC9)=O)=O)[C@@H](C)O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C87H118N20O24/c1-44(2)36-57-75(117)95-55-29-31-68(112)130-43-63-80(122)99-61(78(120)97-57)41-69(113)131-46(5)71(105-79(121)59(39-49-42-93-53-19-10-9-18-51(49)53)100-81(123)65-23-15-35-107(65)85(127)70(45(3)4)104-72(114)52(88)28-30-67(110)111)83(125)101-58(37-48-24-26-50(108)27-25-48)76(118)94-54(73(115)102-62(38-47-16-7-6-8-17-47)84(126)106-34-14-22-64(106)82(124)103-63)20-11-12-32-91-66(109)40-60(98-74(55)116)77(119)96-56(86(128)129)21-13-33-92-87(89)90/h6-10,16-19,24-27,42,44-46,52,54-65,70-71,93,108H,11-15,20-23,28-41,43,88H2,1-5H3,(H,91,109)(H,94,118)(H,95,117)(H,96,119)(H,97,120)(H,98,116)(H,99,122)(H,100,123)(H,101,125)(H,102,115)(H,103,124)(H,104,114)(H,105,121)(H,110,111)(H,128,129)(H4,89,90,92)/t46-,52+,54+,55+,56+,57+,58+,59+,60+,61+,62+,63+,64+,65+,70+,71+/m1/s1",CSSLOCPSDAMIML-IUVQFDFLSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2174,Microviridin N3,,Microviridin,,C82H111N19O21,1697.820192,O=C1C[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CCCNC(N)=N)=O)CC(NCCCC2)=O)=O)CCC(OC3)=O)=O)=O)NC([C@H]3NC([C@H]4N(CCC4)C([C@H](CC5=CC=CC=C5)NC([C@H]2NC([C@H](CC6=CC=C(O)C=C6)NC([C@@H](NC([C@H](CC7=CNC8=C7C=CC=C8)NC([C@H]9N(C([C@H](C(C)C)N)=O)CCC9)=O)=O)[C@@H](C)O1)=O)=O)=O)=O)=O)=O,"InChI=1S/C82H111N19O21/c1-42(2)34-54-70(108)90-52-28-29-64(104)121-41-60-75(113)94-58(73(111)92-54)39-65(105)122-44(5)67(99-74(112)56(37-47-40-88-50-19-10-9-18-49(47)50)95-76(114)62-23-15-33-101(62)80(118)66(83)43(3)4)78(116)96-55(35-46-24-26-48(102)27-25-46)71(109)89-51(68(106)97-59(36-45-16-7-6-8-17-45)79(117)100-32-14-22-61(100)77(115)98-60)20-11-12-30-86-63(103)38-57(93-69(52)107)72(110)91-53(81(119)120)21-13-31-87-82(84)85/h6-10,16-19,24-27,40,42-44,51-62,66-67,88,102H,11-15,20-23,28-39,41,83H2,1-5H3,(H,86,103)(H,89,109)(H,90,108)(H,91,110)(H,92,111)(H,93,107)(H,94,113)(H,95,114)(H,96,116)(H,97,106)(H,98,115)(H,99,112)(H,119,120)(H4,84,85,87)/t44-,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61+,62+,66+,67+/m1/s1",UIBNBIYGQJPKAS-DHYMJBHJSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2175,Nostopeptolide 1052,,other cyclic peptide,,C51H76N10O14,1052.554247,CC(N[C@@H]([C@H](C)CC)C(N[C@H]1COC([C@@H]2CCCN2C([C@@H](NC([C@@H](NC(CNC([C@H](NC(CC([C@@H](NC([C@@H]3C[C@@H](CN3C1=O)C)=O)CC(C)C)=O)=O)CC(C)C)=O)=O)CC(N)=O)=O)CC4=CC=C(C=C4)O)=O)=O)=O)=O,"InChI=1S/C51H76N10O14/c1-9-29(7)44(54-30(8)62)48(71)59-37-25-75-51(74)38-11-10-16-60(38)49(72)36(20-31-12-14-32(63)15-13-31)58-46(69)35(21-41(52)65)56-43(67)23-53-45(68)34(18-27(4)5)55-42(66)22-40(64)33(17-26(2)3)57-47(70)39-19-28(6)24-61(39)50(37)73/h12-15,26-29,33-39,44,63H,9-11,16-25H2,1-8H3,(H2,52,65)(H,53,68)(H,54,62)(H,55,66)(H,56,67)(H,57,70)(H,58,69)(H,59,71)/t28-,29+,33-,34+,35-,36-,37-,38-,39-,44-/m0/s1",VAAMNJLBXPQYCU-PXNRAKBUSA-N,,no,Nostoc ,punctiforme,PCC7 3102
CyanoMetDB_2176,MC-AhppaAhppa,,Microcystin,,C59H77N7O14,1107.55285,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CCCC2=CC=C(O)C=C2)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N3)CCCC4=CC=C(O)C=C4)=O)=O)=O)=O)N(C)C(C(N[C@@H](C3=O)C)=O)=C,"InChI=1S/C59H77N7O14/c1-34(32-35(2)49(80-8)33-42-14-10-9-11-15-42)20-29-45-36(3)52(70)64-48(58(76)77)30-31-50(69)66(7)39(6)55(73)60-38(5)54(72)63-47(19-13-17-41-23-27-44(68)28-24-41)57(75)65-51(59(78)79)37(4)53(71)62-46(56(74)61-45)18-12-16-40-21-25-43(67)26-22-40/h9-11,14-15,20-29,32,35-38,45-49,51,67-68H,6,12-13,16-19,30-31,33H2,1-5,7-8H3,(H,60,73)(H,61,74)(H,62,71)(H,63,72)(H,64,70)(H,65,75)(H,76,77)(H,78,79)/b29-20+,34-32+/t35-,36-,37-,38+,45-,46-,47-,48+,49-,51+/m0/s1",BTTNRPYLPGDHOC-HRTZVOIPSA-N,,yes,Microcystis ,aeruginosa,"field sample, bloom of Microcystis aeruginosa"
CyanoMetDB_2177,MC-AhppaR,,Microcystin,,C54H76N10O13,1072.55933,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N2)CCCC3=CC=C(O)C=C3)=O)=O)=O)=O)N(C)C(C(N[C@@H](C2=O)C)=O)=C,"InChI=1S/C54H76N10O13/c1-30(28-31(2)43(77-8)29-37-14-10-9-11-15-37)19-24-39-32(3)46(67)62-42(52(73)74)25-26-44(66)64(7)35(6)49(70)58-34(5)48(69)61-40(17-12-16-36-20-22-38(65)23-21-36)51(72)63-45(53(75)76)33(4)47(68)60-41(50(71)59-39)18-13-27-57-54(55)56/h9-11,14-15,19-24,28,31-34,39-43,45,65H,6,12-13,16-18,25-27,29H2,1-5,7-8H3,(H,58,70)(H,59,71)(H,60,68)(H,61,69)(H,62,67)(H,63,72)(H,73,74)(H,75,76)(H4,55,56,57)/b24-19+,30-28+/t31-,32-,33-,34+,39-,40-,41-,42+,43-,45+/m0/s1",WWYZEFPPLXTSCI-FQEDTQHSSA-N,145950954,yes,Microcystis ,aeruginosa,"field sample, bloom of Microcystis aeruginosa"
CyanoMetDB_2178,MC-HtyAhppa,,Microcystin,,C58H75N7O14,1093.5372,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CCCC2=CC=C(O)C=C2)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N3)CCC4=CC=C(O)C=C4)=O)=O)=O)=O)N(C)C(C(N[C@@H](C3=O)C)=O)=C,"InChI=1S/C58H75N7O14/c1-33(31-34(2)48(79-8)32-41-13-10-9-11-14-41)17-27-44-35(3)51(69)63-47(57(75)76)29-30-49(68)65(7)38(6)54(72)59-37(5)53(71)62-46(28-22-40-20-25-43(67)26-21-40)56(74)64-50(58(77)78)36(4)52(70)61-45(55(73)60-44)16-12-15-39-18-23-42(66)24-19-39/h9-11,13-14,17-21,23-27,31,34-37,44-48,50,66-67H,6,12,15-16,22,28-30,32H2,1-5,7-8H3,(H,59,72)(H,60,73)(H,61,70)(H,62,71)(H,63,69)(H,64,74)(H,75,76)(H,77,78)/b27-17+,33-31+/t34-,35-,36-,37+,44-,45-,46-,47+,48-,50+/m0/s1",NNMCUUKHSDLGJQ-PBKVJRLFSA-N,145958986,yes,Microcystis ,aeruginosa,"field sample, bloom of Microcystis aeruginosa"
CyanoMetDB_2179,Merosterolic acid A,,other linear non-peptide,terpene,C27H38O4,426.2770097,CC1(C)CCC[C@]2(C)[C@]1([H])CC[C@@]3(C)[C@@]2([H])CC[C@]4(C)[C@]3([H])CC5=C(O)C(O)=CC(C(O)=O)=C54,"InChI=1S/C27H38O4/c1-24(2)9-6-10-25(3)18(24)7-11-26(4)19(25)8-12-27(5)20(26)14-15-21(27)16(23(30)31)13-17(28)22(15)29/h13,18-20,28-29H,6-12,14H2,1-5H3,(H,30,31)/t18-,19+,20-,25-,26+,27-/m1/s1",VSODJBVPHOOTEU-OBYLJCASSA-N,146675136,yes,Scytonema ,n.a.,PCC 10023
CyanoMetDB_2180,Merosterolic acid B,,other linear non-peptide,terpene,C27H38O4,426.2770097,CC1(C)CCC[C@]2(C)[C@]1([H])CC[C@@]([C@@]3([H])CC4=C(O)C(O)=CC(C(O)=O)=C4)(C)[C@@]2([H])CCC3=C,"InChI=1S/C27H38O4/c1-16-7-8-22-26(4,12-9-21-25(2,3)10-6-11-27(21,22)5)19(16)14-17-13-18(24(30)31)15-20(28)23(17)29/h13,15,19,21-22,28-29H,1,6-12,14H2,2-5H3,(H,30,31)/t19-,21+,22+,26+,27+/m0/s1",ANTLVDCACHPFMI-FHUWYTBFSA-N,,yes,Scytonema ,n.a.,PCC 10023
CyanoMetDB_2181,6-deoxytolypodiol,,other linear non-peptide,,C28H40O4,440.2926598,C[C@]12CCC3[C@](C)(C1CC4=C(O2)C=CC(C(OC)=O)=C4)CC(C5[C@@]3([C@@H](CCC5(C)C)O)C)[H],"InChI=1S/C28H40O4/c1-25(2)12-11-23(29)28(5)20(25)9-13-26(3)21(28)10-14-27(4)22(26)16-18-15-17(24(30)31-6)7-8-19(18)32-27/h7-8,15,20-23,29H,9-14,16H2,1-6H3/t20?,21?,22?,23-,26-,27+,28+/m1/s1",XNFPFYUEZQFCLA-XUYFLUFYSA-N,,yes,Nostocales ,n.a.,HT-58-2
CyanoMetDB_2182,11-hydroxytolypodiol,,other linear non-peptide,,C28H40O6,472.282489,C[C@]12C[C@H](O)C3[C@](C)(C1CC4=C(O2)C=CC(C(OC)=O)=C4)C[C@H](C5[C@@]3([C@@H](CCC5(C)C)O)C)O,"InChI=1S/C28H40O6/c1-25(2)10-9-21(31)28(5)22(25)17(29)13-26(3)20-12-16-11-15(24(32)33-6)7-8-19(16)34-27(20,4)14-18(30)23(26)28/h7-8,11,17-18,20-23,29-31H,9-10,12-14H2,1-6H3/t17-,18+,20?,21-,22?,23?,26+,27+,28+/m1/s1",GHWVOKQFEBHUQZ-JHVXUHRBSA-N,,yes,Nostocales ,n.a.,HT-58-2
CyanoMetDB_2183,Hapalindole A,,other linear non-peptide,Hapalindole,C21H23ClN2,338.1549765,Cl[C@@H]1C[C@@H]2C(C)(C)C3=C(C([C@@H]2[C@@H](N=[C])[C@]1(C=C)C)=CN4)C4=CC=C3,"InChI=1S/C21H23ClN2/c1-6-21(4)16(22)10-14-18(19(21)23-5)12-11-24-15-9-7-8-13(17(12)15)20(14,2)3/h6-9,11,14,16,18-19,24H,1,10H2,2-4H3/t14-,16+,18-,19+,21-/m0/s1",UGBGKUYYYCTXAK-DJNKVENRSA-N,185159,yes,Hapalosiphon,fontinalis,V-3-1  
CyanoMetDB_2184,Hapalidole B,Hapalindole A isothiocyanate,other linear non-peptide,Hapalindole,C21H23ClN2S,370.1270472,Cl[C@@H]1C[C@@H]2C(C)(C)C3=C(C([C@@H]2[C@@H](N=C=S)[C@]1(C=C)C)=CN4)C4=CC=C3,"InChI=1S/C21H23ClN2S/c1-5-21(4)16(22)9-14-18(19(21)24-11-25)12-10-23-15-8-6-7-13(17(12)15)20(14,2)3/h5-8,10,14,16,18-19,23H,1,9H2,2-4H3/t14-,16+,18-,19?,21-/m0/s1",HYTBZXQKYMTBRU-ZUCJNZSISA-N,n.a. as of 04.01.022,yes,Hapalosiphon,fontinalis,V-3-1  
CyanoMetDB_2185,12-epi-Hapalindole H,,other linear non-peptide,Hapalindole,C21H24N2,304.1939488,CC1(C)[C@@H]2[C@H]([C@H]([N+]#[C-])[C@@](C)(C=C)CC2)C3=CNC4=C3C1=CC=C4,"InChI=1S/C21H24N2/c1-6-21(4)11-10-15-18(19(21)22-5)13-12-23-16-9-7-8-14(17(13)16)20(15,2)3/h6-9,12,15,18-19,23H,1,10-11H2,2-4H3/t15-,18+,19?,21-/m0/s1",SLUFHMQYBPOTFZ-KARKHZEHSA-N,,yes,Hapalosiphon,laingii,n.a.
CyanoMetDB_2187,12-epi-Hapalindole Q isonitrile,,other linear non-peptide,Hapalindole,C21H24N2,304.1939488,C[C@@]([C@@H]1[N+]#[C-])(C=C)CC[C@H](C(C)=C)[C@@H]1C2=CNC3=CC=CC=C32,"InChI=1S/C21H24N2/c1-6-21(4)12-11-15(14(2)3)19(20(21)22-5)17-13-23-18-10-8-7-9-16(17)18/h6-10,13,15,19-20,23H,1-2,11-12H2,3-4H3/t15-,19-,20?,21-/m1/s1",KGWATBYKCMCFLC-ADSJRPKNSA-N,,yes,Hapalosiphon,laingii,n.a.
CyanoMetDB_2188,Merosterol A,,other linear non-peptide,,C28H32Cl2O8,566.1474234,C[C@]1(COC)[C@@H](Cl)CC[C@]23[C@]1([H])[C@@H](OC3=O)[C@H](O)[C@@]4(C)[C@@]2(O)C[C@@H](O)[C@]5(C)C4=CC6=C(OCO7)C7=CC(Cl)=C65,"InChI=1S/C28H32Cl2O8/c1-24(10-35-4)16(30)5-6-27-21(24)20(38-23(27)33)22(32)26(3)15-7-12-18(13(29)8-14-19(12)37-11-36-14)25(15,2)17(31)9-28(26,27)34/h7-8,16-17,20-22,31-32,34H,5-6,9-11H2,1-4H3/t16-,17+,20+,21+,22-,24-,25-,26-,27+,28-/m0/s1",HBFUMXRTGQYCEA-SCJHGSEDSA-N,146684628,yes,Scytonema ,n.a.,PCC 10023
CyanoMetDB_2189,Merosterol A-regioisomer,,other linear non-peptide,,C28H32Cl2O8,566.1474234,C[C@]1(COC)[C@@H](Cl)CC[C@]23[C@]1([H])[C@@H](OC3=O)[C@H](O)[C@@]4(C)[C@@]2(O)C[C@@H](O)[C@]5(C)C4=CC6=C(Cl)C(OCO7)=C7C=C65,"InChI=1S/C28H32Cl2O8/c1-24(10-35-4)16(29)5-6-27-21(24)20(38-23(27)33)22(32)26(3)15-7-12-13(8-14-19(18(12)30)37-11-36-14)25(15,2)17(31)9-28(26,27)34/h7-8,16-17,20-22,31-32,34H,5-6,9-11H2,1-4H3/t16-,17+,20+,21+,22-,24-,25-,26-,27+,28-/m0/s1",MPDWJOZIRGXLFW-SCJHGSEDSA-N,,yes,Scytonema ,n.a.,PCC 10023
CyanoMetDB_2190,Merosterol B,,other linear non-peptide,,C29H34Cl2O8,580.1630735,C[C@]1(COC)CCC[C@]2(C(OC)=O)[C@]1([H])[C@H](Cl)[C@H](O)[C@@](C3=CC4=C(OCO5)C5=CC(Cl)=C4[C@@]36C)(C)[C@@]2(O)CC6=O,"InChI=1S/C29H34Cl2O8/c1-25(12-36-4)7-6-8-28(24(34)37-5)22(25)20(31)23(33)27(3)17-9-14-19(15(30)10-16-21(14)39-13-38-16)26(17,2)18(32)11-29(27,28)35/h9-10,20,22-23,33,35H,6-8,11-13H2,1-5H3/t20-,22+,23-,25+,26-,27-,28?,29-/m0/s1",SXWRGDXAWWEUSK-UVVHHOFYSA-N,146684629,yes,Scytonema ,n.a.,PCC 10023
CyanoMetDB_2192,Anabaenopeptin 788,,anabaenopeptin,,C41H58N8O8,788.4221108,O=C([C@H](C(C)C)NC(N[C@@H]1CCCCNC([C@H](CC2=CC=CC=C2)NC([C@@H](N(C([C@@H](NC([C@H](C(C)C)NC1=O)=O)CC3=CNC4=C3C=CC=C4)=O)C)C)=O)=O)=O)O,"InChI=1S/C41H56N8O8/c1-23(2)33-38(53)45-32(21-27-22-43-29-17-11-10-16-28(27)29)39(54)49(6)25(5)35(50)44-31(20-26-14-8-7-9-15-26)36(51)42-19-13-12-18-30(37(52)47-33)46-41(57)48-34(24(3)4)40(55)56/h7-11,14-17,22-25,30-34,43H,12-13,18-21H2,1-6H3,(H,42,51)(H,44,50)(H,45,53)(H,47,52)(H,55,56)(H2,46,48,57)/t25-,30+,31-,32-,33-,34-/m0/s1",HEAKELJCVBVEKW-IGRXUTMUSA-N,n.a. as of 04.01.022,yes,Brasilonema ,sp.,CT11
CyanoMetDB_2193,Anabaenopeptin 802a,,anabaenopeptin,,C42H58N8O8,802.4377609,O=C(O)[C@@H](NC(N[C@@H]1CCCCNC([C@@H](NC([C@H](C)N(C)C([C@H](CC2=CNC3=C2C=CC=C3)NC([C@@H](NC1=O)C(C)CC)=O)=O)=O)CC4=CC=CC=C4)=O)=O)C(C)C,"InChI=1S/C42H58N8O8/c1-7-25(4)35-39(54)46-33(22-28-23-44-30-18-12-11-17-29(28)30)40(55)50(6)26(5)36(51)45-32(21-27-15-9-8-10-16-27)37(52)43-20-14-13-19-31(38(53)48-35)47-42(58)49-34(24(2)3)41(56)57/h8-12,15-18,23-26,31-35,44H,7,13-14,19-22H2,1-6H3,(H,43,52)(H,45,51)(H,46,54)(H,48,53)(H,56,57)(H2,47,49,58)/t25?,26-,31+,32-,33-,34-,35-/m0/s1",FMXKKRVABMYCJR-YVUYXKKSSA-N,146684812,yes,Brasilonema ,sp.,CT11
CyanoMetDB_2194,Anabaenopeptin 802b,,anabaenopeptin,,C42H58N8O8,802.4377609,O=C(O)[C@@H](NC(N[C@@H]1CCCCNC([C@@H](NC([C@H](C)N(C)C([C@H](CC2=CNC3=C2C=CC=C3)NC([C@H](CC(C)C)NC1=O)=O)=O)=O)CC4=CC=CC=C4)=O)=O)C(C)C,"InChI=1S/C42H58N8O8/c1-24(2)20-32-39(54)47-34(22-28-23-44-30-17-11-10-16-29(28)30)40(55)50(6)26(5)36(51)45-33(21-27-14-8-7-9-15-27)37(52)43-19-13-12-18-31(38(53)46-32)48-42(58)49-35(25(3)4)41(56)57/h7-11,14-17,23-26,31-35,44H,12-13,18-22H2,1-6H3,(H,43,52)(H,45,51)(H,46,53)(H,47,54)(H,56,57)(H2,48,49,58)/t26-,31+,32-,33-,34-,35-/m0/s1",RZTDEMLYEYEFOR-AXTXQGMUSA-N,146684812,yes,Brasilonema ,sp.,CT11
CyanoMetDB_2195,Anabaenopeptin 816,,anabaenopeptin,,C43H60N8O8,816.453411,O=C(O)[C@H](CC(C)C)NC(N[C@@H]1CCCCNC([C@@H](NC([C@H](C)N(C)C([C@H](CC2=CNC3=C2C=CC=C3)NC([C@H](CC(C)C)NC1=O)=O)=O)=O)CC4=CC=CC=C4)=O)=O,"InChI=1S/C43H60N8O8/c1-25(2)20-33-40(55)48-35(23-29-24-45-31-17-11-10-16-30(29)31)41(56)51(6)27(5)37(52)46-34(22-28-14-8-7-9-15-28)38(53)44-19-13-12-18-32(39(54)47-33)49-43(59)50-36(42(57)58)21-26(3)4/h7-11,14-17,24-27,32-36,45H,12-13,18-23H2,1-6H3,(H,44,53)(H,46,52)(H,47,54)(H,48,55)(H,57,58)(H2,49,50,59)/t27-,32+,33-,34-,35-,36-/m0/s1",APRDGVVSRUXGCI-IIYHYORHSA-N,n.a. as of 04.01.022,no,Brasilonema ,sp.,CT11
CyanoMetDB_2196,Cyanochelin A,,other linear peptide,,C35H52N6O14,780.3541504,CCCCCCCCCCCC1=C(C2=N[C@@H](C(NCC(NCC(N[C@@H](C(C(O)=O)O)C(NCC(N[C@H]([C@H](O)C(O)=O)CO)=O)=O)=O)=O)=O)CO2)C(O)=CC=C1,"InChI=1S/C35H52N6O14/c1-2-3-4-5-6-7-8-9-10-12-20-13-11-14-23(43)27(20)33-40-22(19-55-33)31(49)37-15-24(44)36-16-26(46)41-28(30(48)35(53)54)32(50)38-17-25(45)39-21(18-42)29(47)34(51)52/h11,13-14,21-22,28-30,42-43,47-48H,2-10,12,15-19H2,1H3,(H,36,44)(H,37,49)(H,38,50)(H,39,45)(H,41,46)(H,51,52)(H,53,54)/t21-,22+,28-,29-,30?/m0/s1",JJPKARAEIBOESM-DENNKUBSSA-N,n.a. as of 04.01.022,yes,Rivularia,sp.,PCC 7116
CyanoMetDB_2197,Microviridin 1688,,microviridin,,C79H105N19O23,1687.763071,O=C(O)C(NC(C(NC(C(NC(C(NC(C(NC(C(CO1)NC(C2N(C(C(NC(C3NC(C(N4)CC(C)C)=O)=O)CC5=CC=C(O)C=C5)=O)CCC2)=O)=O)CC(OC(C)C(NC(C(NC(C(NC(C)=O)CCCNC(N)=N)=O)CC(N)=O)=O)C4=O)=O)=O)CC6=CNC7=C6C=CC=C7)=O)CCC1=O)=O)CCC(NCCCC3)=O)=O)CC8=CC=C(O)C=C8,"InChI=1S/C79H105N19O23/c1-39(2)31-53-70(110)87-50-13-7-8-28-83-62(103)26-24-51(69(109)95-58(78(118)119)33-43-18-22-46(101)23-19-43)88-68(108)52-25-27-63(104)120-38-59(96-75(115)60-15-10-30-98(60)77(117)57(94-67(50)107)32-42-16-20-45(100)21-17-42)74(114)92-56(72(112)90-54(71(111)89-52)34-44-37-85-48-12-6-5-11-47(44)48)36-64(105)121-40(3)65(76(116)93-53)97-73(113)55(35-61(80)102)91-66(106)49(86-41(4)99)14-9-29-84-79(81)82/h5-6,11-12,16-23,37,39-40,49-60,65,85,100-101H,7-10,13-15,24-36,38H2,1-4H3,(H2,80,102)(H,83,103)(H,86,99)(H,87,110)(H,88,108)(H,89,111)(H,90,112)(H,91,106)(H,92,114)(H,93,116)(H,94,107)(H,95,109)(H,96,115)(H,97,113)(H,118,119)(H4,81,82,84)",,n.a. as of 04.01.022,no,Nostoc,sp.,TH1SO1
CyanoMetDB_2198,Microviridin 1739,,microviridin,,C82H102N18O25,1738.726351,O=C1C(COC(CC(NC(C(CO2)NC(C3N(C(C(NC(C4NC(C(N1)CCCNC(N)=N)=O)=O)CC5=CC=C(O)C=C5)=O)CCC3)=O)=O)C(NC(CC6=CNC7=C6C=CC=C7)C(NC(CCC2=O)C(NC(CCC(NCCCC4)=O)C(NC(CC8=CC=C(O)C=C8)C(O)=O)=O)=O)=O)=O)=O)NC(C(NC(C(NC(C)=O)CC9=CC=C(O)C=C9)=O)CCC(O)=O)=O,"InChI=1S/C82H102N18O25/c1-42(101)88-57(34-43-13-19-47(102)20-14-43)74(115)92-55(26-29-66(106)107)73(114)98-62-41-125-68(109)38-59-76(117)94-58(37-46-39-87-51-9-3-2-8-50(46)51)75(116)93-56-27-30-67(108)124-40-63(78(119)95-59)99-79(120)64-12-7-33-100(64)80(121)60(35-44-15-21-48(103)22-16-44)96-70(111)52(89-69(110)53(90-77(62)118)11-6-32-86-82(83)84)10-4-5-31-85-65(105)28-25-54(91-71(56)112)72(113)97-61(81(122)123)36-45-17-23-49(104)24-18-45/h2-3,8-9,13-24,39,52-64,87,102-104H,4-7,10-12,25-38,40-41H2,1H3,(H,85,105)(H,88,101)(H,89,110)(H,90,118)(H,91,112)(H,92,115)(H,93,116)(H,94,117)(H,95,119)(H,96,111)(H,97,113)(H,98,114)(H,99,120)(H,106,107)(H,122,123)(H4,83,84,86)",WRRADDIJVYJTHS-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,sp.,TH1SO1
CyanoMetDB_2199,Microviridin 1748,,microviridin,,C85H105N17O24,1747.751837,O=C(N(CCC1)C1C(NC(CO2)C(NC(C(NC(CC3=CNC4=C3C=CC=C4)C(NC(CCC2=O)C(NC(CCC(NCCCC5)=O)C(NC(CC6=CC=C(O)C=C6)C(O)=O)=O)=O)=O)=O)CC(OC(C)C(NC(C(NC(C(NC(C)=O)CC7=CC=C(O)C=C7)=O)CCC(O)=O)=O)C(NC(CCCCN)C8=O)=O)=O)=O)=O)C(NC(C5N8)=O)CC9=CNC%10=C9C=CC=C%10,"InChI=1S/C85H105N17O24/c1-44-72(101-77(115)59(28-31-69(107)108)93-78(116)61(90-45(2)103)36-46-19-23-50(104)24-20-46)83(121)95-57(16-7-9-33-86)73(111)91-56-17-8-10-34-87-68(106)30-27-58(76(114)99-65(85(123)124)37-47-21-25-51(105)26-22-47)92-75(113)60-29-32-70(109)125-43-66(100-82(120)67-18-11-35-102(67)84(122)64(98-74(56)112)39-49-42-89-55-15-6-4-13-53(49)55)81(119)97-63(40-71(110)126-44)80(118)96-62(79(117)94-60)38-48-41-88-54-14-5-3-12-52(48)54/h3-6,12-15,19-26,41-42,44,56-67,72,88-89,104-105H,7-11,16-18,27-40,43,86H2,1-2H3,(H,87,106)(H,90,103)(H,91,111)(H,92,113)(H,93,116)(H,94,117)(H,95,121)(H,96,118)(H,97,119)(H,98,112)(H,99,114)(H,100,120)(H,101,115)(H,107,108)(H,123,124)",QARQTEUPQKNPHW-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,sp.,TH1SO1
CyanoMetDB_2200,Amantamide B,,other linear peptide,,C58H95N9O11,1093.715105,CCCC(N(C)[C@@H](C(C)C)C(N([C@H](C(N[C@H](C(N1CCC[C@H]1C(N([C@H](C(C)C)C(N[C@@H]([C@H](CC)C)C(NCC(N([C@@H](C(N2CCC[C@H]2C(OC)=O)=O)CC3=CC=CC=C3)C)=O)=O)=O)C)=O)=O)CC(C)C)=O)CC(C)C)C)=O)=O,"InChI=1S/C58H95N9O11/c1-17-24-46(68)64(14)50(38(9)10)57(76)63(13)44(32-36(5)6)51(70)60-41(31-35(3)4)54(73)66-29-22-27-42(66)55(74)65(15)49(37(7)8)53(72)61-48(39(11)18-2)52(71)59-34-47(69)62(12)45(33-40-25-20-19-21-26-40)56(75)67-30-23-28-43(67)58(77)78-16/h19-21,25-26,35-39,41-45,48-50H,17-18,22-24,27-34H2,1-16H3,(H,59,71)(H,60,70)(H,61,72)/t39-,41-,42-,43-,44-,45+,48-,49+,50-/m0/s1",POGQLZLHMNTNMI-QWJXWMLISA-N,n.a. as of 04.01.022,yes ,Oscillatoria,sp.,"field isolate, tentatively
identified as part of the genus Oscillatoria, Paracel Islands near Sansha
City (16° 51? 05.52?, 112° 20? 56.13?) in March 2017"
CyanoMetDB_2201,Amantamide,Amantamide A,other linear peptide,,C57H93N9O11,1079.699455,CCCC(=O)N[C@H](C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(=O)OC)[C@@H](C)CC)C(C)C)C(C)C,"InChI=1S/C57H93N9O11/c1-16-23-45(67)60-47(36(7)8)56(75)63(13)43(31-35(5)6)50(69)59-40(30-34(3)4)53(72)65-28-21-26-41(65)54(73)64(14)49(37(9)10)52(71)61-48(38(11)17-2)51(70)58-33-46(68)62(12)44(32-39-24-19-18-20-25-39)55(74)66-29-22-27-42(66)57(76)77-15/h18-20,24-25,34-38,40-44,47-49H,16-17,21-23,26-33H2,1-15H3,(H,58,70)(H,59,69)(H,60,67)(H,61,71)/t38-,40-,41-,42-,43-,44+,47-,48-,49+/m0/s1",ZPZNPEATKLIUKY-SFHKMCQHSA-N,146683173,yes ,Okeania ,n.a.,n.a.
CyanoMetDB_2202,Anabaenopeptin 852,AP 852,Anabaenopeptin,,C43H61N7O11,851.442357,O=C(N(C(C)C(NC(CC1=CC=CC=C1)C2=O)=O)C)C(NC(C(CC(C)C)NC(C(CCCCN2)NC(NC(CCC(O)=O)C(OCC)=O)=O)=O)=O)CCC3=CC=C(O)C=C3,"InChI=1S/C43H61N7O11/c1-6-61-42(59)33(21-22-36(52)53)49-43(60)48-31-14-10-11-23-44-38(55)35(25-29-12-8-7-9-13-29)46-37(54)27(4)50(5)41(58)32(20-17-28-15-18-30(51)19-16-28)45-40(57)34(24-26(2)3)47-39(31)56/h7-9,12-13,15-16,18-19,26-27,31-35,51H,6,10-11,14,17,20-25H2,1-5H3,(H,44,55)(H,45,57)(H,46,54)(H,47,56)(H,52,53)(H2,48,49,60)",CWTCUUWQRANBLV-UHFFFAOYSA-N,n.a. as of 04.01.022,no,n.a.,n.a.,n.a.
CyanoMetDB_2203,Anabaenopeptin 894,AP 894,Anabaenopeptin,,C46H70N8O10,894.520942,O=C(N(C(CCC1=CC=C(O)C=C1)C(NC(CC(C)C)C2=O)=O)C)C(NC(C(CC(C)C)NC(C(CCCCN2)NC(NC(CCCCN)C(O)=O)=O)=O)=O)CCC3=CC=C(O)C=C3,"InChI=1S/C46H70N8O10/c1-28(2)26-37-40(57)48-25-9-7-10-34(52-46(64)53-36(45(62)63)11-6-8-24-47)41(58)50-38(27-29(3)4)42(59)49-35(22-16-30-12-18-32(55)19-13-30)44(61)54(5)39(43(60)51-37)23-17-31-14-20-33(56)21-15-31/h12-15,18-21,28-29,34-39,55-56H,6-11,16-17,22-27,47H2,1-5H3,(H,48,57)(H,49,59)(H,50,58)(H,51,60)(H,62,63)(H2,52,53,64)",JXWXQOYZMYRSMT-UHFFFAOYSA-N,n.a. as of 04.01.022,no,n.a.,n.a.,n.a.
CyanoMetDB_2204,Anabaenopeptin 837,AP 837,Anabaenopeptin,,C42H59N7O11,837.426707,O=C(N(C(C)C(NC(CC1=CC=CC=C1)C2=O)=O)C)C(NC(C(C(C)C)NC(C(CCCCN2)NC(NC(CCC(O)=O)C(OCC)=O)=O)=O)=O)CCC3=CC=C(O)C=C3,"InChI=1S/C42H59N7O11/c1-6-60-41(58)32(21-22-34(51)52)47-42(59)46-30-14-10-11-23-43-37(54)33(24-28-12-8-7-9-13-28)45-36(53)26(4)49(5)40(57)31(20-17-27-15-18-29(50)19-16-27)44-39(56)35(25(2)3)48-38(30)55/h7-9,12-13,15-16,18-19,25-26,30-33,35,50H,6,10-11,14,17,20-24H2,1-5H3,(H,43,54)(H,44,56)(H,45,53)(H,48,55)(H,51,52)(H2,46,47,59)",MFTGBYWNYQGOFU-UHFFFAOYSA-N,n.a. as of 04.01.022,no,n.a.,n.a.,n.a.
CyanoMetDB_2205,MC-E(OMe)R,,Microcystin,,C49H72N10O14,1024.522947,O=C(N(C)C(C(N[C@@H]1C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC1=O)CCC(OC)=O)=O)=O)=O)=O,"InChI=1S/C49H72N10O14/c1-26(24-27(2)37(72-8)25-32-14-11-10-12-15-32)17-18-33-28(3)41(62)57-36(47(68)69)19-21-38(60)59(7)31(6)44(65)53-30(5)43(64)56-35(20-22-39(61)73-9)46(67)58-40(48(70)71)29(4)42(63)55-34(45(66)54-33)16-13-23-52-49(50)51/h10-12,14-15,17-18,24,27-30,33-37,40H,6,13,16,19-23,25H2,1-5,7-9H3,(H,53,65)(H,54,66)(H,55,63)(H,56,64)(H,57,62)(H,58,67)(H,68,69)(H,70,71)(H4,50,51,52)/b18-17+,26-24+/t27-,28-,29-,30+,33-,34-,35-,36+,37-,40+/m0/s1",MYXPYDJPQJCWNX-JVKMVRKTSA-N,,no,n.a.,n.a.,n.a.
CyanoMetDB_2206,MC-HarR,,Microcystin,,C50H77N13O12,1051.581465,O=C(N(C)C(C(N[C@@H]1C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](NC1=O)CCCCNC(N)=N)=O)=O)=O)=O,"InChI=1S/C50H77N13O12/c1-27(25-28(2)38(75-8)26-33-15-10-9-11-16-33)19-20-34-29(3)41(65)61-37(47(71)72)21-22-39(64)63(7)32(6)44(68)57-31(5)43(67)60-35(17-12-13-23-55-49(51)52)46(70)62-40(48(73)74)30(4)42(66)59-36(45(69)58-34)18-14-24-56-50(53)54/h9-11,15-16,19-20,25,28-31,34-38,40H,6,12-14,17-18,21-24,26H2,1-5,7-8H3,(H,57,68)(H,58,69)(H,59,66)(H,60,67)(H,61,65)(H,62,70)(H,71,72)(H,73,74)(H4,51,52,55)(H4,53,54,56)/b20-19+,27-25+/t28-,29-,30-,31+,34-,35-,36-,37+,38-,40+/m0/s1",VNBHESSKTBEXNT-TTXFPCFKSA-N,n.a. as of 04.01.022,no,n.a.,n.a.,n.a.
CyanoMetDB_2207,Spironostoic acid,,other linear non-peptide,Spirovetivane,C15H22O3,250.1568946,O=C1C([H])[C@H](C)[C@]2(C[C@@]([C@@]([H])(C(O)=O)C)([H])CC2)C(C)=C1,"InChI=1S/C15H22O3/c1-9-6-13(16)7-10(2)15(9)5-4-12(8-15)11(3)14(17)18/h6,10-12H,4-5,7-8H2,1-3H3,(H,17,18)/t10-,11?,12+,15+/m0/s1",SABXXOBLGYAFAZ-FMJGZGEYSA-N,n.a. as of 04.01.022,yes,Calothrix,sp.,R-3-1
CyanoMetDB_2208,"11,12-didehydrospironostoic acid",,other linear non-peptide,Spirovetivane,C15H20O3,248.1412445,O=C1C([H])[C@H](C)[C@]2(C[C@@](C(C(O)=O)=C)([H])CC2)C(C)=C1,"InChI=1S/C15H20O3/c1-9-6-13(16)7-10(2)15(9)5-4-12(8-15)11(3)14(17)18/h6,10,12H,3-5,7-8H2,1-2H3,(H,17,18)/t10-,12+,15+/m0/s1",LAWCKNORDBHEQP-JVLSTEMRSA-N,n.a. as of 04.01.022,yes,Calothrix,sp.,R-3-1
CyanoMetDB_2209,12-hydroxy-2-oxo-11-epi-hinesol,,other linear non-peptide,Spirovetivane,C15H24O3,252.1725446,CC([C@@]1(C[C@@]([C@](CO)(C)O)([H])CC1)[C@@H](C)C2)=CC2=O,"InChI=1S/C15H24O3/c1-10-6-13(17)7-11(2)15(10)5-4-12(8-15)14(3,18)9-16/h6,11-12,16,18H,4-5,7-9H2,1-3H3/t11-,12+,14+,15+/m0/s1",FWLWCLDHPUPCHO-CTHBEMJXSA-N,n.a. as of 04.01.022,yes,Calothrix,sp.,R-3-1
CyanoMetDB_2210,Stigolone,,other linear non-peptide,Eudesmane,C15H22O3,250.1568946,O=C1C[C@]2(C)[C@@](C[C@]([H])(C(C)=C)[C@@H](O)[C@H]2O)([H])C(C)=C1,"InChI=1S/C15H22O3/c1-8(2)11-6-12-9(3)5-10(16)7-15(12,4)14(18)13(11)17/h5,11-14,17-18H,1,6-7H2,2-4H3/t11-,12-,13-,14-,15-/m1/s1",CNSUTHNYYDBCKA-KJWHEZOQSA-N,n.a. as of 04.01.022,yes,Scytonema,sp.,U-3-3
CyanoMetDB_2211,"11R,12-dihydroxystigolone",,other linear non-peptide,Eudesmane,C15H24O5,284.1623739,O=C1C[C@]2(C)[C@@](C[C@]([H])([C@@](O)(CO)C)[C@@H](O)[C@H]2O)([H])C(C)=C1,"InChI=1S/C15H24O5/c1-8-4-9(17)6-14(2)10(8)5-11(12(18)13(14)19)15(3,20)7-16/h4,10-13,16,18-20H,5-7H2,1-3H3/t10-,11+,12-,13-,14-,15?/m1/s1",SABNXPXZUNKNJG-ZESULRICSA-N,n.a. as of 04.01.022,yes,Scytonema,sp.,U-3-3
CyanoMetDB_2212,"11S,12-dihydroxystigolone",,other linear non-peptide,Eudesmane,C15H24O5,284.1623739,O=C1C[C@]2(C)[C@@](C[C@]([H])([C@](O)(CO)C)[C@@H](O)[C@H]2O)([H])C(C)=C1,"InChI=1S/C15H24O5/c1-8-4-9(17)6-14(2)10(8)5-11(12(18)13(14)19)15(3,20)7-16/h4,10-13,16,18-20H,5-7H2,1-3H3/t10-,11+,12-,13-,14-,15?/m1/s1",SABNXPXZUNKNJG-ZESULRICSA-N,n.a. as of 04.01.022,yes,Scytonema,sp.,U-3-3
CyanoMetDB_2213,Hierridin C,,other linear non-peptide,,C23H39ClO3,398.2587728,OC1=C(CCCCCCCCCCCCCCC)C(Cl)=C(OC)C=C1OC,"InChI=1S/C23H39ClO3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22(24)20(26-2)18-21(27-3)23(19)25/h18,25H,4-17H2,1-3H3",LOYIDEKETTZLFY-UHFFFAOYSA-N,124158777,Yes,Cyanobium,sp.,LEGE 06113
CyanoMetDB_2214,Bartoloside A,,other linear non-peptide,,C36H62Cl2O6,660.3923451,CCCCCCCC(Cl)CCCCCC1=CC(O)=C(CCCCCC(Cl)CCCCCC)C(O[C@@H]2[C@H](O)[C@@H](O)[C@H](O)CO2)=C1,"InChI=1S/C36H62Cl2O6/c1-3-5-7-9-14-20-29(38)21-15-10-12-18-27-24-31(39)30(23-17-11-16-22-28(37)19-13-8-6-4-2)33(25-27)44-36-35(42)34(41)32(40)26-43-36/h24-25,28-29,32,34-36,39-42H,3-23,26H2,1-2H3/t28?,29?,32-,34+,35-,36-/m1/s1",XYNWKOXRMZVNTQ-UJGBXLCDSA-N,145720602,Yes,Nodosilinea,sp.,LEGE 06102
CyanoMetDB_2215,bartoloside A-17-yl palmitate,,other linear non-peptide,,C52H93ClO8,880.6558976,O[C@@H]1[C@@H](O)[C@H](O)CO[C@H]1OC2=C(CCCCCC(OC(CCCCCCCCCCCCCCC)=O)CCCCCC)C(O)=CC(CCCCCC(Cl)CCCCCCC)=C2,"InChI=1S/C52H93ClO8/c1-4-7-10-13-14-15-16-17-18-19-20-22-31-38-49(56)60-44(35-28-12-9-6-3)36-29-24-30-37-45-46(54)39-42(32-25-23-27-34-43(53)33-26-21-11-8-5-2)40-48(45)61-52-51(58)50(57)47(55)41-59-52/h39-40,43-44,47,50-52,54-55,57-58H,4-38,41H2,1-3H3/t43?,44?,47-,50+,51-,52+/m1/s1",IXIZQQJDULIZIS-WHPXEBKDSA-N,n.a. as of 04.01.022,Yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_2216,bartoloside A-29-yl palmitate,,other linear non-peptide,,C52H93ClO8,880.6558976,O[C@@H]1[C@@H](O)[C@H](O)CO[C@H]1OC2=C(CCCCCC(Cl)CCCCCC)C(O)=CC(CCCCCC(OC(CCCCCCCCCCCCCCC)=O)CCCCCCC)=C2,"InChI=1S/C52H93ClO8/c1-4-7-10-13-14-15-16-17-18-19-20-22-31-38-49(56)60-44(35-28-21-11-8-5-2)36-29-23-25-32-42-39-46(54)45(37-30-24-27-34-43(53)33-26-12-9-6-3)48(40-42)61-52-51(58)50(57)47(55)41-59-52/h39-40,43-44,47,50-52,54-55,57-58H,4-38,41H2,1-3H3/t43?,44?,47-,50+,51-,52+/m1/s1",OCLQGYIXCJLLOX-WHPXEBKDSA-N,n.a. as of 04.01.022,Yes,Synechocystis,salina,LEGE 06099
CyanoMetDB_2217,Bartoloside B,,other linear non-peptide,,C44H76Cl2O10,834.4815541,CCCCCCCCCC(CCCCCC1=CC(=C(C(=C1[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)O)CCCCCC(CCCCCC)Cl)O[C@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)C)O)O)O)Cl,"InChI=1S/C44H76Cl2O10/c1-4-6-8-10-11-12-17-23-32(46)24-18-13-15-21-30-27-35(56-44-42(53)40(51)37(48)29(3)55-44)33(26-20-14-19-25-31(45)22-16-9-7-5-2)38(49)36(30)43-41(52)39(50)34(47)28-54-43/h27,29,31-32,34,37,39-44,47-53H,4-26,28H2,1-3H3/t29-,31?,32?,34+,37-,39-,40+,41+,42+,43-,44-/m0/s1",RVFXECPBKXNNPT-OAOLDTQYSA-N,145720603,Yes,Synechocystis,salina,LEGE 06155
CyanoMetDB_2218,Bartoloside C,,other linear non-peptide,,C44H77ClO10,800.5205264,CCCCCCCCCCCCC1=C(C=C(C(=C1O)[C@H]2[C@@H]([C@H]([C@@H](CO2)O)O)O)CCCCCC(CCCCCCCCC)Cl)O[C@H]3[C@@H]([C@@H]([C@H]([C@@H](O3)C)O)O)O,"InChI=1S/C44H77ClO10/c1-4-6-8-10-12-13-14-16-18-23-27-33-35(55-44-42(52)40(50)37(47)30(3)54-44)28-31(36(38(33)48)43-41(51)39(49)34(46)29-53-43)24-20-19-22-26-32(45)25-21-17-15-11-9-7-5-2/h28,30,32,34,37,39-44,46-52H,4-27,29H2,1-3H3/t30-,32?,34+,37-,39-,40+,41+,42+,43-,44-/m0/s1",HCBVATPLVALITE-MEMNPCRQSA-N,145720604,Yes,Synechocystis,salina,LEGE 06155
CyanoMetDB_2219,Bartoloside D,,other linear non-peptide,,C44H75Cl3O10,868.4425817,CCCCCCCCCC(CCCCCC1=C(C(=C(C(=C1Cl)O[C@H]2[C@@H]([C@@H]([C@H]([C@@H](O2)C)O)O)O)CCCCCC(CCCCCC)Cl)O)[C@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)Cl,"InChI=1S/C44H75Cl3O10/c1-4-6-8-10-11-12-16-22-30(46)23-17-13-19-25-31-34(43-40(53)38(51)33(48)27-55-43)37(50)32(26-20-14-18-24-29(45)21-15-9-7-5-2)42(35(31)47)57-44-41(54)39(52)36(49)28(3)56-44/h28-30,33,36,38-41,43-44,48-54H,4-27H2,1-3H3/t28-,29?,30?,33+,36-,38-,39+,40+,41+,43-,44-/m0/s1",BRMPFHRPTFWBOB-LLONOIEDSA-N,145720605,Yes,Synechocystis,salina,LEGE 06155
CyanoMetDB_2220,Dehydroabietic acid,,other linear non-peptide,Diterpenoid,C20H28O2,300.2089301,CC(C)C1=CC2=C(C=C1)[C@]3(CCC[C@@]([C@@H]3CC2)(C)C(=O)O)C,"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)/t17-,19-,20-/m1/s1",NFWKVWVWBFBAOV-MISYRCLQSA-N,94391,Yes,Synechococcales,sp.,LEGE 10388
CyanoMetDB_2221,Abietic acid,,other linear non-peptide,Diterpenoid,C20H30O2,302.2245802,CC(C)C1=CC2=CC[C@@H]3[C@@]([C@H]2CC1)(CCC[C@@]3(C)C(=O)O)C,"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,10569,no,Nostoc,sp.,LEGE 06077
CyanoMetDB_2222,4-Oxo-beta-apo-13-Carotenone,,other linear non-peptide,,C18H24O2,272.17763,CC1=C(C(CCC1=O)(C)C)/C=C/C(=C/C=C/C(=O)C)/C,"InChI=1S/C18H24O2/c1-13(7-6-8-14(2)19)9-10-16-15(3)17(20)11-12-18(16,4)5/h6-10H,11-12H2,1-5H3/b8-6+,10-9+,13-7+",JKAIYKBBQFBZCO-HYPKMOEDSA-N,15406689,Yes,Anabaena,cylindrica,PCC 7122
CyanoMetDB_2223,132-hydroxy-pheophytin a,,other cyclic non-peptide,,C55H74N4O6,886.5608361,C=CC1=C(/C=C2N=C3C(CC)=C\2C)NC(/C=C4[C@@H](C)[C@H](CCC(OC/C=C(C)/CCCC(C)CCCC(C)CCCC(C)C)=O)C(C([C@](C(OC)=O)(O)C5=O)=C6C5=C(C)/C(N6)=C/3)=N/4)=C1C,"InChI=1S/C55H74N4O6/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)65-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)51(58-44)50-52-49(53(61)55(50,63)54(62)64-12)38(11)45(59-52)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42/h13,26,28-33,37,41,56,59,63H,1,14-25,27H2,2-12H3/b34-26+,42-28-,43-29-,44-28-,45-30-,46-29-,47-30-,51-50+/t32?,33?,37-,41-,55-/m0/s1",FXEQZWHMONOEMA-NHQODRBHSA-N,n.a. as of 04.01.022,Yes,Cyanobium,sp.,LEGE 07175
CyanoMetDB_2224,132-hydroxy-pheofarnesin a,,other cyclic non-peptide,,C50H64N4O6,816.4825858,C=CC1=C(/C=C2N=C3C(CC)=C\2C)NC(/C=C4[C@@H](C)[C@H](CCC(OC/C=C(C)/CCCC(C)CCCC(C)C)=O)C(C([C@](C(OC)=O)(O)C5=O)=C6C5=C(C)/C(N6)=C/3)=N/4)=C1C,"InChI=1S/C50H64N4O6/c1-12-34-30(7)37-24-39-32(9)36(20-21-43(55)60-23-22-29(6)19-15-18-28(5)17-14-16-27(3)4)46(53-39)45-47-44(48(56)50(45,58)49(57)59-11)33(10)40(54-47)26-42-35(13-2)31(8)38(52-42)25-41(34)51-37/h12,22,24-28,32,36,51,54,58H,1,13-21,23H2,2-11H3/b29-22+,37-24-,38-25-,39-24-,40-26-,41-25-,42-26-,46-45+/t28?,32-,36-,50-/m0/s1",UFCKWFRYQWKLDM-BYQOBFRJSA-N,n.a. as of 04.01.022,Yes,Nodosilinea,sp.,LEGE 06001
CyanoMetDB_2228,Nocuolactylate D,,other linear non-peptide,,C31H55ClN2O6,586.3748652,CCCCCC1=NN(C(CCOC([C@H](C)OC(CCCCCCCCCCC([H])Cl)=O)=O)=O)O[C@H](CCCCC)C1,"InChI=1S/C31H55ClN2O6/c1-4-6-15-19-27-25-28(20-16-7-5-2)40-34(33-27)29(35)22-24-38-31(37)26(3)39-30(36)21-17-13-11-9-8-10-12-14-18-23-32/h26,28H,4-25H2,1-3H3/t26-,28+/m0/s1",JLAGHSRVLWTKBE-XTEPFMGCSA-N,n.a. as of 04.01.022,no,Nodularia,sp.,LEGE 06071
CyanoMetDB_2229,Nocuolactylate E,,other linear non-peptide,,C31H56N2O6,552.4138375,CCCCCC1=NN(C(CCOC([C@H](C)OC(CCCCCCCCCCC)=O)=O)=O)O[C@H](CCCCC)C1,"InChI=1S/C31H56N2O6/c1-5-8-11-12-13-14-15-16-19-22-30(35)38-26(4)31(36)37-24-23-29(34)33-32-27(20-17-9-6-2)25-28(39-33)21-18-10-7-3/h26,28H,5-25H2,1-4H3/t26-,28+/m0/s1",PLTHDGCTFOIMBR-XTEPFMGCSA-N,n.a. as of 04.01.022,no,Nodularia,sp.,LEGE 06071
CyanoMetDB_2230,Chlorosphaerolactylate A,,other linear non-peptide,,C15H26Cl2O4,340.1208147,C[C@@H](C(=O)O)OC(=O)CCCCC(CCCCCCCl)Cl,"InChI=1S/C15H26Cl2O4/c1-12(15(19)20)21-14(18)10-6-5-9-13(17)8-4-2-3-7-11-16/h12-13H,2-11H2,1H3,(H,19,20)/t12-,13?/m0/s1",VVAHVWPREJBZKW-UEWDXFNNSA-N,156014689,Yes,Sphaerospermopsis,sp.,LEGE 00249
CyanoMetDB_2231,Chlorosphaerolactylate B,,other linear non-peptide,,C15H27ClO4,306.1597871,CC(C(=O)O)OC(=O)CCCCCCCCCCCCl,"InChI=1S/C15H27ClO4/c1-13(15(18)19)20-14(17)11-9-7-5-3-2-4-6-8-10-12-16/h13H,2-12H2,1H3,(H,18,19)",SFJAMELRYCBOPH-UHFFFAOYSA-N,156017539,Yes,Sphaerospermopsis,sp.,LEGE 00249
CyanoMetDB_2232,Chlorosphaerolactylate C,,other linear non-peptide,,C15H27ClO4,306.1597871,CCCCCCC(CCCCC(=O)OC(C)C(=O)O)Cl,"InChI=1S/C15H27ClO4/c1-3-4-5-6-9-13(16)10-7-8-11-14(17)20-12(2)15(18)19/h12-13H,3-11H2,1-2H3,(H,18,19)",FVQZHQYFGGVUMB-UHFFFAOYSA-N,156011703,Yes,Sphaerospermopsis,sp.,LEGE 00249
CyanoMetDB_2233,Chlorosphaerolactylate D,,other linear non-peptide,,C15H25Cl3O4,374.0818424,CC(C(=O)O)OC(=O)CCCCC(CCCCCC(Cl)Cl)Cl,"InChI=1S/C15H25Cl3O4/c1-11(15(20)21)22-14(19)10-6-5-8-12(16)7-3-2-4-9-13(17)18/h11-13H,2-10H2,1H3,(H,20,21)",ISBIDCLRYLGPPC-UHFFFAOYSA-N,156015038,Yes,Sphaerospermopsis,sp.,LEGE 00249
CyanoMetDB_2235,Hapalosin C,,other cyclic non-peptide,,C28H41NO6,487.293388,CC([C@H](OC([C@H]([C@H]1CCCCCCC)C)=O)C(N([C@@H](CC2=CC=CC=C2)C(CC(O1)=O)=O)C)=O)C,"InChI=1S/C28H41NO6/c1-6-7-8-9-13-16-24-20(4)28(33)35-26(19(2)3)27(32)29(5)22(23(30)18-25(31)34-24)17-21-14-11-10-12-15-21/h10-12,14-15,19-20,22,24,26H,6-9,13,16-18H2,1-5H3/t20-,22-,24+,26-/m0/s1",OOKZFSOXPOOYFR-XDDOSOJWSA-N,n.a. as of 04.01.022,no,Fischerella,sp.,PCC 9431
CyanoMetDB_2236,Hapalosin D,,other cyclic non-peptide,,C27H41NO6,475.293388,CC([C@H](OC(C[C@H]1CCCCCCC)=O)C(N([C@@H](CC2=CC=CC=C2)[C@@H](CC(O1)=O)O)C)=O)C,"InChI=1S/C27H41NO6/c1-5-6-7-8-12-15-21-17-24(30)34-26(19(2)3)27(32)28(4)22(23(29)18-25(31)33-21)16-20-13-10-9-11-14-20/h9-11,13-14,19,21-23,26,29H,5-8,12,15-18H2,1-4H3/t21-,22+,23-,26+/m1/s1",OKLJLJXFMBXPDZ-VUMQFKOGSA-N,n.a. as of 04.01.022,no,Fischerella,sp.,PCC 9431
CyanoMetDB_2237,Hapalosin E,,other cyclic non-peptide,,C27H41NO6,475.293388,CC[C@H](OC([C@H]([C@H]1CCCCCCC)C)=O)C(N([C@@H](CC2=CC=CC=C2)[C@@H](CC(O1)=O)O)C)=O,"InChI=1S/C27H41NO6/c1-5-7-8-9-13-16-24-19(3)27(32)34-23(6-2)26(31)28(4)21(22(29)18-25(30)33-24)17-20-14-11-10-12-15-20/h10-12,14-15,19,21-24,29H,5-9,13,16-18H2,1-4H3/t19-,21-,22+,23-,24+/m0/s1",AZBCVXGNHJUBLD-SMQFJCFBSA-N,n.a. as of 04.01.022,no,Fischerella,sp.,PCC 9431
CyanoMetDB_2238,Hapalosin F,,other cyclic non-peptide,,C26H39NO6,461.277738,CC([C@H](OC([C@H]([C@H]1CCCCC)C)=O)C(N([C@@H](CC2=CC=CC=C2)[C@@H](CC(O1)=O)O)C)=O)C,"InChI=1S/C26H39NO6/c1-6-7-9-14-22-18(4)26(31)33-24(17(2)3)25(30)27(5)20(21(28)16-23(29)32-22)15-19-12-10-8-11-13-19/h8,10-13,17-18,20-22,24,28H,6-7,9,14-16H2,1-5H3/t18-,20-,21+,22+,24-/m0/s1",BLSCHOWASFDSBC-BIRKEBMYSA-N,n.a. as of 04.01.022,no,Fischerella,sp.,PCC 9431
CyanoMetDB_2239,Hapalosin G,,other cyclic non-peptide,,C26H39NO6,461.277738,C[C@H](OC([C@H]([C@H]1CCCCCCC)C)=O)C(N([C@@H](CC2=CC=CC=C2)[C@@H](CC(O1)=O)O)C)=O,"InChI=1S/C26H39NO6/c1-5-6-7-8-12-15-23-18(2)26(31)32-19(3)25(30)27(4)21(22(28)17-24(29)33-23)16-20-13-10-9-11-14-20/h9-11,13-14,18-19,21-23,28H,5-8,12,15-17H2,1-4H3/t18-,19-,21-,22+,23+/m0/s1",LMKYKYILQNHPKH-PXVQWCDCSA-N,n.a. as of 04.01.022,no,Fischerella,sp.,PCC 9431
CyanoMetDB_2240,Microginin 299A,Microginin 299-A,Microginin,,C45H67ClN6O10,886.4607,CC(C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC1=CC=C(C=C1)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)O)NC(=O)[C@H]([C@H](CCCCCCCCl)N)O,"InChI=1S/C45H67ClN6O10/c1-27(2)37(49-41(57)39(55)33(47)13-10-8-7-9-11-23-46)43(59)51(6)38(28(3)4)44(60)50(5)36(26-30-17-21-32(54)22-18-30)42(58)52-24-12-14-35(52)40(56)48-34(45(61)62)25-29-15-19-31(53)20-16-29/h15-22,27-28,33-39,53-55H,7-14,23-26,47H2,1-6H3,(H,48,56)(H,49,57)(H,61,62)/t33-,34-,35-,36-,37-,38-,39-/m0/s1",GTUNZCVHPMEXMH-ZTYVOHGWSA-N,10056525,Yes,Microcystis,aeruginosa,NIES 299
CyanoMetDB_2241,Microginin 299B,Microginin 299-B,Microginin,,C45H66Cl2N6O10,920.4217,CC(C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC1=CC=C(C=C1)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CC3=CC=C(C=C3)O)C(=O)O)NC(=O)[C@H]([C@H](CCCCCCC(Cl)Cl)N)O,"InChI=1S/C45H66Cl2N6O10/c1-26(2)37(50-41(58)39(56)32(48)12-9-7-8-10-14-36(46)47)43(60)52(6)38(27(3)4)44(61)51(5)35(25-29-17-21-31(55)22-18-29)42(59)53-23-11-13-34(53)40(57)49-33(45(62)63)24-28-15-19-30(54)20-16-28/h15-22,26-27,32-39,54-56H,7-14,23-25,48H2,1-6H3,(H,49,57)(H,50,58)(H,62,63)/t32-,33-,34-,35-,37-,38-,39-/m0/s1",IPQXHBHVRZYMAN-RATCGQHHSA-N,11766324,Yes,Microcystis,aeruginosa,NIES 299
CyanoMetDB_2242,Microginin 299C,Microginin 299-C,Microginin,,C45H68N6O10,852.4997,CC(C(NC([C@H](O)C(N)CCCCCCC)=O)C(N([C@H](C(N(C(C(N1CCCC1C(NC(C(O)=O)CC2=CC=C(O)C=C2)=O)=O)CC3=CC=C(O)C=C3)C)=O)C(C)C)C)=O)C,"InChI=1S/C45H68N6O10/c1-8-9-10-11-12-14-33(46)39(54)41(56)48-37(27(2)3)43(58)50(7)38(28(4)5)44(59)49(6)36(26-30-18-22-32(53)23-19-30)42(57)51-24-13-15-35(51)40(55)47-34(45(60)61)25-29-16-20-31(52)21-17-29/h16-23,27-28,33-39,52-54H,8-15,24-26,46H2,1-7H3,(H,47,55)(H,48,56)(H,60,61)/t33-,34-,35-,36-,37-,38-,39-/m0/s1",DTXKFCMLEVLURZ-ZTYVOHGWSA-N,10463277,Yes,Microcystis,aeruginosa,NIES 299
CyanoMetDB_2243,Desmamide A,,other cyclic peptide,Glyco-lipo-peptides,C66H105N11O21,1387.74865,NC(=O)CC[C@H]1NC(=O)C(C)C(CC(O)CCCCC)OC(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)CNC1=O)C(C)C)Cc1ccc(cc1)O[C@H]1OC[C@@H](O)[C@H](O)[C@H]1O)[C@@H](C)O,"InChI=1S/C66H105N11O21/c1-10-11-12-15-39(80)29-49-36(8)56(86)69-41(22-23-50(67)82)57(87)68-30-51(83)76-24-13-16-46(76)61(91)74-52(35(6)7)62(92)71-43(28-38-18-20-40(21-19-38)97-66-55(85)54(84)48(81)32-96-66)58(88)73-45(31-78)60(90)70-42(26-33(2)3)59(89)75-53(37(9)79)63(93)72-44(27-34(4)5)64(94)77-25-14-17-47(77)65(95)98-49/h18-21,33-37,39,41-49,52-55,66,78-81,84-85H,10-17,22-32H2,1-9H3,(H2,67,82)(H,68,87)(H,69,86)(H,70,90)(H,71,92)(H,72,93)(H,73,88)(H,74,91)(H,75,89)/t36?,37-,39?,41-,42+,43+,44+,45+,46+,47+,48-,49?,52+,53+,54+,55-,66-/m1/s1",SGSWMZBFZBNBSH-ONBVFTLRSA-N,n.a. as of 04.01.022,Yes,Desmonostoc,muscorum,LEGE12446
CyanoMetDB_2244,Desmamide B,,other cyclic peptide,Glyco-lipo-peptides,C68H107N11O22,1429.75921,CC(C)C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@@H](CCC(=O)N)NC(=O)C(C)C(CC(O)CCCCC)OC(=O)[C@@H]2CCCN2C1=O)C(C)C)Cc1ccc(cc1)O[C@H]1OC[C@@H](OC(C)=O)[C@H](O)[C@H]1O)[C@@H](C)O,"InChI=1S/C68H107N11O22/c1-11-12-13-16-41(83)30-50-37(8)58(88)71-43(23-24-52(69)84)59(89)70-31-53(85)78-25-14-17-48(78)63(93)76-54(36(6)7)64(94)73-45(29-40-19-21-42(22-20-40)100-68-57(87)56(86)51(33-98-68)99-39(10)82)60(90)75-47(32-80)62(92)72-44(27-34(2)3)61(91)77-55(38(9)81)65(95)74-46(28-35(4)5)66(96)79-26-15-18-49(79)67(97)101-50/h19-22,34-38,41,43-51,54-57,68,80-81,83,86-87H,11-18,23-33H2,1-10H3,(H2,69,84)(H,70,89)(H,71,88)(H,72,92)(H,73,94)(H,74,95)(H,75,90)(H,76,93)(H,77,91)/t37?,38-,41?,43-,44+,45+,46+,47+,48+,49+,50?,51-,54+,55+,56+,57-,68-/m1/s1",HOBULLUHJKDCFY-YBOMPZLVSA-N,n.a. as of 04.01.022,Yes,Desmonostoc,muscorum,LEGE12446
CyanoMetDB_2245,Desmamide C,,other cyclic peptide,Glyco-lipo-peptides,C61H97N11O17,1255.70639,CC(C)C[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)CNC(=O)[C@H](NC(=O)C(C)C(CC(O)CCCCC)OC(=O)[C@@H]2CCCN2C1=O)CCC(N)=O)C(C)C)[C@@H](C)O,"InChI=1S/C61H97N11O17/c1-10-11-12-15-39(76)29-47-35(8)52(79)64-40(22-23-48(62)77)53(80)63-30-49(78)71-24-13-16-45(71)57(84)69-50(34(6)7)58(85)66-42(28-37-18-20-38(75)21-19-37)54(81)68-44(31-73)56(83)65-41(26-32(2)3)55(82)70-51(36(9)74)59(86)67-43(27-33(4)5)60(87)72-25-14-17-46(72)61(88)89-47/h18-21,32-36,39-47,50-51,73-76H,10-17,22-31H2,1-9H3,(H2,62,77)(H,63,80)(H,64,79)(H,65,83)(H,66,85)(H,67,86)(H,68,81)(H,69,84)(H,70,82)/t35?,36-,39?,40-,41+,42+,43+,44+,45+,46+,47?,50+,51+/m1/s1",DULVYLSIPPATMK-VHNJGLBFSA-N,n.a. as of 04.01.022,Yes,Desmonostoc,muscorum,LEGE12446
CyanoMetDB_2246,Anabaenopeptin 899,,Anabaenopeptin,,C48H65N7O10,899.4792913,OC1=CC=C(CCC(N(C2=O)C)C(NC(C(NCCCCC(C(NC(C(NC2CCC3=CC=C(O)C=C3)=O)C(C)C)=O)NC(NC(C(O)=O)CC4=CC=CC=C4)=O)=O)C(C)CC)=O)C=C1,"InChI=1S/C48H65N7O10/c1-6-30(4)41-44(60)49-27-11-10-14-36(51-48(65)52-38(47(63)64)28-33-12-8-7-9-13-33)42(58)53-40(29(2)3)45(61)50-37(25-19-31-15-21-34(56)22-16-31)46(62)55(5)39(43(59)54-41)26-20-32-17-23-35(57)24-18-32/h7-9,12-13,15-18,21-24,29-30,36-41,56-57H,6,10-11,14,19-20,25-28H2,1-5H3,(H,49,60)(H,50,61)(H,53,58)(H,54,59)(H,63,64)(H2,51,52,65)",NRNPTVHAOMDDJE-UHFFFAOYSA-N,n.a. as of 04.01.022,yes,Woronichinia,naegeliana,
CyanoMetDB_2247,Cyanopeptolin 1081,,Cyanopeptolin,,C52H75N9O16,1081.533177,OC1=CC=C(CC(NC(C(CO)O)=O)C(NC(C(NC(C(OC(C(NC(C(N2C)CC3=CC=CC=C3)=O)C(CC)C)=O)C)C(NC(C(NC4CCC(O)N(C(C(C)O)C2=O)C4=O)=O)CC(C)C)=O)=O)CCC(N)=O)=O)C=C1,"InChI=1S/C52H75N9O16/c1-8-27(4)41-52(76)77-29(6)42(59-44(68)33(18-20-39(53)66)54-46(70)36(56-48(72)38(65)25-62)23-31-14-16-32(64)17-15-31)49(73)57-35(22-26(2)3)45(69)55-34-19-21-40(67)61(50(34)74)43(28(5)63)51(75)60(7)37(47(71)58-41)24-30-12-10-9-11-13-30/h9-17,26-29,33-38,40-43,62-65,67H,8,18-25H2,1-7H3,(H2,53,66)(H,54,70)(H,55,69)(H,56,72)(H,57,73)(H,58,71)(H,59,68)",YWHUZBDIJWEVIK-UHFFFAOYSA-N,n.a. as of 04.01.022,yes,Woronichinia,naegeliana,
CyanoMetDB_2248,Aplysiadione,,other linear non-peptide,polyketide,C26H40O5,432.2875744,OC1=CC=CC([C@@H](OC)CC[C@H](C)[C@@H](O)[C@@H](C)/C=C/C(C(C)(C)CC(C)C(C)=O)=O)=C1,"InChI=1S/C26H40O5/c1-17(11-13-23(31-7)21-9-8-10-22(28)15-21)25(30)18(2)12-14-24(29)26(5,6)16-19(3)20(4)27/h8-10,12,14-15,17-19,23,25,28,30H,11,13,16H2,1-7H3/b14-12+/t17-,18-,19?,23?,25+/m0/s1",CSAOHTMPIBTPCE-IEWGFOTKSA-N,n.a. as of 04.01.022,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2249,Aplysiaenal,,other linear non-peptide,polyketide,C16H22O3,262.16,OC1=CC=CC([C@@H](OC)CC[C@H](C)/C=C(C)/C=O)=C1,"InChI=1S/C16H22O3/c1-12(9-13(2)11-17)7-8-16(19-3)14-5-4-6-15(18)10-14/h4-6,9-12,16,18H,7-8H2,1-3H3/b13-9+/t12-,16?/m0/s1",RWVCAAUWOOPGHR-PPTOKFEYSA-N,n.a. as of 04.01.022,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2250,Varlaxin 740,,other linear non-peptide,,C29H52N6O14S,740.3262211,OC1C(OC2CCC3CC(C(NCCCCNC(N)=N)=O)N(C(C(NC(C(COS(O)(=O)=O)OC)=O)C(C)C)=O)C3C2)OC(CO)C(O)C1O,"InChI=1S/C29H52N6O14S/c1-14(2)21(34-26(41)20(46-3)13-47-50(43,44)45)27(42)35-17-11-16(48-28-24(39)23(38)22(37)19(12-36)49-28)7-6-15(17)10-18(35)25(40)32-8-4-5-9-33-29(30)31/h14-24,28,36-39H,4-13H2,1-3H3,(H,32,40)(H,34,41)(H4,30,31,33)(H,43,44,45)",FLXAZZYFDDKSRB-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,,UHCC 0817
CyanoMetDB_2251,Varlaxin 764,,other linear non-peptide,,C31H52N6O14S,764.3262211,OC1C(OC2CCC3CC(C(NCCC4=CCN(C(N)=N)C4)=O)N(C(C(NC(C(COS(O)(=O)=O)OC)=O)C(C)C)=O)C3C2)OC(CO)C(O)C1O,"InChI=1S/C31H52N6O14S/c1-15(2)23(35-28(43)22(48-3)14-49-52(45,46)47)29(44)37-19-11-18(50-30-26(41)25(40)24(39)21(13-38)51-30)5-4-17(19)10-20(37)27(42)34-8-6-16-7-9-36(12-16)31(32)33/h7,15,17-26,30,38-41H,4-6,8-14H2,1-3H3,(H3,32,33)(H,34,42)(H,35,43)(H,45,46,47)",CLSJQIQCDHNIHY-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,,UHCC 0817
CyanoMetDB_2252,Varlaxin 754,,other linear non-peptide,,C30H54N6O14S,754.3418712,OC1C(OC2CCC3CC(C(NCCCCNC(N)=N)=O)N(C(C(NC(C(COS(O)(=O)=O)OC)=O)C(CC)C)=O)C3C2)OC(CO)C(O)C1O,"InChI=1S/C30H54N6O14S/c1-4-15(2)22(35-27(42)21(47-3)14-48-51(44,45)46)28(43)36-18-12-17(49-29-25(40)24(39)23(38)20(13-37)50-29)8-7-16(18)11-19(36)26(41)33-9-5-6-10-34-30(31)32/h15-25,29,37-40H,4-14H2,1-3H3,(H,33,41)(H,35,42)(H4,31,32,34)(H,44,45,46)",RAJLZDCTCSZRRK-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,,UHCC 0870
CyanoMetDB_2253,Varlaxin 778,,other linear non-peptide,,C32H54N6O14S,778.3418712,OC1C(OC2CCC3CC(C(NCCC4=CCN(C(N)=N)C4)=O)N(C(C(NC(C(COS(O)(=O)=O)OC)=O)C(CC)C)=O)C3C2)OC(CO)C(O)C1O,"InChI=1S/C32H54N6O14S/c1-4-16(2)24(36-29(44)23(49-3)15-50-53(46,47)48)30(45)38-20-12-19(51-31-27(42)26(41)25(40)22(14-39)52-31)6-5-18(20)11-21(38)28(43)35-9-7-17-8-10-37(13-17)32(33)34/h8,16,18-27,31,39-42H,4-7,9-15H2,1-3H3,(H3,33,34)(H,35,43)(H,36,44)(H,46,47,48)",DKQPYCNBGRHUCG-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,,UHCC 0870
CyanoMetDB_2262,Varlaxin 1008A,,other linear non-peptide,,C45H64N6O18S,1008.39978,OC1C(O)C(COC(CC2=CC=C(O)C=C2)=O)OC(OC3CCC4CC(C(NCCCCNC(N)=N)=O)N(C(C(NC(C(COS(O)(=O)=O)OC)=O)C(C)C)=O)C4C3)C1OC(CC5=CC=C(O)C=C5)=O,"InChI=1S/C45H64N6O18S/c1-24(2)37(50-42(59)34(64-3)23-66-70(61,62)63)43(60)51-31-21-30(15-10-27(31)20-32(51)41(58)48-16-4-5-17-49-45(46)47)67-44-40(69-36(55)19-26-8-13-29(53)14-9-26)39(57)38(56)33(68-44)22-65-35(54)18-25-6-11-28(52)12-7-25/h6-9,11-14,24,27,30-34,37-40,44,52-53,56-57H,4-5,10,15-23H2,1-3H3,(H,48,58)(H,50,59)(H4,46,47,49)(H,61,62,63)",UPUCQJHDYLIIJC-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,,UHCC 0870
CyanoMetDB_2263,Varlaxin 1032A,,other linear non-peptide,,C47H64N6O18S,1032.39978,OC1C(O)C(COC(CC2=CC=C(O)C=C2)=O)OC(OC3CCC4CC(C(NCCC5=CCN(C(N)=N)C5)=O)N(C(C(NC(C(COS(O)(=O)=O)OC)=O)C(C)C)=O)C4C3)C1OC(CC6=CC=C(O)C=C6)=O,"InChI=1S/C47H64N6O18S/c1-25(2)39(51-44(61)36(66-3)24-68-72(63,64)65)45(62)53-33-21-32(13-8-29(33)20-34(53)43(60)50-16-14-28-15-17-52(22-28)47(48)49)69-46-42(71-38(57)19-27-6-11-31(55)12-7-27)41(59)40(58)35(70-46)23-67-37(56)18-26-4-9-30(54)10-5-26/h4-7,9-12,15,25,29,32-36,39-42,46,54-55,58-59H,8,13-14,16-24H2,1-3H3,(H3,48,49)(H,50,60)(H,51,61)(H,63,64,65)",QLYWEZIERNPRJD-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Nostoc,,UHCC 0870
CyanoMetDB_2264,Varlaxin 1022A,,other linear non-peptide,,C46H66N6O18S,1022.41543,O[C@H]1[C@H](O)[C@@H](COC(CC2=CC=C(O)C=C2)=O)O[C@H](O[C@@H]3CC[C@H]4C[C@@H](C(NCCCCNC(N)=N)=O)N(C([C@H](NC(C(COS(O)(=O)=O)OC)=O)[C@@H](CC)C)=O)[C@H]4C3)[C@@H]1OC(CC5=CC=C(O)C=C5)=O,"InChI=1S/C46H66N6O18S/c1-4-25(2)38(51-43(60)35(65-3)24-67-71(62,63)64)44(61)52-32-22-31(16-11-28(32)21-33(52)42(59)49-17-5-6-18-50-46(47)48)68-45-41(70-37(56)20-27-9-14-30(54)15-10-27)40(58)39(57)34(69-45)23-66-36(55)19-26-7-12-29(53)13-8-26/h7-10,12-15,25,28,31-35,38-41,45,53-54,57-58H,4-6,11,16-24H2,1-3H3,(H,49,59)(H,51,60)(H4,47,48,50)(H,62,63,64)/t25-,28+,31-,32+,33+,34-,35?,38-,39-,40+,41-,45+/m1/s1",SKCVDZKUXKKGHI-ZCNATBBXSA-N,n.a. as of 04.01.022,Yes,Nostoc,,UHCC 0870
CyanoMetDB_2265,Varlaxin 1046A,,other linear non-peptide,,C48H66N6O18S,1046.41543,O[C@H]1[C@H](O)[C@@H](COC(CC2=CC=C(O)C=C2)=O)O[C@H](O[C@@H]3CC[C@H]4C[C@@H](C(NCCC5=CCN(C(N)=N)C5)=O)N(C([C@H](NC(C(COS(O)(=O)=O)OC)=O)[C@@H](CC)C)=O)[C@H]4C3)[C@@H]1OC(CC6=CC=C(O)C=C6)=O,"InChI=1S/C48H66N6O18S/c1-4-26(2)40(52-45(62)37(67-3)25-69-73(64,65)66)46(63)54-34-22-33(14-9-30(34)21-35(54)44(61)51-17-15-29-16-18-53(23-29)48(49)50)70-47-43(72-39(58)20-28-7-12-32(56)13-8-28)42(60)41(59)36(71-47)24-68-38(57)19-27-5-10-31(55)11-6-27/h5-8,10-13,16,26,30,33-37,40-43,47,55-56,59-60H,4,9,14-15,17-25H2,1-3H3,(H3,49,50)(H,51,61)(H,52,62)(H,64,65,66)/t26-,30+,33-,34+,35+,36-,37?,40-,41-,42+,43-,47+/m1/s1",XLWUTXGZKRJUAX-YSJAFXDJSA-N,n.a. as of 04.01.022,Yes,Nostoc,,UHCC 0870
CyanoMetDB_2272,Phormidepistatin,,other linear peptide,,C55H80N6O14,1048.573251,OC(CCCCCC(O)C(C)C(N[C@@H](C(N[C@@H](C(N1[C@@H](C(N[C@@H]([C@@H](C)O)C(N[C@H]([C@@H](CC(NC(CO)CC2=CC=C(O)C=C2)=O)O)CC(C)C)=O)=O)CCC1)=O)CC3=CC=C(O)C=C3)=O)CO)=O)CC4=CC=CC=C4,"InChI=1S/C55H80N6O14/c1-33(2)26-43(48(69)30-49(70)56-39(31-62)27-37-17-21-40(65)22-18-37)57-54(74)50(35(4)64)60-53(73)46-15-11-25-61(46)55(75)44(29-38-19-23-41(66)24-20-38)58-52(72)45(32-63)59-51(71)34(3)47(68)16-10-6-9-14-42(67)28-36-12-7-5-8-13-36/h5,7-8,12-13,17-24,33-35,39,42-48,50,62-69H,6,9-11,14-16,25-32H2,1-4H3,(H,56,70)(H,57,74)(H,58,72)(H,59,71)(H,60,73)/t34?,35-,39?,42?,43+,44-,45-,46-,47?,48-,50+/m1/s1",FAYGUFDOYLBSBK-NNHXCDPSSA-N,n.a. as of 04.01.022,yes ,Phormidium,sp.,UIC 10484
CyanoMetDB_2273,Rivulariapeptolide 1185,,other cyclic peptide,rivulariapeptolide,C61H87N9O15,1185.632163,CCCC(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)OC(=O)[C@@H]2CCCN2C(=O)CCC)C(=O)N[C@H]3[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N4[C@@H](CC[C@@H](C4=O)NC(=O)C(NC3=O)CC(C)C)O)CC5=CC=CC=C5)C)CC6=CC=C(C=C6)O)C(C)C)C,"InChI=1S/C61H87N9O15/c1-10-17-47(72)68-29-15-21-43(68)54(76)65-52(36(7)84-60(82)44-22-16-30-69(44)48(73)18-11-2)57(79)66-51-37(8)85-61(83)50(35(5)6)64-55(77)45(32-39-23-25-40(71)26-24-39)67(9)59(81)46(33-38-19-13-12-14-20-38)70-49(74)28-27-41(58(70)80)62-53(75)42(31-34(3)4)63-56(51)78/h12-14,19-20,23-26,34-37,41-46,49-52,71,74H,10-11,15-18,21-22,27-33H2,1-9H3,(H,62,75)(H,63,78)(H,64,77)(H,65,76)(H,66,79)/t36-,37-,41+,42?,43+,44+,45+,46+,49-,50+,51+,52+/m1/s1",MLONDHJIZVGDPO-FGPZQASWSA-N,154585468,yes ,Rivularia,sp.,
CyanoMetDB_2274,Rivulariapeptolide 1155,,other cyclic peptide,rivulariapeptolide,C59H81N9O15,1155.585213,CC(C)[C@H](NC([C@H](CC1=CC=C(O)C=C1)N(C)C([C@H](CC2=CC=CC=C2)N3[C@H](O)CC[C@H](NC(/C(NC4=O)=C\C)=O)C3=O)=O)=O)C(O[C@H](C)[C@@H]4NC([C@H]([C@@H](OC(C5N(C(CCC)=O)CCC5)=O)C)NC(C6CCCN6C(CCC)=O)=O)=O)=O,"InChI=1S/C59H81N9O15/c1-9-17-45(70)66-29-15-21-41(66)52(74)63-50(34(6)82-58(80)42-22-16-30-67(42)46(71)18-10-2)55(77)64-49-35(7)83-59(81)48(33(4)5)62-53(75)43(31-37-23-25-38(69)26-24-37)65(8)57(79)44(32-36-19-13-12-14-20-36)68-47(72)28-27-40(56(68)78)61-51(73)39(11-3)60-54(49)76/h11-14,19-20,23-26,33-35,40-44,47-50,69,72H,9-10,15-18,21-22,27-32H2,1-8H3,(H,60,76)(H,61,73)(H,62,75)(H,63,74)(H,64,77)/b39-11-/t34-,35+,40+,41?,42?,43-,44-,47-,48-,49+,50+/m1/s1  ",KELSIYWCZZCKIB-IWPVXZTMSA-N,154585451,yes ,Rivularia,sp.,
CyanoMetDB_2275,Rivulariapeptolide 1121,,other cyclic peptide,rivulariapeptolide,C56H83N9O15,1121.600863,CC(C)[C@H](NC([C@H](CC1=CC=C(O)C=C1)N(C)C([C@H](CC(C)C)N2[C@H](O)CC[C@H](NC(/C(NC3=O)=C\C)=O)C2=O)=O)=O)C(O[C@H](C)[C@@H]3NC([C@H]([C@@H](OC(C4N(C(CCC)=O)CCC4)=O)C)NC(C5CCCN5C(CCC)=O)=O)=O)=O,"InChI=1S/C56H83N9O15/c1-11-16-42(67)63-26-14-18-38(63)49(71)60-47(32(8)79-55(77)39-19-15-27-64(39)43(68)17-12-2)52(74)61-46-33(9)80-56(78)45(31(6)7)59-50(72)40(29-34-20-22-35(66)23-21-34)62(10)54(76)41(28-30(4)5)65-44(69)25-24-37(53(65)75)58-48(70)36(13-3)57-51(46)73/h13,20-23,30-33,37-41,44-47,66,69H,11-12,14-19,24-29H2,1-10H3,(H,57,73)(H,58,70)(H,59,72)(H,60,71)(H,61,74)/b36-13+/t32-,33+,37-,38?,39?,40-,41-,44+,45-,46-,47-/m0/s1  ",NSLGLRCZEMNFTE-BSTXMPBESA-N,154585468,yes ,Rivularia,sp.,
CyanoMetDB_2276,Rivulariapeptolide 988,,other cyclic peptide,rivulariapeptolide,C50H68N8O13,988.4905843,CCCC(=O)N1CCCC1C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@H]2[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N3[C@@H](CC[C@@H](C3=O)NC(=O)/C(=C\C)/NC2=O)O)CC4=CC=CC=C4)C)CC5=CC=C(C=C5)O)C(C)C)C,"InChI=1S/C50H68N8O13/c1-8-14-38(61)57-24-13-17-35(57)44(64)54-41(28(5)59)46(66)55-42-29(6)71-50(70)40(27(3)4)53-45(65)36(25-31-18-20-32(60)21-19-31)56(7)49(69)37(26-30-15-11-10-12-16-30)58-39(62)23-22-34(48(58)68)52-43(63)33(9-2)51-47(42)67/h9-12,15-16,18-21,27-29,34-37,39-42,59-60,62H,8,13-14,17,22-26H2,1-7H3,(H,51,67)(H,52,63)(H,53,65)(H,54,64)(H,55,66)/b33-9+/t28-,29+,34-,35?,36-,37-,39+,40-,41-,42-/m0/s1  ",VOJZQYLSWQMIAF-SWYMOLAOSA-N  ,154585501,yes ,Rivularia,sp.,
CyanoMetDB_2277,Molassamide B,,other cyclic peptide,other cyclic depsipeptide,C48H65BrN8O13,1040.385447,CCCC(=O)NC(C)C(=O)NC(C(C)O)C(=O)NC1C(OC(=O)C(NC(=O)C(N(C(=O)C(N2C(CCC(C2=O)NC(=O)/C(=C\C)/NC1=O)O)CC3=CC=CC=C3)C)CC4=CC(=C(C=C4)O)Br)C(C)C)C,"InChI=1S/C48H65BrN8O13/c1-9-14-36(60)50-25(5)41(62)54-39(26(6)58)44(65)55-40-27(7)70-48(69)38(24(3)4)53-43(64)33(23-29-17-19-35(59)30(49)21-29)56(8)47(68)34(22-28-15-12-11-13-16-28)57-37(61)20-18-32(46(57)67)52-42(63)31(10-2)51-45(40)66/h10-13,15-17,19,21,24-27,32-34,37-40,58-59,61H,9,14,18,20,22-23H2,1-8H3,(H,50,60)(H,51,66)(H,52,63)(H,53,64)(H,54,62)(H,55,65)/b31-10+  ",RHDUBBRUOVMSBW-VNTWQREPSA-N  ,154585486,yes ,Rivularia,sp.,
CyanoMetDB_2278,Nostosin G,,other linear peptide,,C25H35N5O6,501.2587339,OC1=CC=C(C[C@H](C(N[C@H](C(N[C@H](C=O)CCCNC(N)=N)=O)CCC2=CC=C(O)C=C2)=O)O)C=C1,"InChI=1S/C25H33N5O6/c26-25(27)28-13-1-2-18(15-31)29-23(35)21(12-7-16-3-8-19(32)9-4-16)30-24(36)22(34)14-17-5-10-20(33)11-6-17/h3-6,8-11,15,18,21-22,32-34H,1-2,7,12-14H2,(H,29,35)(H,30,36)(H4,26,27,28)/t18?,21-,22+/m0/s1",XZGYPANYOCFBHU-LFZQMPOYSA-N,164887574,yes ,Dolichospermum,sp.,NIES-1697
CyanoMetDB_2279,Spiroidesin B,,other linear peptide,,C32H37N3O8,591.2580652,OC1=CC=C(CC[C@H](NC([C@H](NC([C@H](NC=O)CCC2=CC=C(O)C=C2)=O)CCC3=CC=C(O)C=C3)=O)C(O)=O)C=C1,"InChI=1S/C32H37N3O8/c1-20(36)33-27(17-8-21-2-11-24(37)12-3-21)30(40)34-28(18-9-22-4-13-25(38)14-5-22)31(41)35-29(32(42)43)19-10-23-6-15-26(39)16-7-23/h2-7,11-16,27-29,37-39H,8-10,17-19H2,1H3,(H,33,36)(H,34,40)(H,35,41)(H,42,43)/t27-,28-,29?/m1/s1",WWUQKSCOCRYZSP-KSSJMHQNSA-N,n.a. as of 04.01.022,yes ,Dolichospermum,sp.,NIES-1697
CyanoMetDB_2280,nostosin G reduced,,other linear peptide,,C25H35N5O6,503.274384,OC1=CC=C(C[C@H](C(N[C@H](C(N[C@H](CO)CCCNC(N)=N)=O)CCC2=CC=C(O)C=C2)=O)O)C=C1,"InChI=1S/C25H35N5O6/c26-25(27)28-13-1-2-18(15-31)29-23(35)21(12-7-16-3-8-19(32)9-4-16)30-24(36)22(34)14-17-5-10-20(33)11-6-17/h3-6,8-11,18,21-22,31-34H,1-2,7,12-15H2,(H,29,35)(H,30,36)(H4,26,27,28)/t18-,21-,22+/m0/s1",KUDMTGKUAJSKRF-YUXAGFNASA-N,n.a. as of 04.01.022,yes,Dolichospermum,sp.,NIES-1697
CyanoMetDB_2281,Beru’amide,,other linear non-peptide,,C22H34ClNO4,411.2176363,Cl/C=C/C[C@@H]([C@H](C(/C=C/CCNC(CC/C=C/C(C)(C)C)=O)=O)C)OC(C)=O,"InChI=1S/C22H34ClNO4/c1-17(20(12-10-15-23)28-18(2)25)19(26)11-7-9-16-24-21(27)13-6-8-14-22(3,4)5/h7-8,10-11,14-15,17,20H,6,9,12-13,16H2,1-5H3,(H,24,27)/b11-7+,14-8+,15-10+/t17-,20-/m0/s1",SHCKYCWOVJFZKS-NAWCJDCWSA-N,n.a. as of 04.01.022,yes,Okeania,,
CyanoMetDB_2282,[D-Glu(OMe)6]MC-LA,,Microcystin,,C47H69N7O12,923.5004207,O=C(CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](C)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N2)CC(C)C)=O)=O)=O)=O)N(C)C(C(N[C@@H](C2=O)C)=O)=C,"InChI=1S/C47H69N7O12/c1-25(2)22-36-45(61)53-39(46(62)63)29(6)41(57)48-30(7)42(58)50-34(19-18-26(3)23-27(4)37(65-11)24-33-16-14-13-15-17-33)28(5)40(56)51-35(47(64)66-12)20-21-38(55)54(10)32(9)44(60)49-31(8)43(59)52-36/h13-19,23,25,27-31,34-37,39H,9,20-22,24H2,1-8,10-12H3,(H,48,57)(H,49,60)(H,50,58)(H,51,56)(H,52,59)(H,53,61)(H,62,63)/b19-18+,26-23+/t27-,28-,29-,30-,31+,34-,35+,36-,37-,39+/m0/s1",UJASYPDPIBUXRX-PUKRXDPESA-N,,no,,,
CyanoMetDB_2283,"[(6Z)-Adda5,Dha7]MC-LR",,Microcystin,,C48H72N10O12,980.5331178,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C\[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N2)CC(C)C)=O)=O)=O)=O)NC(C(N[C@@H](C2=O)C)=O)=C,"InChI=1S/C48H72N10O12/c1-25(2)22-36-45(65)58-39(47(68)69)29(6)41(61)55-34(16-13-21-51-48(49)50)44(64)54-33(18-17-26(3)23-27(4)37(70-9)24-32-14-11-10-12-15-32)28(5)40(60)56-35(46(66)67)19-20-38(59)52-30(7)42(62)53-31(8)43(63)57-36/h10-12,14-15,17-18,23,25,27-29,31,33-37,39H,7,13,16,19-22,24H2,1-6,8-9H3,(H,52,59)(H,53,62)(H,54,64)(H,55,61)(H,56,60)(H,57,63)(H,58,65)(H,66,67)(H,68,69)(H4,49,50,51)/b18-17+,26-23-/t27-,28-,29-,31+,33-,34-,35+,36-,37-,39+/m0/s1",WLWITBHAANNFHV-XWXSJMPZSA-N,,no,,,
CyanoMetDB_2284,[D-Glu(OMe)6]MC-RR,,Microcystin,,C50H77N13O12,1051.581465,O=C(CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N2)CCCNC(N)=N)=O)=O)=O)=O)N(C)C(C(N[C@@H](C2=O)C)=O)=C,"InChI=1S/C50H77N13O12/c1-27(25-28(2)38(74-8)26-33-15-11-10-12-16-33)19-20-34-29(3)41(65)61-37(48(73)75-9)21-22-39(64)63(7)32(6)44(68)57-31(5)43(67)60-36(18-14-24-56-50(53)54)46(70)62-40(47(71)72)30(4)42(66)59-35(45(69)58-34)17-13-23-55-49(51)52/h10-12,15-16,19-20,25,28-31,34-38,40H,6,13-14,17-18,21-24,26H2,1-5,7-9H3,(H,57,68)(H,58,69)(H,59,66)(H,60,67)(H,61,65)(H,62,70)(H,71,72)(H4,51,52,55)(H4,53,54,56)/b20-19+,27-25+/t28-,29-,30-,31+,34-,35-,36-,37+,38-,40+/m0/s1",RUUBSBXAOSSLLB-TTXFPCFKSA-N,,no,,,
CyanoMetDB_2285,"[D-Leu1,(6Z)-Adda5]MC-LY",,Microcystin,,C55H77N7O13,1043.557936,O=C(CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C\[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CC2=CC=C(O)C=C2)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N3)CC(C)C)=O)=O)=O)=O)N(C)C(C(N[C@@H](C3=O)CC(C)C)=O)=C,"InChI=1S/C55H77N7O13/c1-30(2)25-42-51(68)60-43(26-31(3)4)53(70)61-47(55(73)74)35(8)49(66)58-44(28-38-18-20-39(63)21-19-38)52(69)56-40(22-17-32(5)27-33(6)45(75-11)29-37-15-13-12-14-16-37)34(7)48(65)57-41(54(71)72)23-24-46(64)62(10)36(9)50(67)59-42/h12-22,27,30-31,33-35,40-45,47,63H,9,23-26,28-29H2,1-8,10-11H3,(H,56,69)(H,57,65)(H,58,66)(H,59,67)(H,60,68)(H,61,70)(H,71,72)(H,73,74)/b22-17+,32-27-/t33-,34-,35-,40-,41+,42+,43-,44-,45-,47+/m0/s1",ANDKUSLFYHFLNO-RXUQYKBISA-N,,no,Microcystis,aeruginosa,CPCC464
CyanoMetDB_2286,"[D-Leu1,D-Glu(OMe)6]MC-LY",,Microcystin,,C56H79N7O13,1057.573586,O=C(CC[C@H](C(OC)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC1=CC=CC=C1)NC([C@H](CC2=CC=C(O)C=C2)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N3)CC(C)C)=O)=O)=O)=O)N(C)C(C(N[C@@H](C3=O)CC(C)C)=O)=C,"InChI=1S/C56H79N7O13/c1-31(2)26-43-52(69)61-44(27-32(3)4)54(71)62-48(55(72)73)36(8)50(67)59-45(29-39-19-21-40(64)22-20-39)53(70)57-41(23-18-33(5)28-34(6)46(75-11)30-38-16-14-13-15-17-38)35(7)49(66)58-42(56(74)76-12)24-25-47(65)63(10)37(9)51(68)60-43/h13-23,28,31-32,34-36,41-46,48,64H,9,24-27,29-30H2,1-8,10-12H3,(H,57,70)(H,58,66)(H,59,67)(H,60,68)(H,61,69)(H,62,71)(H,72,73)/b23-18+,33-28+/t34-,35-,36-,41-,42+,43+,44-,45-,46-,48+/m0/s1",GPAUDYCWNMJJNW-KXIWREOXSA-N,,no,Microcystis,aeruginosa,CPCC464
CyanoMetDB_2287,Hapalindole C,,other cyclic peptide,other cyclic peptide,C21H24N2,304.1939488,CC([C@H]1CC[C@@](C=C)(C)[C@H]([N+]#[C-])[C@]1([H])C2=CNC3=CC=CC=C32)=C,"InChI=1S/C21H24N2/c1-6-21(4)12-11-15(14(2)3)19(20(21)22-5)17-13-23-18-10-8-7-9-16(17)18/h6-10,13,15,19-20,23H,1-2,11-12H2,3-4H3/t15-,19+,20?,21+/m1/s1 ",KGWATBYKCMCFLC-JKRQLLNHSA-N ,21773170,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2288,Hapalindole E,,other cyclic peptide,other cyclic peptide,C21H23ClN2,338.1549765,CC([C@H]1C[C@@H](Cl)[C@@](C=C)(C)[C@H]([N+]#[C-])[C@]1([H])C2=CNC3=CC=CC=C32)=C,"InChI=1S/C21H23ClN2/c1-6-21(4)18(22)11-15(13(2)3)19(20(21)23-5)16-12-24-17-10-8-7-9-14(16)17/h6-10,12,15,18-20,24H,1-2,11H2,3-4H3/t15-,18-,19+,20?,21+/m1/s1",IJEJDCXOVNHHAX-DXEDAVMJSA-N,21587706,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2289,Hapalindole G,,other cyclic peptide,other cyclic peptide,C21H23ClN2,338.1549765,[H][C@]1(C2(C)C)C[C@@H](Cl)[C@](C)(C=C)[C@H]([N+]#[C-])[C@]1([H])C3=CNC4=CC=CC2=C34,"InChI=1S/C21H23ClN2/c1-6-21(4)16(22)10-14-18(19(21)23-5)12-11-24-15-9-7-8-13(17(12)15)20(14,2)3/h6-9,11,14,16,18-19,24H,1,10H2,2-4H3/t14-,16+,18+,19?,21-/m0/s1",UGBGKUYYYCTXAK-AUBJYJIXSA-N,11067734,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2290,Hapalindole H,,other cyclic peptide,other cyclic peptide,C21H24N2,304.1939488,[H][C@@]1(C2(C)C)CC[C@](C)(C=C)[C@H]([N+]#[C-])[C@@]1([H])C3=CNC4=CC=CC2=C34,"InChI=1S/C21H24N2/c1-6-21(4)11-10-15-18(19(21)22-5)13-12-23-16-9-7-8-14(17(13)16)20(15,2)3/h6-9,12,15,18-19,23H,1,10-11H2,2-4H3/t15-,18+,19?,21+/m1/s1",SLUFHMQYBPOTFZ-DCMGZCHKSA-N,21671525,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2291,Hapalindole I,,other cyclic peptide,other cyclic peptide,C21H21ClN2,336.1393264,CC1(C)[C@@]2([H])C[C@@H](Cl)[C@](C)(C=C)C([N+]#[C-])=C2C3=CNC4=CC=CC1=C34,"InChI=1S/C21H21ClN2/c1-6-21(4)16(22)10-14-18(19(21)23-5)12-11-24-15-9-7-8-13(17(12)15)20(14,2)3/h6-9,11,14,16,24H,1,10H2,2-4H3/t14-,16+,21-/m0/s1",OFWWEJRYIFRLKS-PXARDIRTSA-N,101288435,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2292,Hapalindole J,,other cyclic peptide,other cyclic peptide,C21H24N2,304.1939488,CC1(C)[C@@]2([H])CC[C@](C)(C=C)[C@H]([N+]#[C-])[C@@]2([H])C3=CNC4=CC=CC1=C34,"InChI=1S/C21H24N2/c1-6-21(4)11-10-15-18(19(21)22-5)13-12-23-16-9-7-8-14(17(13)16)20(15,2)3/h6-9,12,15,18-19,23H,1,10-11H2,2-4H3/t15-,18-,19?,21-/m0/s1",SLUFHMQYBPOTFZ-UXWDNFRVSA-N,21761739,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2293,Hapalindole K,,other cyclic peptide,other cyclic peptide,C21H21ClN2,336.1393264,CC1(C)C(C[C@@H](Cl)[C@](C)(C=C)[C@@H]2[N+]#[C-])=C2C3=CNC4=CC=CC1=C34,"InChI=1S/C21H21ClN2/c1-6-21(4)16(22)10-14-18(19(21)23-5)12-11-24-15-9-7-8-13(17(12)15)20(14,2)3/h6-9,11,16,19,24H,1,10H2,2-4H3/t16-,19?,21+/m1/s1",VRTCQZPYIDLYAS-SZBOGAFOSA-N,101288434,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2294,Hapalindole N/P,,other cyclic peptide,other cyclic peptide,C21H23ClN2O,354.1498911,CC1(C)[C@@]2([H])C[C@@H](Cl)[C@](C)(C3([H])CO3)[C@H]([N+]#[C-])[C@@]2([H])C4=CNC5=CC=CC1=C45,"InChI=1S/C21H23ClN2O/c1-20(2)12-6-5-7-14-17(12)11(9-24-14)18-13(20)8-15(22)21(3,16-10-25-16)19(18)23-4/h5-7,9,13,15-16,18-19,24H,8,10H2,1-3H3/t13-,15+,16?,18-,19?,21+/m0/s1",DJVKRIUTCJPFSC-JKUFENMHSA-N,71434600,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2295,Hapalindole U,,other cyclic peptide,other cyclic peptide,C21H24N2,304.1939488,CC1(C)[C@@]2([H])CC[C@](C)(C=C)[C@H]([N+]#[C-])[C@]2([H])C3=CNC4=CC=CC1=C34,"InChI=1S/C21H24N2/c1-6-21(4)11-10-15-18(19(21)22-5)13-12-23-16-9-7-8-14(17(13)16)20(15,2)3/h6-9,12,15,18-19,23H,1,10-11H2,2-4H3/t15-,18+,19?,21-/m0/s1",SLUFHMQYBPOTFZ-KARKHZEHSA-N,16069589,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2296,Hapalindole V,,other cyclic peptide,other cyclic peptide,C21H23ClN2O,354.1498911,CC1(C)[C@@]2([H])C[C@@H](Cl)[C@](C)(C=C)[C@H]([N+]#[C-])[C@]2(O)C3=CNC4=CC=CC1=C34,"InChI=1S/C21H23ClN2O/c1-6-20(4)16(22)10-15-19(2,3)12-8-7-9-14-17(12)13(11-24-14)21(15,25)18(20)23-5/h6-9,11,15-16,18,24-25H,1,10H2,2-4H3/t15-,16-,18?,20+,21+/m1/s1",CMGQSGIXZPECQF-CYKFJSCESA-N,101288436,yes,Hapalosiphon,fontinalis,n.a.
CyanoMetDB_2297,Hapalindole X,,other cyclic peptide,other cyclic peptide,C21H22N2,302.1782987,CC(C1=C2C([C@]3([H])[C@H]4[N+]#[C-])=CNC2=CC=C1)(C)[C@]3([H])C[C@H](C=C)C4=C,"InChI=1S/C21H22N2/c1-6-13-10-16-19(20(22-5)12(13)2)14-11-23-17-9-7-8-15(18(14)17)21(16,3)4/h6-9,11,13,16,19-20,23H,1-2,10H2,3-4H3/t13-,16+,19-,20?/m0/s1",DYEJLTKYPWPEJT-CUWQPKQQSA-N,86573598,yes,Westiellopsis,sp. ,SAG 20.93
CyanoMetDB_2298,Deschloro hapalindole I,,other cyclic peptide,other cyclic peptide,C21H22N2,302.1782987,CC1(C)[C@@]2([H])CC[C@](C)(C=C)C([N+]#[C-])=C2C3=CNC4=CC=CC1=C34,"InChI=1S/C21H22N2/c1-6-21(4)11-10-15-18(19(21)22-5)13-12-23-16-9-7-8-14(17(13)16)20(15,2)3/h6-9,12,15,23H,1,10-11H2,2-4H3/t15-,21-/m0/s1",OKONSTCTTRLPOR-BTYIYWSLSA-N,n.a. as of 04.01.022,yes,Westiellopsis,sp. ,SAG 20.93
CyanoMetDB_2299,Hapalindole A-formamide,,other cyclic peptide,other cyclic peptide,C21H25ClN2O,356.1655412,Cl[C@@H]1C[C@@]2(C(C3=C4C([C@@]2([C@@H](NC=O)[C@]1(C=C)C)[H])=CNC4=CC=C3)(C)C)[H],"InChI=1S/C21H25ClN2O/c1-5-21(4)16(22)9-14-18(19(21)24-11-25)12-10-23-15-8-6-7-13(17(12)15)20(14,2)3/h5-8,10-11,14,16,18-19,23H,1,9H2,2-4H3,(H,24,25)/t14-,16+,18-,19+,21-/m0/s1",PEOBSZPEDXDLLB-DJNKVENRSA-N,14218407,yes,Hapalosiphon ,sp. ,CBT123
CyanoMetDB_2300,Hapalindole J-formamide,,other cyclic peptide,other cyclic peptide,C21H26N2O,322.2045135,[H][C@]1(C2(C)C)CC[C@](C)(C=C)[C@H](NC=O)[C@@]1([H])C3=CNC4=CC=CC2=C34,"InChI=1S/C21H26N2O/c1-5-21(4)10-9-15-18(19(21)23-12-24)13-11-22-16-8-6-7-14(17(13)16)20(15,2)3/h5-8,11-12,15,18-19,22H,1,9-10H2,2-4H3,(H,23,24)/t15-,18-,19+,21-/m0/s1",DGVMUVBTNMOVFZ-RMYQPGKMSA-N,14218411,yes,Hapalosiphon ,sp. ,CBT123
CyanoMetDB_2301,12-epi-Hapalindole D isothiocyanate,,other cyclic peptide,other cyclic peptide,C21H24N2S,336.1660195,CC([C@H]1CC[C@](C=C)(C)[C@H](N=C=S)[C@]1([H])C2=CNC3=CC=CC=C32)=C,"InChI=1S/C21H24N2S/c1-5-21(4)11-10-15(14(2)3)19(20(21)23-13-24)17-12-22-18-9-7-6-8-16(17)18/h5-9,12,15,19-20,22H,1-2,10-11H2,3-4H3/t15-,19+,20?,21-/m1/s1",PPHWDUZMWNUINO-FBTBGZJPSA-N,21676629,yes,Hapalosiphon ,welwitschii,W. & G.S. West UHIC-52-3
CyanoMetDB_2302,12-epi-Hapalindole F isothiocyanate,,other cyclic peptide,other cyclic peptide,C21H23ClN2S,370.1270472,CC([C@H]1C[C@@H](Cl)[C@](C=C)(C)[C@H](N=C=S)[C@]1([H])C2=CNC3=CC=CC=C32)=C,"InChI=1S/C21H23ClN2S/c1-5-21(4)18(22)10-15(13(2)3)19(20(21)24-12-25)16-11-23-17-9-7-6-8-14(16)17/h5-9,11,15,18-20,23H,1-2,10H2,3-4H3/t15-,18-,19+,20?,21-/m1/s1",GRQUFNAGGOBDNI-MUUICVMPSA-N,21676628,yes,Hapalosiphon ,welwitschii,W. & G.S. West UHIC-52-3
CyanoMetDB_2303,Dechlorofontonamide,,other cyclic peptide,other cyclic peptide,C20H23NO2,309.172879,CC(C1=C2C(NC([H])=O)=CC=C1)(C)[C@@]3([H])CC[C@](C)(C=C)C=C3C2=O,"InChI=1S/C20H23NO2/c1-5-20(4)10-9-14-13(11-20)18(23)17-15(19(14,2)3)7-6-8-16(17)21-12-22/h5-8,11-12,14H,1,9-10H2,2-4H3,(H,21,22)/t14-,20-/m0/s1",XZRPXEKKESPHHS-XOBRGWDASA-N,14314375,yes,Hapalosiphon,fontinalis,V-3-1
CyanoMetDB_2304,Hapalonamide G,,other cyclic peptide,other cyclic peptide,C21H23ClN2O2,370.1448057,CC(C1=C2C(NC([H])=O)=CC=C1)(C)[C@@]3([H])C[C@@H](Cl)[C@](C)(C=C)[C@H]([N+]#[C-])[C@]3([H])C2=O,"InChI=1S/C21H23ClN2O2/c1-6-21(4)15(22)10-13-17(19(21)23-5)18(26)16-12(20(13,2)3)8-7-9-14(16)24-11-25/h6-9,11,13,15,17,19H,1,10H2,2-4H3,(H,24,25)/t13-,15+,17-,19?,21-/m0/s1",FXUGCACUUONQJC-JMPIHABKSA-N,156582182,yes,Hapalosiphon,fontinalis,V-3-1
CyanoMetDB_2305,Hapalonamide H,,other cyclic peptide,other cyclic peptide,C21H24N2O2,336.183778,CC(C1=C2C(NC([H])=O)=CC=C1)(C)[C@]3([H])CC[C@](C)(C=C)[C@H]([N+]#[C-])[C@@]3([H])C2=O,"InChI=1S/C21H24N2O2/c1-6-21(4)11-10-14-17(19(21)22-5)18(25)16-13(20(14,2)3)8-7-9-15(16)23-12-24/h6-9,12,14,17,19H,1,10-11H2,2-4H3,(H,23,24)/t14-,17-,19?,21+/m1/s1",JECFIXMTIIOGJS-MRKPWPLOSA-N,122400449,yes,Hapalosiphon,fontinalis,V-3-1
CyanoMetDB_2306,Hapalonamide V,,other cyclic peptide,other cyclic peptide,C21H23ClN2O3,386.1397203,CC(C1=C2C(NC([H])=O)=CC=C1)(C)[C@@]3([H])C[C@@H](Cl)[C@](C)(C=C)[C@H]([N+]#[C-])[C@]3(O)C2=O,"InChI=1S/C21H23ClN2O3/c1-6-20(4)15(22)10-14-19(2,3)12-8-7-9-13(24-11-25)16(12)17(26)21(14,27)18(20)23-5/h6-9,11,14-15,18,27H,1,10H2,2-4H3,(H,24,25)/t14-,15-,18?,20+,21-/m1/s1",MCXMMTXVFGCBFA-YWBWCIAUSA-N,156582183,yes,Hapalosiphon,fontinalis,V-3-1
CyanoMetDB_2307,N-Methylwelwitindolinone B isothiocyanate,,other cyclic peptide,other cyclic peptide,C22H23ClN2O2S,414.1168764,C[C@@]([C@@](C1=O)(N=C=S)C2=C3C(N4C)=CC=C2)(C=C)[C@H](Cl)C[C@]1([H])C(C)(C)[C@@]3([H])C4=O,"InChI=1S/C22H23ClN2O2S/c1-6-21(4)15(23)10-13-18(26)22(21,24-11-28)12-8-7-9-14-16(12)17(20(13,2)3)19(27)25(14)5/h6-9,13,15,17H,1,10H2,2-5H3/t13-,15+,17+,21+,22?/m0/s1",RBPIZRWOMRMEOB-MPUPZLORSA-N,101959988,yes,Hapalosiphon ,welwitschii,W. & G.S. West UHIC-52-3
CyanoMetDB_2308,Tasiamide F,,other cyclic peptide,other cyclic peptide,C50H74N8O12,978.5426199,CC[C@H](C)[C@@H](C(=O)NCC(=O)N(C)[C@H](CC1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)OC)NC(=O)C[C@@H]([C@H](CC3=CC=CC=C3)NC(=O)[C@H](CCC(=O)N)N(C)C(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](C)O)O,"InChI=1S/C50H74N8O12/c1-9-30(3)43(47(66)52-29-42(63)56(6)38(27-34-20-15-12-16-21-34)48(67)58-25-17-22-37(58)50(69)70-8)54-41(62)28-39(60)35(26-33-18-13-11-14-19-33)53-46(65)36(23-24-40(51)61)57(7)49(68)44(31(4)10-2)55-45(64)32(5)59/h11-16,18-21,30-32,35-39,43-44,59-60H,9-10,17,22-29H2,1-8H3,(H2,51,61)(H,52,66)(H,53,65)(H,54,62)(H,55,64)/t30-,31-,32-,35-,36-,37-,38+,39-,43-,44-/m0/s1",CJLWKFUIIJXJBZ-PMQPHXACSA-N,127050883,yes,Lyngbya ,sp. ,n.a.
CyanoMetDB_2309,Anabaenopeptin 679,,other cyclic peptide,other cyclic peptide,C35H49N7O7,679.369347,OC1=CC=C(CC[C@H](NC([C@H](C(C)C)NC2=O)=O)C(N(C)[C@@H](C)C(N[C@@H](CC3=CC=CC=C3)C(NCCCC[C@H]2NC(N)=O)=O)=O)=O)C=C1,"InChI=1S/C35H49N7O7/c1-21(2)29-33(47)38-27(18-15-23-13-16-25(43)17-14-23)34(48)42(4)22(3)30(44)39-28(20-24-10-6-5-7-11-24)31(45)37-19-9-8-12-26(32(46)41-29)40-35(36)49/h5-7,10-11,13-14,16-17,21-22,26-29,43H,8-9,12,15,18-20H2,1-4H3,(H,37,45)(H,38,47)(H,39,44)(H,41,46)(H3,36,40,49)/t22-,26+,27-,28-,29-/m0/s1",SWEIFQQRNGTQHC-HIGLYJDASA-N,n.a. as of 04.01.022,yes,n.a.,n.a.,n.a.
CyanoMetDB_2310,Anabaenopeptin 731,,other cyclic peptide,other cyclic peptide,C35H53N7O10,731.385391,CC(C[C@H](NC([C@H](C(C)C)NC([C@@H](CCCCNC1=O)NC(N[C@H](C(O)=O)CC2=CC=CC=C2)=O)=O)=O)C(N(CC(N[C@H]1COC(C)=O)=O)C)=O)C,"InChI=1S/C35H53N7O10/c1-20(2)16-25-33(48)42(6)18-28(44)37-27(19-52-22(5)43)30(45)36-15-11-10-14-24(31(46)41-29(21(3)4)32(47)38-25)39-35(51)40-26(34(49)50)17-23-12-8-7-9-13-23/h7-9,12-13,20-21,24-27,29H,10-11,14-19H2,1-6H3,(H,36,45)(H,37,44)(H,38,47)(H,41,46)(H,49,50)(H2,39,40,51)/t24-,25+,26+,27+,29+/m1/s1",WRZIZKCPILZQPW-IYYUCAQOSA-N,n.a. as of 04.01.022,yes,n.a.,n.a.,n.a.
CyanoMetDB_2311,Anabaenopeptin 813,,other cyclic peptide,other cyclic peptide,C43H55N7O9,813.4061264,OC1=CC=C(CCC(NC(C(NC(C(NC(NC(CC2=CC=CC=C2)C(O)=O)=O)CCCCNC3=O)=O)C(C)C)=O)C(N(CC(NC3CC4=CC=CC=C4)=O)C)=O)C=C1,"InChI=1S/C43H55N7O9/c1-27(2)37-40(55)46-33(22-19-28-17-20-31(51)21-18-28)41(56)50(3)26-36(52)45-34(24-29-12-6-4-7-13-29)38(53)44-23-11-10-16-32(39(54)49-37)47-43(59)48-35(42(57)58)25-30-14-8-5-9-15-30/h4-9,12-15,17-18,20-21,27,32-35,37,51H,10-11,16,19,22-26H2,1-3H3,(H,44,53)(H,45,52)(H,46,55)(H,49,54)(H,57,58)(H2,47,48,59)",AUCUVWYLFGPOMT-UHFFFAOYSA-N,n.a. as of 04.01.022,no,n.a.,n.a.,n.a.
CyanoMetDB_2312,Anabaenopeptin KVJ811,,other cyclic peptide,other cyclic peptide,C44H57N7O8,811.4268619,NCCCCC(C(O)=O)NC(NC(C(NC(C(NC1CCC2=CC=CC=C2)=O)C(C)CC)=O)CCCCNC(C(NC(C(NC1=O)CC(NC)=O)=O)CC3=CC=CC=C3)=O)=O,"InChI=1S/C44H57N7O8/c1-29(2)38-41(55)47-35(25-23-31-17-9-5-10-18-31)42(56)51(3)28-37(52)46-34(24-22-30-15-7-4-8-16-30)39(53)45-26-14-13-21-33(40(54)50-38)48-44(59)49-36(43(57)58)27-32-19-11-6-12-20-32/h4-12,15-20,29,33-36,38H,13-14,21-28H2,1-3H3,(H,45,53)(H,46,52)(H,47,55)(H,50,54)(H,57,58)(H2,48,49,59)/t33-,34+,35+,36+,38+/m1/s1",ANUXYAOUUUYOPU-BEJGRMFCSA-N,n.a. as of 04.01.022,yes,Nostoc ,n.a.,n.a.
CyanoMetDB_2313,Anabaenopeptin KVJ827,,other cyclic peptide,other cyclic peptide,C44H57N7O9,827.4217765,CCCCCC(NC(CC(O)=O)C(NC(C(OC(C(NC(C(N(C(N(C1C(O)CCC2C1=O)CC3=CC=CC=C3)=O)C)CC4=CC=C(O)C=C4)=O)C(C)C)=O)C)C(NC(C(N2)=O)CCCCC(N)=N)=O)=O)=O,"InChI=1S/C44H57N7O9/c1-28(2)38-41(56)47-35(24-20-30-14-8-5-9-15-30)42(57)51(3)27-37(53)46-34(23-19-29-12-6-4-7-13-29)39(54)45-25-11-10-16-33(40(55)50-38)48-44(60)49-36(43(58)59)26-31-17-21-32(52)22-18-31/h4-9,12-15,17-18,21-22,28,33-36,38,52H,10-11,16,19-20,23-27H2,1-3H3,(H,45,54)(H,46,53)(H,47,56)(H,50,55)(H,58,59)(H2,48,49,60)/t33-,34+,35+,36+,38+/m1/s1",LRZBWLKBBMDCKW-BEJGRMFCSA-N,n.a. as of 04.01.022,yes,Nostoc ,n.a.,n.a.
CyanoMetDB_2314,Anabaenopeptin KVJ841,,other cyclic peptide,other cyclic peptide,C45H59N7O9,841.4374265,CN1C2=CC=CC=C2C3=C(C(=C4C5=CC=CC=C5NC4=C31)C#N)OC,"InChI=1S/C45H59N7O9/c1-4-29(2)39-42(57)48-36(25-21-31-15-9-6-10-16-31)43(58)52(3)28-38(54)47-35(24-20-30-13-7-5-8-14-30)40(55)46-26-12-11-17-34(41(56)51-39)49-45(61)50-37(44(59)60)27-32-18-22-33(53)23-19-32/h5-10,13-16,18-19,22-23,29,34-37,39,53H,4,11-12,17,20-21,24-28H2,1-3H3,(H,46,55)(H,47,54)(H,48,57)(H,51,56)(H,59,60)(H2,49,50,61)/t29-,34-,35+,36+,37+,39+/m1/s1",UTUBKHJOXGRVTK-FVGXMBITSA-N,n.a. as of 04.01.022,yes,Nostoc ,n.a.,n.a.
CyanoMetDB_2315,Anabaenopeptin 803,,other cyclic peptide,other cyclic peptide,C36H65N7O9S2,803.4285182,CC(C[C@H](NC([C@H](CCSC)N1)=O)C(N(C(C(N[C@@H](CCS(C)=O)C(NCCCC[C@@H](NC(N[C@@H](CC(C)C)C(O)=O)=O)C1=O)=O)=O)C(CC)C)C)=O)C,"InChI=1S/C36H65N7O9S2/c1-10-23(6)29-33(47)39-26(15-18-54(9)52)30(44)37-16-12-11-13-24(41-36(51)42-28(35(49)50)20-22(4)5)31(45)38-25(14-17-53-8)32(46)40-27(19-21(2)3)34(48)43(29)7/h21-29H,10-20H2,1-9H3,(H,37,44)(H,38,45)(H,39,47)(H,40,46)(H,49,50)(H2,41,42,51)/t23?,24-,25+,26+,27+,28+,29?,54?/m1/s1",ZMEKYFONCOOOPU-VLKLXNQJSA-N,n.a. as of 04.01.022,no,,n.a.,
CyanoMetDB_2317,Anabaenopeptin 849,,other cyclic peptide,other cyclic peptide,C43H63N9O9,849.4748747,NCCCCC(C(O)=O)NC(NC(C(NC(C(NC1CCC2=CC=CC=C2)=O)C(C)CC)=O)CCCCNC(C(NC(C(NC1=O)CC(NC)=O)=O)CC3=CC=CC=C3)=O)=O,"InChI=1S/C43H63N9O9/c1-4-27(2)36-41(58)47-31(22-21-28-15-7-5-8-16-28)38(55)49-34(26-35(53)45-3)40(57)48-33(25-29-17-9-6-10-18-29)37(54)46-24-14-12-19-30(39(56)52-36)50-43(61)51-32(42(59)60)20-11-13-23-44/h5-10,15-18,27,30-34,36H,4,11-14,19-26,44H2,1-3H3,(H,45,53)(H,46,54)(H,47,58)(H,48,57)(H,49,55)(H,52,56)(H,59,60)(H2,50,51,61)",KHLAJZGEEVQSNF-UHFFFAOYSA-N,n.a. as of 04.01.022,no,Desmonostoc sp.,,
CyanoMetDB_2318,Ferintoic acid C,,other cyclic peptide,other cyclic peptide,C46H58N8O9S,898.4047462,CC1C(NC(C(NCCCCC(C(NC(C(NC(C(N1C)=O)CCC2=CC=C(C=C2)O)=O)CCSC)=O)NC(NC(CC3=CNC4=CC=CC=C43)C(O)=O)=O)=O)CC5=CC=CC=C5)=O,"InChI=1S/C46H58N8O9S/c1-28-40(56)51-38(25-30-11-5-4-6-12-30)41(57)47-23-10-9-15-35(52-46(63)53-39(45(61)62)26-31-27-48-34-14-8-7-13-33(31)34)42(58)49-36(22-24-64-3)43(59)50-37(44(60)54(28)2)21-18-29-16-19-32(55)20-17-29/h4-8,11-14,16-17,19-20,27-28,35-39,48,55H,9-10,15,18,21-26H2,1-3H3,(H,47,57)(H,49,58)(H,50,59)(H,51,56)(H,61,62)(H2,52,53,63)",GRZREXKZCIMKBM-UHFFFAOYSA-N,n.a. as of 04.01.022,no,,,
CyanoMetDB_2319,Ferintoic acid D,,other cyclic peptide,other cyclic peptide,C46H58N8O10S,914.3996609,CC1C(NC(C(NCCCCC(C(NC(C(NC(C(N1C)=O)CCC2=CC=C(C=C2)O)=O)CCS(C)=O)=O)NC(NC(CC3=CNC4=CC=CC=C43)C(O)=O)=O)=O)CC5=CC=CC=C5)=O,"InChI=1S/C46H58N8O10S/c1-28-40(56)51-38(25-30-11-5-4-6-12-30)41(57)47-23-10-9-15-35(52-46(63)53-39(45(61)62)26-31-27-48-34-14-8-7-13-33(31)34)42(58)49-36(22-24-65(3)64)43(59)50-37(44(60)54(28)2)21-18-29-16-19-32(55)20-17-29/h4-8,11-14,16-17,19-20,27-28,35-39,48,55H,9-10,15,18,21-26H2,1-3H3,(H,47,57)(H,49,58)(H,50,59)(H,51,56)(H,61,62)(H2,52,53,63)",OLIRGDANIKUFAM-UHFFFAOYSA-N,n.a. as of 04.01.022,no,,,
CyanoMetDB_2320,"3,6-Diiodocarbazole",,other cyclic peptide,other cyclic peptide,C12H7NI2,418.8667952,C1=CC2=C(C=C1I)C3=C(N2)C=CC(=C3)I,"InChI=1S/C12H7I2N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6,15H",PECAOKZHORDWAI-UHFFFAOYSA-N,3116488,yes,Kyrtuthrix,maculans,
CyanoMetDB_2321,"3,6-Dibromocarbazole",,other cyclic peptide,other cyclic peptide,C12H7Br2N,322.894525,C1=CC2=C(C=C1Br)C3=C(N2)C=CC(=C3)Br,"InChI=1S/C12H7Br2N/c13-7-1-3-11-9(5-7)10-6-8(14)2-4-12(10)15-11/h1-6,15H",FIHILUSWISKVSR-UHFFFAOYSA-N,274874,yes,Kyrtuthrix,maculans,
CyanoMetDB_2322,"2,7-Dibromocarbazole",,other cyclic peptide,other cyclic peptide,C12H7Br2N,322.894525,C1=CC2=C(C=C1Br)NC3=C2C=CC(=C3)Br,"InChI=1S/C12H7Br2N/c13-7-1-3-9-10-4-2-8(14)6-12(10)15-11(9)5-7/h1-6,15H",QPTWWBLGJZWRAV-UHFFFAOYSA-N,11151503,yes,Kyrtuthrix,maculans,
CyanoMetDB_2323,Kurahamide,,other cyclic peptide,other cyclic peptide,C55H77N9O15,1103.553913,CCCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)OC(=O)[C@H](C)NC(=O)CCC)C(=O)N[C@H]1[C@H](OC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N2C(CC[C@@H](C2=O)NC(=O)/C(=C\C)/NC1=O)O)CC3=CC=CC=C3)C)CC4=CC=C(C=C4)O)C(C)C)C,"InChI=1S/C55H77N9O15/c1-11-17-41(66)56-30(6)47(69)61-46(32(8)78-54(76)31(7)57-42(67)18-12-2)51(73)62-45-33(9)79-55(77)44(29(4)5)60-49(71)39(27-35-21-23-36(65)24-22-35)63(10)53(75)40(28-34-19-15-14-16-20-34)64-43(68)26-25-38(52(64)74)59-48(70)37(13-3)58-50(45)72/h13-16,19-24,29-33,38-40,43-46,65,68H,11-12,17-18,25-28H2,1-10H3,(H,56,66)(H,57,67)(H,58,72)(H,59,70)(H,60,71)(H,61,69)(H,62,73)/b37-13+/t30-,31-,32+,33+,38-,39-,40-,43?,44-,45-,46-/m0/s1",MQELHCGZLCYEHQ-KNGPJCMVSA-N,102231215,yes,Lyngbya,sp.,
CyanoMetDB_2324,Micropeptin MZ1019,,other cyclic peptide,other cyclic peptide,C41H65N9O17S2,1019.393983,CC[C@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N[C@H](C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)[C@@H](C)CC)OC)CCCN=C(N)N)NC(=O)[C@@H](COS(=O)(=O)O)OS(=O)(=O)O)C,"InChI=1S/C41H65N9O17S2/c1-8-22(3)31-40(57)66-24(5)32(48-36(53)29(67-69(61,62)63)21-65-68(58,59)60)37(54)45-26(16-13-19-44-41(42)43)34(51)46-27-17-18-30(64-7)50(38(27)55)33(23(4)9-2)39(56)49(6)28(35(52)47-31)20-25-14-11-10-12-15-25/h10-12,14-15,22-24,26-33H,8-9,13,16-21H2,1-7H3,(H,45,54)(H,46,51)(H,47,52)(H,48,53)(H4,42,43,44)(H,58,59,60)(H,61,62,63)/t22-,23-,24+,26-,27-,28-,29+,30+,31-,32-,33-/m0/s1",ANMNVFNXQIABAK-WLQPTDKLSA-N,45379737,yes ,Microcystis,,
CyanoMetDB_2325,Nostopeptin I,,other cyclic peptide,other cyclic peptide,C47H72N8O12,940.5269698,CC[C@H](C)[C@H]1C(=O)O[C@@H]2[C@@H](C(=O)N[C@H](C(=O)N[C@H]3CC[C@H](N(C3=O)[C@H](C(=O)N([C@H](C(=O)N1)CC4=CC=C(C=C4)OC)C)CC(C)C)O)CC(C)C)N(CC2C)C(=O)[C@H](CCC(=O)N)NC(=O)C,"InChI=1S/C47H72N8O12/c1-11-26(6)38-47(65)67-40-27(7)23-54(44(62)31(49-28(8)56)16-18-36(48)57)39(40)43(61)51-33(20-24(2)3)41(59)50-32-17-19-37(58)55(45(32)63)35(21-25(4)5)46(64)53(9)34(42(60)52-38)22-29-12-14-30(66-10)15-13-29/h12-15,24-27,31-35,37-40,58H,11,16-23H2,1-10H3,(H2,48,57)(H,49,56)(H,50,59)(H,51,61)(H,52,60)/t26-,27?,31-,32-,33-,34-,35-,37+,38-,39-,40-/m0/s1",UFWRVLGKVODWOG-CWNOFNPISA-N,44448102,no,Nostoc  ,linckia,NIES 25
CyanoMetDB_2326,Nostopeptin D,,other cyclic peptide,other cyclic peptide,C47H72N8O12,940.5269698,CC[C@H](C)[C@H]1C(=O)O[C@@H]2[C@@H](C(=O)N[C@H](C(=O)N[C@H]3CC[C@H](N(C3=O)[C@H](C(=O)N([C@H](C(=O)N1)CC4=CC=C(C=C4)O)C)[C@@H](C)CC)O)CC(C)C)N(CC2C)C(=O)[C@H](CCC(=O)N)NC(=O)CC,"InChI=1S/C47H72N8O12/c1-10-25(6)37-47(66)67-40-27(8)23-54(44(63)30(17-19-34(48)57)49-35(58)12-3)39(40)43(62)51-32(21-24(4)5)41(60)50-31-18-20-36(59)55(45(31)64)38(26(7)11-2)46(65)53(9)33(42(61)52-37)22-28-13-15-29(56)16-14-28/h13-16,24-27,30-33,36-40,56,59H,10-12,17-23H2,1-9H3,(H2,48,57)(H,49,58)(H,50,60)(H,51,62)(H,52,61)/t25-,26-,27?,30-,31-,32-,33-,36+,37-,38-,39-,40-/m0/s1",GRVMTANYFFVRTL-FXWCSWMSSA-N,44448172,no,Nostoc ,minutum,NIES 26 
CyanoMetDB_2327,Nostopeptin F,,other cyclic peptide,other cyclic peptide,C47H72N8O12,940.5269698,CC[C@H](C)[C@H]1C(=O)O[C@@H]2[C@@H](C(=O)N[C@H](C(=O)N[C@H]3CC[C@H](N(C3=O)[C@H](C(=O)N([C@H](C(=O)N1)CC4=CC=C(C=C4)O)C)CC(C)C)OC)CC(C)C)N(CC2C)C(=O)[C@H](CCC(=O)N)NC(=O)C,"InChI=1S/C47H72N8O12/c1-11-26(6)38-47(65)67-40-27(7)23-54(44(62)31(49-28(8)56)16-18-36(48)58)39(40)43(61)51-33(20-24(2)3)41(59)50-32-17-19-37(66-10)55(45(32)63)35(21-25(4)5)46(64)53(9)34(42(60)52-38)22-29-12-14-30(57)15-13-29/h12-15,24-27,31-35,37-40,57H,11,16-23H2,1-10H3,(H2,48,58)(H,49,56)(H,50,59)(H,51,61)(H,52,60)/t26-,27?,31-,32-,33-,34-,35-,37+,38-,39-,40-/m0/s1",REUZQOOSPDGNMH-CWNOFNPISA-N,44448285,no,Nostoc ,linckia,NIES 25
CyanoMetDB_2328,Nostopeptin E,,other cyclic peptide,other cyclic peptide,C46H70N8O12,926.5113198,CC[C@H](C)[C@H]1C(=O)O[C@@H]2[C@@H](C(=O)N[C@H](C(=O)N[C@H]3CC[C@H](N(C3=O)[C@H](C(=O)N([C@H](C(=O)N1)CC4=CC=C(C=C4)O)C)CC(C)C)O)CC(C)C)N(CC2C)C(=O)[C@H](CCC(=O)N)NC(=O)C,"InChI=1S/C46H70N8O12/c1-10-25(6)37-46(65)66-39-26(7)22-53(43(62)30(48-27(8)55)15-17-35(47)57)38(39)42(61)50-32(19-23(2)3)40(59)49-31-16-18-36(58)54(44(31)63)34(20-24(4)5)45(64)52(9)33(41(60)51-37)21-28-11-13-29(56)14-12-28/h11-14,23-26,30-34,36-39,56,58H,10,15-22H2,1-9H3,(H2,47,57)(H,48,55)(H,49,59)(H,50,61)(H,51,60)/t25-,26?,30-,31-,32-,33-,34-,36+,37-,38-,39-/m0/s1",OQVHBXPEGJDDFQ-PPCSRKJBSA-N,44448099,no,Nostoc,linckia,NIES 25
CyanoMetDB_2329,Nostopeptin J,,other cyclic peptide,other cyclic peptide,C48H74N8O12,954.5426199,CC[C@H](C)[C@H]1C(=O)O[C@@H]2[C@@H](C(=O)N[C@H](C(=O)N[C@H]3CC[C@H](N(C3=O)[C@H](C(=O)N([C@H](C(=O)N1)CC4=CC=C(C=C4)OC)C)CC(C)C)OC)CC(C)C)N(CC2C)C(=O)[C@H](CCC(=O)N)NC(=O)C,"InChI=1S/C48H74N8O12/c1-12-27(6)39-48(65)68-41-28(7)24-55(45(62)32(50-29(8)57)17-19-37(49)58)40(41)44(61)52-34(21-25(2)3)42(59)51-33-18-20-38(67-11)56(46(33)63)36(22-26(4)5)47(64)54(9)35(43(60)53-39)23-30-13-15-31(66-10)16-14-30/h13-16,25-28,32-36,38-41H,12,17-24H2,1-11H3,(H2,49,58)(H,50,57)(H,51,59)(H,52,61)(H,53,60)/t27-,28?,32-,33-,34-,35-,36-,38+,39-,40-,41-/m0/s1",UFKOGEISKNRUFK-ZYWQCJNISA-N,44448114,no,Nostoc ,linckia,NIES 25
CyanoMetDB_2330,Symplostatin 8,,other cyclic peptide,other cyclic peptide,C47H64N7O16SNa,1037.402794,CC[C@@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N/C(=C\C)/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=C(C=C3)O)C)CC4=CC=CC=C4)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](COS(=O)(=O)[O-])OC)C.[Na+],"InChI=1S/C47H65N7O16S.Na/c1-9-26(5)38-47(64)70-27(6)39(52-43(60)37(25(3)4)50-42(59)35(68-8)24-69-71(65,66)67)44(61)48-31(10-2)40(57)49-32-20-21-36(56)54(45(32)62)34(23-28-14-12-11-13-15-28)46(63)53(7)33(41(58)51-38)22-29-16-18-30(55)19-17-29;/h10-19,25-27,32-39,55-56H,9,20-24H2,1-8H3,(H,48,61)(H,49,57)(H,50,59)(H,51,58)(H,52,60)(H,65,66,67);/q;+1/p-1/b31-10-;/t26-,27-,32+,33+,34+,35-,36-,37+,38+,39+;/m1./s1",IRSOCNJHEKYICW-OOXHBTLOSA-M,71718935,yes,Symploca,sp.,
CyanoMetDB_2331,Symplostatin 5,,other cyclic peptide,other cyclic peptide,C47H64N7O15SNa,1021.40788,CC[C@@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N/C(=C\C)/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)CC4=CC=CC=C4)O)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](COS(=O)(=O)[O-])OC)C.[Na+],"InChI=1S/C47H65N7O15S.Na/c1-9-27(5)38-47(63)69-28(6)39(52-43(59)37(26(3)4)50-42(58)35(67-8)25-68-70(64,65)66)44(60)48-31(10-2)40(56)49-32-21-22-36(55)54(45(32)61)34(24-30-19-15-12-16-20-30)46(62)53(7)33(41(57)51-38)23-29-17-13-11-14-18-29;/h10-20,26-28,32-39,55H,9,21-25H2,1-8H3,(H,48,60)(H,49,56)(H,50,58)(H,51,57)(H,52,59)(H,64,65,66);/q;+1/p-1/b31-10-;/t27-,28-,32+,33+,34+,35-,36-,37+,38+,39+;/m1./s1",KPKJQINJXGFAPS-NBGICTFWSA-M,71711730,yes,Symploca,sp.,
CyanoMetDB_2332,Symplostatin 6,,other cyclic peptide,other cyclic peptide,C46H62N7O15SNa,1007.39223,C/C=C\1/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](COS(=O)(=O)[O-])OC)C)C(C)C)CC3=CC=CC=C3)C)CC4=CC=CC=C4)O.[Na+],"InChI=1S/C46H63N7O15S.Na/c1-9-30-39(55)48-31-20-21-35(54)53(44(31)60)33(23-29-18-14-11-15-19-29)45(61)52(7)32(22-28-16-12-10-13-17-28)40(56)50-37(26(4)5)46(62)68-27(6)38(43(59)47-30)51-42(58)36(25(2)3)49-41(57)34(66-8)24-67-69(63,64)65;/h9-19,25-27,31-38,54H,20-24H2,1-8H3,(H,47,59)(H,48,55)(H,49,57)(H,50,56)(H,51,58)(H,63,64,65);/q;+1/p-1/b30-9-;/t27-,31+,32+,33+,34-,35-,36+,37+,38+;/m1./s1",BPQXOHCKAQYHKH-VODUYPEISA-M,71562455,yes,Symploca,sp.,
CyanoMetDB_2333,Symplostatin 7,,other cyclic peptide,other cyclic peptide,C48H66N7O15SNa,1035.42353,CC[C@@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N/C(=C\C)/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=CC=C3)C)CC4=CC=CC=C4)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](COS(=O)(=O)[O-])OC)C.[Na+],"InChI=1S/C48H67N7O15S.Na/c1-9-27(4)38(51-43(59)36(68-8)26-69-71(65,66)67)44(60)53-40-29(6)70-48(64)39(28(5)10-2)52-42(58)34(24-30-18-14-12-15-19-30)54(7)47(63)35(25-31-20-16-13-17-21-31)55-37(56)23-22-33(46(55)62)50-41(57)32(11-3)49-45(40)61;/h11-21,27-29,33-40,56H,9-10,22-26H2,1-8H3,(H,49,61)(H,50,57)(H,51,59)(H,52,58)(H,53,60)(H,65,66,67);/q;+1/p-1/b32-11-;/t27-,28+,29+,33-,34-,35-,36+,37+,38-,39-,40-;/m0./s1",PQKKBRUUQQKZIM-OFYOIGKZSA-M,71717727,yes,Symploca,sp.,
CyanoMetDB_2334,Symplostatin 9,,other cyclic peptide,other cyclic peptide,C46H62N7O16SNa,1023.387144,C/C=C\1/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N[C@H](C(=O)O[C@@H]([C@@H](C(=O)N1)NC(=O)[C@H](C(C)C)NC(=O)[C@@H](COS(=O)(=O)[O-])OC)C)C(C)C)CC3=CC=C(C=C3)O)C)CC4=CC=CC=C4)O.[Na+],"InChI=1S/C46H63N7O16S.Na/c1-9-30-39(56)48-31-19-20-35(55)53(44(31)61)33(22-27-13-11-10-12-14-27)45(62)52(7)32(21-28-15-17-29(54)18-16-28)40(57)50-37(25(4)5)46(63)69-26(6)38(43(60)47-30)51-42(59)36(24(2)3)49-41(58)34(67-8)23-68-70(64,65)66;/h9-18,24-26,31-38,54-55H,19-23H2,1-8H3,(H,47,60)(H,48,56)(H,49,58)(H,50,57)(H,51,59)(H,64,65,66);/q;+1/p-1/b30-9-;/t26-,31+,32+,33+,34-,35-,36+,37+,38+;/m1./s1",NHXDDQPGWZNWED-FYNDLZNZSA-M,71562563,yes,Symploca,sp.,
CyanoMetDB_2335,Symplostatin 10,,other cyclic peptide,other cyclic peptide,C48H66N7O16SNa,1051.418444,CC[C@@H](C)[C@H]1C(=O)O[C@@H]([C@@H](C(=O)N/C(=C\C)/C(=O)N[C@H]2CC[C@H](N(C2=O)[C@H](C(=O)N([C@H](C(=O)N1)CC3=CC=C(C=C3)O)C)CC4=CC=CC=C4)O)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](COS(=O)(=O)[O-])OC)C.[Na+],"InChI=1S/C48H67N7O16S.Na/c1-9-26(4)38(51-43(60)36(69-8)25-70-72(66,67)68)44(61)53-40-28(6)71-48(65)39(27(5)10-2)52-42(59)34(23-30-17-19-31(56)20-18-30)54(7)47(64)35(24-29-15-13-12-14-16-29)55-37(57)22-21-33(46(55)63)50-41(58)32(11-3)49-45(40)62;/h11-20,26-28,33-40,56-57H,9-10,21-25H2,1-8H3,(H,49,62)(H,50,58)(H,51,60)(H,52,59)(H,53,61)(H,66,67,68);/q;+1/p-1/b32-11-;/t26-,27+,28+,33-,34-,35-,36+,37+,38-,39-,40-;/m0./s1",LKYJXYOTVBTLMJ-SEWPLWSESA-M,71717105,yes,Symploca,sp.,
CyanoMetDB_2336,Cyanopeptolin CP1006,,other cyclic peptide,other cyclic peptide,C50H71N9O13,1005.517133,CCCCCC(NC(CC(O)=O)C(NC(C(OC(C(NC(C(N(C(N(C1C(O)CCC2C1=O)CC3=CC=CC=C3)=O)C)CC4=CC=C(O)C=C4)=O)C(C)C)=O)C)C(NC(C(N2)=O)CCCCC(N)=N)=O)=O)=O,"InChI=1S/C50H71N9O13/c1-6-7-9-18-39(62)53-35(26-40(63)64)46(67)57-42-29(4)72-49(70)41(28(2)3)56-47(68)36(25-30-19-21-32(60)22-20-30)58(5)50(71)59(27-31-14-10-8-11-15-31)43-37(61)24-23-33(44(43)65)54-45(66)34(55-48(42)69)16-12-13-17-38(51)52/h8,10-11,14-15,19-22,28-29,33-37,41-43,60-61H,6-7,9,12-13,16-18,23-27H2,1-5H3,(H3,51,52)(H,53,62)(H,54,66)(H,55,69)(H,56,68)(H,57,67)(H,63,64)",YUWREOHAGIRWOH-UHFFFAOYSA-N,n.a. as of 04.01.022,yes,Nostoc ,edaphicum,CCNP 1411
CyanoMetDB_2337,Insulapeptolide A,,other cyclic peptide,other cyclic peptide,C46H71N9O12,941.5222188,C[C@@H]1CN(C([C@@H](NC(C)=O)CCCNC(N)=O)=O)[C@H](C(N[C@@H](CC(C)C)C(N[C@@H]2C([N@@]([C@@H]([C@H](CC)C)C(N(C)[C@H]3CC4=CC=C(O)C=C4)=O)[C@H](O)CC2)=O)=O)=O)[C@@H]1OC([C@H](C(C)C)NC3=O)=O,"InChI=1S/C46H71N9O12/c1-10-25(6)36-44(64)53(9)33(21-28-13-15-29(57)16-14-28)40(60)52-35(24(4)5)45(65)67-38-26(7)22-54(42(62)30(49-27(8)56)12-11-19-48-46(47)66)37(38)41(61)51-32(20-23(2)3)39(59)50-31-17-18-34(58)55(36)43(31)63/h13-16,23-26,30-38,57-58H,10-12,17-22H2,1-9H3,(H,49,56)(H,50,59)(H,51,61)(H,52,60)(H3,47,48,66)/t25-,26+,30-,31-,32-,33-,34+,35-,36-,37-,38+/m0/s1",FDLDCKDOWJJMPR-DELOUUOYSA-N,n.a. as of 04.01.022,yes,Nostoc ,insulare,SAG 54.79
CyanoMetDB_2338,Insulapeptolide B,,other cyclic peptide,other cyclic peptide,C47H73N9O12,955.5378689,C[C@@H]1CN(C([C@@H](NC(C)=O)CCCNC(N)=O)=O)[C@H](C(N[C@@H](CC(C)C)C(N[C@@H]2C([N@@]([C@@H]([C@H](CC)C)C(N(C)[C@H]3CC4=CC=C(O)C=C4)=O)[C@H](O)CC2)=O)=O)=O)[C@@H]1OC([C@H]([C@H](C)CC)NC3=O)=O,"InChI=1S/C47H73N9O12/c1-10-25(5)36-46(66)68-39-27(7)23-55(43(63)31(50-28(8)57)13-12-20-49-47(48)67)38(39)42(62)52-33(21-24(3)4)40(60)51-32-18-19-35(59)56(44(32)64)37(26(6)11-2)45(65)54(9)34(41(61)53-36)22-29-14-16-30(58)17-15-29/h14-17,24-27,31-39,58-59H,10-13,18-23H2,1-9H3,(H,50,57)(H,51,60)(H,52,62)(H,53,61)(H3,48,49,67)/t25-,26+,27-,31+,32+,33+,34+,35-,36+,37+,38+,39-/m1/s1",NXSMTDUTDMMFAU-HSZWYVOHSA-N,n.a. as of 04.01.022,yes,Nostoc ,insulare,SAG 54.79
CyanoMetDB_2339,Insulapeptolide C,,other cyclic peptide,other cyclic peptide,C47H73N9O12,955.5378689,C[C@@H]1CN(C([C@@H](NC(C)=O)CCCNC(N)=O)=O)[C@H](C(N[C@@H](CC(C)C)C(N[C@@H]2C([N@@]([C@@H]([C@H](CC)C)C(N(C)[C@H]3CC4=CC=C(OC)C=C4)=O)[C@H](O)CC2)=O)=O)=O)[C@@H]1OC([C@H](C(C)C)NC3=O)=O,"InChI=1S/C47H73N9O12/c1-11-26(6)37-45(64)54(9)34(22-29-14-16-30(67-10)17-15-29)41(60)53-36(25(4)5)46(65)68-39-27(7)23-55(43(62)31(50-28(8)57)13-12-20-49-47(48)66)38(39)42(61)52-33(21-24(2)3)40(59)51-32-18-19-35(58)56(37)44(32)63/h14-17,24-27,31-39,58H,11-13,18-23H2,1-10H3,(H,50,57)(H,51,59)(H,52,61)(H,53,60)(H3,48,49,66)/t26-,27+,31-,32-,33-,34-,35+,36-,37-,38-,39+/m0/s1",UURVSKVCKDFFAS-CTCGOBHXSA-N,n.a. as of 04.01.022,yes,Nostoc,insulare,SAG 54.79
CyanoMetDB_2340,Insulapeptolide D,,other cyclic peptide,other cyclic peptide,C48H75N9O12,969.5535189,C[C@@H]1CN(C([C@@H](NC(C)=O)CCCNC(N)=O)=O)[C@H](C(N[C@@H](CC(C)C)C(N[C@@H]2C([N@@]([C@@H]([C@H](CC)C)C(N(C)[C@H]3CC4=CC=C(OC)C=C4)=O)[C@H](O)CC2)=O)=O)=O)[C@@H]1OC([C@H]([C@H](C)CC)NC3=O)=O,"InChI=1S/C48H75N9O12/c1-11-26(5)37-47(66)69-40-28(7)24-56(44(63)32(51-29(8)58)14-13-21-50-48(49)67)39(40)43(62)53-34(22-25(3)4)41(60)52-33-19-20-36(59)57(45(33)64)38(27(6)12-2)46(65)55(9)35(42(61)54-37)23-30-15-17-31(68-10)18-16-30/h15-18,25-28,32-40,59H,11-14,19-24H2,1-10H3,(H,51,58)(H,52,60)(H,53,62)(H,54,61)(H3,49,50,67)/t26-,27+,28-,32+,33+,34+,35+,36-,37+,38+,39+,40-/m1/s1",CHDGJSXGBVKFIF-LMGIIRSZSA-N,n.a. as of 04.01.022,yes,Nostoc ,insulare,SAG 54.79
CyanoMetDB_2341,Insulapeptolide E,,other cyclic peptide,other cyclic peptide,C51H72N8O14,1020.516799,CCCC(N1[C@H](C(N[C@H](C(N[C@@H]([C@H](OC([C@H]([C@H](C)CC)N2)=O)C)C(N[C@@H](CCC3=CC=CC=C3)C(N[C@@H]4C([N@@]([C@H](C(N(C)[C@H](C2=O)CC5=CC=C(O)C=C5)=O)[C@@H](C)O)[C@H](O)CC4)=O)=O)=O)=O)CO)=O)CCC1)=O,"InChI=1S/C51H72N8O14/c1-7-13-39(63)58-25-12-16-37(58)46(67)54-36(27-60)45(66)56-42-30(5)73-51(72)41(28(3)8-2)55-47(68)38(26-32-17-20-33(62)21-18-32)57(6)50(71)43(29(4)61)59-40(64)24-23-35(49(59)70)53-44(65)34(52-48(42)69)22-19-31-14-10-9-11-15-31/h9-11,14-15,17-18,20-21,28-30,34-38,40-43,60-62,64H,7-8,12-13,16,19,22-27H2,1-6H3,(H,52,69)(H,53,65)(H,54,67)(H,55,68)(H,56,66)/t28-,29-,30-,34+,35+,36+,37+,38+,40-,41+,42+,43+/m1/s1",NCTMHAKMWCIMCA-KPQXWPPMSA-N,n.a. as of 04.01.022,yes,Nostoc ,insulare,SAG 54.79
CyanoMetDB_2342,Insulapeptolide F,,other cyclic peptide,other cyclic peptide,C50H70N8O14,1006.501149,CCCC(N1[C@H](C(N[C@H](C(N[C@@H]([C@H](OC([C@H](C(C)C)N2)=O)C)C(N[C@@H](CCC3=CC=CC=C3)C(N[C@@H]4C([N@@]([C@H](C(N(C)[C@H](C2=O)CC5=CC=C(O)C=C5)=O)[C@@H](C)O)[C@H](O)CC4)=O)=O)=O)=O)CO)=O)CCC1)=O,"InChI=1S/C50H70N8O14/c1-7-12-38(62)57-24-11-15-36(57)45(66)53-35(26-59)44(65)55-41-29(5)72-50(71)40(27(2)3)54-46(67)37(25-31-16-19-32(61)20-17-31)56(6)49(70)42(28(4)60)58-39(63)23-22-34(48(58)69)52-43(64)33(51-47(41)68)21-18-30-13-9-8-10-14-30/h8-10,13-14,16-17,19-20,27-29,33-37,39-42,59-61,63H,7,11-12,15,18,21-26H2,1-6H3,(H,51,68)(H,52,64)(H,53,66)(H,54,67)(H,55,65)/t28-,29-,33+,34+,35+,36+,37+,39-,40+,41+,42+/m1/s1",YGYHKTCZYNOIBL-RAKGUDTISA-N,n.a. as of 04.01.022,yes,Nostoc,insulare,SAG 54.79
CyanoMetDB_2343,Insulapeptolide G,,other cyclic peptide,other cyclic peptide,C50H70N8O13,990.5062344,CCCC(N1[C@H](C(N[C@H](C(N[C@@H]([C@H](OC([C@H](C(C)C)N2)=O)C)C(N[C@@H](CCC3=CC=CC=C3)C(N[C@@H]4C([N@@]([C@H](C(N(C)[C@H](C2=O)CC5=CC=CC=C5)=O)[C@@H](C)O)[C@H](O)CC4)=O)=O)=O)=O)CO)=O)CCC1)=O,"InChI=1S/C50H70N8O13/c1-7-15-38(61)57-25-14-20-36(57)45(65)53-35(27-59)44(64)55-41-30(5)71-50(70)40(28(2)3)54-46(66)37(26-32-18-12-9-13-19-32)56(6)49(69)42(29(4)60)58-39(62)24-23-34(48(58)68)52-43(63)33(51-47(41)67)22-21-31-16-10-8-11-17-31/h8-13,16-19,28-30,33-37,39-42,59-60,62H,7,14-15,20-27H2,1-6H3,(H,51,67)(H,52,63)(H,53,65)(H,54,66)(H,55,64)/t29-,30-,33+,34+,35+,36+,37+,39-,40+,41+,42+/m1/s1",FWWSPBIYNIQGJB-MZAIBGPZSA-N,n.a. as of 04.01.022,yes,Nostoc,insulare,SAG 54.79
CyanoMetDB_2344,Insulapeptolide H,,other cyclic peptide,other cyclic peptide,C51H72N8O13,1004.521884,CCCC(N1[C@H](C(N[C@H](C(N[C@@H]([C@H](OC([C@H]([C@H](C)CC)N2)=O)C)C(N[C@@H](CCC3=CC=CC=C3)C(N[C@@H]4C([N@@]([C@H](C(N(C)[C@H](C2=O)CC5=CC=CC=C5)=O)[C@@H](C)O)[C@H](O)CC4)=O)=O)=O)=O)CO)=O)CCC1)=O,"InChI=1S/C51H72N8O13/c1-7-16-39(62)58-26-15-21-37(58)46(66)54-36(28-60)45(65)56-42-31(5)72-51(71)41(29(3)8-2)55-47(67)38(27-33-19-13-10-14-20-33)57(6)50(70)43(30(4)61)59-40(63)25-24-35(49(59)69)53-44(64)34(52-48(42)68)23-22-32-17-11-9-12-18-32/h9-14,17-20,29-31,34-38,40-43,60-61,63H,7-8,15-16,21-28H2,1-6H3,(H,52,68)(H,53,64)(H,54,66)(H,55,67)(H,56,65)/t29-,30-,31-,34+,35+,36+,37+,38+,40-,41+,42+,43+/m1/s1",KADJXRUDRPKAEU-NBHXZYMHSA-N,n.a. as of 04.01.022,yes,Nostoc ,insulare,SAG 54.79
CyanoMetDB_2345,Maculalactone B,,other cyclic peptide,other cyclic peptide,C25H20O2,352.1463299,C1=CC=C(C=C1)CC\2=C(C(=O)O/C2=C\C3=CC=CC=C3)CC4=CC=CC=C4,"InChI=1S/C25H20O2/c26-25-23(17-20-12-6-2-7-13-20)22(16-19-10-4-1-5-11-19)24(27-25)18-21-14-8-3-9-15-21/h1-15,18H,16-17H2/b24-18-",LUUFEHDSGHDNCI-MOHJPFBDSA-N,10665700,yes,Kyrtuthrix,maculans,
CyanoMetDB_2346,Maculalactone F,,other cyclic peptide,other cyclic peptide,C34H28O4,500.1987594,C1[C@@H]([C@@]2(C(=C(C(=O)O2)CC3=CC=CC=C3)[C@@](C1=O)(C4=CC=CC=C4)O)CC5=CC=CC=C5)C6=CC=CC=C6,"InChI=1S/C34H28O4/c35-30-22-29(26-17-9-3-10-18-26)33(23-25-15-7-2-8-16-25)31(34(30,37)27-19-11-4-12-20-27)28(32(36)38-33)21-24-13-5-1-6-14-24/h1-20,29,37H,21-23H2/t29-,33-,34+/m1/s1",ZHAMDNLRQOFZPU-SJZCYFJVSA-N,10649055,yes,Kyrtuthrix,maculans,
CyanoMetDB_2347,Maculalactone D,,other cyclic peptide,other cyclic peptide,C34H30O3,486.2194948,C1[C@@H]([C@@H](C2=C(C(=O)O[C@@]2([C@H]1C3=CC=CC=C3)CC4=CC=CC=C4)CC5=CC=CC=C5)C6=CC=CC=C6)O,"InChI=1S/C34H30O3/c35-30-22-29(26-17-9-3-10-18-26)34(23-25-15-7-2-8-16-25)32(31(30)27-19-11-4-12-20-27)28(33(36)37-34)21-24-13-5-1-6-14-24/h1-20,29-31,35H,21-23H2/t29-,30+,31+,34-/m1/s1",VUFRSSRORSULJP-MNHGUUTPSA-N,10767276,yes,Kyrtuthrix,maculans,
CyanoMetDB_2348,Maculalactone,,other cyclic peptide,other cyclic peptide,C25H22O2,354.1619799,C1=CC=C(C=C1)CC2C(=C(C(=O)O2)CC3=CC=CC=C3)CC4=CC=CC=C4,"InChI=1S/C25H22O2/c26-25-23(17-20-12-6-2-7-13-20)22(16-19-10-4-1-5-11-19)24(27-25)18-21-14-8-3-9-15-21/h1-15,24H,16-18H2",IQRURBLUDNZHDE-UHFFFAOYSA-N,11394099,yes,Kyrtuthrix,maculans,
CyanoMetDB_2349,Maculalactone L,,other cyclic peptide,other cyclic peptide,C25H22O3,370.1568946,C1=CC=C(C=C1)CC2/C(=C/C3=CC=CC=C3)/C(C(=O)O2)(CC4=CC=CC=C4)O,"InChI=1S/C25H22O3/c26-24-25(27,18-21-14-8-3-9-15-21)22(16-19-10-4-1-5-11-19)23(28-24)17-20-12-6-2-7-13-20/h1-16,23,27H,17-18H2/b22-16-",WGASWKHIQMYEHL-JWGURIENSA-N,21575399,yes,Kyrtuthrix,maculans,
CyanoMetDB_2350,Maculalactone K,,other cyclic peptide,other cyclic peptide,C34H28O6,532.1885886,C1[C@H]([C@@]23[C@@H](O[C@@]2([C@@](C(=O)O3)(CC4=CC=CC=C4)O)[C@@](C1=O)(C5=CC=CC=C5)O)C6=CC=CC=C6)C7=CC=CC=C7,"InChI=1S/C34H28O6/c35-28-21-27(24-15-7-2-8-16-24)33-29(25-17-9-3-10-18-25)39-34(33,32(28,38)26-19-11-4-12-20-26)31(37,30(36)40-33)22-23-13-5-1-6-14-23/h1-20,27,29,37-38H,21-22H2/t27-,29-,31-,32-,33+,34-/m0/s1",GFAMJDLEQYJMPF-DLMDRUJCSA-N,139583928,yes,Kyrtuthrix,maculans,
CyanoMetDB_2351,Maculalactone I,,other cyclic peptide,other cyclic peptide,C34H30O6,534.2042387,C1[C@H]([C@@]23[C@@H](O[C@@]2([C@@](C(=O)O3)(CC4=CC=CC=C4)O)[C@@]([C@@H]1O)(C5=CC=CC=C5)O)C6=CC=CC=C6)C7=CC=CC=C7,"InChI=1S/C34H30O6/c35-28-21-27(24-15-7-2-8-16-24)33-29(25-17-9-3-10-18-25)39-34(33,32(28,38)26-19-11-4-12-20-26)31(37,30(36)40-33)22-23-13-5-1-6-14-23/h1-20,27-29,35,37-38H,21-22H2/t27-,28+,29-,31-,32-,33+,34-/m0/s1",WLKKMDMOHWGGMV-QLMQZALKSA-N,139583979,yes,Kyrtuthrix,maculans,
CyanoMetDB_2352,Maculalactone G,,other cyclic peptide,other cyclic peptide,C34H30O5,518.2093241,C1[C@@H]([C@@]2([C@]3([C@](O3)(C(=O)O2)CC4=CC=CC=C4)[C@]([C@H]1O)(C5=CC=CC=C5)O)CC6=CC=CC=C6)C7=CC=CC=C7,"InChI=1S/C34H30O5/c35-29-21-28(26-17-9-3-10-18-26)31(22-24-13-5-1-6-14-24)34(33(29,37)27-19-11-4-12-20-27)32(39-34,30(36)38-31)23-25-15-7-2-8-16-25/h1-20,28-29,35,37H,21-23H2/t28-,29+,31-,32-,33-,34+/m1/s1",MDTCKIOSBREYAT-YNFXEPLVSA-N,10553941,yes,Kyrtuthrix,maculans,
CyanoMetDB_2353,Maculalactone C,,other cyclic peptide,other cyclic peptide,C25H20O2,352.1463299,C1=CC=C(C=C1)CC\2=C(C(=O)O/C2=C/C3=CC=CC=C3)CC4=CC=CC=C4,"InChI=1S/C25H20O2/c26-25-23(17-20-12-6-2-7-13-20)22(16-19-10-4-1-5-11-19)24(27-25)18-21-14-8-3-9-15-21/h1-15,18H,16-17H2/b24-18+",LUUFEHDSGHDNCI-HKOYGPOVSA-N,10784186,yes,Kyrtuthrix,maculans,
CyanoMetDB_2354,Maculalactone E,,other cyclic peptide,other cyclic peptide,C34H30O4,502.2144094,C1[C@@H]([C@@]2(C(=C(C(=O)O2)CC3=CC=CC=C3)[C@]([C@H]1O)(C4=CC=CC=C4)O)CC5=CC=CC=C5)C6=CC=CC=C6,"InChI=1S/C34H30O4/c35-30-22-29(26-17-9-3-10-18-26)33(23-25-15-7-2-8-16-25)31(34(30,37)27-19-11-4-12-20-27)28(32(36)38-33)21-24-13-5-1-6-14-24/h1-20,29-30,35,37H,21-23H2/t29-,30+,33-,34-/m1/s1",NQTOOGBFGKMSCH-GBWWDHKLSA-N,11799629,yes,Kyrtuthrix,maculans,
CyanoMetDB_2355,Maculalactone H,,other cyclic peptide,other cyclic peptide,C34H30O6,534.2042387,C1[C@@H]([C@@]2([C@]3([C@](O3)(C(=O)O2)CC4=CC=CC=C4)[C@]([C@H]1O)(C5=CC=CC=C5)O)C(C6=CC=CC=C6)O)C7=CC=CC=C7,"InChI=1S/C34H30O6/c35-28-21-27(24-15-7-2-8-16-24)33(29(36)25-17-9-3-10-18-25)34(32(28,38)26-19-11-4-12-20-26)31(40-34,30(37)39-33)22-23-13-5-1-6-14-23/h1-20,27-29,35-36,38H,21-22H2/t27-,28+,29?,31-,32-,33+,34+/m1/s1",NMHJQXMIRNYVEX-JEQGAVSCSA-N,21600021,yes,Kyrtuthrix,maculans,
CyanoMetDB_2356,Maculalactone M,,other cyclic peptide,other cyclic peptide,C34H28O5,516.193674,C1=CC=C(C=C1)CC2=C([C@@](OC2=O)(CC3=CC=CC=C3)[C@H](CC(=O)O)C4=CC=CC=C4)C(=O)C5=CC=CC=C5,"nChI=1S/C34H28O5/c35-30(36)22-29(26-17-9-3-10-18-26)34(23-25-15-7-2-8-16-25)31(32(37)27-19-11-4-12-20-27)28(33(38)39-34)21-24-13-5-1-6-14-24/h1-20,29H,21-23H2,(H,35,36)/t29-,34-/m1/s1",COUKTGIAAFYSMG-ANHUGMMASA-N,101192913,yes,Kyrtuthrix,maculans,
CyanoMetDB_2357,Maculalactone J,,other cyclic peptide,other cyclic peptide,C34H30O6,534.2042387,C1[C@H]([C@@]23[C@@H](O[C@@]([C@]2([C@@]([C@@H]1O)(C4=CC=CC=C4)O)O)(C(=O)O3)CC5=CC=CC=C5)C6=CC=CC=C6)C7=CC=CC=C7,"InChI=1S/C34H30O6/c35-28-21-27(24-15-7-2-8-16-24)33-29(25-17-9-3-10-18-25)39-31(30(36)40-33,22-23-13-5-1-6-14-23)34(33,38)32(28,37)26-19-11-4-12-20-26/h1-20,27-29,35,37-38H,21-22H2/t27-,28+,29-,31+,32-,33+,34+/m0/s1",ZRTHDXCISSSDQB-JQQVBRSKSA-N,139585309,yes,Kyrtuthrix,maculans,
CyanoMetDB_2358,"Norharmane (9H-pyrido(3,4-b)indole",,other cyclic peptide,other cyclic peptide,C11H8N2,168.0687483,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,64961,yes,Nodularia ,harveyana,
CyanoMetDB_2359,"1,8-Dihydroxy-4-methylanthraquinone",,other cyclic peptide,other cyclic peptide,C15H10O4,254.0579088,CC1=C2C(=C(C=C1)O)C(=O)C3=C(C2=O)C=CC=C3O,"InChI=1S/C15H10O4/c1-7-5-6-10(17)13-11(7)14(18)8-3-2-4-9(16)12(8)15(13)19/h2-6,16-17H,1H3",SRVOZHBUHVINKL-UHFFFAOYSA-N,10244017,yes,Nostoc,commune,
CyanoMetDB_2360,Scytonemin,,other cyclic peptide,other cyclic peptide,C36H20N2O4,544.1423071,C1=CC=C2C(=C1)C3=C(C(=O)C(=CC4=CC=C(C=C4)O)C3=N2)C5=C6C7=CC=CC=C7N=C6C(=CC8=CC=C(C=C8)O)C5=O,"InChI=1S/C36H20N2O4/c39-21-13-9-19(10-14-21)17-25-33-29(23-5-1-3-7-27(23)37-33)31(35(25)41)32-30-24-6-2-4-8-28(24)38-34(30)26(36(32)42)18-20-11-15-22(40)16-12-20/h1-18,39-40H",CGZKSPLDUIRCIO-UHFFFAOYSA-N,122864,yes,Stigonema; Scytonema; Lyngbya,sp.,
CyanoMetDB_2361,Nostocionone,,other cyclic peptide,other cyclic peptide,C22H28O4,356.1987594,CC1=C(C(CCC1)(C)C)/C=C/C(=O)/C=C/C2=CC(=C(C(=C2)OC)O)OC,"InChI=1S/C22H28O4/c1-15-7-6-12-22(2,3)18(15)11-10-17(23)9-8-16-13-19(25-4)21(24)20(14-16)26-5/h8-11,13-14,24H,6-7,12H2,1-5H3/b9-8+,11-10+",UXASDRVSRFWWJJ-BNFZFUHLSA-N,71472183,yes,Nostoc ,commune,
CyanoMetDB_2362,N-Acetyltryptamine,,other cyclic peptide,other cyclic peptide,C12H14N2O,202.1106131,CC(=O)NCCC1=CNC2=CC=CC=C21,"InChI=1S/C12H14N2O/c1-9(15)13-7-6-10-8-14-12-5-3-2-4-11(10)12/h2-5,8,14H,6-7H2,1H3,(H,13,15)",NVUGEQAEQJTCIX-UHFFFAOYSA-N,70547,yes,Nostoc ,commune,
CyanoMetDB_2363,Carbamidocyclophane J,,other cyclic peptide,other cyclic peptide,C38H56Cl2N2O8,738.3413722,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C([C@@H]1OC(=O)N)C=C3O)O)CCCCCl)C)OC(=O)N)O)CCCCCl,"InChI=1S/C38H56Cl2N2O8/c1-23-11-3-5-13-25(15-7-9-17-39)34-31(45)21-28(22-32(34)46)36(50-38(42)48)24(2)12-4-6-14-26(16-8-10-18-40)33-29(43)19-27(20-30(33)44)35(23)49-37(41)47/h19-26,35-36,43-46H,3-18H2,1-2H3,(H2,41,47)(H2,42,48)/t23-,24-,25+,26+,35+,36+/m0/s1",DMRAUQGZAOJUBZ-LHTGRSOQSA-N,122206459,yes,Nostoc ,sp.,CAVN2
CyanoMetDB_2364,Cylindrocyclophane B,,other cyclic peptide,other cyclic peptide,C38H58O7,626.4182542,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)O)C)CCCC)C(=C2)O)O)OC(=O)C)C,"InChI=1S/C38H58O7/c1-6-8-16-27-19-13-11-15-25(4)38(45-26(5)39)30-22-33(42)36(34(43)23-30)28(17-9-7-2)18-12-10-14-24(3)37(44)29-20-31(40)35(27)32(41)21-29/h20-25,27-28,37-38,40-44H,6-19H2,1-5H3/t24-,25-,27-,28-,37+,38+/m0/s1",NUTUTERKXLKYNP-KZSBEIIZSA-N,21726857,yes,Cylindrospermum ,licheniforme,
CyanoMetDB_2365,Cylindrocyclophane D,,other cyclic peptide,other cyclic peptide,C40H60O8,668.4288189,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H]([C@H](C3=CC(=C1C(=C3)O)O)OC(=O)C)C)CCCC)C(=C2)O)O)OC(=O)C)C,"InChI=1S/C40H60O8/c1-7-9-17-29-19-13-11-15-25(3)40(48-28(6)42)32-23-35(45)38(36(46)24-32)30(18-10-8-2)20-14-12-16-26(4)39(47-27(5)41)31-21-33(43)37(29)34(44)22-31/h21-26,29-30,39-40,43-46H,7-20H2,1-6H3/t25-,26-,29-,30-,39+,40+/m0/s1",ISFVAVZOVOHZSB-IUWWWGALSA-N,10258912,yes,Cylindrospermum ,licheniforme,
CyanoMetDB_2366,Nostotrebinol 3,,other cyclic peptide,other cyclic peptide,C25H20O6,416.1259884,C1=CC(=CC=C1CC2=C(C(=O)C(C2=O)(C3=CC=C(C=C3)O)O)CC4=CC=C(C=C4)O)O,"InChI=1S/C25H20O6/c26-18-7-1-15(2-8-18)13-21-22(14-16-3-9-19(27)10-4-16)24(30)25(31,23(21)29)17-5-11-20(28)12-6-17/h1-12,26-28,31H,13-14H2",KYSRHPAVQNGVEF-UHFFFAOYSA-N,156580734,yes,Nostoc ,sp.,CBT1153
CyanoMetDB_2367,Nostolactone 4,,other cyclic peptide,other cyclic peptide,C25H20O6,416.1259884,C1=CC(=CC=C1CC2=C(C(=O)OC(=C2)C3=CC=C(C=C3)O)CC4=C(C=C(C=C4)O)O)O,"InChI=1S/C25H20O6/c26-19-6-1-15(2-7-19)11-18-13-24(16-3-8-20(27)9-4-16)31-25(30)22(18)12-17-5-10-21(28)14-23(17)29/h1-10,13-14,26-29H,11-12H2",ALOKGBOHBCZWBY-UHFFFAOYSA-N,156013417,yes,Nostoc ,sp.,CBT1153
CyanoMetDB_2368,Nostotrebin 7,,other cyclic peptide,other cyclic peptide,C50H38O11,814.241412,C1=CC(=CC=C1CC2=C(C(=O)C(C2=O)(C3=CC=C(C=C3)O)C4(C(=O)C(=C(C4=O)CC5=C(C=C(C=C5)O)O)CC6=CC=C(C=C6)O)C7=CC=C(C=C7)O)CC8=CC=C(C=C8)O)O,"InChI=1S/C50H38O11/c51-34-12-1-28(2-13-34)23-40-41(24-29-3-14-35(52)15-4-29)46(59)49(45(40)58,32-8-19-37(54)20-9-32)50(33-10-21-38(55)22-11-33)47(60)42(25-30-5-16-36(53)17-6-30)43(48(50)61)26-31-7-18-39(56)27-44(31)57/h1-22,27,51-57H,23-26H2",RLVXRRBFCACGMY-UHFFFAOYSA-N,156580735,yes,Nostoc ,sp.,CBT1153
CyanoMetDB_2369,Nostotrebinlactone 7,,other cyclic peptide,other cyclic peptide,C50H38O11,814.241412,C1=CC(=CC=C1CC2=C(C(=O)OC(=C2)C3=CC=C(C=C3)O)CC4=CC(=C(C=C4O)O)C5(C(=O)C(=C(C5=O)CC6=CC=C(C=C6)O)CC7=CC=C(C=C7)O)C8=CC=C(C=C8)O)O,"InChI=1S/C50H38O11/c51-35-11-1-28(2-12-35)21-32-26-46(31-7-17-38(54)18-8-31)61-49(60)40(32)24-33-25-43(45(57)27-44(33)56)50(34-9-19-39(55)20-10-34)47(58)41(22-29-3-13-36(52)14-4-29)42(48(50)59)23-30-5-15-37(53)16-6-30/h1-20,25-27,51-57H,21-24H2",AUBZSMDAMFIBDR-UHFFFAOYSA-N,156010554,yes,Nostoc ,sp.,CBT1153
CyanoMetDB_2370,Mabuniamide,,other cyclic peptide,other cyclic peptide,C58H87N9O11,1085.652505,CCCC(=O)N(C)[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N(C)[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC(C)C)C(=O)N(C)[C@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N(C)[C@H](CC3=CC=CC=C3)C(=O)N4CCC[C@H]4C(=O)OC,"InChI=1S/C58H87N9O11/c1-14-23-47(68)62(9)39(8)54(73)66-30-21-28-43(66)56(75)64(11)45(33-40-24-17-15-18-25-40)51(70)60-42(32-36(2)3)55(74)65(12)50(38(6)7)53(72)61-49(37(4)5)52(71)59-35-48(69)63(10)46(34-41-26-19-16-20-27-41)57(76)67-31-22-29-44(67)58(77)78-13/h15-20,24-27,36-39,42-46,49-50H,14,21-23,28-35H2,1-13H3,(H,59,71)(H,60,70)(H,61,72)/t39-,42-,43-,44-,45-,46+,49-,50+/m0/s1",BUBPCYJNLILLLQ-KZHFVTEZSA-N,145721243,yes,Okeania,sp.,
CyanoMetDB_2371,Microcolin E,,other cyclic peptide,other cyclic peptide,C39H63N5O8,729.467664,CCCC[C@@H](C)C[C@@H](C)C(=O)N(C)[C@@H](C=C(C)C)C(=O)N[C@@H]([C@@H](C)OC(=O)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N2[C@H](C=CC2=O)C,"InChI=1S/C39H63N5O8/c1-13-14-16-25(6)22-26(7)36(48)41(11)31(21-23(2)3)35(47)40-33(28(9)52-29(10)45)38(50)42(12)34(24(4)5)39(51)43-20-15-17-30(43)37(49)44-27(8)18-19-32(44)46/h18-19,21,24-28,30-31,33-34H,13-17,20,22H2,1-12H3,(H,40,47)/t25-,26-,27+,28-,30+,31+,33+,34+/m1/s1",IZGRARLNRPFDMM-APCQCXEZSA-N,139291904,yes,Moorea,producens,
CyanoMetDB_2372,Microcolin F,,other cyclic peptide,other cyclic peptide,C39H63N5O9,745.4625786,CCCC[C@@H](C)C[C@@H](C)C(=O)N(C)[C@@H](C=C(C)C)C(=O)N[C@@H]([C@@H](C)OC(=O)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C[C@H](C[C@H]1C(=O)N2[C@H](C=CC2=O)C)O,"InChI=1S/C39H63N5O9/c1-13-14-15-24(6)19-25(7)36(49)41(11)30(18-22(2)3)35(48)40-33(27(9)53-28(10)45)38(51)42(12)34(23(4)5)39(52)43-21-29(46)20-31(43)37(50)44-26(8)16-17-32(44)47/h16-18,23-27,29-31,33-34,46H,13-15,19-21H2,1-12H3,(H,40,48)/t24-,25-,26+,27-,29+,30+,31+,33+,34+/m1/s1",KRHBBIAEHFFEMF-PLBHUYDJSA-N,139291932,yes,Moorea,producens,
CyanoMetDB_2373,Microcolin G,,other cyclic peptide,other cyclic peptide,C37H61N5O8,703.452014,CCCC[C@@H](C)C[C@@H](C)C(=O)N(C)[C@@H](C=C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C[C@H](C[C@H]1C(=O)N2[C@H](C=CC2=O)C)O,"InChI=1S/C37H61N5O8/c1-12-13-14-23(6)18-24(7)34(47)39(10)28(17-21(2)3)33(46)38-31(26(9)43)36(49)40(11)32(22(4)5)37(50)41-20-27(44)19-29(41)35(48)42-25(8)15-16-30(42)45/h15-17,22-29,31-32,43-44H,12-14,18-20H2,1-11H3,(H,38,46)/t23-,24-,25+,26-,27+,28+,29+,31+,32+/m1/s1",JYBPDZNTEAJICX-COBHXZBRSA-N,139291920,yes,Moorea,producens,
CyanoMetDB_2374,Microcolin H,,other cyclic peptide,other cyclic peptide,C38H63N5O9,733.4625786,CCCCCC[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)OC(=O)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C[C@H](C[C@H]1C(=O)N2[C@H](C=CC2=O)C)O,"InChI=1S/C38H63N5O9/c1-12-13-14-15-16-24(6)35(48)40(10)29(19-22(2)3)34(47)39-32(26(8)52-27(9)44)37(50)41(11)33(23(4)5)38(51)42-21-28(45)20-30(42)36(49)43-25(7)17-18-31(43)46/h17-18,22-26,28-30,32-33,45H,12-16,19-21H2,1-11H3,(H,39,47)/t24-,25+,26-,28+,29+,30+,32+,33+/m1/s1",VVVUQZUDSPOQAQ-PEYQGHOASA-N,139292112,yes,Moorea,producens,
CyanoMetDB_2375,Microcolin I,,other cyclic peptide,other cyclic peptide,C38H63N5O8,717.467664,CCCCCC[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)OC(=O)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N2[C@H](C=CC2=O)C,"InChI=1S/C38H63N5O8/c1-12-13-14-15-17-25(6)35(47)40(10)30(22-23(2)3)34(46)39-32(27(8)51-28(9)44)37(49)41(11)33(24(4)5)38(50)42-21-16-18-29(42)36(48)43-26(7)19-20-31(43)45/h19-20,23-27,29-30,32-33H,12-18,21-22H2,1-11H3,(H,39,46)/t25-,26+,27-,29+,30+,32+,33+/m1/s1",AHUBGMIKOUFGDE-SIMQFNBDSA-N,139291778,yes,Moorea ,producens,
CyanoMetDB_2376,Microcolin L,,other cyclic peptide,other cyclic peptide,C40H67N5O9,761.4938788,CCCC[C@@H](C)C[C@@H](C)C(=O)N(C)[C@@H](CC(C)CC)C(=O)N[C@@H]([C@@H](C)OC(=O)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C[C@H](C[C@H]1C(=O)N2[C@H](C=CC2=O)C)O,"InChI=1S/C40H67N5O9/c1-13-15-16-25(6)19-26(7)37(50)42(11)31(20-24(5)14-2)36(49)41-34(28(9)54-29(10)46)39(52)43(12)35(23(3)4)40(53)44-22-30(47)21-32(44)38(51)45-27(8)17-18-33(45)48/h17-18,23-28,30-32,34-35,47H,13-16,19-22H2,1-12H3,(H,41,49)/t24?,25-,26-,27+,28-,30+,31+,32+,34+,35+/m1/s1",SVBLJQAMQKXPFK-RYEZEJOOSA-N,139292074,yes,Moorea,producens,
CyanoMetDB_2377,Microcolin M,,other cyclic peptide,other cyclic peptide,C34H60N4O9,668.4360295,CCCC[C@@H](C)C[C@@H](C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)OC(=O)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1C[C@H](C[C@H]1C(=O)O)O,"InChI=1S/C34H60N4O9/c1-12-13-14-21(6)16-22(7)31(42)36(10)26(15-19(2)3)30(41)35-28(23(8)47-24(9)39)32(43)37(11)29(20(4)5)33(44)38-18-25(40)17-27(38)34(45)46/h19-23,25-29,40H,12-18H2,1-11H3,(H,35,41)(H,45,46)/t21-,22-,23-,25+,26+,27+,28+,29+/m1/s1",GMLAMSMDQXLNOI-RGVJTZTDSA-N,139291861,yes,Moorea,producens,
CyanoMetDB_2378,Diatoxanthin,,other cyclic peptide,other cyclic peptide,C40H54O2,566.412381,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#CC2=C(C[C@H](CC2(C)C)O)C)/C)/C,"InChI=1S/C40H54O2/c1-29(17-13-19-31(3)21-23-37-33(5)25-35(41)27-39(37,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-38-34(6)26-36(42)28-40(38,9)10/h11-21,23,35-36,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,29-15+,30-16+,31-19+,32-20+/t35-,36-/m1/s1",HNYJHQMUSVNWPV-DRCJTWAYSA-N,6440986,no,Arthrospira ,platensis,
CyanoMetDB_2379,Diadinoxanthin,,other cyclic peptide,other cyclic peptide,C40H54O3,582.4072956,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/[C@]23[C@](O2)(C[C@H](CC3(C)C)O)C)/C)/C,"InChI=1S/C40H54O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-20,23-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,24-23+,29-15+,30-16+,31-19+,32-20+/t34-,35+,39-,40+/m1/s1",OGHZCSINIMWCSB-GHIQLMQGSA-N,6449888,no,Arthrospira ,platensis,
CyanoMetDB_2380,Kanamienamide,,other cyclic peptide,other cyclic peptide,C28H48N2O5,492.3563227,CC/C(=C/C(=O)N(C)/C=C\CCC[C@H]1CC[C@@H](C[C@H](C(=O)N([C@H](C(=O)O1)CC(C)C)C)C)C)/OC,"InChI=1S/C28H48N2O5/c1-9-23(34-8)19-26(31)29(6)16-12-10-11-13-24-15-14-21(4)18-22(5)27(32)30(7)25(17-20(2)3)28(33)35-24/h12,16,19-22,24-25H,9-11,13-15,17-18H2,1-8H3/b16-12-,23-19-/t21-,22+,24-,25-/m0/s1",MTZDCZNHECVTPF-ZIXRUXROSA-N,132915918,yes,Moorea ,bouillonii,
CyanoMetDB_2381,Kurahyne,,other cyclic peptide,other cyclic peptide,C47H78N6O7,838.5931989,CC[C@H](C)[C@@H](C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)CC)N(C)C(=O)[C@H]([C@@H](C)CC)N(C)C(=O)/C(=C/CCCC#C)/C,"InChI=1S/C47H78N6O7/c1-16-20-21-22-25-34(11)42(55)50(14)40(32(9)17-2)46(59)51(15)41(33(10)18-3)45(58)48(12)38(30(5)6)44(57)49(13)39(31(7)8)47(60)53-29-24-27-36(53)43(56)52-28-23-26-35(52)37(54)19-4/h1,25,30-33,35-36,38-41H,17-24,26-29H2,2-15H3/b34-25+/t32-,33-,35-,36-,38-,39-,40-,41-/m0/s1",LXNZOJGPYBTQHD-BTEYVOOESA-N,122193699,yes,Lyngbya,sp.,
CyanoMetDB_2382,Cocosolide,,other cyclic peptide,other cyclic peptide,C46H76O16,884.5133364,CC[C@@H]1C[C@H]1[C@@H]2C[C@@H]3C[C@@H](C([C@@H](O3)CC(=O)O[C@@H](C[C@@H]4C[C@@H](C([C@@H](O4)CC(=O)O2)(C)C)O[C@H]5[C@@H]([C@H]([C@@H](CO5)OC)OC)O)[C@@H]6C[C@H]6CC)(C)C)O[C@H]7[C@@H]([C@H]([C@@H](CO7)OC)OC)O,"InChI=1S/C46H76O16/c1-11-23-13-27(23)29-15-25-17-33(61-43-39(49)41(53-9)31(51-7)21-55-43)45(3,4)36(57-25)20-38(48)60-30(28-14-24(28)12-2)16-26-18-34(46(5,6)35(58-26)19-37(47)59-29)62-44-40(50)42(54-10)32(52-8)22-56-44/h23-36,39-44,49-50H,11-22H2,1-10H3/t23-,24-,25-,26-,27-,28-,29+,30+,31-,32-,33+,34+,35+,36+,39-,40-,41+,42+,43+,44+/m1/s1",UZEBHYHXOFOAPB-FITCGFMWSA-N,132579202,yes,Symploca,sp.,
CyanoMetDB_2383,Lyngbyabellin L,,other cyclic peptide,other cyclic peptide,C23H29ClN2O7S2,544.1104705,C[C@H]1[C@@H](OC(=O)C2=CSC(=N2)[C@@H](COC(=O)C3=CSC(=N3)[C@@H](OC1=O)C(C)C)O)CCC[C@@H](C)Cl,"InChI=1S/C23H29ClN2O7S2/c1-11(2)18-20-26-14(9-35-20)22(29)31-8-16(27)19-25-15(10-34-19)23(30)32-17(7-5-6-12(3)24)13(4)21(28)33-18/h9-13,16-18,27H,5-8H2,1-4H3/t12-,13+,16-,17+,18+/m1/s1",MBWMZYZBCQWQOJ-VGVSJJQXSA-N,70677297,yes,Moorea ,bouillonii,
CyanoMetDB_2384,Lyngbyabellin N,,other cyclic peptide,other cyclic peptide,C40H58Cl2N4O11S2,904.2920556,C[C@H]1[C@@H](OC(=O)C2=CSC(=N2)[C@@H](COC(=O)C3=CSC(=N3)[C@@H](OC1=O)C(C)C)OC(=O)C[C@H]([C@H](CC(C)C)NC(=O)[C@H](C(C)C)N(C)C)OC(=O)C)CCCC(C)(Cl)Cl,"InChI=1S/C40H58Cl2N4O11S2/c1-20(2)15-25(43-34(49)32(21(3)4)46(10)11)29(54-24(8)47)16-31(48)55-30-17-53-38(51)26-18-59-36(45-26)33(22(5)6)57-37(50)23(7)28(13-12-14-40(9,41)42)56-39(52)27-19-58-35(30)44-27/h18-23,25,28-30,32-33H,12-17H2,1-11H3,(H,43,49)/t23-,25-,28-,29+,30+,32-,33-/m0/s1",SCYRNRIZFGMUSB-STOGWRBBSA-N,70677428,yes,Moorea ,bouillonii,
CyanoMetDB_2385,7-epi-Lyngbyabellin L,,other cyclic peptide,other cyclic peptide,C23H29ClN2O7S2,544.1104705,C[C@H]1[C@@H](OC(=O)C2=CSC(=N2)[C@@H](COC(=O)C3=CSC(=N3)[C@@H](OC1=O)C(C)C)O)CCC[C@H](C)Cl,"InChI=1S/C23H29ClN2O7S2/c1-11(2)18-20-26-14(9-35-20)22(29)31-8-16(27)19-25-15(10-34-19)23(30)32-17(7-5-6-12(3)24)13(4)21(28)33-18/h9-13,16-18,27H,5-8H2,1-4H3/t12-,13-,16+,17-,18-/m0/s1",MBWMZYZBCQWQOJ-JQJKNKOQSA-N,70677298,yes,Moorea ,bouillonii,
CyanoMetDB_2386,Lyngbyabellin O,,other cyclic peptide,other cyclic peptide,C24H32Cl2N2O9S2,626.0926275,C[C@@H]([C@H](CCCC(C)(Cl)Cl)OC(=O)C1=CSC(=N1)[C@@H](CO)O)C(=O)O[C@H](C2=NC(=CS2)C(=O)OC)C(C)(C)O,"InChI=1S/C24H32Cl2N2O9S2/c1-12(20(31)37-17(23(2,3)34)19-28-13(10-39-19)21(32)35-5)16(7-6-8-24(4,25)26)36-22(33)14-11-38-18(27-14)15(30)9-29/h10-12,15-17,29-30,34H,6-9H2,1-5H3/t12-,15+,16-,17+/m0/s1",FQAXEPWBFFKCAO-NKKGCODLSA-N,139589824,yes,Okeania,sp.,
CyanoMetDB_2387,Lyngbyabellin P,,other cyclic peptide,other cyclic peptide,C36H53Cl2N3O12S2,853.244771,CCCC(=O)N[C@@H](CC(C)C)[C@@H](CC(=O)OC[C@H](C1=NC(=CS1)C(=O)O[C@@H](CCCC(C)(Cl)Cl)[C@H](C)C(=O)O[C@H](C2=NC(=CS2)C(=O)OC)C(C)(C)O)O)O,"InChI=1S/C36H53Cl2N3O12S2/c1-9-11-27(44)39-21(14-19(2)3)24(42)15-28(45)51-16-25(43)30-40-23(18-54-30)34(48)52-26(12-10-13-36(7,37)38)20(4)32(46)53-29(35(5,6)49)31-41-22(17-55-31)33(47)50-8/h17-21,24-26,29,42-43,49H,9-16H2,1-8H3,(H,39,44)/t20-,21-,24+,25+,26-,29+/m0/s1",OBWCQUXEFAKVED-CBHXVBAKSA-N,139589825,yes,Okeania,sp.,
CyanoMetDB_2389,Aeruginazole A,,other cyclic peptide,other cyclic peptide,C53H65N13O11S3,1155.408862,O=C(NCC(NCC(NCC(N[C@@H](C(C)C)C(N[C@@H](CC1=CC=CC=C1)C(N[C@H]2C(C)C)=O)=O)=O)=O)=O)C3=CSC([C@H](CC(N)=O)NC([C@@H](CC4=CC=C(O)C=C4)NC(C5=CSC([C@@H](CC(C)C)NC(C6=CSC2=N6)=O)=N5)=O)=O)=N3,"InChI=1S/C53H65N13O11S3/c1-26(2)16-34-51-63-37(24-79-51)48(75)58-32(18-30-12-14-31(67)15-13-30)46(73)61-35(19-39(54)68)52-62-36(23-78-52)45(72)57-21-41(70)55-20-40(69)56-22-42(71)65-43(27(3)4)50(77)59-33(17-29-10-8-7-9-11-29)47(74)66-44(28(5)6)53-64-38(25-80-53)49(76)60-34/h7-15,23-28,32-35,43-44,67H,16-22H2,1-6H3,(H2,54,68)(H,55,70)(H,56,69)(H,57,72)(H,58,75)(H,59,77)(H,60,76)(H,61,73)(H,65,71)(H,66,74)/t32-,33+,34-,35+,43+,44+/m1/s1",QHNWFWGAYHZBIR-DWEXPOFESA-N,101524711,yes,Microcystis,sp.,
CyanoMetDB_2390,"4,4'-Dihydroxybipheny",,other cyclic peptide,other cyclic peptide,C12H10O2,186.0680796,OC1=CC=C(C2=CC=C(O)C=C2)C=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,n.a. as of 04.01.022,no,Nostoc  ,insulare,
CyanoMetDB_2391,Carbamidocyclophane H,,other cyclic peptide,other cyclic peptide,C37H57NO7,627.4135032,C[C@@H]1[C@@H](OC(N)=O)C2=CC(O)=C([C@@H](CCCC)CCCC[C@H](C)[C@@H](O)C(C=C3O)=CC(O)=C3[C@@H](CCCC)CCCC1)C(O)=C2,"InChI=1S/C37H57NO7/c1-5-7-15-25-18-12-10-14-24(4)36(45-37(38)44)28-21-31(41)34(32(42)22-28)26(16-8-6-2)17-11-9-13-23(3)35(43)27-19-29(39)33(25)30(40)20-27/h19-26,35-36,39-43H,5-18H2,1-4H3,(H2,38,44)/t23-,24-,25-,26-,35+,36+/m0/s1",ZVBSXPFOVLVNGT-WDCWCBICSA-N,n.a. as of 04.01.022,yes ,Nostoc  ,sp.,CAVN2
CyanoMetDB_2392,Carbamidocyclophane I,,other cyclic peptide,other cyclic peptide,C37H56ClNO7,661.3745309,C[C@@H]1[C@@H](OC(N)=O)C2=CC(O)=C([C@@H](CCCC)CCCC[C@H](C)[C@@H](O)C(C=C3O)=CC(O)=C3[C@@H](CCCCCl)CCCC1)C(O)=C2,"InChI=1S/C37H56ClNO7/c1-4-5-14-25-15-8-6-12-23(2)35(44)27-19-29(40)34(30(41)20-27)26(17-10-11-18-38)16-9-7-13-24(3)36(46-37(39)45)28-21-31(42)33(25)32(43)22-28/h19-26,35-36,40-44H,4-18H2,1-3H3,(H2,39,45)/t23-,24-,25-,26+,35+,36+/m0/s1",CRKUQBYZVIIMFU-YXTQZPCGSA-N,n.a. as of 04.01.022,yes ,Nostoc  ,sp.,CAVN2
CyanoMetDB_2393,Carbamidocyclophane L,,other cyclic peptide,other cyclic peptide,C37H54Cl3NO7,729.2965862,C[C@@H]1[C@@H](OC(N)=O)C2=CC(O)=C([C@@H](CCCCCl)CCCC[C@H](C)[C@@H](O)C(C=C3O)=CC(O)=C3[C@@H](CCCC(Cl)Cl)CCCC1)C(O)=C2,"InChI=1S/C37H54Cl3NO7/c1-22-10-3-5-12-24(14-7-8-17-38)33-30(44)20-27(21-31(33)45)36(48-37(41)47)23(2)11-4-6-13-25(15-9-16-32(39)40)34-28(42)18-26(35(22)46)19-29(34)43/h18-25,32,35-36,42-46H,3-17H2,1-2H3,(H2,41,47)/t22-,23-,24+,25+,35+,36+/m0/s1",MRZSNJLELSACSG-IULTZZOBSA-N,n.a. as of 04.01.022,yes ,Nostoc  ,sp.,CAVN2
CyanoMetDB_2394,Carbamidocyclophane K,,other cyclic peptide,other cyclic peptide,C37H55Cl2NO7,695.3355585,C[C@@H]1[C@@H](OC(N)=O)C2=CC(O)=C([C@@H](CCCC)CCCC[C@H](C)[C@@H](O)C(C=C3O)=CC(O)=C3[C@@H](CCCC(Cl)Cl)CCCC1)C(O)=C2,"InChI=1S/C37H55Cl2NO7/c1-4-5-13-24-14-8-6-11-22(2)35(45)26-18-28(41)34(29(42)19-26)25(16-10-17-32(38)39)15-9-7-12-23(3)36(47-37(40)46)27-20-30(43)33(24)31(44)21-27/h18-25,32,35-36,41-45H,4-17H2,1-3H3,(H2,40,46)/t22-,23-,24-,25+,35+,36+/m0/s1",CTOMRWHWYYOKEM-CCNIBDGSSA-N,n.a. as of 04.01.022,yes ,Nostoc  ,sp.,CAVN2
CyanoMetDB_2395,Microcolin J,,other cyclic peptide,other cyclic peptide,C40H67N5O9,761.4938788,CCCC[C@@H](C)C[C@@H](C)C(N([C@H](C(N[C@H](C(N(C)[C@@H](C(C)C)C(N1[C@H](C(N2C(C=C[C@@H]2C)=O)=O)C[C@H](O)C1)=O)=O)[C@H](OC(CC)=O)C)=O)CC(C)C)C)=O,"InChI=1S/C40H67N5O9/c1-13-15-16-25(7)20-26(8)37(50)42(11)30(19-23(3)4)36(49)41-34(28(10)54-33(48)14-2)39(52)43(12)35(24(5)6)40(53)44-22-29(46)21-31(44)38(51)45-27(9)17-18-32(45)47/h17-18,23-31,34-35,46H,13-16,19-22H2,1-12H3,(H,41,49)/t25-,26-,27+,28-,29+,30+,31+,34+,35+/m1/s1",ODPNKPYOFDDULA-CRESJYSRSA-N,139292097,yes ,Moorea ,producens,
CyanoMetDB_2396,Microcolin K,,other cyclic peptide,other cyclic peptide,C38H63N5O8,717.467664,CCCC[C@@H](C)C[C@@H](C)C(N([C@H](C(N[C@H](C(N[C@@H](C(C)C)C(N1[C@H](C(N2C(C=C[C@@H]2C)=O)=O)CCC1)=O)=O)[C@H](OC(C)=O)C)=O)CC(C)C)C)=O,"InChI1S/C38H63N5O8/c1-12-13-15-24(6)21-25(7)36(48)41(11)30(20-22(2)3)34(46)40-33(27(9)51-28(10)44)35(47)39-32(23(4)5)38(50)42-19-14-16-29(42)37(49)43-26(8)17-18-31(43)45/h17-18,22-27,29-30,32-33H,12-16,19-21H2,1-11H3,(H,39,47)(H,40,46)/t24-,25-,26+,27-,29+,30+,32+,33+/m1/s1",UTLZQVRRNRCCAZ-DXGHJHHWSA-N,139291991,yes ,Moorea ,producens,
CyanoMetDB_2397,Iheyamide A,,other cyclic peptide,other cyclic peptide,C51H73N7O8,911.5520624,O=C(N(C)[C@@H](C(C)C)C(N1[C@H](C(N(C)[C@](C(N2[C@H](C(N3C(C=C(OC)[C@@H]3C(C)C)=O)=O)CCC2)=O)([C@@H](C)CC)[H])=O)CCC1)=O)[C@@H](CC4=CC=CC=C4)NC([C@H](CC5=CC=CC=C5)N(C)C)=O,"InChI=1S/C51H73N7O8/c1-12-34(6)45(51(65)57-28-20-26-39(57)49(63)58-42(59)31-41(66-11)43(58)32(2)3)55(10)48(62)38-25-19-27-56(38)50(64)44(33(4)5)54(9)47(61)37(29-35-21-15-13-16-22-35)52-46(60)40(53(7)8)30-36-23-17-14-18-24-36/h13-18,21-24,31-34,37-40,43-45H,12,19-20,25-30H2,1-11H3,(H,52,60)/t34-,37+,38-,39-,40-,43-,44-,45-/m0/s1",RIAXHXFNIGMQKF-CDUSOLRDSA-N,156580769,yes ,Dapis,sp.,
CyanoMetDB_2398,Iheyamide B,,other cyclic peptide,other cyclic peptide,C43H62N6O7,774.4679984,O=C(N(C)[C@@H](C(C)C)C(N1[C@H](C(N(C)[C@](C(N2[C@H](C(O)=O)CCC2)=O)([C@@H](C)CC)[H])=O)CCC1)=O)[C@@H](CC3=CC=CC=C3)NC([C@H](CC4=CC=CC=C4)N(C)C)=O,"InChI=1S/C43H62N6O7/c1-9-29(4)37(42(54)49-25-17-23-34(49)43(55)56)47(8)40(52)33-22-16-24-48(33)41(53)36(28(2)3)46(7)39(51)32(26-30-18-12-10-13-19-30)44-38(50)35(45(5)6)27-31-20-14-11-15-21-31/h10-15,18-21,28-29,32-37H,9,16-17,22-27H2,1-8H3,(H,44,50)(H,55,56)/t29-,32+,33-,34-,35-,36-,37-/m0/s1",CZTIPXPWSQRPSH-IVZUNISYSA-N,156580770,yes ,Dapis,sp.,
CyanoMetDB_2399,Iheyamide C,,other cyclic peptide,other cyclic peptide,C38H55N5O6,677.4152345,O=C(N(C)[C@@H](C(C)C)C(N1[C@H](C(N(C)[C@](C(O)=O)([C@@H](C)CC)[H])=O)CCC1)=O)[C@@H](CC2=CC=CC=C2)NC([C@H](CC3=CC=CC=C3)N(C)C)=O,"InChI=1S/C38H55N5O6/c1-9-26(4)33(38(48)49)42(8)36(46)30-21-16-22-43(30)37(47)32(25(2)3)41(7)35(45)29(23-27-17-12-10-13-18-27)39-34(44)31(40(5)6)24-28-19-14-11-15-20-28/h10-15,17-20,25-26,29-33H,9,16,21-24H2,1-8H3,(H,39,44)(H,48,49)/t26-,29+,30-,31-,32-,33-/m0/s1",MFLOERPGEKLIJM-LJNUWHPGSA-N,156580771,yes ,Dapis,sp.,
CyanoMetDB_2400,Kurahyne B,,other cyclic peptide,other cyclic peptide,C46H76N6O7,824.5775488,C[C@H]([C@@](N(C([C@](NC(/C(C)=C/CCCC#C)=O)([H])[C@H](CC)C)=O)C)([H])C(N([C@H](C(N([C@H](C(N1CCC[C@H]1C(N2CCC[C@H]2C(CC)=O)=O)=O)C(C)C)C)=O)C(C)C)C)=O)CC,"InChI=1S/C46H76N6O7/c1-15-19-20-21-24-33(11)41(54)47-37(31(9)16-2)43(56)50(14)40(32(10)17-3)45(58)48(12)38(29(5)6)44(57)49(13)39(30(7)8)46(59)52-28-23-26-35(52)42(55)51-27-22-25-34(51)36(53)18-4/h1,24,29-32,34-35,37-40H,16-23,25-28H2,2-14H3,(H,47,54)/b33-24+/t31-,32-,34-,35-,37-,38-,39-,40-/m0/s1",MRAAWPUFCZEHDM-SHRBXBQQSA-N,n.a. as of 04.01.022,yes ,Okeania,sp.,
CyanoMetDB_2401,Odoamide,,other cyclic peptide,other cyclic peptide,C46H73N5O10,855.5357436,CN(C([C@H](C)NC([C@H](O1)[C@@H](C)CC)=O)=O)[C@@H](C(N(CC(N[C@H](C(N([C@@H](C)C(O[C@H]([C@@H](C)CCC)[C@@H](C)[C@@H](O)C/C=C(C)/C1=O)=O)C)=O)[C@H](CC)C)=O)C)=O)CC2=CC=CC=C2,"InChI=1S/C46H73N5O10/c1-14-20-29(6)39-31(8)36(52)24-23-30(7)45(58)61-40(28(5)16-3)41(54)47-32(9)42(55)51(13)35(25-34-21-18-17-19-22-34)43(56)49(11)26-37(53)48-38(27(4)15-2)44(57)50(12)33(10)46(59)60-39/h17-19,21-23,27-29,31-33,35-36,38-40,52H,14-16,20,24-26H2,1-13H3,(H,47,54)(H,48,53)/b30-23+/t27-,28-,29-,31-,32-,33-,35+,36-,38-,39+,40+/m0/s1",YJQOYCXXISGMIG-LVAZOHBQSA-N,139590176,yes ,Okeania,sp.,
CyanoMetDB_2402,Microguanidine 703,MGD-703,other cyclic peptide,other cyclic peptide,C24H41N4O14S3,705.1775906,CC(C(C1=CC(COS(=O)(O)=O)=C(C=C1)OS(=O)(O)=O)OS(=O)(O)=O)OC(C(CCCN(C/C=C(C)\C)C(N)=N)[N+](C)(C)C)=O,"InChI=1S/C24H40N4O14S3/c1-16(2)11-13-27(24(25)26)12-7-8-20(28(4,5)6)23(29)40-17(3)22(42-45(36,37)38)18-9-10-21(41-44(33,34)35)19(14-18)15-39-43(30,31)32/h9-11,14,17,20,22H,7-8,12-13,15H2,1-6H3,(H5-,25,26,30,31,32,33,34,35,36,37,38)/p+1",YRCMJUMYISWWOS-UHFFFAOYSA-O,n.a. as of 04.01.022,no,field sample: Microcystis bloom,,
CyanoMetDB_2403,Microguanidine amide 771,MGA-771,other cyclic peptide,other cyclic peptide,C29H50N5O13S3,772.2561753,CC(C(C1=CC(COS(=O)(O)=O)=C(C=C1)OS(=O)(O)=O)OS(=O)(O)=O)NC(C(CCCN(C/C=C(C)\CC/C=C(C)/C)C(N)=N)[N+](C)(C)C)=O,"InChI=1S/C29H49N5O13S3/c1-20(2)10-8-11-21(3)15-17-33(29(30)31)16-9-12-25(34(5,6)7)28(35)32-22(4)27(47-50(42,43)44)23-13-14-26(46-49(39,40)41)24(18-23)19-45-48(36,37)38/h10,13-15,18,22,25,27H,8-9,11-12,16-17,19H2,1-7H3,(H6-,30,31,32,35,36,37,38,39,40,41,42,43,44)/p+1/b21-15-",HGOPAKLYVWSKPQ-QNGOZBTKSA-O,n.a. as of 04.01.022,yes ,field sample: Microcystis bloom,,
CyanoMetDB_2404,Microguanidine amide 787,MGA-787,other cyclic peptide,other cyclic peptide,C29H50N5O14S3,788.2510899,CC(C(C1=CC(COS(=O)(O)=O)=C(C=C1)OS(=O)(O)=O)OS(=O)(O)=O)NC(C(CCCN(C/C=C(C)\CCC(O)C(C)=C)C(N)=N)[N+](C)(C)C)=O,"InChI=1S/C29H49N5O14S3/c1-19(2)25(35)12-10-20(3)14-16-33(29(30)31)15-8-9-24(34(5,6)7)28(36)32-21(4)27(48-51(43,44)45)22-11-13-26(47-50(40,41)42)23(17-22)18-46-49(37,38)39/h11,13-14,17,21,24-25,27,35H,1,8-10,12,15-16,18H2,2-7H3,(H6-,30,31,32,36,37,38,39,40,41,42,43,44,45)/p+1/b20-14-",UWTXKITXALYADV-ZHZULCJRSA-O,n.a. as of 04.01.022,no,field sample: Microcystis bloom,,
CyanoMetDB_2405,Pukeleimide C,,other cyclic peptide,other cyclic peptide,C14H18N2O6,310.1164863,COCC1(C(N(C)/C(C1)=C/C(N2C(C=C(OC)C2)=O)=O)=O)O,"InChI=1S/C14H18N2O6/c1-15-9(6-14(20,8-21-2)13(15)19)4-11(17)16-7-10(22-3)5-12(16)18/h4-5,20H,6-8H2,1-3H3/b9-4+",GVPMLCNQCGYKQV-RUDMXATFSA-N,23247769,yes ,Lyngbya,majuscula,
CyanoMetDB_2406,Pukeleimide F,,other cyclic peptide,other cyclic peptide,C14H16N2O5,292.1059216,O=C(N1C(C=C(OC)C1)=O)/C=C(N2C)/C=C(COC)C2=O,"InChI=1S/C14H16N2O5/c1-15-10(4-9(8-20-2)14(15)19)5-12(17)16-7-11(21-3)6-13(16)18/h4-6H,7-8H2,1-3H3/b10-5-",WIKPEERQBVZRIY-YHYXMXQVSA-N,23247772,yes ,Lyngbya,majuscula,
CyanoMetDB_2407,Microcolin D,,other cyclic peptide,other cyclic peptide,C37H63N5O8,705.467664,CCCC[C@@H](C)C[C@@H](C)C(N(C)[C@@H](CC(C)C)C(N[C@@H]([C@@H](C)O)C(N(C)[C@@H](C(C)C)C(N1[C@H](C(N2C(C=C[C@@H]2C)=O)=O)C[C@H](O)C1)=O)=O)=O)=O,"InChI=1S/C37H63N5O8/c1-12-13-14-23(6)18-24(7)34(47)39(10)28(17-21(2)3)33(46)38-31(26(9)43)36(49)40(11)32(22(4)5)37(50)41-20-27(44)19-29(41)35(48)42-25(8)15-16-30(42)45/h15-16,21-29,31-32,43-44H,12-14,17-20H2,1-11H3,(H,38,46)/t23-,24-,25+,26-,27+,28+,29+,31+,32+/m1/s1",LGFRMTGWBFXONS-COBHXZBRSA-N,139291944,yes ,Moorea ,producens,
CyanoMetDB_2408,Palmyrrolinone,,other cyclic peptide,other cyclic peptide,C12H15NO4,237.100108,OC/C=C/C(OC)=C([H])\C(N1C(C=C[C@@H]1C)=O)=O,"InChI=1S/C12H15NO4/c1-9-5-6-11(15)13(9)12(16)8-10(17-2)4-3-7-14/h3-6,8-9,14H,7H2,1-2H3/b4-3+,10-8+/t9-/m0/s1",VHHVNQCXHWHJGF-VVQVOPMGSA-N,53355894,yes ,cf. Oscillatoria and Hormoscilla ,spp.,
CyanoMetDB_2409,N-(p-Coumaroyl)-tryptamine,,other cyclic peptide,other cyclic peptide,C19H18N2O2,306.1368278,OC(C=C1)=CC=C1/C=C/C(NCCC2=CNC3=CC=CC=C32)=O,"InChI=1S/C19H18N2O2/c22-16-8-5-14(6-9-16)7-10-19(23)20-12-11-15-13-21-18-4-2-1-3-17(15)18/h1-10,13,21-22H,11-12H2,(H,20,23)/b10-7+",CDMGLLBADMBULG-JXMROGBWSA-N,5458878,yes ,Nostoc,commune Vauch,
CyanoMetDB_2410,3-Oxo-b-ionone,,other cyclic peptide,other cyclic peptide,C13H18O2,206.1306798,CC1(C)CCC(C(C)=C1/C=C/C(C)=O)=O,"InChI=1S/C13H18O2/c1-9(14)5-6-11-10(2)12(15)7-8-13(11,3)4/h5-6H,7-8H2,1-4H3/b6-5+",OBHGOXFSRVNKBS-AATRIKPKSA-N,n.a. as of 04.01.022,yes ,Nostoc,commune,
CyanoMetDB_2411,Carbamidocyclophane V,,other cyclic peptide,other cyclic peptide,C37H53Cl4NO6,747.2626993,C[C@H]1CCCC[C@@H](C2=C(C=C(C=C2O)[C@@H]([C@H](CCCC[C@@H](C3=C(C=C(C1)C=C3O)O)CCCC(Cl)Cl)C)OC(=O)N)O)CCCC(Cl)Cl,"InChI=1S/C37H53Cl4NO6/c1-22-9-3-5-11-26(14-8-16-33(40)41)35-30(45)20-27(21-31(35)46)36(48-37(42)47)23(2)10-4-6-12-25(13-7-15-32(38)39)34-28(43)18-24(17-22)19-29(34)44/h18-23,25-26,32-33,36,43-46H,3-17H2,1-2H3,(H2,42,47)/t22-,23-,25+,26+,36+/m0/s1",VIRGUKOCQNXUQX-KFCUGCEISA-N,156582704,yes ,Cylindrospermum,stagnale,BEA 0605B
CyanoMetDB_2412,Carbamidocylindrofridin A,,other cyclic peptide,other cyclic peptide,C38H55Cl5N2O8,842.2401053,C[C@@H](CCCCC(CCCC(Cl)Cl)C1=C(C=C(C=C1O)[C@@H]([C@@H](C)CCCCC(CCCC(Cl)Cl)Cl)OC(=O)N)O)[C@H](C2=CC(=CC(=C2)O)O)OC(=O)N,"InChI=1S/C38H55Cl5N2O8/c1-22(35(52-37(44)50)25-17-28(46)21-29(47)18-25)9-3-5-11-24(12-7-15-32(40)41)34-30(48)19-26(20-31(34)49)36(53-38(45)51)23(2)10-4-6-13-27(39)14-8-16-33(42)43/h17-24,27,32-33,35-36,46-49H,3-16H2,1-2H3,(H2,44,50)(H2,45,51)/t22-,23-,24?,27?,35+,36+/m0/s1",NKBHZMFKBIRIAA-LJBJXKIKSA-N,156582705,yes ,Cylindrospermum,stagnale,BEA 0605B
CyanoMetDB_2413,Nostodione A,,other cyclic peptide,other cyclic peptide,C18H11NO3,289.0738932,C1=CC=C2C(=C1)C3=C(N2)/C(=C\C4=CC=C(C=C4)O)/C(=O)C3=O,"InChI=1S/C18H11NO3/c20-11-7-5-10(6-8-11)9-13-16-15(18(22)17(13)21)12-3-1-2-4-14(12)19-16/h1-9,19-20H/b13-9+",FOJRFMGTQBVGNJ-UKTHLTGXSA-N,21592415,yes ,Nostoc ,commune,
CyanoMetDB_2414,Kohamamide A,,other cyclic peptide,other cyclic peptide,C41H67N5O9,773.4938788,CC[C@H](C)[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O1)C(C)C)C)C(C)C)(C)C)CCCC#C)C)CC(C)C,"InChI=1S/C41H67N5O9/c1-14-16-17-20-30-41(11,12)40(53)44-31(24(5)6)36(49)45(13)32(25(7)8)39(52)55-33(26(9)15-2)37(50)46-21-18-19-29(46)35(48)43-28(22-23(3)4)34(47)42-27(10)38(51)54-30/h1,23-33H,15-22H2,2-13H3,(H,42,47)(H,43,48)(H,44,53)/t26-,27-,28-,29-,30-,31-,32-,33-/m0/s1",SYMJQMVNHFFMJD-DKTXOJPGSA-N,139589740,yes ,Okeania,sp.,
CyanoMetDB_2415,Kohamamide B,,other cyclic peptide,other cyclic peptide,C41H69N5O9,775.5095288,CC(C[C@H](NC([C@H]1N2CCC1)=O)C(N[C@@H](C)C(O[C@H](C(C)(C)C(N[C@@H](C(C)C)C(N([C@@H](C(C)C)C(O[C@]([C@H](CC)C)([H])C2=O)=O)C)=O)=O)CCCC=C)=O)=O)C,"InChI=1S/C41H69N5O9/c1-14-16-17-20-30-41(11,12)40(53)44-31(24(5)6)36(49)45(13)32(25(7)8)39(52)55-33(26(9)15-2)37(50)46-21-18-19-29(46)35(48)43-28(22-23(3)4)34(47)42-27(10)38(51)54-30/h14,23-33H,1,15-22H2,2-13H3,(H,42,47)(H,43,48)(H,44,53)/t26-,27-,28-,29-,30-,31-,32-,33-/m0/s1",HZXADFFZXXFRJU-DKTXOJPGSA-N,132506217,yes ,Okeania,sp.,
CyanoMetDB_2416,Kohamamide C,,other cyclic peptide,other cyclic peptide,C41H71N5O9,777.5251789,CCCCC[C@H]1C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@H](C(=O)O1)C)CC(C)C)[C@@H](C)CC)C(C)C)C)C(C)C)(C)C,"InChI=1S/C41H71N5O9/c1-14-16-17-20-30-41(11,12)40(53)44-31(24(5)6)36(49)45(13)32(25(7)8)39(52)55-33(26(9)15-2)37(50)46-21-18-19-29(46)35(48)43-28(22-23(3)4)34(47)42-27(10)38(51)54-30/h23-33H,14-22H2,1-13H3,(H,42,47)(H,43,48)(H,44,53)/t26-,27-,28-,29-,30-,31-,32-,33-/m0/s1",RWDZWKKRSSTUCK-DKTXOJPGSA-N,139589742,yes ,Okeania,sp.,
CyanoMetDB_2417,Leptolyngbyolide A,,other cyclic peptide,other cyclic peptide,C46H76O15,868.5184217,CO[C@H]([C@@]1(CO1)[C@@H](OC)C[C@@H](OC)[C@H](C)[C@@H]([C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]2C[C@H](OC)C[C@H](C)O2)OC3=O)C[C@H]4O[C@H](C[C@H](C/C=C(/C=C/3)C)O[C@H]5OC[C@H](O)[C@@H](O)[C@@H]5O)C=CC4,"InChI=1S/C46H76O15/c1-26-13-16-34(60-45-43(51)42(50)36(47)24-56-45)20-31-11-10-12-32(59-31)22-38(54-8)46(25-57-46)39(55-9)23-37(53-7)29(4)44(61-40(48)18-14-26)30(5)41(49)27(2)15-17-33-21-35(52-6)19-28(3)58-33/h10-11,13-14,18,27-39,41-45,47,49-51H,12,15-17,19-25H2,1-9H3/b18-14+,26-13+/t27-,28-,29-,30-,31-,32-,33-,34-,35+,36-,37+,38-,39-,41-,42+,43-,44-,45+,46-/m0/s1",WQAGYQWCNZVPBH-WSDAVYQWSA-N,101577972,yes ,Leptolyngbya,sp. ,
CyanoMetDB_2418,Leptolyngbyolide B,,other cyclic peptide,other cyclic peptide,C46H78O15,870.5340718,CO[C@H]([C@@H](CO)[C@@H](OC)C[C@@H](OC)[C@H](C)[C@@H]([C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]1C[C@H](OC)C[C@H](C)O1)OC2=O)C[C@H]3O[C@H](C[C@H](C/C=C(/C=C/2)C)O[C@H]4OC[C@H](O)[C@@H](O)[C@@H]4O)C=CC3,"InChI=1S/C46H78O15/c1-26-13-16-34(60-46-44(52)43(51)37(48)25-57-46)20-31-11-10-12-32(59-31)22-39(55-8)36(24-47)40(56-9)23-38(54-7)29(4)45(61-41(49)18-14-26)30(5)42(50)27(2)15-17-33-21-35(53-6)19-28(3)58-33/h10-11,13-14,18,27-40,42-48,50-52H,12,15-17,19-25H2,1-9H3/b18-14+,26-13+/t27-,28-,29-,30-,31-,32-,33-,34-,35+,36+,37-,38+,39-,40-,42-,43+,44-,45-,46+/m0/s1",QRNJWCXUTNJCFF-LCMRYDMKSA-N,101577973,yes ,Leptolyngbya,sp. ,
CyanoMetDB_2419,Leptolyngbyolide C,,other cyclic peptide,other cyclic peptide,C41H70O10,722.4968984,O[C@@H](C/C=C(/C=C/1)C)C[C@@H]2C=CC[C@@H](C[C@H](OC)[C@@H](C)[C@@H](OC)C[C@@H](OC)[C@H](C)[C@@H]([C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]3C[C@H](OC)C[C@H](C)O3)OC1=O)O2,"InChI=1S/C41H70O10/c1-25-14-17-31(42)21-32-12-11-13-33(50-32)23-36(46-8)28(4)37(47-9)24-38(48-10)29(5)41(51-39(43)19-15-25)30(6)40(44)26(2)16-18-34-22-35(45-7)20-27(3)49-34/h11-12,14-15,19,26-38,40-42,44H,13,16-18,20-24H2,1-10H3/b19-15+,25-14+/t26-,27-,28+,29-,30-,31-,32-,33-,34-,35+,36-,37-,38+,40-,41-/m0/s1",XIDJAWCQNJMXID-JQKQTBLXSA-N,101577974,yes ,Leptolyngbya,sp. ,
CyanoMetDB_2420,Leptolyngbyolide D,,other cyclic peptide,other cyclic peptide,C41H70O11,738.4918131,O[C@@H](C/C=C(/C=C/1)C)C[C@@H]2C=CC[C@@H](C[C@H](OC)[C@@H](CO)[C@@H](OC)C[C@@H](OC)[C@H](C)[C@@H]([C@@H](C)[C@@H](O)[C@@H](C)CC[C@H]3C[C@H](OC)C[C@H](C)O3)OC1=O)O2,"InChI=1S/C41H70O11/c1-25-13-16-30(43)20-31-11-10-12-32(51-31)22-37(48-8)35(24-42)38(49-9)23-36(47-7)28(4)41(52-39(44)18-14-25)29(5)40(45)26(2)15-17-33-21-34(46-6)19-27(3)50-33/h10-11,13-14,18,26-38,40-43,45H,12,15-17,19-24H2,1-9H3/b18-14+,25-13+/t26-,27-,28-,29-,30-,31-,32-,33-,34+,35+,36+,37-,38-,40-,41-/m0/s1",WLCGOUZSQSIKDE-VIRRSBRTSA-N,101577975,yes ,Leptolyngbya,sp. ,
CyanoMetDB_2422,Ambigol D,,other cyclic peptide,other cyclic peptide,C18H8Cl6O3,481.8604604,C1=CC(=C(C=C1Cl)Cl)OC2=C(C(=C(C=C2O)Cl)C3=C(C(=CC(=C3)Cl)Cl)O)Cl,"InChI=1S/C18H8Cl6O3/c19-7-1-2-14(10(21)4-7)27-18-13(25)6-11(22)15(16(18)24)9-3-8(20)5-12(23)17(9)26/h1-6,25-26H",QDBDYUNNEBPLSG-UHFFFAOYSA-N,156582793,yes,Fischerella ,ambigua,
CyanoMetDB_2423,Ambigol E,,other cyclic peptide,other cyclic peptide,C18H8Cl6O3,481.8604604,C1=CC(=C(C=C1Cl)Cl)OC2=C(C(=C(C=C2C3=C(C(=CC(=C3)Cl)Cl)O)Cl)O)Cl,"InChI=1S/C18H8Cl6O3/c19-7-1-2-14(11(21)4-7)27-18-10(6-13(23)17(26)15(18)24)9-3-8(20)5-12(22)16(9)25/h1-6,25-26H",PTSAOYMKLTZNCQ-UHFFFAOYSA-N,156582794,yes,Fischerella ,ambigua,
CyanoMetDB_2424,Nocuolactylate A,,other cyclic peptide,other cyclic peptide,C31H53ClN2O6,584.3592151,CCCCCC1=NN(C(CCOC([C@H](C)OC(C/C=C/CCCCCCCC([H])Cl)=O)=O)=O)O[C@H](CCCCC)C1,"InChI=1S/C31H53ClN2O6/c1-4-6-15-19-27-25-28(20-16-7-5-2)40-34(33-27)29(35)22-24-38-31(37)26(3)39-30(36)21-17-13-11-9-8-10-12-14-18-23-32/h13,17,26,28H,4-12,14-16,18-25H2,1-3H3/b17-13+/t26-,28+/m0/s1",ABZLAAWMNHBHEK-GCYRPIBMSA-N,n.a. as of 04.01.022,yes,Nodularia,sp. ,LEGE 06071
CyanoMetDB_2425,Nocuolactylate B,,other cyclic peptide,other cyclic peptide,C31H52Cl2N2O6,618.3202428,CCCCCC1=NN(C(CCOC([C@H](C)OC(C/C=C/CCCCCCCC(Cl)Cl)=O)=O)=O)O[C@H](CCCCC)C1,"InChI=1S/C31H52Cl2N2O6/c1-4-6-14-18-26-24-27(19-15-7-5-2)41-35(34-26)29(36)22-23-39-31(38)25(3)40-30(37)21-17-13-11-9-8-10-12-16-20-28(32)33/h13,17,25,27-28H,4-12,14-16,18-24H2,1-3H3/b17-13+/t25-,27+/m0/s1",WQVGBSKXYMJWPC-MHJWUGSZSA-N,n.a. as of 04.01.022,yes,Nodularia,sp. ,LEGE 06071
CyanoMetDB_2426,Nocuolactylate C,,other cyclic peptide,other cyclic peptide,C31H54N2O6,550.3981875,CCCCCC1=NN(C(CCOC([C@H](C)OC(C/C=C/CCCCCCCC([H])[H])=O)=O)=O)O[C@H](CCCCC)C1,"InChI=1S/C31H54N2O6/c1-5-8-11-12-13-14-15-16-19-22-30(35)38-26(4)31(36)37-24-23-29(34)33-32-27(20-17-9-6-2)25-28(39-33)21-18-10-7-3/h16,19,26,28H,5-15,17-18,20-25H2,1-4H3/b19-16+/t26-,28+/m0/s1",DPCLMFFAHQYQQZ-UQFUQSBQSA-N,n.a. as of 04.01.022,no,Nodularia,sp. ,LEGE 06071
CyanoMetDB_2427,Nostoclide N1,,other cyclic peptide,other cyclic peptide,C19H16O3,292.1099444,O=C(O/1)C(CC2=CC=CC=C2)=C(C)C1=C\C3=CC=C(O)C=C3,"InChI=1S/C19H16O3/c1-13-17(11-14-5-3-2-4-6-14)19(21)22-18(13)12-15-7-9-16(20)10-8-15/h2-10,12,20H,11H2,1H3/b18-12-",CFVWITDRESMAJD-PDGQHHTCSA-N,n.a. as of 04.01.022,yes,Nostoc,punctiforme,PCC 73102 
CyanoMetDB_2428,Nostoclide N2,,other cyclic peptide,other cyclic peptide,C20H18O4,322.1205091,O=C(O/1)C(CC2=CC=CC=C2)=C(C)C1=C\C3=CC(OC)=C(O)C=C3,"InChI=1S/C20H18O4/c1-13-16(10-14-6-4-3-5-7-14)20(22)24-18(13)11-15-8-9-17(21)19(12-15)23-2/h3-9,11-12,21H,10H2,1-2H3/b18-11-",FXYVGXQCFYJNOM-WQRHYEAKSA-N,n.a. as of 04.01.022,yes,Nostoc,punctiforme,PCC 73102 
CyanoMetDB_2429,Nostovalerolactone,,other cyclic peptide,other cyclic peptide,C20H26O7,378.1678532,CCCC/C=C/C=C/CC1OC(C(OC(C2=O)=C)=O)(O)C2=C(O)CC1(O)C,"InChI=1S/C20H26O7/c1-4-5-6-7-8-9-10-11-15-19(3,24)12-14(21)16-17(22)13(2)26-18(23)20(16,25)27-15/h7-10,15,21,24-25H,2,4-6,11-12H2,1,3H3/b8-7+,10-9+",WCUARMGZZMSDPS-XBLVEGMJSA-N,n.a. as of 04.01.022,yes,Nostoc,punctiforme,PCC 73102 
CyanoMetDB_2430,9-Dehydronostovalerolactone,,other cyclic peptide,other cyclic peptide,C20H24O6,360.1572885,CCCC/C=C/C=C/CC1OC(C(OC(C2=O)=C)=O)(O)C2=C(O)C=C1C,"InChI=1S/C20H24O6/c1-4-5-6-7-8-9-10-11-16-13(2)12-15(21)17-18(22)14(3)25-19(23)20(17,24)26-16/h7-10,12,16,21,24H,3-6,11H2,1-2H3/b8-7+,10-9+",XZHMWRYIKFOAKY-XBLVEGMJSA-N,n.a. as of 04.01.022,yes,Nostoc,punctiforme,PCC 73102 
CyanoMetDB_2431,Homodolastatin 16,,other cyclic peptide,,C48H72N6O10,892.5309925,CC[C@@H](C)[C@@H]1C(=O)N2CCC[C@H]2C(=O)NC(C(=O)N3CCC[C@H]3C(=O)NC(C(C(=O)OC(C(=O)N4CCC[C@H]4C(=O)O[C@@H](C(=O)N1C)C(C)C)C)C)C(C)C)C(C)CC5=CC=CC=C5,"InChI=1S/C48H72N6O10/c1-11-29(6)39-45(59)53-24-16-21-35(53)42(56)50-38(30(7)26-33-18-13-12-14-19-33)44(58)52-23-15-20-34(52)41(55)49-37(27(2)3)31(8)47(61)63-32(9)43(57)54-25-17-22-36(54)48(62)64-40(28(4)5)46(60)51(39)10/h12-14,18-19,27-32,34-40H,11,15-17,20-26H2,1-10H3,(H,49,55)(H,50,56)/t29-,30?,31?,32?,34+,35+,36+,37?,38?,39-,40-/m1/s1",FHDYETHRKSGXJQ-BHNJPRHWSA-N,21629651,yes,Lyngbya/Moorea,majuscula/producens,n.a.
CyanoMetDB_2432,Eremophilone,,other linear non-peptide,,C15H22O,18.1670653,C[C@H]1CCC=C2[C@@]1(C[C@@H](CC2=O)C(=C)C)C,"InChI=1S/C15H22O/c1-10(2)12-8-14(16)13-7-5-6-11(3)15(13,4)9-12/h7,11-12H,1,5-6,8-9H2,2-4H3/t11-,12+,15+/m0/s1",BSUGIIZTULADOL-YWPYICTPSA-N,21591457,yes,Calothrix  ,,PCC  7507
CyanoMetDB_2433,"6,11-epoxyisodaucane",,other linear non-peptide,,C15H26O,223.2056419,C[C@@H]1CCC[C@@]2(CC[C@H]3C2[C@@H]1OC3(C)C)C,"InChI=1S/C15H26O/c1-10-6-5-8-15(4)9-7-11-12(15)13(10)16-14(11,2)3/h10-13H,5-9H2,1-4H3/t10-,11+,12?,13-,15-/m1/s1",GAZOZLXFXCZLCJ-SMGHJGIKSA-N,22297709,yes,Calothrix  ,,PCC  7507
CyanoMetDB_2434,Isodihydroagarofuran,Dihydroagarofuran,other linear non-peptide,,C15H26O,223.2056419,C[C@H]1CCC[C@@]2([C@]13C[C@@H](CC2)C(O3)(C)C)C,"InChI=1S/C15H26O/c1-11-6-5-8-14(4)9-7-12-10-15(11,14)16-13(12,2)3/h11-12H,5-10H2,1-4H3/t11-,12+,14-,15-/m0/s1",HVAVUZLEYSAYGE-NEBZKDRISA-N,10775429,yes,Calothrix  ,,PCC  7507
CyanoMetDB_2435,Isomalyngamide K,,other linear non-peptide,,C24H38ClNO3,423.2540218,CCCCCCC[C@H](OC)C/C=C/CCC(NC/C(C1=CCCCC1=O)=C/Cl)=O,"InChI=1S/C24H38ClNO3/c1-3-4-5-6-8-13-21(29-2)14-9-7-10-17-24(28)26-19-20(18-25)22-15-11-12-16-23(22)27/h7,9,15,18,21H,3-6,8,10-14,16-17,19H2,1-2H3,(H,26,28)/b9-7+,20-18-/t21-/m0/s1",MFDHYPQDDSVRFS-KLNBHVKMSA-N,n.a. as of 04.01.23,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2436,Malyngamide D,,other linear non-peptide,,C24H38ClNO4,439.2489364,CCCCCCC[C@H](OC)C/C=C/CCC(NC/C(C1=CCCC(O)C1=O)=C/Cl)=O,"InChI=1S/C24H38ClNO4/c1-3-4-5-6-8-12-20(30-2)13-9-7-10-16-23(28)26-18-19(17-25)21-14-11-15-22(27)24(21)29/h7,9,14,17,20,22,27H,3-6,8,10-13,15-16,18H2,1-2H3,(H,26,28)/b9-7+,19-17-/t20-,22?/m0/s1",KEMQTMQXSBOLLF-AUARJMGZSA-N,23424744,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2437,12-epi-lyngbyatoxin A,,other linear non-peptide,,C27H39N3O2,437.3042275,CC(C)[C@@H]1C(=O)N[C@@H](CC2=CNC3=C(C=CC(=C23)N1C)[C@](C)(CCC=C(C)C)C=C)CO,"InChI=1S/C27H39N3O2/c1-8-27(6,13-9-10-17(2)3)21-11-12-22-23-19(15-28-24(21)23)14-20(16-31)29-26(32)25(18(4)5)30(22)7/h8,10-12,15,18,20,25,28,31H,1,9,13-14,16H2,2-7H3,(H,29,32)/t20-,25+,27-/m0/s1",KISDGNGREAJPQR-FESMNKHTSA-N,3034379,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2438,2-oxo-3(R)-hydroxy-lyngbyatoxin A,2-Oxo-3-hydroxy-teleocidin A-1,other linear non-peptide,,C27H39N3O4,469.2940568,CC(C)[C@H]1C(=O)N[C@@H](C[C@]2(C3=C(N1C)C=CC(=C3NC2=O)[C@](C)(CCC=C(C)C)C=C)O)CO,"InChI=1S/C27H39N3O4/c1-8-26(6,13-9-10-16(2)3)19-11-12-20-21-22(19)29-25(33)27(21,34)14-18(15-31)28-24(32)23(17(4)5)30(20)7/h8,10-12,17-18,23,31,34H,1,9,13-15H2,2-7H3,(H,28,32)(H,29,33)/t18-,23-,26-,27+/m0/s1",AKAPGGFVVBCFAJ-RFERPQLCSA-N,101883963,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2439,"2,3-seco-2,3-dioxo-lyngbyatoxin A",,other linear non-peptide,,C27H39N3O4,469.2940568,CC(C)[C@H]1C(=O)N[C@@H](CC(=O)C2=C(N1C)C=CC(=C2NC=O)[C@](C)(CCC=C(C)C)C=C)CO,"InChI=1S/C27H39N3O4/c1-8-27(6,13-9-10-17(2)3)20-11-12-21-23(24(20)28-16-32)22(33)14-19(15-31)29-26(34)25(18(4)5)30(21)7/h8,10-12,16,18-19,25,31H,1,9,13-15H2,2-7H3,(H,28,32)(H,29,34)/t19-,25-,27-/m0/s1",JYUKIYQJAAZEOB-BYGVMDBSSA-N,156581227,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2440,Oscillatoxin B,,other cyclic non-peptide,,C32H46O10,590.3090977,C[C@H]1[C@@H]2C[C@@]3(O[C@@H]1[C@@H](CC[C@H](OC)C4=CC(O)=CC=C4)C)C(C)(C)CC(C)(O)/C(O3)=C/C(O[C@@H]([C@H](O)C)CC(O2)=O)=O,"InChI=1S/C32H46O10/c1-18(11-12-23(38-7)21-9-8-10-22(34)13-21)29-19(2)25-16-32(42-29)30(4,5)17-31(6,37)26(41-32)15-28(36)39-24(20(3)33)14-27(35)40-25/h8-10,13,15,18-20,23-25,29,33-34,37H,11-12,14,16-17H2,1-7H3/b26-15-/t18-,19+,20-,23+,24-,25+,29-,31?,32-/m1/s1",VGJHVHJVPWZOAH-DELNKCHWSA-N,6442978,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2441,Biselyngbyaside F,,other cyclic non-peptide,,C34H52O9,604.3611332,C/C([C@@H](OC)C/C=C/[C@@H](O[C@H]1[C@H](O)[C@@H](OC)[C@H](O)[C@@H](CO)O1)CC2=O)=C\[C@H](C/C=C/C=C/C[C@H](/C=C(C)/C/C=C/C)O2)C,"InChI=1S/C34H52O9/c1-7-8-14-24(3)20-26-16-12-10-9-11-15-23(2)19-25(4)28(39-5)18-13-17-27(21-30(36)41-26)42-34-32(38)33(40-6)31(37)29(22-35)43-34/h7-13,17,19-20,23,26-29,31-35,37-38H,14-16,18,21-22H2,1-6H3/b8-7+,11-9+,12-10+,17-13+,24-20+,25-19+/t23-,26+,27+,28-,29+,31+,32+,33-,34+/m0/s1",QLNOFWPLTFNJPW-QASZSBGESA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_2444,Viequeamide C,,other cyclic peptide,,C44H67N5O9,809.4938788,C[C@H]1C(=O)N[C@H](C(=O)O[C@H](C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N1C)CC3=CC=CC=C3)C(C)C)C)C(C)C)(C)C)CCCC=C)C(C)C,"InChI=1S/C44H67N5O9/c1-13-14-16-23-33-44(9,10)43(56)46-34(26(2)3)40(53)48(12)36(28(6)7)42(55)57-32(25-30-20-17-15-18-21-30)39(52)49-24-19-22-31(49)38(51)47(11)29(8)37(50)45-35(27(4)5)41(54)58-33/h13,15,17-18,20-21,26-29,31-36H,1,14,16,19,22-25H2,2-12H3,(H,45,50)(H,46,56)/t29-,31-,32-,33-,34-,35-,36-/m0/s1",BDBPXKKUGNFRBV-ZBZKAUHLSA-N,71454619,no,Rivularia,n.a.,n.a.
CyanoMetDB_2445,Viequeamide D,,other cyclic peptide,,C44H69N5O9,811.5095288,CCCCC[C@H]1C(C(=O)N[C@H](C(=O)N([C@H](C(=O)O[C@H](C(=O)N2CCC[C@H]2C(=O)N([C@H](C(=O)N[C@H](C(=O)O1)C(C)C)C)C)CC3=CC=CC=C3)C(C)C)C)C(C)C)(C)C,"InChI=1S/C44H69N5O9/c1-13-14-16-23-33-44(9,10)43(56)46-34(26(2)3)40(53)48(12)36(28(6)7)42(55)57-32(25-30-20-17-15-18-21-30)39(52)49-24-19-22-31(49)38(51)47(11)29(8)37(50)45-35(27(4)5)41(54)58-33/h15,17-18,20-21,26-29,31-36H,13-14,16,19,22-25H2,1-12H3,(H,45,50)(H,46,56)/t29-,31-,32-,33-,34-,35-,36-/m0/s1",QCVXHIWOHZXQKT-ZBZKAUHLSA-N,71454620,no,Rivularia,n.a.,n.a.
CyanoMetDB_2446,Nostocyclopeptide M1,Ncp-M1,Cyclamide,,C47H59N7O10,881.4323412,C[C@H]1CC2C(=O)NC(C=NC(C(=O)NC(C(=O)N[C@@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N2C1)C(C)C)CCO)CC4=CC=C(C=C4)O)CC5=CC=C(C=C5)O)CC6=CC=C(C=C6)O,"InChI=1S/C47H59N7O10/c1-27(2)41-47(64)54-26-28(3)21-40(54)45(62)49-32(22-29-6-12-33(56)13-7-29)25-48-37(23-30-8-14-34(57)15-9-30)42(59)51-38(24-31-10-16-35(58)17-11-31)43(60)50-36(18-20-55)46(63)53-19-4-5-39(53)44(61)52-41/h6-17,25,27-28,32,36-41,55-58H,4-5,18-24,26H2,1-3H3,(H,49,62)(H,50,60)(H,51,59)(H,52,61)/t28-,32?,36+,37?,38?,39-,40?,41-/m0/s1",DVUWQGYGLZYWGL-QCSTXCLLSA-N,146683701,yes,Nostoc,sp.,
CyanoMetDB_2447,Nostopeptolide A2,,other cyclic peptide,other cyclic depsipeptide,C52H78N10O14,1066.569897,CCCC(=O)N[C@@H](C(C)C)C(=O)N[C@H]1COC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)CC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H](CN3C1=O)C)CC(C)C)CC(C)C)CC(=O)N)CC4=CC=C(C=C4)O,"nChI=1S/C52H78N10O14/c1-9-11-42(66)60-45(29(6)7)49(72)59-37-26-76-52(75)38-12-10-17-61(38)50(73)36(21-31-13-15-32(63)16-14-31)58-47(70)35(22-41(53)65)56-44(68)24-54-46(69)34(19-28(4)5)55-43(67)23-40(64)33(18-27(2)3)57-48(71)39-20-30(8)25-62(39)51(37)74/h13-16,27-30,33-39,45,63H,9-12,17-26H2,1-8H3,(H2,53,65)(H,54,69)(H,55,67)(H,56,68)(H,57,71)(H,58,70)(H,59,72)(H,60,66)/t30-,33-,34-,35-,36-,37-,38-,39-,45-/m0/s1",UEVIIAJOLZZKQH-PFARYBADSA-N,10819955,yes,Nostoc,n.a.,GSV 224
CyanoMetDB_2448,Aetokthonotoxin,AETX,other linear non-peptide,,C17H6Br5N3,646.6478617,N#CC1=C(N2C(Br)=C(Br)C3=C2C=CC(Br)=C3)NC4=C(Br)C=C(Br)C=C41,"InChI=1S/C17H6Br5N3/c18-7-1-2-13-10(3-7)14(21)16(22)25(13)17-11(6-23)9-4-8(19)5-12(20)15(9)24-17/h1-5,24H",JXJDQKCOJBAPQM-UHFFFAOYSA-N,155818808,yes,Aetokthonos,hydrillicola,CBT1886
CyanoMetDB_2449,Trikoramide A,,other cyclic peptide,,C68H97N11O10,1227.741988,CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCCC2C(=O)N[C@H](C(=O)N3CCC[C@H]3C(=O)N[C@H](C(=O)N4CCC[C@H]4C(=O)N[C@H](C(=O)N5CCC[C@H]5C(=O)N6[C@@H](C[C@@]7([C@H]6NC8=CC=CC=C87)CC=C(C)C)C(=O)N1)C(C)C)CC(C)C)CC(C)C)CC9=CC=CC=C9  ,"InChI=1S/C68H97N11O10/c1-39(2)28-29-68-38-55-61(84)69-47(34-40(3)4)57(80)70-50(37-44-20-12-11-13-21-44)64(87)76-31-17-25-52(76)59(82)71-48(35-41(5)6)62(85)75-30-16-24-51(75)58(81)72-49(36-42(7)8)63(86)77-32-18-26-53(77)60(83)74-56(43(9)10)66(89)78-33-19-27-54(78)65(88)79(55)67(68)73-46-23-15-14-22-45(46)68/h11-15,20-23,28,40-43,47-56,67,73H,16-19,24-27,29-38H2,1-10H3,(H,69,84)(H,70,80)(H,71,82)(H,72,81)(H,74,83)/t47-,48-,49-,50-,51-,52?,53-,54-,55-,56-,67-,68-/m0/s1  ",MZDZNXTVCVUCNV-SEPHMDQTSA-N,145721317,yes,Symploca,hydnoides,
CyanoMetDB_2450,Biselyngbyaside E,,other cyclic non-peptide,,C34H54O9,606.3767833,C/C([C@@H](OC)CCC[C@@H](O[C@H]1[C@H](O)[C@@H](OC)[C@H](O)[C@@H](CO)O1)CC2=O)=C\[C@H](C/C=C/C=C/C[C@H](/C=C(C/C=C/C)/C)O2)C,"InChI=1S/C34H54O9/c1-7-8-14-24(3)20-26-16-12-10-9-11-15-23(2)19-25(4)28(39-5)18-13-17-27(21-30(36)41-26)42-34-32(38)33(40-6)31(37)29(22-35)43-34/h7-12,19-20,23,26-29,31-35,37-38H,13-18,21-22H2,1-6H3/b8-7+,11-9+,12-10+,24-20-,25-19+/t23-,26+,27+,28-,29+,31+,32+,33-,34+/m0/s1",ZZKQOVMUYFKADO-IGTKPHDOSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_2451,Minnamide A,,other linear peptide,,C74H132N10O18,1448.972107,CCC[C@@H](O)C[C@H](C)C[C@@H](O)C[C@H](C)C[C@@H](O)C[C@H](C)C[C@H](O)CC(N[C@H](C(N(C)[C@](C(N[C@@H](C(N[C@H](CC(C)C)C(N(C)[C@H](C(N[C@H](C(N([C@H](C(N([C@@H](CCC(N)=O)C(N[C@@H](CC1=CC=C(OC)C=C1)CO)=O)C)=O)C(C)C)C)=O)CO)=O)C(C)C)=O)=O)CO)=O)([H])[C@H](CC)C)=O)CC(C)C)=O,"InChI=1S/C74H132N10O18/c1-20-22-52(88)31-46(11)32-53(89)33-47(12)34-54(90)35-48(13)36-55(91)38-63(93)77-57(29-42(3)4)71(98)84(18)66(49(14)21-2)70(97)79-59(40-86)67(94)78-58(30-43(5)6)72(99)82(16)64(44(7)8)69(96)80-60(41-87)73(100)83(17)65(45(9)10)74(101)81(15)61(27-28-62(75)92)68(95)76-51(39-85)37-50-23-25-56(102-19)26-24-50/h23-26,42-49,51-55,57-61,64-66,85-91H,20-22,27-41H2,1-19H3,(H2,75,92)(H,76,95)(H,77,93)(H,78,94)(H,79,97)(H,80,96)/t46-,47-,48-,49-,51-,52+,53+,54+,55-,57-,58+,59+,60-,61-,64-,65-,66+/m0/s1",QGFKIJHYWFMMLE-KPZCQLIWSA-N,,yes,Okeania ,hirsuta,
CyanoMetDB_2452,Ulongapeptin,,other cyclic peptide,,C44H68N6O8,808.5098632,C[C@H]1[C@H](CCCC#C)NC([C@H](C(C)C)NC([C@@H](CC2=CC=CC=C2)N(C)C([C@@H](C(C)C)N(C)C([C@H](C(C)C)NC([C@H](C(C)C)N(C)C([C@H](C)OC1=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C44H68N6O8/c1-15-16-18-23-32-29(10)44(57)58-30(11)41(54)49(13)36(27(6)7)40(53)47-35(26(4)5)42(55)50(14)37(28(8)9)43(56)48(12)33(24-31-21-19-17-20-22-31)38(51)46-34(25(2)3)39(52)45-32/h1,17,19-22,25-30,32-37H,16,18,23-24H2,2-14H3,(H,45,52)(H,46,51)(H,47,53)/t29-,30-,32-,33+,34-,35-,36-,37+/m0/s1",KLTWAAGRSKZRSM-OLLKMYFESA-N,10974841,yes ,Lyngbya,n.a.,
CyanoMetDB_2453,Jahanyne,,other linear peptide,,C60H94N8O9,1070.714377,C#CCCCC[C@H](C)C[C@@H](C)C(N(C)[C@H](C(N1CCC[C@H]1C(N([C@H](C(N([C@H](C(N([C@@H](C(N([C@H](C(N2[C@H](C(N3[C@H](C(C)=O)CCC3)=O)CCC2)=O)CC4=CC=CC=C4)C)=O)C(C)C)C)=O)C(C)C)C)=O)C(C)C)C)=O)=O)C)=O,"InChI=1S/C60H94N8O9/c1-17-18-19-21-27-41(8)36-42(9)53(70)61(12)43(10)54(71)67-34-25-31-47(67)55(72)63(14)51(39(4)5)59(76)65(16)52(40(6)7)60(77)64(15)50(38(2)3)58(75)62(13)49(37-45-28-22-20-23-29-45)57(74)68-35-26-32-48(68)56(73)66-33-24-30-46(66)44(11)69/h1,20,22-23,28-29,38-43,46-52H,18-19,21,24-27,30-37H2,2-16H3/t41-,42+,43-,46-,47-,48-,49-,50+,51-,52-/m0/s1",XHANIXUWEUFGJS-RWYDVKHMSA-N,122225466,yes,Lyngbya,n.a.,
CyanoMetDB_2454,Ikoamide,,other linear peptide,,C62H107N9O16,1233.783578,CCC[C@H](C[C@@H](CC(=O)N(C)[C@H]([C@@H](C)CC)C(=O)N[C@H](CO)C(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N(C)[C@@H]([C@@H](C)CC)C(=O)N(C)[C@@H](CCC(=O)N)C(=O)N(C)[C@@H](CC1=CC=C(C=C1)OC)C(=O)OC)OC)OC,"InChI=1S/C62H107N9O16/c1-20-23-43(85-17)33-44(86-18)34-51(75)70(14)53(38(8)21-2)57(78)65-46(35-72)55(76)64-45(30-36(4)5)58(79)68(12)48(31-37(6)7)56(77)66-52(40(10)73)60(81)71(15)54(39(9)22-3)61(82)67(11)47(28-29-50(63)74)59(80)69(13)49(62(83)87-19)32-41-24-26-42(84-16)27-25-41/h24-27,36-40,43-49,52-54,72-73H,20-23,28-35H2,1-19H3,(H2,63,74)(H,64,76)(H,65,78)(H,66,77)/t38-,39-,40+,43+,44-,45+,46+,47-,48-,49-,52-,53+,54-/m0/s1",FCHLMWAXQCNHTK-MXZYASFVSA-N,156010314,yes,Okeania ,sp.,
CyanoMetDB_2455,Alotamide A,,other cyclic peptide,cyclic depsipeptide,C32H49N3O5S,239.1108715,C/C1=C\C=C\CC(C)/C=C(C(N2[C@H](C3=N[C@@H](C(N([C@H](C(OC(C1)CC(C)OC)=O)C(C)C)C)=O)CS3)CCC2)=O)\C,"InChI=1S/C32H49N3O5S/c1-20(2)28-32(38)40-25(18-24(6)39-8)17-22(4)13-10-9-12-21(3)16-23(5)30(36)35-15-11-14-27(35)29-33-26(19-41-29)31(37)34(28)7/h9-10,13,16,20-21,24-28H,11-12,14-15,17-19H2,1-8H3/b10-9+,22-13+,23-16+/t21?,24?,25?,26-,27+,28+/m1/s1",NCUIESRBHFXRKK-LLEBMXSWSA-N,44480487,yes,Lyngbya,bouillonii,
CyanoMetDB_2456,31-noroscillatoxin B,,other cyclic non-peptide,cyclic depsipeptide,C31H44O10,576.2934476,C[C@H]1[C@@H]2C[C@@]3(O[C@@H]1[C@@H](CC[C@H](OC)C4=CC(O)=CC=C4)C)C(C)(C)CC(C)(O)/C(O3)=C/C(O[C@@H](CO)CC(O2)=O)=O,"InChI=1S/C31H44O10/c1-18(10-11-23(37-6)20-8-7-9-21(33)12-20)28-19(2)24-15-31(41-28)29(3,4)17-30(5,36)25(40-31)14-27(35)38-22(16-32)13-26(34)39-24/h7-9,12,14,18-19,22-24,28,32-33,36H,10-11,13,15-17H2,1-6H3/b25-14-/t18-,19+,22-,23+,24+,28-,30?,31-/m1/s1",YHHCTNRVZNNSHN-RYFCUMDUSA-N,6442997,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2457,30-methyloscillatoxin D,,other cyclic non-peptide,,C32H44O8,556.3036184,C[C@@H]1CC(C)([C@]2(C=C[C@@H]([C@H](O2)[C@H](C)CC[C@@H](C3=CC(O)=CC=C3)OC)C)[C@@H](C1=O)C(O[C@@H]4CC(OC4C)=O)=O)C,"InChI=1S/C32H44O8/c1-18(11-12-24(37-7)22-9-8-10-23(33)15-22)29-19(2)13-14-32(40-29)27(28(35)20(3)17-31(32,5)6)30(36)39-25-16-26(34)38-21(25)4/h8-10,13-15,18-21,24-25,27,29,33H,11-12,16-17H2,1-7H3/t18-,19+,20-,21?,24+,25-,27+,29-,32+/m1/s1",PRHBNKNLOZFUEA-RDVILQHLSA-N,185389,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2458,Oscillatoxin D,,other cyclic non-peptide,,C31H42O8,542.2879683,C[C@@H]1CC(C)(C)[C@@]2([C@H](C(O[C@@H]3CC(OC3)=O)=O)C1=O)C=C[C@H](C)[C@@H]([C@@H](CC[C@H](OC)C4=CC(O)=CC=C4)C)O2,"InChI=1S/C31H42O8/c1-18(10-11-24(36-6)21-8-7-9-22(32)14-21)28-19(2)12-13-31(39-28)26(27(34)20(3)16-30(31,4)5)29(35)38-23-15-25(33)37-17-23/h7-9,12-14,18-20,23-24,26,28,32H,10-11,15-17H2,1-6H3/t18-,19+,20-,23-,24+,26+,28-,31+/m1/s1",RYBYHPJXPIRVFK-CXRUDJRQSA-N,101283546,yes,,,
CyanoMetDB_2459,Prenylagaramide C,,other cyclic peptide,,C52H80N10O11,1020.600803,CC[C@@H]([C@H]1C(N2CCC[C@H]2C(N[C@@H](CC(C)C)C(N3CCC[C@H]3C(N[C@@H](CCC(N)=O)C(N[C@@H](C)C(N[C@@H](CC4=CC=C(OC/C=C(C)/C)C=C4)C(N[C@@H](CC(C)C)C(NCC(N1)=O)=O)=O)=O)=O)=O)=O)=O)=O)C,"InChI=1S/C52H80N10O11/c1-10-32(8)44-52(72)62-23-12-14-41(62)50(70)59-39(26-31(6)7)51(71)61-22-11-13-40(61)49(69)56-36(19-20-42(53)63)47(67)55-33(9)45(65)57-38(27-34-15-17-35(18-16-34)73-24-21-29(2)3)48(68)58-37(25-30(4)5)46(66)54-28-43(64)60-44/h15-18,21,30-33,36-41,44H,10-14,19-20,22-28H2,1-9H3,(H2,53,63)(H,54,66)(H,55,67)(H,56,69)(H,57,65)(H,58,68)(H,59,70)(H,60,64)/t32-,33-,36-,37-,38-,39-,40-,41-,44-/m0/s1",SIPYAYHFDUJHRA-FBUBZPHJSA-N,156582187,no,Planktothrix,agardhii,NIES-596
CyanoMetDB_2460,Bouillonamide,Bouillonamide A,other cyclic peptide,,C46H67N5O8,817.4989642,CC(CC/C=C/N(C)C(CC1C)=O)C(N[C@@H](C(N([C@H](C(N(C)[C@@H](C(C)O)C(N(C)[C@H](C(OC(C1)CC)=O)CC2=CC=CC=C2)=O)=O)CC3=CC=CC=C3)C)=O)C(C)C)=O,"InChI=1S/C46H67N5O8/c1-11-36-26-31(4)27-39(53)48(7)25-19-18-20-32(5)42(54)47-40(30(2)3)44(56)49(8)37(28-34-21-14-12-15-22-34)43(55)51(10)41(33(6)52)45(57)50(9)38(46(58)59-36)29-35-23-16-13-17-24-35/h12-17,19,21-25,30-33,36-38,40-41,52H,11,18,20,26-29H2,1-10H3,(H,47,54)/b25-19+/t31?,32?,33?,36?,37-,38-,40+,41-/m0/s1",LJNGIVUAMWQJIA-XLXQUYCLSA-N,139588400,yes,Moorea,bouillonii,
CyanoMetDB_2461,"6-cyano-5-methoxy-12-methylindolo[2,3-a]carbazole",,other linear non-peptide,,C21H15N3O,325.1215121,CN1C2=CC=CC=C2C3=C(C(=C4C5=CC=CC=C5NC4=C31)C#N)OC,"InChI=1S/C21H15N3O/c1-24-16-10-6-4-8-13(16)18-20(24)19-17(14(11-22)21(18)25-2)12-7-3-5-9-15(12)23-19/h3-10,23H,1-2H3",RZBCCAZHJQZKLL-UHFFFAOYSA-N,131447,yes,Nostoc,shaericum,EX-5-1
CyanoMetDB_2462,Carriebowlinol,"5-hydroxy-4-(chloromethyl)-5,6,7,8-tetrahydroquinoline",other linear non-peptide,alkaloid,C10H12ClNO,197.0607417,ClCC1=C([C@@H](O)CCC2)C2=NC=C1,"InChI=1S/C10H12ClNO/c11-6-7-4-5-12-8-2-1-3-9(13)10(7)8/h4-5,9,13H,1-3,6H2/t9-/m0/s1",GZEHTZDKKUTPMR-VIFPVBQESA-N,n.a. as of 04.01.23,yes,,,BCBC12-12.1 ;  BCBC12-12.2
CyanoMetDB_2463,Caylobolide A,"(26S,30S,34S)-36-hexan-2-yl-6,10,14,18,22,26,28,30,34-nonahydroxy-4-methyl-oxacyclohexatriacontan-2-one",other cyclic non-peptide,,C42H82O11,762.5857134,CCCCC(C1C[C@@H](O)CCC[C@H](O)CC(O)C[C@@H](O)CCCC(O)CCCC(O)CCCC(O)CCCC(O)CCCC(O)CC(C)CC(O1)=O)C,"InChI=1S/C42H82O11/c1-4-5-12-31(3)41-29-39(50)24-11-23-38(49)28-40(51)27-37(48)22-10-20-35(46)18-8-16-33(44)14-6-13-32(43)15-7-17-34(45)19-9-21-36(47)25-30(2)26-42(52)53-41/h30-41,43-51H,4-29H2,1-3H3/t30?,31?,32?,33?,34?,35?,36?,37-,38-,39-,40?,41?/m0/s1",ROFXLRMRNXXAJM-AJABYBDISA-N,102378697,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2464,Coibacin B,"(6S)-6beta-[(1E,3E,7E)-8-(2beta-Methylcyclopropane-1alpha-yl)-1,3,7-octatrienyl]-5,6-dihydro-2H-pyran-2-one",other linear non-peptide,,C17H22O2,258.1619799,C[C@H]1C[C@@H]1/C=C/CC/C=C/C=C/[C@@H]2CC=CC(=O)O2,"InChI=1S/C17H22O2/c1-14-13-15(14)9-6-4-2-3-5-7-10-16-11-8-12-17(18)19-16/h3,5-10,12,14-16H,2,4,11,13H2,1H3/b5-3+,9-6+,10-7+/t14-,15-,16+/m0/s1",PSXMSFFZXPEIJP-KLCVJRGZSA-N,60203969,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_2465,Coibacin D,,other linear non-peptide,,C15H21ClO2,268.1230076,C/C(=C\Cl)/C/C=C/CCCC[C@@H]1CC=CC(=O)O1,"InChI=1S/C15H21ClO2/c1-13(12-16)8-5-3-2-4-6-9-14-10-7-11-15(17)18-14/h3,5,7,11-12,14H,2,4,6,8-10H2,1H3/b5-3+,13-12+/t14-/m1/s1",VLBAJBDZRVUUIE-XCKYQUDOSA-N,102452154,yes,Oscillatoria/Planktothrix,,n.a.
CyanoMetDB_2466,Geosmin,,other linear non-peptide,,C12H22O,182.1670653,C[C@H]1CCC[C@@]2([C@@]1(CCCC2)O)C,"InChI=1S/C12H22O/c1-10-6-5-8-11(2)7-3-4-9-12(10,11)13/h10,13H,3-9H2,1-2H3/t10-,11+,12-/m0/s1",JLPUXFOGCDVKGO-TUAOUCFPSA-N,29746,yes,Oscillatoria,simplicissima,
CyanoMetDB_2467,Lyngbyapeptin B,,other linear peptide,,C38H51N5O7S,721.3509198,C[C@@H](C1=NC=CS1)NC(=O)[C@H](CC2=CC=C(C=C2)OC)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC3=CC=C(C=C3)OC)N(C)C(=O)/C=C(\C)/OC,"InChI=1S/C38H51N5O7S/c1-24(2)34(43(7)37(46)32(41(5)33(44)21-25(3)48-8)23-28-13-17-30(50-10)18-14-28)38(47)42(6)31(22-27-11-15-29(49-9)16-12-27)35(45)40-26(4)36-39-19-20-51-36/h11-21,24,26,31-32,34H,22-23H2,1-10H3,(H,40,45)/b25-21+/t26-,31-,32-,34-/m0/s1",FSPMQCXNAYXLFE-CYOLQUESSA-N,11146976,yes,Lyngbya,sp.,
CyanoMetDB_2468,Lyngbyapeptin C,,other linear peptide,,C39H53N5O7S,735.3665698,CC/C(=C\C(=O)N(C)[C@@H](CC1=CC=C(C=C1)OC)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)OC)C(=O)N[C@@H](C)C3=NC=CS3)/OC,"InChI=1S/C39H53N5O7S/c1-11-29(49-8)24-34(45)42(5)33(23-28-14-18-31(51-10)19-15-28)38(47)44(7)35(25(2)3)39(48)43(6)32(22-27-12-16-30(50-9)17-13-27)36(46)41-26(4)37-40-20-21-52-37/h12-21,24-26,32-33,35H,11,22-23H2,1-10H3,(H,41,46)/b29-24+/t26-,32-,33-,35-/m0/s1",BFEYGASJARPMCI-FRVJNIFGSA-N,11018063,yes,Lyngbya,sp.,
CyanoMetDB_2469,2-oxo-3(R)-hydroxy-13-N-desmethyl-lyngbyatoxin A,2-Oxo-3-hydroxy-13-N-desmethyl-teleocidin A-1,other linear non-peptide,,C26H37N3O4,455.2784067,CC(C)[C@H]1C(=O)N[C@@H](C[C@]2(C3=C(N1)C=CC(=C3NC2=O)[C@](C)(CCC=C(C)C)C=C)O)CO,"InChI=1S/C26H37N3O4/c1-7-25(6,12-8-9-15(2)3)18-10-11-19-20-22(18)29-24(32)26(20,33)13-17(14-30)27-23(31)21(28-19)16(4)5/h7,9-11,16-17,21,28,30,33H,1,8,12-14H2,2-6H3,(H,27,31)(H,29,32)/t17-,21-,25-,26+/m0/s1",IYWSJDFNYQWKPV-URWKRNFESA-N,101883964,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2470,Microginin 51A,Microginin 51-A,Microginin,,C49H68N6O11,916.4946071,CCCCCCC[C@@H]([C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)O)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)O)O)N,"InChI=1S/C49H68N6O11/c1-6-7-8-9-10-12-37(50)43(59)45(61)51-38(27-31-14-20-34(56)21-15-31)46(62)54(5)42(30(2)3)48(64)53(4)41(29-33-18-24-36(58)25-19-33)47(63)55-26-11-13-40(55)44(60)52-39(49(65)66)28-32-16-22-35(57)23-17-32/h14-25,30,37-43,56-59H,6-13,26-29,50H2,1-5H3,(H,51,61)(H,52,60)(H,65,66)/t37-,38-,39-,40-,41-,42-,43-/m0/s1",KNCUIJOWAGGZPU-NKUVHBIJSA-N,10102281,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_2471,Microginin 51B,Microginin 51-B,Microginin,,C50H70N6O11,930.5102571,CCCCCCC[C@@H]([C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N(C)[C@@H](C(C)C)C(=O)N(C)[C@@H](CC2=CC=C(C=C2)O)C(=O)N3CCC[C@H]3C(=O)N[C@@H](CC4=CC=C(C=C4)O)C(=O)O)O)NC,"InChI=1S/C50H70N6O11/c1-7-8-9-10-11-13-38(51-4)44(60)46(62)52-39(28-32-15-21-35(57)22-16-32)47(63)55(6)43(31(2)3)49(65)54(5)42(30-34-19-25-37(59)26-20-34)48(64)56-27-12-14-41(56)45(61)53-40(50(66)67)29-33-17-23-36(58)24-18-33/h15-26,31,38-44,51,57-60H,7-14,27-30H2,1-6H3,(H,52,62)(H,53,61)(H,66,67)/t38-,39-,40-,41-,42-,43-,44-/m0/s1",DHZQUBRGHKSKJI-VLOLPVCOSA-N,10843502,yes,Microcystis,aeruginosa,NIES 478
CyanoMetDB_2472,Cylindrocyclophane E,,other cyclic non-peptide,,C38H58O6,610.4233396,CCCC[C@H]1CCCC[C@@H]([C@H](C2=CC(=C([C@H](CCCC[C@@H](CC3=CC(=C1C(=C3)O)O)C)CCCC)C(=C2)O)O)OC(=O)C)C,"InChI=1S/C38H58O6/c1-6-8-16-29-19-13-11-15-26(4)38(44-27(5)39)31-23-34(42)37(35(43)24-31)30(17-9-7-2)18-12-10-14-25(3)20-28-21-32(40)36(29)33(41)22-28/h21-26,29-30,38,40-43H,6-20H2,1-5H3/t25-,26-,29-,30-,38+/m0/s1",FVCCCELSDGJJMK-QYBUPKPRSA-N,102306484,yes,Cylindrospermum ,licheniforme,
CyanoMetDB_2473,Patellamide A,,other cyclic peptide,,C35H50N8O6S2,742.3294729,CC[C@H](C)[C@H]1C2=N[C@@H](CO2)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=N[C@@H]([C@H](O4)C)C(=O)N[C@@H](C5=NC(=CS5)C(=O)N1)C(C)C)[C@@H](C)CC)C(C)C,"InChI=1S/C35H50N8O6S2/c1-10-17(7)25-32-36-20(12-48-32)28(44)39-23(15(3)4)34-37-22(14-50-34)30(46)42-26(18(8)11-2)33-43-27(19(9)49-33)31(47)40-24(16(5)6)35-38-21(13-51-35)29(45)41-25/h13-20,23-27H,10-12H2,1-9H3,(H,39,44)(H,40,47)(H,41,45)(H,42,46)/t17-,18-,19+,20-,23+,24+,25-,26-,27-/m0/s1",ZGJIVWQOEHQWLW-SWTUTNCKSA-N,157454,no,Prochloron ,didemni,
CyanoMetDB_2474,Patellamide C,,other cyclic peptide,Cyanobactin,C37H46N8O6S2,762.2981727,CC[C@H](C)[C@H]1C2=N[C@@H]([C@H](O2)C)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=N[C@@H]([C@H](O4)C)C(=O)N[C@@H](C5=NC(=CS5)C(=O)N1)C)C(C)C)CC6=CC=CC=C6,"InChI=1S/C37H46N8O6S2/c1-8-18(4)27-35-45-29(21(7)51-35)33(49)39-23(14-22-12-10-9-11-13-22)37-41-25(16-53-37)30(46)42-26(17(2)3)34-44-28(20(6)50-34)32(48)38-19(5)36-40-24(15-52-36)31(47)43-27/h9-13,15-21,23,26-29H,8,14H2,1-7H3,(H,38,48)(H,39,49)(H,42,46)(H,43,47)/t18-,19+,20+,21+,23+,26-,27-,28-,29-/m0/s1",CFXBLGFMQUFLKS-FUEDQDKVSA-N,9767970,Yes,Prochloron ,didemni,
CyanoMetDB_2475,Tantazole B,,other linear non-peptide,,C25H34N6O2S4,578.1626073,CC1=C(N=C(O1)[C@@]2(CSC(=N2)[C@@]3(CSC(=N3)[C@@]4(CSC(=N4)[C@]5(CSC(=N5)C(C)C)C)C)C)C)C(=O)NC,"InChI=1S/C25H34N6O2S4/c1-13(2)17-28-23(5,10-34-17)19-30-25(7,12-36-19)21-31-24(6,11-37-21)20-29-22(4,9-35-20)18-27-15(14(3)33-18)16(32)26-8/h13H,9-12H2,1-8H3,(H,26,32)/t22-,23+,24-,25-/m0/s1",QQRRYMHITBHPAI-NDBXHCKUSA-N,10348203,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_2476,Tolyporphin,TolyporphinA,other cyclic non-peptide,,C40H46N4O10,742.3213937,C[C@@H]1[C@H](O)C[C@@H](OC(C)=O)C([C@@]2(C)/C3=C/C4=CC(C)=C(/C=C5C([C@@](C)(C6[C@H](OC(C)=O)C[C@@H](O)[C@@H](C)O6)C(/C=C7C(C)=C/C(N/7)=C/C(C2=O)=N3)=N/5)=O)N4)O1,"InChI=1S/C40H46N4O10/c1-17-10-24-12-33-39(7,37-31(53-21(5)45)15-29(47)19(3)51-37)35(49)27(43-33)11-23-9-18(2)26(41-23)14-34-40(8,36(50)28(44-34)13-25(17)42-24)38-32(54-22(6)46)16-30(48)20(4)52-38/h9-14,19-20,29-32,37-38,41-42,47-48H,15-16H2,1-8H3/b23-11-,24-12-,25-13-,26-14-,27-11-,28-13-,33-12-,34-14-/t19-,20-,29-,30-,31-,32-,37?,38?,39+,40+/m1/s1",RQOFTLFCRJDAJR-OKXQDICBSA-N,21775645,yes,Tolypothrix,nodosa,HT-58-2
CyanoMetDB_2477,Trichamide,,other cyclic peptide,,C46H66N16O12S2,1098.448753,CC(C)C[C@H]1C(=O)N[C@H](C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@@H](C4=NC(=CS4)C(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N1)CC(=O)O)CO)CC(C)C)CCCN=C(N)N)CC5=CN=CN5,"InChI=1S/C46H66N16O12S2/c1-22(2)11-26-40(71)58-29(13-24-15-49-21-53-24)45(74)62-10-6-8-33(62)42(73)56-25(7-5-9-50-46(47)48)39(70)57-28(12-23(3)4)43-61-32(20-75-43)41(72)59-30(18-63)44-60-31(19-76-44)38(69)52-17-35(65)55-27(14-36(66)67)37(68)51-16-34(64)54-26/h15,19-23,25-30,33,63H,5-14,16-18H2,1-4H3,(H,49,53)(H,51,68)(H,52,69)(H,54,64)(H,55,65)(H,56,73)(H,57,70)(H,58,71)(H,59,72)(H,66,67)(H4,47,48,50)/t25-,26-,27-,28+,29-,30+,33-/m0/s1",WLYAGLFEKFHTPS-LJVFBLKJSA-N,24762144,no,Trichodesmium ,erythraeum,ISM101
CyanoMetDB_2478,Thiopalmyrone,,other linear non-peptide,,C7H10O3S,174.0350649,COC1=CC(=O)S[C@H](C1)CO,"InChI=1S/C7H10O3S/c1-10-5-2-6(4-8)11-7(9)3-5/h3,6,8H,2,4H2,1H3/t6-/m1/s1",LDZGBXIHQQUFKM-ZCFIWIBFSA-N,53355799,yes,cf. Oscillatoria and Hormoscilla ,spp.,
CyanoMetDB_2479,Tantazole A,,other linear non-peptide,,C24H32N6O2S4,564.1469572,CC(C)C(SC1)=N[C@]1(C)C(SC2)=N[C@]2([H])C(SC3)=N[C@]3(C)C(SC4)=N[C@]4(C)C5=NC(C(NC)=O)=C(C)O5,"InChI=1S/C24H32N6O2S4/c1-12(2)17-28-23(5,10-34-17)20-26-14(8-33-20)18-29-24(6,11-35-18)21-30-22(4,9-36-21)19-27-15(13(3)32-19)16(31)25-7/h12,14H,8-11H2,1-7H3,(H,25,31)/t14-,22-,23-,24-/m0/s1",DQTRTKWROSDCPR-PFPQXOPDSA-N,n.a. as of 04.01.23,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_2483,Tantazole F,,other linear non-peptide,,C24H32N6O2S4,564.1469572,CC(C)C(SC1)=N[C@]1(C)C(SC2)=N[C@]2(C)C(SC3)=N[C@]3(C)C(SC4)=N[C@]4([H])C5=NC(C(NC)=O)=C(C)O5,"InChI=1S/C24H32N6O2S4/c1-12(2)18-28-23(5,9-34-18)20-30-24(6,11-36-20)21-29-22(4,10-35-21)19-26-14(8-33-19)17-27-15(13(3)32-17)16(31)25-7/h12,14H,8-11H2,1-7H3,(H,25,31)/t14-,22-,23-,24-/m0/s1",GVJPLGIXTTUHTR-PFPQXOPDSA-N,n.a. as of 04.01.23,yes,Scytonema,mirabilis,BY-8-1
CyanoMetDB_2484,deoxy-Malyngamide C,,other linear non-peptide,,C24H38ClNO4,439.2489364,CCCCCCC[C@@H](C/C=C/CCC(NC/C(C1=C[C@H](CCC1=O)O)=C/Cl)=O)OC,"InChI=1S/C24H38ClNO4/c1-3-4-5-6-8-11-21(30-2)12-9-7-10-13-24(29)26-18-19(17-25)22-16-20(27)14-15-23(22)28/h7,9,16-17,20-21,27H,3-6,8,10-15,18H2,1-2H3,(H,26,29)/b9-7+,19-17-/t20-,21-/m0/s1",YOJMGEDZKFQKKL-FZLMFBQKSA-N,n.a. as of 04.01.23,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2485,Biselyngbyaside,,other cyclic non-peptide,,C34H52O9,604.3611332,C/C(C/C=C/C)=C/[C@H](O1)C/C=C/C=C/C[C@@H](/C=C([C@H](C/C=C/[C@H](CC1=O)O[C@H](O[C@@H]([C@H]([C@@H]2OC)O)CO)[C@@H]2O)OC)\C)C,"InChI=1S/C34H52O9/c1-7-8-14-24(3)20-26-16-12-10-9-11-15-23(2)19-25(4)28(39-5)18-13-17-27(21-30(36)41-26)42-34-32(38)33(40-6)31(37)29(22-35)43-34/h7-13,17,19-20,23,26-29,31-35,37-38H,14-16,18,21-22H2,1-6H3/b8-7+,11-9+,12-10+,17-13+,24-20-,25-19+/t23-,26+,27+,28-,29+,31+,32+,33-,34+/m0/s1",QLNOFWPLTFNJPW-CMAVNLJPSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_2486,Aestuaramide G,,other cyclic peptide,,C38H47N7O6S3,793.2749945,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC3=CS2)C)=O)CCC1)=O)CC4=CC=C(OC(C)(C=C)C)C=C4)C5=CSC([C@@H]6CCCN6C([C@H](CCSC)NC3=O)=O)=N5,"InChI=1S/C38H47N7O6S3/c1-6-38(3,4)51-24-13-11-23(12-14-24)19-26-37(50)44-16-7-9-29(44)33(48)39-22(2)34-42-27(20-53-34)31(46)40-25(15-18-52-5)36(49)45-17-8-10-30(45)35-43-28(21-54-35)32(47)41-26/h6,11-14,20-22,25-26,29-30H,1,7-10,15-19H2,2-5H3,(H,39,48)(H,40,46)(H,41,47)/t22-,25-,26-,29-,30-/m0/s1",UTNSRXPMIWKOSF-DMFYUYIISA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2487,Aestuaramide I,,other cyclic peptide,,C38H47N7O6S3,793.2749945,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC3=CS2)C)=O)CCC1)=O)CC4=CC(C/C=C(C)/C)=C(O)C=C4)C5=CSC([C@@H]6CCCN6C([C@H](CCSC)NC3=O)=O)=N5,"InChI=1S/C38H47N7O6S3/c1-21(2)9-11-24-17-23(10-12-31(24)46)18-26-38(51)44-14-5-7-29(44)34(49)39-22(3)35-42-27(19-53-35)32(47)40-25(13-16-52-4)37(50)45-15-6-8-30(45)36-43-28(20-54-36)33(48)41-26/h9-10,12,17,19-20,22,25-26,29-30,46H,5-8,11,13-16,18H2,1-4H3,(H,39,49)(H,40,47)(H,41,48)/t22-,25-,26-,29-,30-/m0/s1",OUBHQGSZWIALLW-DMFYUYIISA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2488,Aestuaramide J,,other cyclic peptide,,C38H47N7O7S3,809.2699091,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC3=CS2)C)=O)CCC1)=O)CC4=CC=C(OC(C)(C=C)C)C=C4)C5=CSC([C@@H]6CCCN6C([C@H](CCS(C)=O)NC3=O)=O)=N5,"InChI=1S/C38H47N7O7S3/c1-6-38(3,4)52-24-13-11-23(12-14-24)19-26-37(50)44-16-7-9-29(44)33(48)39-22(2)34-42-27(20-53-34)31(46)40-25(15-18-55(5)51)36(49)45-17-8-10-30(45)35-43-28(21-54-35)32(47)41-26/h6,11-14,20-22,25-26,29-30H,1,7-10,15-19H2,2-5H3,(H,39,48)(H,40,46)(H,41,47)/t22-,25-,26-,29-,30-,55?/m0/s1",YOBVOKDITCGTKT-KRXCYGPDSA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2489,Aestuaramide L,,other cyclic peptide,,C38H47N7O7S3,809.2699091,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC3=CS2)C)=O)CCC1)=O)CC4=CC(C/C=C(C)/C)=C(O)C=C4)C5=CSC([C@@H]6CCCN6C([C@H](CCS(C)=O)NC3=O)=O)=N5,"InChI=1S/C38H47N7O7S3/c1-21(2)9-11-24-17-23(10-12-31(24)46)18-26-38(51)44-14-5-7-29(44)34(49)39-22(3)35-42-27(19-53-35)32(47)40-25(13-16-55(4)52)37(50)45-15-6-8-30(45)36-43-28(20-54-36)33(48)41-26/h9-10,12,17,19-20,22,25-26,29-30,46H,5-8,11,13-16,18H2,1-4H3,(H,39,49)(H,40,47)(H,41,48)/t22-,25-,26-,29-,30-,55?/m0/s1",TXWCZFSALPTFSG-KRXCYGPDSA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2490,Aestuaramide D,,other cyclic peptide,,C40H51N7O7S3,837.3012092,O=C(C1=CSC([C@@H]2CCCN2C([C@@H](N3)CCS(C)=O)=O)=N1)N[C@@H](CC4=CC=C(C=C4)OC(C)(C)C=C)C(N5[C@@H](CCC5)C(N[C@@H](C(C)C)C6=NC(C3=O)=CS6)=O)=O,"InChI=1S/C40H51N7O7S3/c1-7-40(4,5)54-25-14-12-24(13-15-25)20-27-39(52)46-17-8-10-30(46)35(50)45-32(23(2)3)37-44-29(22-56-37)33(48)41-26(16-19-57(6)53)38(51)47-18-9-11-31(47)36-43-28(21-55-36)34(49)42-27/h7,12-15,21-23,26-27,30-32H,1,8-11,16-20H2,2-6H3,(H,41,48)(H,42,49)(H,45,50)/t26-,27-,30-,31-,32-,57?/m0/s1",OMSIIBMRDDGYGB-UXJPLUDTSA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2491,Aestuaramide F,,other cyclic peptide,,C40H51N7O7S3,838.3084857,O=C(C1=CSC([C@@H]2CCCN2C([C@@H](N3)CCS(C)=O)=O)=N1)N[C@@H](CC4=CC(C/C=C(C)\C)=C(C=C4)O)C(N5[C@@H](CCC5)C(N[C@@H](C(C)C)C6=NC(C3=O)=CS6)=O)=O,"InChI=1S/C40H51N7O7S3/c1-22(2)10-12-25-18-24(11-13-32(25)48)19-27-40(53)46-15-6-8-30(46)36(51)45-33(23(3)4)38-44-29(21-56-38)34(49)41-26(14-17-57(5)54)39(52)47-16-7-9-31(47)37-43-28(20-55-37)35(50)42-27/h10-11,13,18,20-21,23,26-27,30-31,33,48H,6-9,12,14-17,19H2,1-5H3,(H,41,49)(H,42,50)(H,45,51)/t26-,27-,30-,31-,33-,57?/m0/s1",XQTWOKFWZNOOSN-PZUJGFHOSA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2492,Trikoveramide A,,other cyclic peptide,other cyclic depsipeptide,C40H58N4O8,722.4254649,O=C(N[C@@H](C(C)C)C(N(C)[C@@H](C(C)C)C(O[C@H](CC1=CC=CC=C1)C(N(CCC2)[C@@H]2C(N(C)[C@H]3C(C)C)=O)=O)=O)=O)[C@@H](C)[C@@H](CCCC#C)OC3=O,"InChI=1S/C40H58N4O8/c1-11-12-14-21-30-27(8)35(45)41-32(24(2)3)38(48)43(10)34(26(6)7)40(50)52-31(23-28-18-15-13-16-19-28)37(47)44-22-17-20-29(44)36(46)42(9)33(25(4)5)39(49)51-30/h1,13,15-16,18-19,24-27,29-34H,12,14,17,20-23H2,2-10H3,(H,41,45)/t27-,29-,30+,31+,32-,33-,34-/m0/s1",DIXVUYUBAUWGGM-BGXDYLHZSA-N,n.a. as of 04.01.022,yes,Symploca ,hydnoides,
CyanoMetDB_2493,Cyanostatin B1,isomeric cyanostatin B,Microginin,,C40H59N5O9,753.4307,CCCCCCC[C@@H](N)[C@H](O)C(N[C@H](C(N([C@H](C(N1CCC[C@H]1C(N[C@H](C(O)=O)CC2=CC=C(O)C=C2)=O)=O)CC(C)C)C)=O)CC3=CC=C(O)C=C3)=O,"InChI=1S/C40H59N5O9/c1-5-6-7-8-9-11-30(41)35(48)37(50)42-31(23-26-13-17-28(46)18-14-26)38(51)44(4)34(22-25(2)3)39(52)45-21-10-12-33(45)36(49)43-32(40(53)54)24-27-15-19-29(47)20-16-27/h13-20,25,30-35,46-48H,5-12,21-24,41H2,1-4H3,(H,42,50)(H,43,49)(H,53,54)/t30-,31+,32+,33+,34+,35+/m1/s1",IOOZLJHOWVLNDK-SDCRPUFZSA-N,,no,,,
CyanoMetDB_2494,Trikoveramide B,,other cyclic peptide,other cyclic depsipeptide,C40H60N4O8,724.4411149,O=C(N[C@@H](C(C)C)C(N(C)[C@@H](C(C)C)C(O[C@H](CC1=CC=CC=C1)C(N(CCC2)[C@@H]2C(N(C)[C@H]3C(C)C)=O)=O)=O)=O)[C@@H](C)[C@@H](CCCC=C)OC3=O,"InChI=1S/C40H60N4O8/c1-11-12-14-21-30-27(8)35(45)41-32(24(2)3)38(48)43(10)34(26(6)7)40(50)52-31(23-28-18-15-13-16-19-28)37(47)44-22-17-20-29(44)36(46)42(9)33(25(4)5)39(49)51-30/h11,13,15-16,18-19,24-27,29-34H,1,12,14,17,20-23H2,2-10H3,(H,41,45)/t27-,29-,30+,31+,32-,33-,34-/m0/s1",CPFFJEDBIGCYAV-BGXDYLHZSA-N,n.a. as of 04.01.022,yes,Symploca ,hydnoides,
CyanoMetDB_2495,Trikoveramide C,,other cyclic peptide,other cyclic depsipeptide,C40H62N4O8,726.456765,O=C(N[C@@H](C(C)C)C(N(C)[C@@H](C(C)C)C(O[C@H](CC1=CC=CC=C1)C(N(CCC2)[C@@H]2C(N(C)[C@H]3C(C)C)=O)=O)=O)=O)[C@@H](C)[C@@H](CCCCC)OC3=O,"InChI=1S/C40H62N4O8/c1-11-12-14-21-30-27(8)35(45)41-32(24(2)3)38(48)43(10)34(26(6)7)40(50)52-31(23-28-18-15-13-16-19-28)37(47)44-22-17-20-29(44)36(46)42(9)33(25(4)5)39(49)51-30/h13,15-16,18-19,24-27,29-34H,11-12,14,17,20-23H2,1-10H3,(H,41,45)/t27-,29-,30+,31+,32-,33-,34-/m0/s1",FSPIGQZDISTRDY-BGXDYLHZSA-N,n.a. as of 04.01.022,yes,Symploca ,hydnoides,
CyanoMetDB_2496,MZ845A,,Cyanopeptolin,Micropeptin,C40H63N9O11,845.4642,CC(C)C[C@H]1C(O[C@@H]([C@@H](C(N[C@H](C(N[C@H]2CC[C@H]([N@](C2=O)[C@@H](C(N([C@H](C(N1)=O)CC3=CC=CC=C3)C)=O)CC(C)C)O)=O)CCC/N=C(N)\N)=O)NC([C@H](CO)O)=O)C)=O,"InChI=1S/C40H63N9O11/c1-21(2)17-27-39(59)60-23(5)32(47-35(55)30(51)20-50)36(56)44-25(13-10-16-43-40(41)42)33(53)45-26-14-15-31(52)49(37(26)57)29(18-22(3)4)38(58)48(6)28(34(54)46-27)19-24-11-8-7-9-12-24/h7-9,11-12,21-23,25-32,50-52H,10,13-20H2,1-6H3,(H,44,56)(H,45,53)(H,46,54)(H,47,55)(H4,41,42,43)/t23-,25+,26+,27+,28+,29-,30+,31-,32+/m1/s1",DNEOBOYULVQMEE-ASSRCULXSA-N,,no,,,
CyanoMetDB_2497,MZ845B,,Cyanopeptolin,Micropeptin,C40H63N9O11,845.4642,CC(C)C[C@H]1C(O[C@@H]([C@@H](C(N[C@H](C(N[C@H]2CC[C@H]([N@](C2=O)[C@@H](C(N([C@H](C(N1)=O)CC3=CC=CC=C3)C)=O)[C@H](C)CC)O)=O)CCC/N=C(N)\N)=O)NC([C@H](CO)O)=O)C)=O,"InChI=1S/C40H63N9O11/c1-7-22(4)32-38(58)48(6)28(19-24-12-9-8-10-13-24)34(54)46-27(18-21(2)3)39(59)60-23(5)31(47-35(55)29(51)20-50)36(56)44-25(14-11-17-43-40(41)42)33(53)45-26-15-16-30(52)49(32)37(26)57/h8-10,12-13,21-23,25-32,50-52H,7,11,14-20H2,1-6H3,(H,44,56)(H,45,53)(H,46,54)(H,47,55)(H4,41,42,43)/t22-,23-,25+,26+,27+,28+,29+,30-,31+,32-/m1/s1",WVIOEIJFTSXRSK-BROKJWNKSA-N,,no,,,
CyanoMetDB_2498,MZ845C,,Cyanopeptolin,Micropeptin,C40H63N9O11,845.4642,CC[C@@H](C)[C@H]1C(O[C@@H]([C@@H](C(N[C@H](C(N[C@H]2CC[C@H]([N@](C2=O)[C@@H](C(N([C@H](C(N1)=O)CC3=CC=CC=C3)C)=O)CC(C)C)O)=O)CCC/N=C(N)\N)=O)NC([C@H](CO)O)=O)C)=O,"InChI=1S/C40H63N9O11/c1-7-22(4)31-39(59)60-23(5)32(47-35(55)29(51)20-50)36(56)44-25(14-11-17-43-40(41)42)33(53)45-26-15-16-30(52)49(37(26)57)28(18-21(2)3)38(58)48(6)27(34(54)46-31)19-24-12-9-8-10-13-24/h8-10,12-13,21-23,25-32,50-52H,7,11,14-20H2,1-6H3,(H,44,56)(H,45,53)(H,46,54)(H,47,55)(H4,41,42,43)/t22-,23-,25+,26+,27+,28-,29+,30-,31+,32+/m1/s1",OQAWEMLMPDLISX-HQQRJMMJSA-N,,no,,,
CyanoMetDB_2499,Viequeamide E,,other cyclic peptide,,C45H67N5O9,821.4938788,C[C@H]1C(NC(C(C)CC)C(O[C@@H](CCCC#C)C(C)(C)C(N[C@@H](C(C)C)C(N(C)[C@@H](C(C)C)C(O[C@@H](CC2=CC=CC=C2)C(N3CCC[C@H]3C(N1C)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C45H67N5O9/c1-13-15-17-24-34-45(9,10)44(57)47-35(27(3)4)41(54)49(12)37(28(5)6)43(56)58-33(26-31-21-18-16-19-22-31)40(53)50-25-20-23-32(50)39(52)48(11)30(8)38(51)46-36(29(7)14-2)42(55)59-34/h1,16,18-19,21-22,27-30,32-37H,14-15,17,20,23-26H2,2-12H3,(H,46,51)(H,47,57)/t29?,30-,32-,33-,34-,35-,36?,37-/m0/s1",VCMSHTWREYRVSC-XMWOACDWSA-N,n.a. as of 04.01.23,no,Rivularia,n.a.,n.a.
CyanoMetDB_2500,Viequeamide F,,other cyclic peptide,,C45H67N5O9,821.4938788,C[C@H]1C(NC(C(C)C)C(O[C@@H](CCCC#C)C(C)(C)C(N[C@@H](C(C)C)C(N(C)[C@@H]([C@@H](CC)C)C(O[C@@H](CC2=CC=CC=C2)C(N3CCC[C@H]3C(N1C)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C45H67N5O9/c1-13-15-17-24-34-45(9,10)44(57)47-35(27(3)4)41(54)49(12)37(29(7)14-2)43(56)58-33(26-31-21-18-16-19-22-31)40(53)50-25-20-23-32(50)39(52)48(11)30(8)38(51)46-36(28(5)6)42(55)59-34/h1,16,18-19,21-22,27-30,32-37H,14-15,17,20,23-26H2,2-12H3,(H,46,51)(H,47,57)/t29-,30+,32+,33+,34+,35+,36?,37+/m1/s1",ASWUIHLNYTUXRY-RBDCKXRSSA-N,n.a. as of 04.01.23,no,Rivularia,n.a.,n.a.
CyanoMetDB_2502,MC-PrhcysR,,Microcystin,,C50H76N10O12S,1040.5359,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCSCCC)=O)=O)=O)=O,"InChI=1S/C50H76N10O12S/c1-10-24-73-25-22-37-47(67)59-41(49(70)71)31(5)43(63)56-36(17-14-23-53-50(51)52)46(66)55-35(19-18-28(2)26-29(3)39(72-9)27-34-15-12-11-13-16-34)30(4)42(62)58-38(48(68)69)20-21-40(61)60(8)33(7)45(65)54-32(6)44(64)57-37/h11-13,15-16,18-19,26,29-32,35-39,41H,7,10,14,17,20-25,27H2,1-6,8-9H3,(H,54,65)(H,55,66)(H,56,63)(H,57,64)(H,58,62)(H,59,67)(H,68,69)(H,70,71)(H4,51,52,53)/b19-18+,28-26+/t29-,30-,31-,32+,35-,36-,37-,38+,39-,41+/m0/s1",JZGASCVJGPHUHK-OJAUVJIOSA-N,,no,,,
CyanoMetDB_2503,MC-Prhcys(O)R,,Microcystin ,,C50H76N10O13S,1056.5309,O=C(N(C)C(C(N[C@@H](C1=O)C)=O)=C)CC[C@H](C(O)=O)NC([C@@H](C)[C@H](/C=C/C(C)=C/[C@H](C)[C@@H](OC)CC2=CC=CC=C2)NC([C@H](CCCNC(N)=N)NC([C@@H](C)[C@H](C(O)=O)NC([C@@H](N1)CCS(CCC)=O)=O)=O)=O)=O,"InChI=1S/C50H76N10O13S/c1-10-24-74(72)25-22-37-47(67)59-41(49(70)71)31(5)43(63)56-36(17-14-23-53-50(51)52)46(66)55-35(19-18-28(2)26-29(3)39(73-9)27-34-15-12-11-13-16-34)30(4)42(62)58-38(48(68)69)20-21-40(61)60(8)33(7)45(65)54-32(6)44(64)57-37/h11-13,15-16,18-19,26,29-32,35-39,41H,7,10,14,17,20-25,27H2,1-6,8-9H3,(H,54,65)(H,55,66)(H,56,63)(H,57,64)(H,58,62)(H,59,67)(H,68,69)(H,70,71)(H4,51,52,53)/b19-18+,28-26+/t29-,30-,31-,32+,35-,36-,37-,38+,39-,41+,74?/m0/s1",YCBFQQLWXYZRGR-FIMIXFQWSA-N,,no,,,
CyanoMetDB_2504,MG 821A,,Microginin,,C40H57Cl2N5O9,821.3528,CCC(C)C(C(N1CCCC1C(NC(C(O)=O)CC2=CC=C(O)C=C2)=O)=O)N(C(C(CC3=CC=C(O)C=C3)NC(C(O)C(N)CCCCCCC(Cl)Cl)=O)=O)C,"InChI=1S/C40H57Cl2N5O9/c1-4-24(2)34(39(54)47-21-9-11-32(47)36(51)45-31(40(55)56)23-26-15-19-28(49)20-16-26)46(3)38(53)30(22-25-13-17-27(48)18-14-25)44-37(52)35(50)29(43)10-7-5-6-8-12-33(41)42/h13-20,24,29-35,48-50H,4-12,21-23,43H2,1-3H3,(H,44,52)(H,45,51)(H,55,56)",FZTZSZSBDOINHA-UHFFFAOYSA-N ,,no,,,
CyanoMetDB_2505,Portobelamide A,,other cyclic peptide,other cyclic depsipeptide,C61H104N10O14,1200.773348,O=C(N[C@@H](C(C)C)C(N(C)[C@@H](COC)C(N[C@@H](C(C)C)C1=O)=O)=O)[C@@H](C(C)C)OC([C@@H](C)[C@H](CCCC#C)NC([C@H](C(C)C)N(C)C([C@H](C)N(C)C([C@H](COC)NC([C@H](C(C)C)N(C)C([C@H](CC(C)C)N(C)C([C@H]2N1CCC2)=O)=O)=O)=O)=O)=O)=O,"InChI=1S/C61H104N10O14/c1-23-24-25-27-41-39(14)61(82)85-50(38(12)13)54(75)65-46(34(4)5)59(80)68(18)45(32-84-22)51(72)64-47(35(6)7)60(81)71-29-26-28-43(71)57(78)67(17)44(30-33(2)3)58(79)70(20)49(37(10)11)53(74)63-42(31-83-21)56(77)66(16)40(15)55(76)69(19)48(36(8)9)52(73)62-41/h1,33-50H,24-32H2,2-22H3,(H,62,73)(H,63,74)(H,64,72)(H,65,75)/t39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50+/m0/s1",HLWUZSDGXDQYFA-MWPQZYGSSA-N,n.a. as of 04.01.022,yes,Caldora,sp.,
CyanoMetDB_2506,Portobelamide B,,other cyclic peptide,other cyclic depsipeptide,C68H117N11O15,1327.873062,CC[C@H](C)[C@H](N(C)C([C@H](C(C)C)N(C)C([C@@H](C(C)C)OC([C@@H](C)[C@H](CCCC#C)NC([C@H](C(C)C)N(C)C([C@@H](N(C)C([C@H](C(C)C)N1)=O)COC)=O)=O)=O)=O)=O)C(N[C@@H](C(C)C)C(N2[C@H](C(N(C)[C@@H](C(C)C)C(N(C)[C@@H](C)C(N(C)[C@@H](COC)C1=O)=O)=O)=O)CCC2)=O)=O,"InChI=1S/C68H117N11O15/c1-27-29-30-32-46-44(16)68(91)94-56(42(13)14)67(90)77(23)54(41(11)12)66(89)78(24)55(43(15)28-2)59(82)71-51(38(5)6)64(87)79-34-31-33-47(79)61(84)76(22)53(40(9)10)65(88)72(18)45(17)60(83)73(19)48(35-92-25)57(80)70-50(37(3)4)63(86)74(20)49(36-93-26)62(85)75(21)52(39(7)8)58(81)69-46/h1,37-56H,28-36H2,2-26H3,(H,69,81)(H,70,80)(H,71,82)/t43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56+/m0/s1",VRIISIYNWPTJHW-HRAYEEIUSA-N,n.a. as of 04.01.022,yes,Caldora,sp.,
CyanoMetDB_2507,Caciqueamide,,other linear peptide,,C39H65N5O9S,779.4502994,O=C(C(NC(C1=CSC(C(NC(/C(NC(C(C(C)O)NC(C(C)C(O)CCCCCCCCCCCCC(CCCC)=O)=O)=O)=C/C)=O)C)=N1)=O)C)OC,"InChI=1S/C39H65N5O9S/c1-8-10-21-29(46)22-19-17-15-13-11-12-14-16-18-20-23-32(47)25(3)34(48)44-33(28(6)45)37(51)42-30(9-2)35(49)40-26(4)38-43-31(24-54-38)36(50)41-27(5)39(52)53-7/h9,24-28,32-33,45,47H,8,10-23H2,1-7H3,(H,40,49)(H,41,50)(H,42,51)(H,44,48)/b30-9-",SVRMOJLZYKEVHX-LZWSGYTISA-N,n.a. as of 04.01.022,yes,Caldora,sp.,
CyanoMetDB_2508,Argicyclamide A,,other cyclic peptide,,C57H91N11O8,1057.705209,O=C(N[C@@H](C(C)C)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](C(C)C)C(N[C@@H](CC(C)C)C(N2[C@H]3CCC2)=O)=O)=O)=O)=O)[C@H](CCCN/C(NC/C=C(C)/C)=N/C/C=C(C)/C)NC([C@@H]4CCCN4C3=O)=O,"InChI=1S/C57H91N11O8/c1-13-39(12)48-54(74)65-47(38(10)11)53(73)63-43(32-36(6)7)55(75)68-31-19-24-45(68)56(76)67-30-18-23-44(67)51(71)61-41(22-17-27-58-57(59-28-25-34(2)3)60-29-26-35(4)5)49(69)64-46(37(8)9)52(72)62-42(50(70)66-48)33-40-20-15-14-16-21-40/h14-16,20-21,25-26,36-39,41-48H,13,17-19,22-24,27-33H2,1-12H3,(H,61,71)(H,62,72)(H,63,73)(H,64,69)(H,65,74)(H,66,70)(H2,58,59,60)/t39-,41-,42-,43-,44-,45-,46-,47-,48-/m0/s1",VDUSVHGJGCEEDO-XCLFSWKQSA-N,n.a. as of 04.01.022,yes,Microcystis,aeruginosa,NIES-88
CyanoMetDB_2509,Argicyclamide B,,other cyclic peptide,,C52H83N11O8,989.6426087,O=C(N[C@@H](C(C)C)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](C(C)C)C(N[C@@H](CC(C)C)C(N2[C@H]3CCC2)=O)=O)=O)=O)=O)[C@H](CCCNC(NC/C=C(C)/C)=N)NC([C@@H]4CCCN4C3=O)=O,"InChI=1S/C52H83N11O8/c1-11-34(10)43-49(69)60-42(33(8)9)48(68)58-38(28-31(4)5)50(70)63-27-17-22-40(63)51(71)62-26-16-21-39(62)46(66)56-36(20-15-24-54-52(53)55-25-23-30(2)3)44(64)59-41(32(6)7)47(67)57-37(45(65)61-43)29-35-18-13-12-14-19-35/h12-14,18-19,23,31-34,36-43H,11,15-17,20-22,24-29H2,1-10H3,(H,56,66)(H,57,67)(H,58,68)(H,59,64)(H,60,69)(H,61,65)(H3,53,54,55)/t34-,36-,37-,38-,39-,40-,41-,42-,43-/m0/s1",FGNFJKZJHUJNGP-BVJLKCAWSA-N,n.a. as of 04.01.022,yes,Microcystis,aeruginosa,NIES-88
CyanoMetDB_2510,Argicyclamide C,,other cyclic peptide,,C47H75N11O8,921.5800085,O=C(N[C@@H](C(C)C)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](C(C)C)C(N[C@@H](CC(C)C)C(N2[C@H]3CCC2)=O)=O)=O)=O)=O)[C@H](CCCNC(N)=N)NC([C@@H]4CCCN4C3=O)=O,"InChI=1S/C47H75N11O8/c1-9-29(8)38-44(64)55-37(28(6)7)43(63)53-33(24-26(2)3)45(65)58-23-15-20-35(58)46(66)57-22-14-19-34(57)41(61)51-31(18-13-21-50-47(48)49)39(59)54-36(27(4)5)42(62)52-32(40(60)56-38)25-30-16-11-10-12-17-30/h10-12,16-17,26-29,31-38H,9,13-15,18-25H2,1-8H3,(H,51,61)(H,52,62)(H,53,63)(H,54,59)(H,55,64)(H,56,60)(H4,48,49,50)/t29-,31-,32-,33-,34-,35-,36-,37-,38-/m0/s1",AMEGMYQPFZPGCJ-PZZKTYJJSA-N,n.a. as of 04.01.022,yes,Microcystis,aeruginosa,NIES-88
CyanoMetDB_2511,Trikoramide B,,other cyclic peptide,,C68H97N11O11,1243.736903,OC(C)(/C=C/[C@@]1(C[C@@H](C(N[C@H](C(N[C@H](C(N2[C@H](C3=O)CCC2)=O)CC4=CC=CC=C4)=O)CC(C)C)=O)N5C([C@@H]6CCCN6C([C@@H](NC([C@@H]7CCCN7C([C@@H](NC([C@@H]8CCCN8C([C@@H](N3)CC(C)C)=O)=O)CC(C)C)=O)=O)C(C)C)=O)=O)C9=C(N[C@@]51[H])C=CC=C9)C,"InChI=1S/C68H97N11O11/c1-39(2)34-46-56(80)70-49(37-43-20-12-11-13-21-43)63(87)76-31-17-25-51(76)58(82)71-47(35-40(3)4)61(85)75-30-16-24-50(75)57(81)72-48(36-41(5)6)62(86)77-32-18-26-52(77)59(83)74-55(42(7)8)65(89)78-33-19-27-53(78)64(88)79-54(60(84)69-46)38-68(29-28-67(9,10)90)44-22-14-15-23-45(44)73-66(68)79/h11-15,20-23,28-29,39-42,46-55,66,73,90H,16-19,24-27,30-38H2,1-10H3,(H,69,84)(H,70,80)(H,71,82)(H,72,81)(H,74,83)/b29-28+/t46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,66-,68+/m0/s1",KXIQVBWQDPJHBO-HRSCYUBXSA-N,n.a. as of 04.01.022,yes,Symploca,hydnoides,
CyanoMetDB_2512,Trikoramide C,,other cyclic peptide,,C68H97N11O12,1259.731818,O=C(N[C@@H](CC(C)C)C(N(CCC1)[C@@H]1C(N[C@@H](C(C)C)C(N2[C@H](C(N3[C@@H](C[C@@]4(/C=C/C(C)(O)C)[C@@]3([H])N(O)C5=C4C=CC=C5)C(N[C@@H](CC(C)C)C(N[C@@H](CC6=CC=CC=C6)C(N7CCC[C@H]7C(N[C@@H](CC(C)C)C8=O)=O)=O)=O)=O)=O)CCC2)=O)=O)=O)[C@H]9N8CCC9,"InChI=1S/C68H97N11O12/c1-39(2)34-45-56(80)70-48(37-43-20-12-11-13-21-43)63(87)75-31-17-25-51(75)58(82)71-46(35-40(3)4)61(85)74-30-16-24-50(74)57(81)72-47(36-41(5)6)62(86)76-32-18-26-52(76)59(83)73-55(42(7)8)65(89)77-33-19-27-53(77)64(88)78-54(60(84)69-45)38-68(29-28-67(9,10)90)44-22-14-15-23-49(44)79(91)66(68)78/h11-15,20-23,28-29,39-42,45-48,50-55,66,90-91H,16-19,24-27,30-38H2,1-10H3,(H,69,84)(H,70,80)(H,71,82)(H,72,81)(H,73,83)/b29-28+/t45-,46-,47-,48-,50-,51-,52-,53-,54-,55-,66+,68+/m0/s1",WZQMCYGKMJFAPO-YMWLVXOBSA-N,n.a. as of 04.01.022,yes,Symploca,hydnoides,
CyanoMetDB_2513,Trikoramide D,,other cyclic peptide,,C68H96BrN11O11,1321.647416,O=C(N[C@@H](CC(C)C)C(N(CCC1)[C@@H]1C(N[C@@H](C(C)C)C(N2[C@H](C(N3[C@@H](C[C@@]4(/C=C/C(C)(O)C)[C@@]3([H])NC5=C4C=C(Br)C=C5)C(N[C@@H](CC(C)C)C(N[C@@H](CC6=CC=CC=C6)C(N7CCC[C@H]7C(N[C@@H](CC(C)C)C8=O)=O)=O)=O)=O)=O)CCC2)=O)=O)=O)[C@H]9N8CCC9,"InChI=1S/C68H96BrN11O11/c1-38(2)32-46-56(81)71-49(35-42-18-12-11-13-19-42)63(88)77-29-15-21-51(77)58(83)72-47(33-39(3)4)61(86)76-28-14-20-50(76)57(82)73-48(34-40(5)6)62(87)78-30-16-22-52(78)59(84)75-55(41(7)8)65(90)79-31-17-23-53(79)64(89)80-54(60(85)70-46)37-68(27-26-67(9,10)91)44-36-43(69)24-25-45(44)74-66(68)80/h11-13,18-19,24-27,36,38-41,46-55,66,74,91H,14-17,20-23,28-35,37H2,1-10H3,(H,70,85)(H,71,81)(H,72,83)(H,73,82)(H,75,84)/b27-26+/t46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,66-,68+/m0/s1",LULDCFVPWVSVCR-OCBHCENISA-N,n.a. as of 04.01.022,yes,Symploca,hydnoides,
CyanoMetDB_2514,Aetokthonostatin,AEST,other linear peptide,,C43H75N5O7,773.5666498,CC(OC)C(NC(C(C)C(OC)C1CCCN1C(CC(OC)C(C(C)CC)N(C)C(C(C(C)C)NC(C([NH+](C)C)C(C)CC)=O)=O)=O)=O)CC2=CC=CC=C2,"InChI=1S/C43H75N5O7/c1-15-28(5)38(47(11)43(52)37(27(3)4)45-42(51)39(46(9)10)29(6)16-2)35(54-13)26-36(49)48-24-20-23-34(48)40(55-14)30(7)41(50)44-33(31(8)53-12)25-32-21-18-17-19-22-32/h17-19,21-22,27-31,33-35,37-40H,15-16,20,23-26H2,1-14H3,(H,44,50)(H,45,51)/p+1",BJHMSSKDHAKANG-UHFFFAOYSA-O,n.a. as of 04.01.022,yes,Aetokthonos hydrillicola,,CBT1886
CyanoMetDB_2515,Monomethylaetokthonostatin,Monomethyl-AEST,other linear peptide,,C43H73N5O7,771.5509997,C[C@H](OC)[C@@H](NC([C@H](C)[C@@H](OC)[C@@H]1CCCN1C(C[C@@H](OC)[C@H]([C@@H](C)CC)N(C)C([C@H](C(C)C)NC([C@@H](NC)[C@@H](C)CC)=O)=O)=O)=O)CC2=CC=CC=C2,"InChI=1S/C42H73N5O7/c1-14-27(5)37(43-9)41(50)45-36(26(3)4)42(51)46(10)38(28(6)15-2)34(53-12)25-35(48)47-23-19-22-33(47)39(54-13)29(7)40(49)44-32(30(8)52-11)24-31-20-17-16-18-21-31/h16-18,20-21,26-30,32-34,36-39,43H,14-15,19,22-25H2,1-13H3,(H,44,49)(H,45,50)/t27-,28-,29+,30-,32-,33-,34+,36-,37-,38-,39+/m0/s1",KDCAOWORTWHEIW-BFVPZQAKSA-N,n.a. as of 04.01.022,yes,Aetokthonos hydrillicola,,CBT1886
CyanoMetDB_2516,Desaetophenineaetokthonostatin,DesAph-AEST,other linear peptide,,C32H60N4O7,612.4462003,OC([C@H](C)[C@@H](OC)[C@@H]1CCCN1C(C[C@@H](OC)[C@H]([C@@H](C)CC)N(C)C([C@H](C(C)C)NC([C@@H](N(C)C)[C@@H](C)CC)=O)=O)=O)=O,"InChI=1S/C32H60N4O7/c1-13-20(5)27(35(10)31(39)26(19(3)4)33-30(38)28(34(8)9)21(6)14-2)24(42-11)18-25(37)36-17-15-16-23(36)29(43-12)22(7)32(40)41/h19-24,26-29H,13-18H2,1-12H3,(H,33,38)(H,40,41)/t20-,21-,22+,23-,24+,26-,27-,28-,29+/m0/s1",KVCOFNFLKLPQCK-ZNVWUHHUSA-N,n.a. as of 04.01.022,yes,Aetokthonos hydrillicola,,CBT1886
CyanoMetDB_2517,Tjipanazol K,,other linear non-peptide,,C20H11Cl2N3O,379.0279174,O=C1NCC2=C1C3=C(C4=C2C5=C(C=CC(Cl)=C5)N4)NC6=CC=C(Cl)C=C63,"InChI=1S/C20H11Cl2N3O/c21-8-1-3-13-10(5-8)15-12-7-23-20(26)17(12)16-11-6-9(22)2-4-14(11)25-19(16)18(15)24-13/h1-6,24-25H,7H2,(H,23,26)",TVMMZYBZNKBAOH-UHFFFAOYSA-N,n.a. as of 04.01.022,yes,Fischerella ,ambigua,
CyanoMetDB_2518,Tjipanazol L,,other linear non-peptide,,C20H9Cl2N3O2,393.007182,O=C1NC(C2=C1C3=C(C4=C2C5=C(N4)C=CC(Cl)=C5)NC6=C3C=C(Cl)C=C6)=O,"InChI=1S/C20H9Cl2N3O2/c21-7-1-3-11-9(5-7)13-15-16(20(27)25-19(15)26)14-10-6-8(22)2-4-12(10)24-18(14)17(13)23-11/h1-6,23-24H,(H,25,26,27)",DYJREVOKIDWZEE-UHFFFAOYSA-N,n.a. as of 04.01.022,yes,Fischerella ,ambigua,
CyanoMetDB_2519,Tjipanazol M,,other linear non-peptide,,C20H10ClN3O2,359.0461543,C1=CC=C2C(=C1)C3=C4C(=C5C6=C(C=CC(=C6)Cl)NC5=C3N2)C(=O)NC4=O,"InChI=1S/C20H10ClN3O2/c21-8-5-6-12-10(7-8)14-16-15(19(25)24-20(16)26)13-9-3-1-2-4-11(9)22-17(13)18(14)23-12/h1-7,22-23H,(H,24,25,26)",CBNJGGAGZSSENK-UHFFFAOYSA-N,n.a. as of 04.01.022,yes,Fischerella ,ambigua,
CyanoMetDB_2520,Anhydrocyanobacterin,,other linear non-peptide,,C23H21ClO5,412.1077515,CC(C)C1=C(C(=O)OC1=CC2=CC=C(C=C2)OC)CC3=CC4=C(C(=C3)Cl)OCO4,"InChI=1S/C23H21ClO5/c1-13(2)21-17(8-15-9-18(24)22-20(11-15)27-12-28-22)23(25)29-19(21)10-14-4-6-16(26-3)7-5-14/h4-7,9-11,13H,8,12H2,1-3H3/b19-10-",GNRHIDBFAWGJDI-GRSHGNNSSA-N,n.a. as of 04.01.022,yes,Fischerella ,ambigua,
CyanoMetDB_2521,Biselyngbyaside A,Biselyngbyaside,other cyclic non-peptide,,C34H52O9,604.3611332,C/C=C/C/C(C)=C\[C@@H](C/C=C/C=C/C[C@H](C)/C=C([C@H](C/C=C/[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC)[C@H]1O)C2)OC)\C)OC2=O,"InChI=1S/C34H52O9/c1-7-8-14-24(3)20-26-16-12-10-9-11-15-23(2)19-25(4)28(39-5)18-13-17-27(21-30(36)41-26)42-34-32(38)33(40-6)31(37)29(22-35)43-34/h7-13,17,19-20,23,26-29,31-35,37-38H,14-16,18,21-22H2,1-6H3/b8-7+,11-9+,12-10+,17-13+,24-20-,25-19+/t23-,26+,27+,28-,29+,31+,32+,33-,34+/m0/s1",QLNOFWPLTFNJPW-CMAVNLJPSA-N,,yes,Lyngbya,n.a.,n.a.
CyanoMetDB_2522,Aestuaramide E,,other cyclic peptide,,C35H43N7O7S3,769.238609,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC3=CS2)C(C)C)=O)CCC1)=O)CC4=CC=C(O)C=C4)C5=CSC([C@@H]6CCCN6C([C@H](CCS(C)=O)NC3=O)=O)=N5,"InChI=1S/C35H43N7O7S3/c1-19(2)28-33-39-25(18-51-33)29(44)36-22(12-15-52(3)49)34(47)42-14-5-7-27(42)32-38-24(17-50-32)30(45)37-23(16-20-8-10-21(43)11-9-20)35(48)41-13-4-6-26(41)31(46)40-28/h8-11,17-19,22-23,26-28,43H,4-7,12-16H2,1-3H3,(H,36,44)(H,37,45)(H,40,46)/t22-,23-,26-,27-,28-,52?/m0/s1",NMJKKJCWAZPNRI-GBURIORWSA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2523,Aestuaramide H,,other cyclic peptide,,C33H39N7O6S3,725.2123942,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC3=CS2)C)=O)CCC1)=O)CC4=CC=C(O)C=C4)C5=CSC([C@@H]6CCCN6C([C@H](CCSC)NC3=O)=O)=N5,"InChI=1S/C33H39N7O6S3/c1-18-30-37-23(16-48-30)27(42)35-21(11-14-47-2)32(45)40-13-4-6-26(40)31-38-24(17-49-31)28(43)36-22(15-19-7-9-20(41)10-8-19)33(46)39-12-3-5-25(39)29(44)34-18/h7-10,16-18,21-22,25-26,41H,3-6,11-15H2,1-2H3,(H,34,44)(H,35,42)(H,36,43)/t18-,21-,22-,25-,26-/m0/s1",MCBIEBWVPSPFBA-NIOPNQFXSA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2524,Aestuaramide K,,other cyclic peptide,,C33H39N7O7S3,742.2145853,O=C(N[C@H](C(N1[C@H](C(N[C@H](C2=NC3=CS2)C)=O)CCC1)=O)CC4=CC=C(O)C=C4)C5=CSC([C@@H]6CCCN6C([C@H](CCS(C)=O)NC3=O)=O)=N5,"InChI=1S/C33H39N7O7S3/c1-18-30-37-23(16-48-30)27(42)35-21(11-14-50(2)47)32(45)40-13-4-6-26(40)31-38-24(17-49-31)28(43)36-22(15-19-7-9-20(41)10-8-19)33(46)39-12-3-5-25(39)29(44)34-18/h7-10,16-18,21-22,25-26,41H,3-6,11-15H2,1-2H3,(H,34,44)(H,35,42)(H,36,43)/t18-,21-,22-,25-,26-,50?/m0/s1",MRLCFFFRMUUOII-BNLTTZCDSA-N,n.a. as of 04.01.23,yes,Lyngbya,aestuarii,
CyanoMetDB_2525,Arthrospiramide A,,other cyclic peptide,,C40H51N9O7S3,865.3073573,CC(C)C[C@@H](C(N1[C@H](C(NCC(N[C@H](C(N2C3CCC2)=O)CCSC)=O)=O)CCC1)=O)NC(CNC(C4=CSC(C(NC(C5=CSC3=N5)=O)CC6=CC=CC=C6)=N4)=O)=O,"InChI=1S/C40H51N9O7S3/c1-23(2)17-27-40(56)48-14-7-11-30(48)36(54)42-20-32(50)43-25(13-16-57-3)39(55)49-15-8-12-31(49)38-47-29(22-59-38)35(53)45-26(18-24-9-5-4-6-10-24)37-46-28(21-58-37)34(52)41-19-33(51)44-27/h4-6,9-10,21-23,25-27,30-31H,7-8,11-20H2,1-3H3,(H,41,52)(H,42,54)(H,43,50)(H,44,51)(H,45,53)/t25-,26?,27-,30-,31?/m0/s1",WIQLKXXEQJMMCB-RIKHEZEDSA-N,n.a. as of 04.01.23,no,Arthrospira,spirulina,
CyanoMetDB_2526,Arthrospiramide A sulfoxide,,other cyclic peptide,,C40H51N9O8S3,882.3095483,CC(C)C[C@@H](C(N1[C@H](C(NCC(N[C@H](C(N2C3CCC2)=O)CCS(C)=O)=O)=O)CCC1)=O)NC(CNC(C4=CSC(C(NC(C5=CSC3=N5)=O)CC6=CC=CC=C6)=N4)=O)=O,"InChI=1S/C40H51N9O8S3/c1-23(2)17-27-40(56)48-14-7-11-30(48)36(54)42-20-32(50)43-25(13-16-60(3)57)39(55)49-15-8-12-31(49)38-47-29(22-59-38)35(53)45-26(18-24-9-5-4-6-10-24)37-46-28(21-58-37)34(52)41-19-33(51)44-27/h4-6,9-10,21-23,25-27,30-31H,7-8,11-20H2,1-3H3,(H,41,52)(H,42,54)(H,43,50)(H,44,51)(H,45,53)/t25-,26?,27-,30-,31?,60?/m0/s1",YZGAGEWYOXPBEB-UCKNWKADSA-N,n.a. as of 04.01.23,no,Arthrospira,spirulina,
CyanoMetDB_2527,Arthrospiramide B,,other cyclic peptide,,C44H61N9O7S3,923.3856076,CC(C)C[C@@H](C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N1C2CCC1)=O)CCSC)=O)=O)C(C)C)=O)NC(CNC(C3=CSC(C(NC(C4=CSC2=N4)=O)CC5=CC=CC=C5)=N3)=O)=O,"InChI=1S/C44H61N9O7S3/c1-24(2)18-29-39(57)52-36(26(5)6)41(59)48-30(19-25(3)4)38(56)47-28(15-17-61-7)44(60)53-16-11-14-34(53)43-51-33(23-63-43)40(58)49-31(20-27-12-9-8-10-13-27)42-50-32(22-62-42)37(55)45-21-35(54)46-29/h8-10,12-13,22-26,28-31,34,36H,11,14-21H2,1-7H3,(H,45,55)(H,46,54)(H,47,56)(H,48,59)(H,49,58)(H,52,57)/t28-,29-,30-,31?,34?,36-/m0/s1",SVOJYSSWZIZZFE-WNMQVPGQSA-N,n.a. as of 04.01.23,no,Arthrospira,spirulina,
CyanoMetDB_2528,Arthrospiramide B sulfoxide,,other cyclic peptide,,C44H61N9O8S3,939.3805222,CC(C)C[C@@H](C(N[C@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N1C2CCC1)=O)CCS(C)=O)=O)=O)C(C)C)=O)NC(CNC(C3=CSC(C(NC(C4=CSC2=N4)=O)CC5=CC=CC=C5)=N3)=O)=O,"InChI=1S/C44H61N9O8S3/c1-24(2)18-29-39(57)52-36(26(5)6)41(59)48-30(19-25(3)4)38(56)47-28(15-17-64(7)61)44(60)53-16-11-14-34(53)43-51-33(23-63-43)40(58)49-31(20-27-12-9-8-10-13-27)42-50-32(22-62-42)37(55)45-21-35(54)46-29/h8-10,12-13,22-26,28-31,34,36H,11,14-21H2,1-7H3,(H,45,55)(H,46,54)(H,47,56)(H,48,59)(H,49,58)(H,52,57)/t28-,29-,30-,31?,34?,36-,64?/m0/s1",RZDOAAAQCFMVQL-LNTHAFDSSA-N,n.a. as of 04.01.23,no,Arthrospira,spirulina,
CyanoMetDB_2529,"6-cyano-5-methoxyindolo[2,3-a]carbazole",,other linear non-peptide,,C20H13N3O,311.1058621,N#CC1=C2C3=CC=CC=C3NC2=C(NC4=CC=CC=C45)C5=C1OC,"InChI=1S/C20H13N3O/c1-24-20-13(10-21)16-11-6-2-4-8-14(11)22-18(16)19-17(20)12-7-3-5-9-15(12)23-19/h2-9,22-23H,1H3",ADLSFYJDHWUKFP-UHFFFAOYSA-N,n.a. as of 04.01.23,yes,Nostoc,shaericum,EX-5-1
CyanoMetDB_2530,Cyanothecamide A,,other cyclic peptide,,C38H57N9O10S,831.3949098,OC1=CC=C(C=C1)C[C@H](NC([C@@H](N2)CC(C)C)=O)C(N[C@@H](CCCCN)C(N[C@H](C(N[C@@H](CCC(N)=O)C3=NC(CS3)C(N[C@@H](C(C)C)C2=O)=O)=O)CC(O)=O)=O)=O,"InChI=1S/C38H57N9O10S/c1-19(2)15-25-33(53)43-26(16-21-8-10-22(48)11-9-21)34(54)41-23(7-5-6-14-39)32(52)44-27(17-30(50)51)35(55)42-24(12-13-29(40)49)38-46-28(18-58-38)36(56)47-31(20(3)4)37(57)45-25/h8-11,19-20,23-28,31,48H,5-7,12-18,39H2,1-4H3,(H2,40,49)(H,41,54)(H,42,55)(H,43,53)(H,44,52)(H,45,57)(H,47,56)(H,50,51)/t23-,24-,25-,26-,27-,28?,31-/m0/s1",PJANMIXYOJKMLO-RXDNWWJFSA-N,n.a. as of 04.01.23,no,Cyanothece,sp.,PCC 7425
CyanoMetDB_2531,Cyanothecamide B,,other cyclic peptide,,C38H55N9O10S,829.3792598,OC1=CC=C(C=C1)C[C@H](NC([C@@H](N2)CC(C)C)=O)C(N[C@@H](CCCCN)C(N[C@H](C(N[C@@H](CCC(N)=O)C3=NC(C(N[C@@H](C(C)C)C2=O)=O)=CS3)=O)CC(O)=O)=O)=O,"InChI=1S/C38H55N9O10S/c1-19(2)15-25-33(53)43-26(16-21-8-10-22(48)11-9-21)34(54)41-23(7-5-6-14-39)32(52)44-27(17-30(50)51)35(55)42-24(12-13-29(40)49)38-46-28(18-58-38)36(56)47-31(20(3)4)37(57)45-25/h8-11,18-20,23-27,31,48H,5-7,12-17,39H2,1-4H3,(H2,40,49)(H,41,54)(H,42,55)(H,43,53)(H,44,52)(H,45,57)(H,47,56)(H,50,51)/t23-,24-,25-,26-,27-,31-/m0/s1",XFDAIKVOVRZGQW-GKDLNYNLSA-N,n.a. as of 04.01.23,no,Cyanothece,sp.,PCC 7425
CyanoMetDB_2532,Cyanothecamide C,,other cyclic peptide,,C33H46N8O9S,730.3108459,O=C(N[C@H](C1=NC(C(N[C@H](C(N[C@H](C(NCC(N[C@H]2CC(O)=O)=O)=O)CC(C)C)=O)CCCCN)=O)CS1)CC3=CC=C(O)C=C3)C4N=C2OC4,"InChI=1S/C33H46N8O9S/c1-17(2)11-21-28(46)35-14-26(43)36-22(13-27(44)45)32-40-24(15-50-32)30(48)39-23(12-18-6-8-19(42)9-7-18)33-41-25(16-51-33)31(49)37-20(29(47)38-21)5-3-4-10-34/h6-9,17,20-25,42H,3-5,10-16,34H2,1-2H3,(H,35,46)(H,36,43)(H,37,49)(H,38,47)(H,39,48)(H,44,45)/t20-,21-,22-,23-,24?,25?/m0/s1",BBMNLLBDIJBAMZ-AADMUFJASA-N,n.a. as of 04.01.23,no,Cyanothece,sp.,PCC 7425
CyanoMetDB_2533,di(hydroxymethyl)dihydroxypyrrolidine (DMDP),DMDP,other cyclic peptide,cyclic depsipeptide,C6H13NO4,163.0844579,OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](CO)N1,"InChI=1S/C6H13NO4/c8-1-3-5(10)6(11)4(2-9)7-3/h3-11H,1-2H2/t3-,4-,5-,6-/m1/s1",PFYHYHZGDNWFIF-KVTDHHQDSA-N,n.a. as of 04.01.23,yes,Cylindrospermum,licheniforme Kützing ,ATCC 29412
CyanoMetDB_2534,Hyellazone,,other linear non-peptide,,C20H17NO,287.1310142,CC1=C(OC)C=C2C3=C(NC2=C1C4=CC=CC=C4)C=CC=C3,"InChI=1S/C20H17NO/c1-13-18(22-2)12-16-15-10-6-7-11-17(15)21-20(16)19(13)14-8-4-3-5-9-14/h3-12,21H,1-2H3",WMOYBLZINTVESP-UHFFFAOYSA-N,n.a. as of 04.01.23,yes,Hyella,caespitosa,n.a.
CyanoMetDB_2535,Malyngamide D acetate,,other linear non-peptide,,C26H40ClNO5,481.2595011,CCCCCCCC(OC)C/C=C/CCC(NC/C(C1=CCC[C@@H](OC(C)=O)C1=O)=C/Cl)=O,"InChI=1S/C26H40ClNO5/c1-4-5-6-7-9-13-22(32-3)14-10-8-11-17-25(30)28-19-21(18-27)23-15-12-16-24(26(23)31)33-20(2)29/h8,10,15,18,22,24H,4-7,9,11-14,16-17,19H2,1-3H3,(H,28,30)/b10-8+,21-18-/t22?,24-/m1/s1",GNKNIPRNBZCJGO-TVJPFUESSA-N,n.a. as of 04.01.23,yes,Lyngbya/Moorea,majuscula/producens,
CyanoMetDB_2536,Cyanopeptolin 958,,Cyanopeptolin,,C45H70N10O13,958.5124,O=C(C(NC(CCC)=O)CCC(O)=O)NC(C(C)OC1=O)C(NC(C(NC2C(N(C(CC2)O)C(CC(C)C)C(N(C)C(CC3=CC=C(C=C3)O)C(NC1C(C)C)=O)=O)=O)=O)CCCNC(N)=N)=O,"InChI=1S/C45H70N10O13/c1-8-10-33(57)49-29(17-19-35(59)60)39(62)53-37-25(6)68-44(67)36(24(4)5)52-40(63)31(22-26-12-14-27(56)15-13-26)54(7)43(66)32(21-23(2)3)55-34(58)18-16-30(42(55)65)51-38(61)28(50-41(37)64)11-9-20-48-45(46)47/h12-15,23-25,28-32,34,36-37,56,58H,8-11,16-22H2,1-7H3,(H,49,57)(H,50,64)(H,51,61)(H,52,63)(H,53,62)(H,59,60)(H4,46,47,48)",GSURKUJCJKPVAC-UHFFFAOYSA-N,n.a. as of 09.01.23,no,Microcystis,,
CyanoMetDB_2537,Microginin 789,,microginin,lipopeptide,C39H53Cl2N5O8,789.32712,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CCCN3C(CC(CCCCCCC(Cl)Cl)N)=O)=O)CCC4=CC=C(O)C=C4)=O)CCC2)=O)C=C1,"InChI=1S/C39H53Cl2N5O8/c40-34(41)10-4-2-1-3-7-27(42)24-35(49)45-21-5-8-32(45)36(50)43-30(20-15-25-11-16-28(47)17-12-25)38(52)46-22-6-9-33(46)37(51)44-31(39(53)54)23-26-13-18-29(48)19-14-26/h11-14,16-19,27,30-34,47-48H,1-10,15,20-24,42H2,(H,43,50)(H,44,51)(H,53,54)",PJFISHIYBBBHKP-UHFFFAOYSA-N,,yes,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2538,Microginin 755,,microginin,lipopeptide,C39H54ClN5O8,755.36609,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CCCN3C(CC(CCCCCCC(Cl)[H])N)=O)=O)CCC4=CC=C(O)C=C4)=O)CCC2)=O)C=C1,"InChI=1S/C39H54ClN5O8/c40-21-5-3-1-2-4-8-28(41)25-35(48)44-22-6-9-33(44)36(49)42-31(20-15-26-11-16-29(46)17-12-26)38(51)45-23-7-10-34(45)37(50)43-32(39(52)53)24-27-13-18-30(47)19-14-27/h11-14,16-19,28,31-34,46-47H,1-10,15,20-25,41H2,(H,42,49)(H,43,50)(H,52,53)",GQILAPOESMOZJI-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2539,Microginin 721,,microginin,lipopeptide,C39H55N5O8,721.40506,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CCCN3C(CC(CCCCCCC([H])[H])N)=O)=O)CCC4=CC=C(O)C=C4)=O)CCC2)=O)C=C1,"InChI=1S/C39H55N5O8/c1-2-3-4-5-6-9-28(40)25-35(47)43-22-7-10-33(43)36(48)41-31(21-16-26-12-17-29(45)18-13-26)38(50)44-23-8-11-34(44)37(49)42-32(39(51)52)24-27-14-19-30(46)20-15-27/h12-15,17-20,28,31-34,45-46H,2-11,16,21-25,40H2,1H3,(H,41,48)(H,42,49)(H,51,52)",IKGQCCPKYXSKJK-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2540,Microginin 773,,microginin,lipopeptide,C39H53Cl2N5O7,773.3322,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CCCN3C(CC(CCCCCCC(Cl)Cl)N)=O)=O)CCC4=CC=CC=C4)=O)CCC2)=O)C=C1,"InChI=1S/C39H53Cl2N5O7/c40-34(41)15-7-2-1-6-12-28(42)25-35(48)45-22-8-13-32(45)36(49)43-30(21-18-26-10-4-3-5-11-26)38(51)46-23-9-14-33(46)37(50)44-31(39(52)53)24-27-16-19-29(47)20-17-27/h3-5,10-11,16-17,19-20,28,30-34,47H,1-2,6-9,12-15,18,21-25,42H2,(H,43,49)(H,44,50)(H,52,53)",KBYFOBFEVWUAKD-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2541,Microginin 739,,microginin,lipopeptide,C39H54ClN5O7,739.37118,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CCCN3C(CC(CCCCCCC(Cl)[H])N)=O)=O)CCC4=CC=CC=C4)=O)CCC2)=O)C=C1,"InChI=1S/C39H54ClN5O7/c40-22-8-3-1-2-7-13-29(41)26-35(47)44-23-9-14-33(44)36(48)42-31(21-18-27-11-5-4-6-12-27)38(50)45-24-10-15-34(45)37(49)43-32(39(51)52)25-28-16-19-30(46)20-17-28/h4-6,11-12,16-17,19-20,29,31-34,46H,1-3,7-10,13-15,18,21-26,41H2,(H,42,48)(H,43,49)(H,51,52)",ODWVJEFTOQVIQW-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2542,Microginin 705,,microginin,lipopeptide,C39H55N5O7,705.4101492,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CCCN3C(CC(CCCCCCC([H])[H])N)=O)=O)CCC4=CC=CC=C4)=O)CCC2)=O)C=C1,"InChI=1S/C39H55N5O7/c1-2-3-4-5-9-14-29(40)26-35(46)43-23-10-15-33(43)36(47)41-31(22-19-27-12-7-6-8-13-27)38(49)44-24-11-16-34(44)37(48)42-32(39(50)51)25-28-17-20-30(45)21-18-28/h6-8,12-13,17-18,20-21,29,31-34,45H,2-5,9-11,14-16,19,22-26,40H2,1H3,(H,41,47)(H,42,48)(H,50,51)",KCIMYTFEDPWDPF-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2543,Microginin 803,,microginin,lipopeptide,C40H55Cl2N5O8,803.34277,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CC(C)CN3C(CC(CCCCCCC(Cl)Cl)N)=O)=O)CCC4=CC=C(O)C=C4)=O)CCC2)=O)C=C1,"InChI=1S/C40H55Cl2N5O8/c1-25-21-34(47(24-25)36(50)23-28(43)7-4-2-3-5-9-35(41)42)38(52)44-31(19-14-26-10-15-29(48)16-11-26)39(53)46-20-6-8-33(46)37(51)45-32(40(54)55)22-27-12-17-30(49)18-13-27/h10-13,15-18,25,28,31-35,48-49H,2-9,14,19-24,43H2,1H3,(H,44,52)(H,45,51)(H,54,55)",HKDUHJNLZOVWHW-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2544,Microginin 769,,microginin,lipopeptide,C40H56ClN5O8,769.38174,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CC(C)CN3C(CC(CCCCCCC(Cl)[H])N)=O)=O)CCC4=CC=C(O)C=C4)=O)CCC2)=O)C=C1,"InChI=1S/C40H56ClN5O8/c1-26-22-35(46(25-26)36(49)24-29(42)8-5-3-2-4-6-20-41)38(51)43-32(19-14-27-10-15-30(47)16-11-27)39(52)45-21-7-9-34(45)37(50)44-33(40(53)54)23-28-12-17-31(48)18-13-28/h10-13,15-18,26,29,32-35,47-48H,2-9,14,19-25,42H2,1H3,(H,43,51)(H,44,50)(H,53,54)",XUTNXUICNNBAHB-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2545,Microginin 735,,microginin,lipopeptide,C40H57N5O8,735.42071,OC1=CC=C(CC(C(O)=O)NC(C2N(C(C(NC(C3CC(C)CN3C(CC(CCCCCCC([H])[H])N)=O)=O)CCC4=CC=C(O)C=C4)=O)CCC2)=O)C=C1,"InChI=1S/C40H57N5O8/c1-3-4-5-6-7-9-29(41)24-36(48)45-25-26(2)22-35(45)38(50)42-32(20-15-27-11-16-30(46)17-12-27)39(51)44-21-8-10-34(44)37(49)43-33(40(52)53)23-28-13-18-31(47)19-14-28/h11-14,16-19,26,29,32-35,46-47H,3-10,15,20-25,41H2,1-2H3,(H,42,50)(H,43,49)(H,52,53)",XQSIQLHXAPICNQ-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2546,Microginin 626,,microginin,lipopeptide,C30H44Cl2N4O6,626.26379,OC(C1N(C(C(NC(C2CCCN2C(CC(CCCCCCC(Cl)Cl)N)=O)=O)CCC3=CC=C(O)C=C3)=O)CCC1)=O,"InChI=1S/C30H44Cl2N4O6/c31-26(32)10-4-2-1-3-7-21(33)19-27(38)35-17-5-8-24(35)28(39)34-23(16-13-20-11-14-22(37)15-12-20)29(40)36-18-6-9-25(36)30(41)42/h11-12,14-15,21,23-26,37H,1-10,13,16-19,33H2,(H,34,39)(H,41,42)",SVIIUNHBJSJMNU-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2547,Microginin 592,,microginin,lipopeptide,C30H45ClN4O6,592.3027629,OC(C1N(C(C(NC(C2CCCN2C(CC(CCCCCCC([H])Cl)N)=O)=O)CCC3=CC=C(O)C=C3)=O)CCC1)=O,"InChI=1S/C30H45ClN4O6/c31-17-5-3-1-2-4-8-22(32)20-27(37)34-18-6-9-25(34)28(38)33-24(16-13-21-11-14-23(36)15-12-21)29(39)35-19-7-10-26(35)30(40)41/h11-12,14-15,22,24-26,36H,1-10,13,16-20,32H2,(H,33,38)(H,40,41)",NGCPBTCWLINIEZ-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2548,Microginin 558,,microginin,lipopeptide,C30H46N4O6,558.34174,OC(C1N(C(C(NC(C2CCCN2C(CC(CCCCCCC([H])[H])N)=O)=O)CCC3=CC=C(O)C=C3)=O)CCC1)=O,"InChI=1S/C30H46N4O6/c1-2-3-4-5-6-9-22(31)20-27(36)33-18-7-10-25(33)28(37)32-24(17-14-21-12-15-23(35)16-13-21)29(38)34-19-8-11-26(34)30(39)40/h12-13,15-16,22,24-26,35H,2-11,14,17-20,31H2,1H3,(H,32,37)(H,39,40)",IKRSTJGYJNFCFV-UHFFFAOYSA-N,,no,Microcystis,aeruginosa,LEGE 91341
CyanoMetDB_2549,11-Carboxyhomoanatoxin-a,,Anatoxin-a,,C12H17NO3,223.1208,O=C(C1=CCC[C@@H]2CC[C@H]1N2)C(C)C(O)=O,"InChI=1S/C12H17NO3/c1-7(12(15)16)11(14)9-4-2-3-8-5-6-10(9)13-8/h4,7-8,10,13H,2-3,5-6H2,1H3,(H,15,16)/t7?,8-,10-/m1/s1",CTEMOVFTLUXBBJ-JDOFKEMOSA-N,,no,Oscillatoria,,PCC 6505
CyanoMetDB_2550,cis-Carboxydihydroanatoxin-a,trans-Carboxydihydroanatoxin-a,Anatoxin-a,,C11H17NO3,211.1208,O=C([C@H]1[C@H]2CC[C@@H](CCC1)N2)CC(O)=O,"InChI=1S/C11H17NO3/c13-10(6-11(14)15)8-3-1-2-7-4-5-9(8)12-7/h7-9,12H,1-6H2,(H,14,15)/t7-,8-,9-/m1/s1",XVDSSPXRAXBXPF-IWSPIJDZSA-N,,no,Cylindrosprmum,stagnale,PCC 7417
CyanoMetDB_2551,trans-Carboxydihydroanatoxin-a,cis-Carboxydihydroanatoxin-a,Anatoxin-a,,C11H17NO3,211.1208,O=C([C@@H]1[C@H]2CC[C@@H](CCC1)N2)CC(O)=O,"InChI=1S/C11H17NO3/c13-10(6-11(14)15)8-3-1-2-7-4-5-9(8)12-7/h7-9,12H,1-6H2,(H,14,15)/t7-,8+,9-/m1/s1",XVDSSPXRAXBXPF-HRDYMLBCSA-N,,no,Cylindrosprmum,stagnale,PCC 7417
CyanoMetDB_2552,"2,3-dihydro-3-methoxyhomoanatoxin-a",,Anatoxin-a,,C12H21NO2,211.1572,O=C(C1[C@H]2CC[C@@H](CCC1OC)N2)CC,"InChI=1S/C12H21NO2/c1-3-10(14)12-9-6-4-8(13-9)5-7-11(12)15-2/h8-9,11-13H,3-7H2,1-2H3/t8-,9+,11?,12?/m0/s1",BLXMTYAPVHZNGV-CAQTZKSYSA-N,71419095,yes,Raphidiopsis ,mediterranea,LBRI 48
CyanoMetDB_2553,Dysamide C,(-)-Dysamide C,other linear non-peptide,Polychlorinated Leucines,C14H16Cl6N2O2,453.934294,C[C@H](C(Cl)(Cl)Cl)/C=C(C(N/1C)=O)/N(C)C(C1=C\[C@H](C)C(Cl)(Cl)Cl)=O,"InChI=1S/C14H16Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h5-8H,1-4H3/b9-5-,10-6+/t7-,8-/m0/s1",JNSPCDDEJLXLIO-NEHVXSQKSA-N,,Yes,,,
CyanoMetDB_2554,Dysamide A,(-)-Dysamide A,other linear non-peptide,Polychlorinated Leucines,C14H20Cl6N2O2,457.9655942,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1C(=O)N(C)[C@@H](C[C@@H](C(Cl)(Cl)Cl)C)C(=O)N1C,"InChI=1S/C14H20Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h7-10H,5-6H2,1-4H3/t7-,8-,9-,10-/m0/s1",FAXNAEOPEXUENY-XKNYDFJKSA-N,74052391,Yes,,,
CyanoMetDB_2555,Dysamide B,(+)-Dysamide B,other linear non-peptide,Polychlorinated Leucines,C14H22Cl4N2O2,390.0435388,C([C@@H](C(Cl)Cl)C)[C@H]1C(=O)N(C)[C@@H](C[C@@H](C(Cl)Cl)C)C(=O)N1C,"InChI=1S/C14H22Cl4N2O2/c1-7(11(15)16)5-9-13(21)20(4)10(14(22)19(9)3)6-8(2)12(17)18/h7-12H,5-6H2,1-4H3/t7-,8-,9-,10-/m0/s1",VRQZGAPBWYEDHZ-XKNYDFJKSA-N,101425117,Yes,,,
CyanoMetDB_2556,Callyspongiamide B,,other linear non-peptide,Polychlorinated Leucines,C14H19Cl6NO2,442.9546951,[C@@H](C[C@@H](C(Cl)(Cl)Cl)C)(NC(/C=C/[C@@H](C(Cl)(Cl)Cl)C)=O)C(CC)=O,"InChI=1S/C14H19Cl6NO2/c1-4-11(22)10(7-9(3)14(18,19)20)21-12(23)6-5-8(2)13(15,16)17/h5-6,8-10H,4,7H2,1-3H3,(H,21,23)/b6-5+/t8-,9-,10-/m0/s1",ZQVVKTNITFQVMX-JKNZDJNPSA-N,,Yes,Unknown,,
CyanoMetDB_2557,Callyspongiamide A,,other linear non-peptide,Polychlorinated Leucines,C16H26Cl6N2O2,488.0125444,[C@H](NC([C@H](C[C@@H](C(Cl)(Cl)Cl)C)N(C)C)=O)(C[C@@H](C(Cl)(Cl)Cl)C)C(CC)=O,"InChI=1S/C16H26Cl6N2O2/c1-6-13(25)11(7-9(2)15(17,18)19)23-14(26)12(24(4)5)8-10(3)16(20,21)22/h9-12H,6-8H2,1-5H3,(H,23,26)/t9-,10-,11-,12-/m0/s1",HOXGICVBHXJSEI-BJDJZHNGSA-N,,Yes,Unknown,,
CyanoMetDB_2558,Hexamollamide,,other cyclic peptide,Cyanobactin,C36H52N6O6S,696.3669042,O=C1N2[C@](C(=O)N[C@@H]([C@@H](C)C)C(=O)N[C@@H]([C@@H](C)C)C3=N[C@@](C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@H]1CC4=CC=CC=C4)[H])(CS3)[H])(CCC2)[H],"InChI=1S/C36H52N6O6S/c1-9-36(7,8)48-22(6)29-33(46)37-24(18-23-14-11-10-12-15-23)35(47)42-17-13-16-26(42)31(44)39-27(20(2)3)32(45)40-28(21(4)5)34-38-25(19-49-34)30(43)41-29/h9-12,14-15,20-22,24-29H,1,13,16-19H2,2-8H3,(H,37,46)(H,39,44)(H,40,45)(H,41,43)/t22-,24+,25-,26+,27+,28+,29+/m1/s1",QDTYTQUIHBLXAH-FBSGWIMVSA-N,25053357,Yes,Prochloron,sp. ,
CyanoMetDB_2559,Lissoclinamide 2,,other cyclic peptide,Cyanobactin,C33H41N7O5S2,679.2610589,O=C1NC(C(=O)N2CCCC2C3=NC(C(=O)NC(C4=NC(C(=O)NC(C5=NC1=CS5)C)CS4)C(C)CC)C(O3)C)CC=6C=CC=CC6,"InChI=1S/C33H41N7O5S2/c1-5-17(2)25-32-37-22(16-47-32)27(41)34-18(3)31-36-23(15-46-31)28(42)35-21(14-20-10-7-6-8-11-20)33(44)40-13-9-12-24(40)30-39-26(19(4)45-30)29(43)38-25/h6-8,10-11,15,17-19,21-22,24-26H,5,9,12-14,16H2,1-4H3,(H,34,41)(H,35,42)(H,38,43)",MXZCBFXSFNFJTR-UHFFFAOYSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2560,Lissoclinamide 1,,other cyclic peptide,Cyanobactin,C35H43N7O5S2,705.276709,O=C1NC(C(=O)N2CCCC2C3=NC(C(=O)NC(C4=NC(=CS4)C(=O)NC(C5=NC1=CS5)C(C)CC)C(C)C)C(O3)C)CC=6C=CC=CC6,"InChI=1S/C35H43N7O5S2/c1-6-19(4)27-34-38-23(16-49-34)29(43)36-22(15-21-11-8-7-9-12-21)35(46)42-14-10-13-25(42)32-41-28(20(5)47-32)31(45)39-26(18(2)3)33-37-24(17-48-33)30(44)40-27/h7-9,11-12,16-20,22,25-28H,6,10,13-15H2,1-5H3,(H,36,43)(H,39,45)(H,40,44)/t19-,20+,22-,25-,26-,27+,28+/m0/s1",JQFURXDLANWKPX-OGBJDVFRSA-N,23247392,Yes,Prochloron,sp. ,
CyanoMetDB_2561,"3,4,6-Tribromo-2-(3,5-dibromo-2-hydroxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H5Br5O3,591.6155585,BrC=1C=C(Br)C(O)=C(OC=2C(Br)=C(Br)C=C(Br)C2O)C1,"InChI=1S/C12H5Br5O3/c13-4-1-6(15)10(18)8(2-4)20-12-9(17)5(14)3-7(16)11(12)19/h1-3,18-19H",QJOJMIGBIPHDPW-UHFFFAOYSA-N,45273079,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2562,Patellamide E,,other linear non-peptide,Cyanobactin,C39H50N8O6S2,790.3294729,O=C1NC(C2=NC(C(=O)NC(C3=NC(=CS3)C(=O)NC(C4=NC(C(=O)NC(C5=NC1=CS5)CC=6C=CC=CC6)C(O4)C)C(C)CC)C(C)C)C(O2)C)C(C)C,"InChI=1S/C39H50N8O6S2/c1-9-20(6)29-37-47-30(21(7)53-37)34(50)40-24(15-23-13-11-10-12-14-23)38-41-25(16-54-38)32(48)43-27(18(2)3)36-46-31(22(8)52-36)35(51)44-28(19(4)5)39-42-26(17-55-39)33(49)45-29/h10-14,16-22,24,27-31H,9,15H2,1-8H3,(H,40,50)(H,43,48)(H,44,51)(H,45,49)/t20-,21-,22-,24-,27+,28-,29+,30+,31+/m1/s1",BEMLSIBAHWVXGD-SGFBMDCRSA-N,44576033,Yes,Prochloron,sp. ,
CyanoMetDB_2563,Dysamide J,,other linear non-peptide,Polychlorinated Leucines,C14H17Cl5N2O2,419.9732664,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1C(=O)N(C)/C(=C\C(=C(Cl)Cl)C)/C(=O)N1C,"InChI=1S/C14H17Cl5N2O2/c1-7(11(15)16)5-9-12(22)21(4)10(13(23)20(9)3)6-8(2)14(17,18)19/h5,8,10H,6H2,1-4H3/b9-5-/t8-,10-/m0/s1",GSTRDEBFQFLBIV-FMDAWORTSA-N,10598334,Yes,,,
CyanoMetDB_2564,Dysamide I,,other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2O2,455.9499441,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1C(=O)N(C)/C(=C\[C@@H](C(Cl)(Cl)Cl)C)/C(=O)N1C,"InChI=1S/C14H18Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h5,7-8,10H,6H2,1-4H3/b9-5-/t7-,8-,10-/m0/s1",XJCMCNILUZGERI-YQDKCZNOSA-N,10504115,Yes,,,
CyanoMetDB_2565,Dysamide O,,other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2O3,471.9448587,C([C@@H](C(Cl)(Cl)Cl)CO)[C@H]1C(=O)N(C)\C(=C\[C@@H](C(Cl)(Cl)Cl)C)\C(=O)N1C,"InChI=1S/C14H18Cl6N2O3/c1-7(13(15,16)17)4-9-11(24)22(3)10(12(25)21(9)2)5-8(6-23)14(18,19)20/h4,7-8,10,23H,5-6H2,1-3H3/b9-4+/t7-,8+,10-/m0/s1",GDHLAVHINSNNNB-JECZYSCISA-N,10504733,Yes,,,
CyanoMetDB_2566,Dysamide Q,,other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2O3,471.9448587,C([C@@H](C(Cl)(Cl)Cl)C)C1(O)C(=O)N(C)\C(=C\[C@@H](C(Cl)(Cl)Cl)C)\C(=O)N1C,"InChI=1S/C14H18Cl6N2O3/c1-7(13(15,16)17)5-9-10(23)22(4)12(25,11(24)21(9)3)6-8(2)14(18,19)20/h5,7-8,25H,6H2,1-4H3/b9-5+/t7-,8-,12?/m0/s1",JWHSXBUUGFTVRQ-JIHUYVJASA-N,,Yes,,,
CyanoMetDB_2567,Dysamide R,,other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2O3,471.9448587,C([C@@H](C(Cl)(Cl)Cl)C)C1(O)C(=O)N(C)\C(=C\[C@@H](C(Cl)(Cl)Cl)C)\C(=O)N1C,"InChI=1S/C14H18Cl6N2O3/c1-7(13(15,16)17)5-9-10(23)22(4)12(25,11(24)21(9)3)6-8(2)14(18,19)20/h5,7-8,25H,6H2,1-4H3/b9-5+/t7-,8-,12?/m0/s1",JWHSXBUUGFTVRQ-JIHUYVJASA-N,,Yes,,,
CyanoMetDB_2568,Dysamide S,,other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2O3,471.9448587,C([C@@H](C(Cl)(Cl)Cl)C)C1(O)C(=O)N(C)/C(=C\[C@@H](C(Cl)(Cl)Cl)C)/C(=O)N1C,"InChI=1S/C14H18Cl6N2O3/c1-7(13(15,16)17)5-9-10(23)22(4)12(25,11(24)21(9)3)6-8(2)14(18,19)20/h5,7-8,25H,6H2,1-4H3/b9-5-/t7-,8-,12?/m0/s1",JWHSXBUUGFTVRQ-VGPQRVRJSA-N,,Yes,,,
CyanoMetDB_2569,Dysamide T,,other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2O3,471.9448587,C([C@@H](C(Cl)(Cl)Cl)C)C1(O)C(=O)N(C)/C(=C\[C@@H](C(Cl)(Cl)Cl)C)/C(=O)N1C,"InChI=1S/C14H18Cl6N2O3/c1-7(13(15,16)17)5-9-10(23)22(4)12(25,11(24)21(9)3)6-8(2)14(18,19)20/h5,7-8,25H,6H2,1-4H3/b9-5-/t7-,8-,12?/m0/s1",JWHSXBUUGFTVRQ-VGPQRVRJSA-N,,Yes,,,
CyanoMetDB_2570,Dysamide K,,other linear non-peptide,Polychlorinated Leucines,C14H19Cl5N2O2,421.9889164,C(\[C@@H](C(Cl)(Cl)Cl)C)=C/1\C(=O)N(C)[C@@H](C[C@@H](C(Cl)Cl)C)C(=O)N1C,"InChI=1S/C14H19Cl5N2O2/c1-7(11(15)16)5-9-12(22)21(4)10(13(23)20(9)3)6-8(2)14(17,18)19/h6-9,11H,5H2,1-4H3/b10-6+/t7-,8-,9-/m0/s1",XYRSDRQEWZIHGT-HUTQZXEVSA-N,10598428,Yes,,,
CyanoMetDB_2571,Dysamide L,,other linear non-peptide,Polychlorinated Leucines,C14H19Cl5N2O2,421.9889164,C(\[C@@H](C(Cl)(Cl)Cl)C)=C\1/C(=O)N(C)[C@@H](C[C@@H](C(Cl)Cl)C)C(=O)N1C,"InChI=1S/C14H19Cl5N2O2/c1-7(11(15)16)5-9-12(22)21(4)10(13(23)20(9)3)6-8(2)14(17,18)19/h6-9,11H,5H2,1-4H3/b10-6-/t7-,8-,9-/m0/s1",XYRSDRQEWZIHGT-FHWSAXHRSA-N,10693629,Yes,,,
CyanoMetDB_2572,Dysamide N,,other linear non-peptide,Polychlorinated Leucines,C14H19Cl5N2O2,421.9889164,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1C(=O)N(C)/C(=C\[C@@H](C(Cl)Cl)C)/C(=O)N1C,"InChI=1S/C14H19Cl5N2O2/c1-7(11(15)16)5-9-12(22)21(4)10(13(23)20(9)3)6-8(2)14(17,18)19/h5,7-8,10-11H,6H2,1-4H3/b9-5-/t7-,8-,10-/m0/s1",VNDCRMHOOMVIFT-YQDKCZNOSA-N,10526365,Yes,,,
CyanoMetDB_2573,Dysamide M,,other linear non-peptide,Polychlorinated Leucines,C14H20Cl4N2O2,388.0278887,C([C@@H](C(Cl)Cl)C)[C@H]1C(=O)N(C)/C(=C\[C@@H](C(Cl)Cl)C)/C(=O)N1C,"InChI=1S/C14H20Cl4N2O2/c1-7(11(15)16)5-9-13(21)20(4)10(14(22)19(9)3)6-8(2)12(17)18/h5,7-8,10-12H,6H2,1-4H3/b9-5-/t7-,8-,10-/m0/s1",HPESIQPIRSOIDD-YQDKCZNOSA-N,10762951,Yes,,,
CyanoMetDB_2574,Dysamide P,,other linear non-peptide,Polychlorinated Leucines,C14H20Cl6N2O3,473.9605088,C([C@@H](C(Cl)(Cl)Cl)C)C1(O)C(=O)N(C)[C@@H](C[C@@H](C(Cl)(Cl)Cl)C)C(=O)N1C,"InChI=1S/C14H20Cl6N2O3/c1-7(13(15,16)17)5-9-10(23)22(4)12(25,11(24)21(9)3)6-8(2)14(18,19)20/h7-9,25H,5-6H2,1-4H3/t7-,8-,9-,12?/m0/s1",SCZVSPHRZSPBCV-ITTAVEFGSA-N,100916684,Yes,,,
CyanoMetDB_2575,Preulithiacyclamide,,other cyclic peptide,Cyanobactin,C32H46N8O8S4,798.2321434,CC(C)C[C@@H](NC([C@](NC([C@@H](NC(C1=CSC([C@H](NC([C@](N2)([H])[C@@H](O)C)=O)CC(C)C)=N1)=O)CSSC[C@@H](C2=O)NC3=O)=O)([H])[C@@H](O)C)=O)C4=NC3=CS4,"InChI=1S/C32H46N8O8S4/c1-13(2)7-17-31-37-19(9-49-31)25(43)35-22-12-52-51-11-21(27(45)39-23(15(5)41)29(47)33-17)36-26(44)20-10-50-32(38-20)18(8-14(3)4)34-30(48)24(16(6)42)40-28(22)46/h9-10,13-18,21-24,41-42H,7-8,11-12H2,1-6H3,(H,33,47)(H,34,48)(H,35,43)(H,36,44)(H,39,45)(H,40,46)/t15-,16-,17+,18+,21-,22-,23-,24-/m0/s1",MASBANRVOBJFHH-NMJMRQOTSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2576,"3,6-dibromo-2-(5-bromo-2-hydroxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H7Br3O3,435.7945328,BrC1=C(O)C(OC2=C(O)C=CC(Br)=C2)=C(Br)C=C1,"InChI=1S/C12H7Br3O3/c13-6-1-4-9(16)10(5-6)18-12-8(15)3-2-7(14)11(12)17/h1-5,16-17H",DTRDRUPAUUMKLU-UHFFFAOYSA-N,,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2577,Desoxydysinosin C,,Aeruginosin,,C25H42N6O8S,602.2734,O=S(OCC(OC)C(NC(C(C)C)C(N1[C@]2([H])[C@](CC[C@H](C2)O)([H])C[C@H]1C(NCCC3=CCN(C(N)=N)C3)=O)=O)=O)(O)=O,"InChI=1S/C25H42N6O9S/c1-14(2)21(29-23(34)20(39-3)13-40-41(36,37)38)24(35)31-18-11-17(32)5-4-16(18)10-19(31)22(33)28-8-6-15-7-9-30(12-15)25(26)27/h7,14,16-21,32H,4-6,8-13H2,1-3H3,(H3,26,27)(H,28,33)(H,29,34)(H,36,37,38)/t16-,17+,18-,19-,20?,21?/m0/s1",BPRGGSWUMFHOJH-SKZYFWNGSA-N,,No,Hormoscilla ,spongeliae,GUM007
CyanoMetDB_2578,Desoxydysinosin B,,Aeruginosin,,C31H52N6O14S,764.3262211,O=S(OCC(OC)C(NC(C(C)C)C(N1[C@]2([H])[C@](CC[C@H](C2)O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)O)O)CO)([H])C[C@H]1C(NCCC4=CCN(C(N)=N)C4)=O)=O)=O)(O)=O,"InChI=1S/C31H52N6O14S/c1-15(2)23(35-28(43)22(48-3)14-49-52(45,46)47)29(44)37-19-11-18(50-30-26(41)25(40)24(39)21(13-38)51-30)5-4-17(19)10-20(37)27(42)34-8-6-16-7-9-36(12-16)31(32)33/h7,15,17-26,30,38-41H,4-6,8-14H2,1-3H3,(H3,32,33)(H,34,42)(H,35,43)(H,45,46,47)/t17-,18+,19-,20-,21+,22?,23?,24+,25-,26+,30+/m0/s1",CLSJQIQCDHNIHY-QRFQPTPCSA-N,,No,Hormoscilla ,spongeliae,GUM007
CyanoMetDB_2579,Aulosirazole B,,other linear non-peptide,,C12H7NO3S,245.01466,O=C1C2=C(C(C3=C1C=CC=C3)=O)C(OC)=NS2,"InChI=1S/C12H7NO3S/c1-16-12-8-9(14)6-4-2-3-5-7(6)10(15)11(8)17-13-12/h2-5H,1H3",CCCMMLCIAHLDEX-UHFFFAOYSA-N,,Yes,Nostoc,sp.,UIC 10771
CyanoMetDB_2580,Aulosirazole C,,other linear non-peptide,,C13H7NO6S,304.99941,O=C1C2=C(C(C3=C1C(C(O)=O)=CC=C3O)=O)C(OC)=NS2,"InChI=1S/C13H7NO6S/c1-20-12-8-9(16)7-5(15)3-2-4(13(18)19)6(7)10(17)11(8)21-14-12/h2-3,15H,1H3,(H,18,19)",NTXPGPUNJDYDFF-UHFFFAOYSA-N,,Yes,Nostoc,sp.,UIC 10771
CyanoMetDB_2581,Minimide,,other cyclic peptide,Cyanobactin,C36H60N6O7S,720.424419,C=CC(C)(C)O[C@H](C)[C@@H](C(N[C@@H]([C@@H](C)CC)C1=N[C@H](CS1)C2=O)=O)NC([C@@H](NC([C@H](CC(C)C)NC([C@@H](N2)[C@H](OC(C)(C=C)C)C)=O)=O)C)=O,"InChI=1S/C36H60N6O7S/c1-14-20(6)26-34-39-25(18-50-34)31(45)42-27(22(8)48-35(10,11)15-2)32(46)38-24(17-19(4)5)30(44)37-21(7)29(43)41-28(33(47)40-26)23(9)49-36(12,13)16-3/h15-16,19-28H,2-3,14,17-18H2,1,4-13H3,(H,37,44)(H,38,46)(H,40,47)(H,41,43)(H,42,45)/t20-,21-,22+,23+,24-,25+,26-,27-,28-/m0/s1",QUIGIVDZUXQPGY-PSMXCGSBSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2582,Ulithiacyclamide F,,other cyclic peptide,Cyanobactin,C35H42N8O7S4,814.2059287,C([C@@H]1C2=NC(=CS2)C(=O)N[C@@]3(C(=O)N[C@@]([C@@H](C)O)(C(=O)N[C@H](CC(C)C)C4=NC(C(=O)N[C@](C5=N[C@](C(=O)N1)([C@@H](C)O5)[H])(CSSC3)[H])=CS4)[H])[H])C6=CC=CC=C6,"InChI=1S/C35H42N8O7S4/c1-16(2)10-20-34-40-23(13-51-34)29(46)39-25-15-54-53-14-24(30(47)42-26(17(3)44)31(48)36-20)38-28(45)22-12-52-35(41-22)21(11-19-8-6-5-7-9-19)37-32(49)27-18(4)50-33(25)43-27/h5-9,12-13,16-18,20-21,24-27,44H,10-11,14-15H2,1-4H3,(H,36,48)(H,37,49)(H,38,45)(H,39,46)(H,42,47)/t17-,18-,20-,21-,24+,25+,26+,27+/m1/s1",PWPRWPDNHHLZPB-JGBLAYLZSA-N,21775220,Yes,Prochloron,sp. ,
CyanoMetDB_2583,Ulithiacyclamide G,,other cyclic peptide,Cyanobactin,C35H42N8O7S4,814.2059287,C([C@@H]1C2=NC(=CS2)C(=O)N[C@@]3(C4=N[C@@]([C@@H](C)O4)(C(=O)N[C@H](CC(C)C)C5=NC(C(=O)N[C@](C(=O)N[C@@]([C@@H](C)O)(C(=O)N1)[H])(CSSC3)[H])=CS5)[H])[H])C6=CC=CC=C6,"InChI=1S/C35H42N8O7S4/c1-16(2)10-20-34-40-22(12-51-34)28(45)38-24-14-53-54-15-25(33-43-27(18(4)50-33)32(49)36-20)39-29(46)23-13-52-35(41-23)21(11-19-8-6-5-7-9-19)37-31(48)26(17(3)44)42-30(24)47/h5-9,12-13,16-18,20-21,24-27,44H,10-11,14-15H2,1-4H3,(H,36,49)(H,37,48)(H,38,45)(H,39,46)(H,42,47)/t17-,18-,20-,21-,24+,25+,26+,27+/m1/s1",XTSHAALAASYFFM-JGBLAYLZSA-N,100927669,Yes,Prochloron,sp. ,
CyanoMetDB_2584,Ulithiacyclamide E,,other cyclic peptide,Cyanobactin,C35H44N8O8S4,832.2164934,C([C@@H]1C2=NC(=CS2)C(=O)N[C@@]3(C(=O)N[C@@]([C@@H](C)O)(C(=O)N[C@H](CC(C)C)C4=NC(C(=O)N[C@](C(=O)N[C@@]([C@@H](C)O)(C(=O)N1)[H])(CSSC3)[H])=CS4)[H])[H])C5=CC=CC=C5,"InChI=1S/C35H44N8O8S4/c1-16(2)10-20-34-40-22(12-52-34)28(46)38-25-15-55-54-14-24(30(48)42-26(17(3)44)32(50)36-20)39-29(47)23-13-53-35(41-23)21(11-19-8-6-5-7-9-19)37-33(51)27(18(4)45)43-31(25)49/h5-9,12-13,16-18,20-21,24-27,44-45H,10-11,14-15H2,1-4H3,(H,36,50)(H,37,51)(H,38,46)(H,39,47)(H,42,48)(H,43,49)/t17-,18-,20-,21-,24+,25+,26+,27+/m1/s1",NLVXWJPLNQGFEL-JGBLAYLZSA-N,10653061,Yes,Prochloron,sp. ,
CyanoMetDB_2585,Patellamide G,,other cyclic peptide,Cyanobactin,C38H50N8O7S2,794.3243875,C([C@@H]1C2=NC(=CS2)C(=O)N[C@@]([C@H](CC)C)(C(=O)N[C@@]([C@@H](C)O)(C(=O)N[C@H](C)C3=NC(C(=O)N[C@@H](CC(C)C)C4=N[C@](C(=O)N1)([C@@H](C)O4)[H])=CS3)[H])[H])C5=CC=CC=C5,"InChI=1S/C38H50N8O7S2/c1-8-19(4)28-33(50)45-29(21(6)47)34(51)39-20(5)37-42-26(16-54-37)31(48)40-24(14-18(2)3)36-46-30(22(7)53-36)35(52)41-25(15-23-12-10-9-11-13-23)38-43-27(17-55-38)32(49)44-28/h9-13,16-22,24-25,28-30,47H,8,14-15H2,1-7H3,(H,39,51)(H,40,48)(H,41,52)(H,44,49)(H,45,50)/t19-,20+,21+,22+,24-,25+,28-,29-,30-/m0/s1",VLOXUMQANREDRL-XGKKPBRYSA-N,44584086,Yes,Prochloron,sp. ,
CyanoMetDB_2586,Dysidamide A,(-)-Dysidamide,other linear non-peptide,Polychlorinated Leucines,C15H21Cl6NO3,472.9652598,C([C@@H](C(Cl)(Cl)Cl)C)[C@@H]1N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C(=O)C(C)(C)[C@@H]1O,"InChI=1S/C15H21Cl6NO3/c1-7(14(16,17)18)5-9-11(24)13(3,4)12(25)22(9)10(23)6-8(2)15(19,20)21/h7-9,11,24H,5-6H2,1-4H3/t7-,8-,9-,11+/m0/s1",SZYKZXUJGUQVIX-FTYOSLGDSA-N,6711373,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2587,O-Acetyldysidamide,Dysidamide acetate,other linear non-peptide,Polychlorinated Leucines,C17H23Cl6NO4,514.9758245,C([C@@H](C(Cl)(Cl)Cl)C)[C@@H]1N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C(=O)C(C)(C)[C@@H]1OC(C)=O,"InChI=1S/C17H23Cl6NO4/c1-8(16(18,19)20)6-11-13(28-10(3)25)15(4,5)14(27)24(11)12(26)7-9(2)17(21,22)23/h8-9,11,13H,6-7H2,1-5H3/t8-,9-,11-,13+/m0/s1",KEZKFOGHLRWFHG-LKAMGYQZSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2588,"3,5-dibromo-2-(3,5-dibromo-2-methoxyphenoxy)phenol","3,4',5,6'-Tetrabromo-2,2'-oxydiphenol 1'-methyl ether",other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C13H8Br4O3,527.7206957,BrC=1C=C(Br)C(OC=2C=C(Br)C=C(Br)C2OC)=C(O)C1,"InChI=1S/C13H8Br4O3/c1-19-13-9(17)3-7(15)5-11(13)20-12-8(16)2-6(14)4-10(12)18/h2-5,18H,1H3",KMQWWGLIGSFYAT-UHFFFAOYSA-N,11455391,Yes,Hormoscilla ,spongeliae,"SP12, GUM202"
CyanoMetDB_2589,Ulithiacyclamide,,other cyclic peptide,Cyanobactin,C32H42N8O6S4,762.2110141,O=C1NC2C3=NC(C(=O)NC(C4=NC(=CS4)C(=O)NC(C5=NC(C(=O)NC(C6=NC1=CS6)CC(C)C)C(O5)C)CSSC2)CC(C)C)C(O3)C,"InChI=1S/C32H42N8O6S4/c1-13(2)7-17-31-37-19(9-47-31)25(41)35-22-12-50-49-11-21(29-39-23(15(5)45-29)27(43)33-17)36-26(42)20-10-48-32(38-20)18(8-14(3)4)34-28(44)24-16(6)46-30(22)40-24/h9-10,13-18,21-24H,7-8,11-12H2,1-6H3,(H,33,43)(H,34,44)(H,35,41)(H,36,42)",FSUFGKVPTHSJKC-UHFFFAOYSA-N,5633,Yes,Prochloron,sp. ,
CyanoMetDB_2590,Ulicyclamide,,other cyclic peptide,Cyanobactin,C33H39N7O5S2,677.2454089,CCC(C)C1NC(C(CC2=CC=CC=C2)NC(C3=CSC(C(C)NC(C4CCCN4C(C5C(OC(C6=CSC1=N6)=N5)C)=O)=O)=N3)=O)=O,"InChI=1S/C33H39N7O5S2/c1-5-17(2)25-32-37-23(16-47-32)30-39-26(19(4)45-30)33(44)40-13-9-12-24(40)29(43)34-18(3)31-36-22(15-46-31)28(42)35-21(27(41)38-25)14-20-10-7-6-8-11-20/h6-8,10-11,15-19,21,24-26H,5,9,12-14H2,1-4H3,(H,34,43)(H,35,42)(H,38,41)",ABGWWXGWIGDCFQ-UHFFFAOYSA-N,9767976,Yes,Prochloron,sp. ,
CyanoMetDB_2591,Mollamide F,,other cyclic peptide,Cyanobactin,C33H46N6O5S,638.3250394,O=C1[C@]2(N(C(=O)[C@H](C(C)C)NC(=O)[C@]([C@H](CC)C)(NC(=O)[C@@]3(N=C([C@@H](CC4=CC=CC=C4)NC(=O)[C@]5(N1CCC5)[H])SC3)[H])[H])CCC2)[H],"InChI=1S/C33H46N6O5S/c1-5-20(4)27-30(42)36-26(19(2)3)33(44)39-16-10-14-25(39)32(43)38-15-9-13-24(38)29(41)34-22(17-21-11-7-6-8-12-21)31-35-23(18-45-31)28(40)37-27/h6-8,11-12,19-20,22-27H,5,9-10,13-18H2,1-4H3,(H,34,41)(H,36,42)(H,37,40)/t20-,22+,23+,24-,25-,26-,27-/m0/s1",PCJVGSSHAGXUGI-NIGUMGSVSA-N,70697324,Yes,Prochloron,sp. ,
CyanoMetDB_2592,Mollamide E,,other cyclic peptide,Cyanobactin,C35H50N6O7S,698.3461687,C([C@@H]1C2=N[C@](CS2)(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N3[C@](C(=O)N1)(CCC3)[H])[H])[H])C4=CC=CC=C4,"InChI=1S/C35H50N6O7S/c1-7-35(5,6)48-21(4)28-32(46)36-23(16-20(2)3)29(43)38-25(18-42)34(47)41-15-11-14-27(41)31(45)37-24(17-22-12-9-8-10-13-22)33-39-26(19-49-33)30(44)40-28/h7-10,12-13,20-21,23-28,42H,1,11,14-19H2,2-6H3,(H,36,46)(H,37,45)(H,38,43)(H,40,44)/t21-,23+,24-,25+,26-,27+,28+/m1/s1",OOYFLPWTUQXPSY-FVULWXNXSA-N,66553498,Yes,Prochloron,sp. ,
CyanoMetDB_2593,5-Epidysidamide G,,other linear non-peptide,Polychlorinated Leucines,C10H14Cl3NO2,285.0090118,C([C@@H](C(Cl)(Cl)Cl)C)[C@@H]1C(=O)C(C)(C)C(=O)N1,"InChI=1S/C10H14Cl3NO2/c1-5(10(11,12)13)4-6-7(15)9(2,3)8(16)14-6/h5-6H,4H2,1-3H3,(H,14,16)/t5-,6+/m0/s1",FGAIQUBOQVNVPA-NTSWFWBYSA-N,76764241,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2594,Dysidamide G,,other linear non-peptide,Polychlorinated Leucines,C10H14Cl3NO2,285.0090118,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1C(=O)C(C)(C)C(=O)N1,"InChI=1S/C10H14Cl3NO2/c1-5(10(11,12)13)4-6-7(15)9(2,3)8(16)14-6/h5-6H,4H2,1-3H3,(H,14,16)/t5-,6-/m0/s1",FGAIQUBOQVNVPA-WDSKDSINSA-N,12190933,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2595,Dysidamide F,N-Desacyldysidamide,other linear non-peptide,Polychlorinated Leucines,C10H16Cl3NO2,287.0246619,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1[C@@H](O)C(C)(C)C(=O)N1,"InChI=1S/C10H16Cl3NO2/c1-5(10(11,12)13)4-6-7(15)9(2,3)8(16)14-6/h5-7,15H,4H2,1-3H3,(H,14,16)/t5-,6-,7+/m0/s1",WXVMITZTZFBSBV-LYFYHCNISA-N,14825941,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2596,Dysidamide H,,other linear non-peptide,Polychlorinated Leucines,C15H19Cl6NO3,470.9496097,C(C(C(Cl)(Cl)Cl)C)[C@@H]1N(C(CC(C(Cl)(Cl)Cl)C)=O)C(=O)C(C)(C)C1=O,"InChI=1S/C15H19Cl6NO3/c1-7(14(16,17)18)5-9-11(24)13(3,4)12(25)22(9)10(23)6-8(2)15(19,20)21/h7-9H,5-6H2,1-4H3/t7?,8?,9-/m0/s1",NWMDRGHUAJWWKA-HACHORDNSA-N,21777974,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2597,Dysidamide D,,other linear non-peptide,Polychlorinated Leucines,C15H22Cl5NO3,439.0042321,C(C[C@@H](C(Cl)Cl)C)(=O)N1[C@@H](C[C@@H](C(Cl)(Cl)Cl)C)[C@@H](O)C(C)(C)C1=O,"InChI=1S/C15H22Cl5NO3/c1-7(12(16)17)5-10(22)21-9(6-8(2)15(18,19)20)11(23)14(3,4)13(21)24/h7-9,11-12,23H,5-6H2,1-4H3/t7-,8-,9-,11+/m0/s1",YPWZUTUEUOEWPU-FTYOSLGDSA-N,102213339,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2598,Dysidamide E,,other linear non-peptide,Polychlorinated Leucines,C15H22Cl5NO3,439.0042321,C(C[C@@H](C(Cl)(Cl)Cl)C)(=O)N1[C@@H](C[C@@H](C(Cl)Cl)C)[C@@H](O)C(C)(C)C1=O,"InChI=1S/C15H22Cl5NO3/c1-7(12(16)17)5-9-11(23)14(3,4)13(24)21(9)10(22)6-8(2)15(18,19)20/h7-9,11-12,23H,5-6H2,1-4H3/t7-,8-,9-,11+/m0/s1",WPKBEZAKAOZZQJ-FTYOSLGDSA-N,12190929,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2599,"Methyl (4S,6S)-7,7,7-trichloro-2,2,6-trimethyl-3-oxo-4-[[(3S)-4,4,4-trichloro-3-methyl-1-oxobutyl]amino]heptanoate",,other linear non-peptide,Polychlorinated Leucines,C16H23Cl6NO4,502.9758245,[C@H](C(C(C(OC)=O)(C)C)=O)(NC(C[C@@H](C(Cl)(Cl)Cl)C)=O)C[C@@H](C(Cl)(Cl)Cl)C,"InChI=1S/C16H23Cl6NO4/c1-8(15(17,18)19)6-10(12(25)14(3,4)13(26)27-5)23-11(24)7-9(2)16(20,21)22/h8-10H,6-7H2,1-5H3,(H,23,24)/t8-,9-,10-/m0/s1",HEECAFWSCHGCSA-GUBZILKMSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2600,"Methyl (3S,4S,6S)-7,7,7-trichloro-3-hydroxy-2,2,6-trimethyl-4-[[(3S)-4,4,4-trichloro-3-methyl-1-oxobutyl]amino]heptanoate",,other linear non-peptide,Polychlorinated Leucines,C16H25Cl6NO4,504.9914746,[C@H]([C@H](C(C(OC)=O)(C)C)O)(NC(C[C@@H](C(Cl)(Cl)Cl)C)=O)C[C@@H](C(Cl)(Cl)Cl)C,"InChI=1S/C16H25Cl6NO4/c1-8(15(17,18)19)6-10(12(25)14(3,4)13(26)27-5)23-11(24)7-9(2)16(20,21)22/h8-10,12,25H,6-7H2,1-5H3,(H,23,24)/t8-,9-,10-,12+/m0/s1",SDCSLPMDBRNYJO-QFOLPQNPSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2601,Herbamide A,,other linear non-peptide,Polychlorinated Leucines,C16H21Cl3N2OS,394.0440172,O=C(C=CC=CCC(C)C(Cl)(Cl)Cl)NC(C1=NC=CS1)C(C)C,"InChI=1S/C16H21Cl3N2OS/c1-11(2)14(15-20-9-10-23-15)21-13(22)8-6-4-5-7-12(3)16(17,18)19/h4-6,8-12,14H,7H2,1-3H3,(H,21,22)/b5-4+,8-6+",RCVQKFJHXSGUHH-DVBIZMGNSA-N,,Yes,Dysidea ,herbacea,coll. no. 93153
CyanoMetDB_2602,Mollamide C,,other cyclic peptide,Cyanobactin,C30H46N6O6S,618.319954,O=C1N2[C@@](CCC2)(C(=O)NCC(=O)N[C@@H](COC(C=C)(C)C)C(=O)N[C@@H](CC(C)C)C3=NC(C(=O)N[C@]1([C@H](CC)C)[H])=CS3)[H],"InChI=1S/C30H46N6O6S/c1-8-18(5)24-29(41)36-12-10-11-22(36)27(40)31-14-23(37)32-20(15-42-30(6,7)9-2)25(38)33-19(13-17(3)4)28-34-21(16-43-28)26(39)35-24/h9,16-20,22,24H,2,8,10-15H2,1,3-7H3,(H,31,40)(H,32,37)(H,33,38)(H,35,39)/t18-,19-,20-,22-,24-/m0/s1",XUWMKNIBSBACMR-RNDDGGPQSA-N,24899403,Yes,Prochloron,sp. ,
CyanoMetDB_2603,Mollamide B,,other cyclic peptide,Cyanobactin,C36H52N6O6S,696.3669042,O=C1N2[C@](C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@@H](C(C)C)C3=N[C@](C(=O)N[C@@H](C(C)C)C(=O)N[C@H]1CC4=CC=CC=C4)(CS3)[H])[H])(CCC2)[H],"InChI=1S/C36H52N6O6S/c1-9-36(7,8)48-22(6)29-33(46)40-28(21(4)5)34-38-25(19-49-34)30(43)39-27(20(2)3)32(45)37-24(18-23-14-11-10-12-15-23)35(47)42-17-13-16-26(42)31(44)41-29/h9-12,14-15,20-22,24-29H,1,13,16-19H2,2-8H3,(H,37,45)(H,39,43)(H,40,46)(H,41,44)/t22-,24+,25+,26+,27+,28+,29+/m1/s1",DXCFOKOBTQHBHK-GBUGJBKCSA-N,24899159,Yes,Prochloron,sp. ,
CyanoMetDB_2604,Divamide B,,other cyclic peptide,,C79H128N21O29S3,1930.834896,CC[C@H](C)[C@H]1C(=O)N[C@H]2CS[C@H]([C@@H]3C(=O)N[C@H]4CS[C@H]([C@H](C(=O)N[C@H](C(=O)N1)C)NC(=O)[C@@H](NC(=O)[C@@H]5CCCN5C(=O)CNC(=O)[C@@H](NC(=O)[C@H](CNCCCC[C@H](NC(=O)[C@@H]([C@@H](SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3)CO)C)NC(=O)[C@H](CCC(=O)O)[N+](C)(C)C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC2=O)[C@H](C(=O)O)O)[C@@H](C)O)C(=O)O)NC4=O)CO)[C@@H](C)CC)C)C  ,"InChI=1S/C79H127N21O29S3/c1-14-33(3)53-72(120)90-47-32-132-39(9)57-77(125)91-46-31-131-38(8)56(75(123)84-36(6)62(110)93-53)96-73(121)54(34(4)15-2)94-69(117)48-20-18-24-99(48)51(105)27-82-63(111)43(28-101)88-64(112)42(86-67(46)115)25-80-23-17-16-19-41(78(126)127)85-76(124)58(97-74(122)55(37(7)103)92-50(104)26-81-71(119)59(98-68(47)116)60(108)79(128)129)40(10)130-30-45(89-70(118)49(100(11,12)13)21-22-52(106)107)66(114)83-35(5)61(109)87-44(29-102)65(113)95-57/h33-49,53-60,80,101-103,108H,14-32H2,1-13H3,(H20-,81,82,83,84,85,86,87,88,89,90,91,92,93,94,95,96,97,98,104,106,107,109,110,111,112,113,114,115,116,117,118,119,120,121,122,123,124,125,126,127,128,129)/p+1/t33-,34-,35-,36-,37+,38-,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,53-,54-,55-,56+,57+,58+,59-,60+/m0/s1",BXUPAXDHRCWPIU-CIDQOVMCSA-O,131801638,Yes,Prochloron,sp. ,
CyanoMetDB_2605,Divamide A,,other cyclic peptide,,C87H138N21O28S3,2020.918231,CC[C@H](C)[C@H]1C(=O)N[C@H](C(=O)N[C@@H]2[C@@H](SC[C@H]3C(=O)N[C@@H](CNCCCC[C@H](NC(=O)[C@H]4[C@@H](SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H]([C@@H](SC[C@@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N4)[C@@H](C)O)[C@H](C(=O)O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(C)C)C)C(=O)N3)CO)C)NC(=O)[C@H](CCC(=O)O)[N+](C)(C)C)C)C(=O)O)C(=O)N[C@H](C(=O)NCC(=O)N1)CC5=CC=CC=C5)C)C(C)C,"InChI=1S/C87H137N21O28S3/c1-17-40(7)61-80(127)102-60(39(5)6)79(126)105-66-46(13)138-36-53-74(121)94-50(71(118)93-49(30-47-24-20-19-21-25-47)70(117)89-32-56(111)99-61)31-88-29-23-22-26-48(86(133)134)92-83(130)65-45(12)137-35-52(96-76(123)55(108(14,15)16)27-28-58(113)114)73(120)91-42(9)69(116)95-51(34-109)72(119)104-64(84(131)98-53)44(11)139-37-54(97-78(125)59(38(3)4)101-81(128)62(41(8)18-2)103-85(66)132)75(122)107-67(68(115)87(135)136)77(124)90-33-57(112)100-63(43(10)110)82(129)106-65/h19-21,24-25,38-46,48-55,59-68,88,109-110,115H,17-18,22-23,26-37H2,1-16H3,(H21-,89,90,91,92,93,94,95,96,97,98,99,100,101,102,103,104,105,106,107,111,112,113,114,116,117,118,119,120,121,122,123,124,125,126,127,128,129,130,131,132,133,134,135,136)/p+1/t40-,41-,42-,43+,44-,45-,46-,48-,49-,50-,51-,52-,53-,54-,55-,59-,60-,61-,62-,63-,64+,65+,66+,67-,68+/m0/s1",UCUCWKJHBRGGFM-FIKWHDLOSA-O,131801640,Yes,Prochloron,sp. ,
CyanoMetDB_2606,Didechlorodihydrodysamide C,,other linear non-peptide,Polychlorinated Leucines,C14H20Cl4N2O2,538.1456948,C([C@@H](C(Cl)Cl)C)[C@H]1C(=O)N(C)\C(=C\[C@@H](C(Cl)Cl)C)\C(=O)N1C,"InChI=1S/C14H20Cl4N2O2/c1-7(11(15)16)5-9-13(21)20(4)10(14(22)19(9)3)6-8(2)12(17)18/h5,7-8,10-12H,6H2,1-4H3/b9-5+/t7-,8-,10-/m0/s1",HPESIQPIRSOIDD-QLRJEXERSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2607,Dihydrodysamide C,,other linear non-peptide,Polychlorinated Leucines,C15H20Cl6N2O2,762.2110141,C([C@@H](CC(Cl)(Cl)Cl)C)[C@H]1C(=O)N(C)\C(=C\[C@@H](C(Cl)(Cl)Cl)C)\C(=O)N1C,"InChI=1S/C15H20Cl6N2O2/c1-8(7-14(16,17)18)5-10-12(24)23(4)11(13(25)22(10)3)6-9(2)15(19,20)21/h6,8-10H,5,7H2,1-4H3/b11-6+/t8-,9-,10-/m0/s1",QYPNHKOSJJFDRV-LZEFRMTCSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2608,11-Dechloro-13-demethylisodysidenine,11-Monodechloro-13-demethylisodysidenin,other linear non-peptide,Polychlorinated Leucines,C16H22Cl5N3O2S,686.3461687,[C@H](N(C(C[C@@H](C(Cl)Cl)C)=O)C)(C(NCC1=NC=CS1)=O)C[C@@H](C(Cl)(Cl)Cl)C,"InChI=1S/C16H22Cl5N3O2S/c1-9(14(17)18)6-13(25)24(3)11(7-10(2)16(19,20)21)15(26)23-8-12-22-4-5-27-12/h4-5,9-11,14H,6-8H2,1-3H3,(H,23,26)/t9-,10-,11+/m0/s1",HRTWOYRCWPBHAL-GARJFASQSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2609,13-demethyldysidenin,(-)-13-Demethyldysidenine,other linear non-peptide,Polychlorinated Leucines,C16H21Cl6N3O2S,638.3250394,[C@@H](N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C)(C(NCC1=NC=CS1)=O)C[C@@H](C(Cl)(Cl)Cl)C,"InChI=1S/C16H21Cl6N3O2S/c1-9(15(17,18)19)6-11(14(27)24-8-12-23-4-5-28-12)25(3)13(26)7-10(2)16(20,21)22/h4-5,9-11H,6-8H2,1-3H3,(H,24,27)/t9-,10-,11-/m0/s1",KDAYUPCSRRZKKN-DCAQKATOSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2610,13-demethylisodysidenin,(+)-13-Demethylisodysidenine,other linear non-peptide,Polychlorinated Leucines,C16H21Cl6N3O2S,638.3250394,[C@H](N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C)(C(NCC1=NC=CS1)=O)C[C@@H](C(Cl)(Cl)Cl)C,"InChI=1S/C16H21Cl6N3O2S/c1-9(15(17,18)19)6-11(14(27)24-8-12-23-4-5-28-12)25(3)13(26)7-10(2)16(20,21)22/h4-5,9-11H,6-8H2,1-3H3,(H,24,27)/t9-,10-,11+/m0/s1",KDAYUPCSRRZKKN-GARJFASQSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2611,Dysidamide C,(-)-Dysidamide C,other linear non-peptide,Polychlorinated Leucines,C10H17Cl2NO2,354.0668611,CC(C(Cl)Cl)C[C@H]1[C@@H](O)C(C)(C)C(N1)=O,"InChI=1S/C10H17Cl2NO2/c1-5(8(11)12)4-6-7(14)10(2,3)9(15)13-6/h5-8,14H,4H2,1-3H3,(H,13,15)/t5?,6-,7+/m0/s1",LAJOJYACHKZCLJ-BOJSHJERSA-N,102213340,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2612,Dysidamide B,(+)-Dysidamide B,other linear non-peptide,Polychlorinated Leucines,C15H23Cl4NO3,695.2559736,C[C@@H](CC(=O)N1[C@H]([C@H](C(C1=O)(C)C)O)CC(C)C(Cl)Cl)C(Cl)Cl,"InChI=1S/C15H23Cl4NO3/c1-7(12(16)17)5-9-11(22)15(3,4)14(23)20(9)10(21)6-8(2)13(18)19/h7-9,11-13,22H,5-6H2,1-4H3",KSLNDMUDKLQWJA-UHFFFAOYSA-N,102213338,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2613,Dysamide D,,other linear non-peptide,Polychlorinated Leucines,C14H21Cl5N2O2,693.2259358,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1C(=O)N(C)[C@@H](C[C@@H](C(Cl)Cl)C)C(=O)N1C,"InChI=1S/C14H21Cl5N2O2/c1-7(11(15)16)5-9-12(22)21(4)10(13(23)20(9)3)6-8(2)14(17,18)19/h7-11H,5-6H2,1-4H3/t7-,8-,9-,10-/m0/s1",UTEKGWWXPYZXIW-XKNYDFJKSA-N,10550375,Yes,,,
CyanoMetDB_2614,Sintokamide B,,other linear non-peptide,Polychlorinated Leucines,C18H24Cl6N2O4,696.3669042,C([C@@H](C(Cl)(Cl)Cl)C)[C@@H]1N(C([C@@H](C[C@@H](C(Cl)(Cl)Cl)C)NC(CC)=O)=O)C(=O)C=C1OC,"InChI=1S/C18H24Cl6N2O4/c1-5-14(27)25-11(6-9(2)17(19,20)21)16(29)26-12(7-10(3)18(22,23)24)13(30-4)8-15(26)28/h8-12H,5-7H2,1-4H3,(H,25,27)/t9-,10-,11+,12-/m0/s1",URLUPICIFJDTOG-YFKTTZPYSA-N,45140266,Yes,,,
CyanoMetDB_2615,Sintokamide A,,other linear non-peptide,Polychlorinated Leucines,C18H25Cl5N2O4,772.322279,C([C@@H](C[C@@H](C(Cl)(Cl)Cl)C)NC(CC)=O)(=O)N1[C@@H](C[C@@H](C(Cl)Cl)C)C(OC)=CC1=O,"InChI=1S/C18H25Cl5N2O4/c1-5-14(26)24-11(7-10(3)18(21,22)23)17(28)25-12(6-9(2)16(19)20)13(29-4)8-15(25)27/h8-12,16H,5-7H2,1-4H3,(H,24,26)/t9-,10-,11+,12-/m0/s1",BOAGQOUETKWYRA-YFKTTZPYSA-N,25140878,Yes,,,
CyanoMetDB_2616,Sintokamide C,,other linear non-peptide,Polychlorinated Leucines,C18H26Cl4N2O4,756.3451229,C([C@@H](C(Cl)Cl)C)[C@@H]1N(C([C@@H](C[C@@H](C(Cl)Cl)C)NC(CC)=O)=O)C(=O)C=C1OC,"InChI=1S/C18H26Cl4N2O4/c1-5-14(25)23-11(6-9(2)16(19)20)18(27)24-12(7-10(3)17(21)22)13(28-4)8-15(24)26/h8-12,16-17H,5-7H2,1-4H3,(H,23,25)/t9-,10-,11+,12-/m0/s1",BWRBCPLQKLOCKU-YFKTTZPYSA-N,45142132,Yes,,,
CyanoMetDB_2617,Sintokamide D,,other linear non-peptide,Polychlorinated Leucines,C18H26Cl4N2O4,756.3451229,C([C@@H](CCl)C)[C@@H]1N(C([C@@H](C[C@@H](C(Cl)(Cl)Cl)C)NC(CC)=O)=O)C(=O)C=C1OC,"InChI=1S/C18H26Cl4N2O4/c1-5-15(25)23-12(7-11(3)18(20,21)22)17(27)24-13(6-10(2)9-19)14(28-4)8-16(24)26/h8,10-13H,5-7,9H2,1-4H3,(H,23,25)/t10-,11-,12+,13-/m0/s1",SMVFICSBIUXYHT-RVMXOQNASA-N,45140267,Yes,,,
CyanoMetDB_2618,Sintokamide E,,other linear non-peptide,Polychlorinated Leucines,C18H27Cl3N2O4,720.424419,C(C(C)C)[C@@H]1N(C([C@@H](C[C@@H](C(Cl)(Cl)Cl)C)NC(CC)=O)=O)C(=O)C=C1OC,"InChI=1S/C18H27Cl3N2O4/c1-6-15(24)22-12(8-11(4)18(19,20)21)17(26)23-13(7-10(2)3)14(27-5)9-16(23)25/h9-13H,6-8H2,1-5H3,(H,22,24)/t11-,12+,13-/m0/s1",YJCXZJZJBDKQTD-XQQFMLRXSA-N,45140268,Yes,,,
CyanoMetDB_2619,Dysidenin,"(-)-Dysidenin, Dysidenine",other linear non-peptide,Polychlorinated Leucines,C17H23Cl6N3O2S,742.3294729,C[C@@H](C[C@@H](C(=O)N[C@@H](C)C1=NC=CS1)N(C)C(=O)C[C@H](C)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl  ,"InChI=1S/C17H23Cl6N3O2S/c1-9(16(18,19)20)7-12(14(28)25-11(3)15-24-5-6-29-15)26(4)13(27)8-10(2)17(21,22)23/h5-6,9-12H,7-8H2,1-4H3,(H,25,28)/t9-,10-,11-,12-/m0/s1",BFVRAKVNXYQMID-BJDJZHNGSA-N,10007601,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2620,Patellamide A,,other cyclic peptide,Cyanobactin,C35H50N8O6S2,742.3294729,[C@@H](CC)(C)[C@]1(C2=N[C@@]([C@@H](C)O2)(C(=O)N[C@H]([C@H](C)C)C3=NC(=CS3)C(=O)N[C@@]([C@H](CC)C)(C4=N[C@](C(=O)N[C@H]([C@H](C)C)C5=NC(C(=O)N1)=CS5)(CO4)[H])[H])[H])[H],"InChI=1S/C35H50N8O6S2/c1-10-17(7)25-32-36-20(12-48-32)28(44)39-23(15(3)4)34-37-22(14-50-34)30(46)42-26(18(8)11-2)33-43-27(19(9)49-33)31(47)40-24(16(5)6)35-38-21(13-51-35)29(45)41-25/h13-20,23-27H,10-12H2,1-9H3,(H,39,44)(H,40,47)(H,41,45)(H,42,46)/t17-,18-,19+,20-,23+,24+,25-,26-,27-/m0/s1",ZGJIVWQOEHQWLW-SWTUTNCKSA-N,157454,Yes,Prochloron,sp. ,
CyanoMetDB_2621,Patellamide B,,other cyclic peptide,Cyanobactin,C38H48N8O6S2,776.3138228,CC[C@H](C)[C@H]1C2=N[C@@H]([C@H](O2)C)C(=O)N[C@@H](C3=NC(=CS3)C(=O)N[C@H](C4=N[C@@H]([C@H](O4)C)C(=O)N[C@@H](C5=NC(=CS5)C(=O)N1)C)CC(C)C)CC6=CC=CC=C6,"InChI=1S/C38H48N8O6S2/c1-8-19(4)28-36-46-30(22(7)52-36)34(50)41-25(15-23-12-10-9-11-13-23)38-43-26(17-54-38)31(47)40-24(14-18(2)3)35-45-29(21(6)51-35)33(49)39-20(5)37-42-27(16-53-37)32(48)44-28/h9-13,16-22,24-25,28-30H,8,14-15H2,1-7H3,(H,39,49)(H,40,47)(H,41,50)(H,44,48)/t19-,20+,21+,22+,24-,25+,28-,29-,30-/m0/s1",FDAPKNJHIHKHDM-XGKKPBRYSA-N,9767971,Yes,Prochloron,sp. ,
CyanoMetDB_2622,Lissoclinamide 3,,other cyclic peptide,Cyanobactin,C33H41N7O5S2,801.5364123,O=C1NC(C(=O)N2CCCC2C3=NC(C(=O)NC(C4=NC(C(=O)NC(C5=NC1=CS5)C)CS4)C(C)CC)C(O3)C)CC=6C=CC=CC6,"InChI=1S/C33H41N7O5S2/c1-5-17(2)25-32-37-22(16-47-32)27(41)34-18(3)31-36-23(15-46-31)28(42)35-21(14-20-10-7-6-8-11-20)33(44)40-13-9-12-24(40)30-39-26(19(4)45-30)29(43)38-25/h6-8,10-11,15,17-19,21-22,24-26H,5,9,12-14,16H2,1-4H3,(H,34,41)(H,35,42)(H,38,43)",MXZCBFXSFNFJTR-UHFFFAOYSA-N,56661221,Yes,Prochloron,sp. ,
CyanoMetDB_2623,Tawicyclamide A,,other cyclic peptide,Cyanobactin,C39H50N8O5S3,772.322279,C[C@@H](CC)[C@@H](NC1=O)C2=NC(C(N[C@@H](C)C(N3[C@@H](CCC3)C(N[C@@H](C(C)C)C4=NC(C(N[C@@H](CC5=CC=CC=C5)C6=N[C@H]1CS6)=O)=CS4)=O)=O)=O)=CS2,"InChI=1S/C39H50N8O5S3.CH4/c1-7-22(6)31-38-43-27(19-55-38)33(49)45-30(21(4)5)39(52)47-15-11-14-28(47)35(51)44-29(20(2)3)37-42-25(18-54-37)32(48)40-24(16-23-12-9-8-10-13-23)36-41-26(17-53-36)34(50)46-31;/h8-10,12-13,18-22,24,26,28-31H,7,11,14-17H2,1-6H3,(H,40,48)(H,44,51)(H,45,49)(H,46,50);1H4/t22-,24-,26-,28-,29-,30-,31+;/m0./s1",YBYVWRCYTHLDDC-HOUCAKFWSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2624,Tawicyclamide B,,other cyclic peptide,Cyanobactin,C36H52N8O5S3,806.306629,C[C@@H](CC)[C@@H](NC1=O)C2=NC(C(N[C@@H](C(C)C)C(N3[C@@H](CCC3)C(N[C@@H](C(C)C)C4=NC(C(N[C@@H](CC(C)C)C5=N[C@H]1CS5)=O)=CS4)=O)=O)=O)=CS2,"InChI=1S/C36H52N8O5S3/c1-9-20(8)28-35-40-24(16-52-35)30(46)42-27(19(6)7)36(49)44-12-10-11-25(44)32(48)41-26(18(4)5)34-39-22(15-51-34)29(45)37-21(13-17(2)3)33-38-23(14-50-33)31(47)43-28/h15-21,23,25-28H,9-14H2,1-8H3,(H,37,45)(H,41,48)(H,42,46)(H,43,47)/t20-,21-,23-,25-,26-,27-,28+/m0/s1",NPLDQKMDNMUEOR-KWXHWTAGSA-N,10350247,Yes,Prochloron,sp. ,
CyanoMetDB_2625,"(2R,4S)-5,5,5-trichloro-4-methyl-2-((S)-4,4,4-trichloro-N,3-dimethylbutanamido)pentanoic acid","D-Leucine, 5,5,5-trichloro-N-methyl-N-[(3S)-4,4,4-trichloro-3-methyl-1-oxobutyl]-, (4S)-",other linear non-peptide,Polychlorinated Leucines,C12H17Cl6NO3,424.0045665,[C@@H](N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)(Cl)Cl)C)C(O)=O,"InChI=1S/C12H17Cl6NO3/c1-6(11(13,14)15)4-8(10(21)22)19(3)9(20)5-7(2)12(16,17)18/h6-8H,4-5H2,1-3H3,(H,21,22)/t6-,7-,8+/m0/s1",HYTMKWWXLHMGOH-BIIVOSGPSA-N,,Yes,,,
CyanoMetDB_2626,"(2S,4S)-5,5,5-trichloro-4-methyl-2-((S)-4,4,4-trichloro-N,3-dimethylbutanamido)pentanoic acid","L-Leucine, 5,5,5-trichloro-N-methyl-N-[(3S)-4,4,4-trichloro-3-methyl-1-oxobutyl]-, (4S)-",other linear non-peptide,Polychlorinated Leucines,C12H17Cl6NO3,424.0045665,[C@H](N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)(Cl)Cl)C)C(O)=O,"InChI=1S/C12H17Cl6NO3/c1-6(11(13,14)15)4-8(10(21)22)19(3)9(20)5-7(2)12(16,17)18/h6-8H,4-5H2,1-3H3,(H,21,22)/t6-,7-,8-/m0/s1",HYTMKWWXLHMGOH-FXQIFTODSA-N,,Yes,,,
CyanoMetDB_2627,"methyl (2R,4S)-5,5,5-trichloro-4-methyl-2-((S)-4,4,4-trichloro-N,3-dimethylbutanamido)pentanoate","D-Leucine, 5,5,5-trichloro-N-methyl-N-[(3S)-4,4,4-trichloro-3-methyl-1-oxobutyl]-, methyl ester, (4S)-",other linear non-peptide,Polychlorinated Leucines,C13H19Cl6NO3,528.9485639,[C@@H](N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)(Cl)Cl)C)C(OC)=O,"InChI=1S/C13H19Cl6NO3/c1-7(12(14,15)16)5-9(11(22)23-4)20(3)10(21)6-8(2)13(17,18)19/h7-9H,5-6H2,1-4H3/t7-,8-,9+/m0/s1",LZMPHAKNNSOSQK-XHNCKOQMSA-N,,Yes,,,
CyanoMetDB_2628,"methyl (2S,4S)-5,5,5-trichloro-4-methyl-2-((S)-4,4,4-trichloro-N,3-dimethylbutanamido)pentanoate","L-Leucine, 5,5,5-trichloro-N-methyl-N-[(3S)-4,4,4-trichloro-3-methyl-1-oxobutyl]-, methyl ester, (4S)-",other linear non-peptide,Polychlorinated Leucines,C13H19Cl6NO3,528.9485639,[C@H](N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)(Cl)Cl)C)C(OC)=O,"InChI=1S/C13H19Cl6NO3/c1-7(12(14,15)16)5-9(11(22)23-4)20(3)10(21)6-8(2)13(17,18)19/h7-9H,5-6H2,1-4H3/t7-,8-,9-/m0/s1",LZMPHAKNNSOSQK-CIUDSAMLSA-N,,Yes,,,
CyanoMetDB_2629,"methyl (2R,4S)-5,5-dichloro-2-((S)-4,4-dichloro-N,3-dimethylbutanamido)-4-methylpentanoate","D-Leucine, 5,5-dichloro-N-[(3S)-4,4-dichloro-3-methyl-1-oxobutyl]-N-methyl-, methyl ester, (4S)-",other linear non-peptide,Polychlorinated Leucines,C13H21Cl4NO3,494.9875363,[C@@H](N(C(C[C@@H](C(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)Cl)C)C(OC)=O,"InChI=1S/C13H21Cl4NO3/c1-7(11(14)15)5-9(13(20)21-4)18(3)10(19)6-8(2)12(16)17/h7-9,11-12H,5-6H2,1-4H3/t7-,8-,9+/m0/s1",GTDZPIKWOGYUIC-XHNCKOQMSA-N,,Yes,,,
CyanoMetDB_2630,Lissoclinamide 9,,other cyclic peptide,Cyanobactin,C35H45N7O5S2,707.2923591,O=C1N2[C@](C3=N[C@@]([C@@H](C)O3)(C(=O)N[C@@]([C@H](CC)C)(C4=N[C@@](CS4)(C(=O)N[C@H](C(C)C)C5=NC(C(=O)N[C@@H]1CC6=CC=CC=C6)=CS5)[H])[H])[H])(CCC2)[H],"InChI=1S/C35H45N7O5S2/c1-6-19(4)27-34-38-24(17-49-34)30(44)39-26(18(2)3)33-37-23(16-48-33)29(43)36-22(15-21-11-8-7-9-12-21)35(46)42-14-10-13-25(42)32-41-28(20(5)47-32)31(45)40-27/h7-9,11-12,16,18-20,22,24-28H,6,10,13-15,17H2,1-5H3,(H,36,43)(H,39,44)(H,40,45)/t19-,20+,22+,24-,25-,26+,27-,28-/m0/s1",YNBCKFJSPUOTNW-FSRPSNKUSA-N,21775935,Yes,Prochloron,sp. ,
CyanoMetDB_2631,Lissoclinamide 10,,other cyclic peptide,Cyanobactin,C36H49N7O5S2,723.3236592,O=C1N2[C@](C3=N[C@@]([C@@H](C)O3)(C(=O)N[C@@]([C@H](CC)C)(C4=N[C@@](CS4)(C(=O)N[C@@]([C@H](CC)C)(C5=N[C@](C(=O)N[C@@H]1CC6=CC=CC=C6)(CS5)[H])[H])[H])[H])[H])(CCC2)[H],"InChI=1S/C36H49N7O5S2/c1-6-19(3)27-34-38-24(17-49-34)30(44)37-23(16-22-12-9-8-10-13-22)36(47)43-15-11-14-26(43)33-42-29(21(5)48-33)32(46)41-28(20(4)7-2)35-39-25(18-50-35)31(45)40-27/h8-10,12-13,19-21,23-29H,6-7,11,14-18H2,1-5H3,(H,37,44)(H,40,45)(H,41,46)/t19-,20-,21+,23+,24-,25-,26-,27-,28-,29-/m0/s1",JMDXIJWOYKHTDI-DFZTUYHZSA-N,21775934,Yes,Prochloron,sp. ,
CyanoMetDB_2632,"2,3-Dihydrodysamide C","(-)-2,3-Dihydrodysamide C",other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2O2,542.964214,C([C@@H](C(Cl)(Cl)Cl)C)[C@H]1C(=O)N(C)\C(=C\[C@@H](C(Cl)(Cl)Cl)C)\C(=O)N1C,"InChI=1S/C14H18Cl6N2O2/c1-7(13(15,16)17)5-9-11(23)22(4)10(12(24)21(9)3)6-8(2)14(18,19)20/h5,7-8,10H,6H2,1-4H3/b9-5+/t7-,8-,10-/m0/s1",XJCMCNILUZGERI-QLRJEXERSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2633,Isodysidenin,"(+)-Isodysidenin, Isodysidenine",other linear non-peptide,Polychlorinated Leucines,C17H23Cl6N3O2S,742.3294729,C[C@H](C(Cl)(Cl)Cl)C[C@H](C(N[C@@H](C)C1=NC=CS1)=O)N(C(C[C@H](C)C(Cl)(Cl)Cl)=O)C,"InChI=1S/C17H23Cl6N3O2S/c1-9(16(18,19)20)7-12(14(28)25-11(3)15-24-5-6-29-15)26(4)13(27)8-10(2)17(21,22)23/h5-6,9-12H,7-8H2,1-4H3,(H,25,28)/t9-,10-,11-,12+/m0/s1",BFVRAKVNXYQMID-FIQHERPVSA-N,21775291,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2634,"2,3,4,5-Tetrabromo-6-(3,5-dibromo-2-hydroxyphenoxy)phenol",NSC 364753,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H4Br6O3,470.9496097,BrC=1C=C(Br)C(O)=C(OC=2C(Br)=C(Br)C(Br)=C(Br)C2O)C1,"InChI=1S/C12H4Br6O3/c13-3-1-4(14)10(19)5(2-3)21-12-9(18)7(16)6(15)8(17)11(12)20/h1-2,19-20H",OMYZFHYKAPRFFQ-UHFFFAOYSA-N,339231,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2635,"2,3,5-Tribromo-6-(3,5-dibromo-2-hydroxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H5Br5O3,513.7050457,BrC=1C=C(Br)C(O)=C(OC=2C(Br)=CC(Br)=C(Br)C2O)C1,"InChI=1S/C12H5Br5O3/c13-4-1-6(15)10(18)8(2-4)20-12-7(16)3-5(14)9(17)11(12)19/h1-3,18-19H",OBMWDTFRQJRRIM-UHFFFAOYSA-N,10348509,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2636,"2,4-Dibromo-6-(2,4-dibromophenoxy)phenol","2?-Hydroxy-2,3?,4,5?-tetrabromodiphenylether",other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H6Br4O2,469.9655942,BrC1=CC=C(OC=2C=C(Br)C=C(Br)C2O)C(Br)=C1,"InChI=1S/C12H6Br4O2/c13-6-1-2-10(8(15)3-6)18-11-5-7(14)4-9(16)12(11)17/h1-5,17H",QEPYTQFGTBSZQY-UHFFFAOYSA-N,4563,Yes,Hormoscilla ,spongeliae,"GUM020, SP4"
CyanoMetDB_2637,"3,5-Dibromo-2-(2,4-dibromophenoxy)phenol","6-Hydroxy-2,2?,4,4?-tetrabromodiphenylether",other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H6Br4O2,469.9655942,BrC1=CC=C(OC=2C(Br)=CC(Br)=CC2O)C(Br)=C1,"InChI=1S/C12H6Br4O2/c13-6-1-2-11(8(15)3-6)18-12-9(16)4-7(14)5-10(12)17/h1-5,17H",SNCQITRZEBFIRW-UHFFFAOYSA-N,3086109,Yes,Hormoscilla ,spongeliae,SP4
CyanoMetDB_2638,Lissoclinamide 5,,other cyclic peptide,Cyanobactin,C38H41N7O5S2,739.2610589,O=C1N2[C@](C3=N[C@@]([C@@H](C)O3)(C(=O)N[C@@H](C(C)C)C4=NC(=CS4)C(=O)N[C@H](CC5=CC=CC=C5)C6=NC(C(=O)N[C@H]1CC7=CC=CC=C7)=CS6)[H])(CCC2)[H],"InChI=1S/C38H41N7O5S2/c1-21(2)30-37-42-28(20-52-37)32(46)39-25(17-23-11-6-4-7-12-23)36-41-27(19-51-36)33(47)40-26(18-24-13-8-5-9-14-24)38(49)45-16-10-15-29(45)35-44-31(22(3)50-35)34(48)43-30/h4-9,11-14,19-22,25-26,29-31H,10,15-18H2,1-3H3,(H,39,46)(H,40,47)(H,43,48)/t22-,25-,26+,29+,30+,31+/m1/s1",XWRRCRXUEXAWCD-ILHVVAMWSA-N,9767978,Yes,Prochloron,sp. ,
CyanoMetDB_2639,Barbaleucamide B,,other linear non-peptide,Polychlorinated Leucines,C17H22Cl6N2O2S,707.2923591,CO/C(=C\C(=O)N(C)C(CC(C)C(Cl)(Cl)Cl)C1=NC=CS1)CC(C)C(Cl)(Cl)Cl ,"InChI=1S/C17H22Cl6N2O2S/c1-10(16(18,19)20)7-12(27-4)9-14(26)25(3)13(15-24-5-6-28-15)8-11(2)17(21,22)23/h5-6,9-11,13H,7-8H2,1-4H3/b12-9+/t10-,11-,13-/m0/s1",FAZKBTFQSATIIN-MXMUKZBDSA-N,101131158,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2640,Neodysidenin," (-)-Neodysidenin, (13S)-Neodysidenin, (13S)-Pseudodysidenin ",other linear non-peptide,Polychlorinated Leucines,C17H23Cl6N3O2S,742.3294729,C[C@H](C(Cl)(Cl)Cl)C[C@@H](C(N[C@H](C)C1=NC=CS1)=O)N(C(C[C@H](C)C(Cl)(Cl)Cl)=O)C,"InChI=1S/C17H23Cl6N3O2S/c1-9(16(18,19)20)7-12(14(28)25-11(3)15-24-5-6-29-15)26(4)13(27)8-10(2)17(21,22)23/h5-6,9-12H,7-8H2,1-4H3,(H,25,28)/t9-,10-,11+,12-/m0/s1",BFVRAKVNXYQMID-YFKTTZPYSA-N,15482063,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2641,Didmolamide A,,other cyclic peptide,Cyanobactin,C25H26N6O4S2,762.2981727,C([C@H]1C2=N[C@@]([C@@H](C)O2)(C(=O)N[C@@H](C)C3=NC(=CS3)C(=O)N[C@@H](C)C4=NC(C(=O)N1)=CS4)[H])C5=CC=CC=C5,"InChI=1S/C25H26N6O4S2/c1-12-24-30-18(11-37-24)21(33)28-16(9-15-7-5-4-6-8-15)23-31-19(14(3)35-23)22(34)27-13(2)25-29-17(10-36-25)20(32)26-12/h4-8,10-14,16,19H,9H2,1-3H3,(H,26,32)(H,27,34)(H,28,33)/t12-,13-,14+,16-,19-/m0/s1",QCYRITGWCJOIEV-MABMQTIPSA-N,10256715,Yes,Prochloron,sp. ,
CyanoMetDB_2642,Didmolamide B,,other cyclic peptide,Cyanobactin,C25H28N6O5S2,732.424419,O=C1C=2N=C(SC2)[C@H](C)NC(=O)C=3N=C(SC3)[C@H](C)NC(=O)[C@]([C@@H](C)O)(NC(=O)[C@H](CC4=CC=CC=C4)N1)[H],"InChI=1S/C25H28N6O5S2/c1-12-24-30-18(11-38-24)22(35)28-16(9-15-7-5-4-6-8-15)20(33)31-19(14(3)32)23(36)27-13(2)25-29-17(10-37-25)21(34)26-12/h4-8,10-14,16,19,32H,9H2,1-3H3,(H,26,34)(H,27,36)(H,28,35)(H,31,33)/t12-,13-,14+,16-,19-/m0/s1",ARCFFCLBNNIVPM-MABMQTIPSA-N,10257132,Yes,Prochloron,sp. ,
CyanoMetDB_2643,Ulithiacyclamide B,,other cyclic peptide,Cyanobactin,C35H40N8O6S4,962.5299468,O=C(C1=CSC([C@@H](CC2=CC=CC=C2)N3)=N1)N[C@H]4C5=N[C@@H]([C@@H](C)O5)C(C[C@H](CC(C)C)C6=NC(C(N[C@H](CSSC4)C(O[C@@H]7C)=N[C@@H]7C3=O)=O)=CS6)=O,"InChI=1S/C36H41N7O6S4/c1-17(2)10-21-12-27(44)28-18(3)48-33(42-28)25-15-52-53-16-26(39-30(45)23-13-50-35(21)40-23)34-43-29(19(4)49-34)32(47)37-22(11-20-8-6-5-7-9-20)36-41-24(14-51-36)31(46)38-25/h5-9,13-14,17-19,21-22,25-26,28-29H,10-12,15-16H2,1-4H3,(H,37,47)(H,38,46)(H,39,45)/t18-,19-,21+,22-,25-,26-,28+,29+/m1/s1",AHKVAHKKPGWMFO-BTBDCPOBSA-N,3086606,Yes,Prochloron,sp. ,
CyanoMetDB_2644,"3,6-Dibromo-2-(3,5-dibromo-2-hydroxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H6Br4O3,472.9652598,BrC=1C=C(Br)C(O)=C(OC=2C(Br)=CC=C(Br)C2O)C1,"InChI=1S/C12H6Br4O3/c13-5-3-8(16)10(17)9(4-5)19-12-7(15)2-1-6(14)11(12)18/h1-4,17-18H",SFRUBLKYXLNPMS-UHFFFAOYSA-N,16115952,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2645,"2,3,4,5-Tetrabromo-6-(3,5-dibromo-2-methoxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C13H6Br6O3,461.0265086,BrC=1C=C(Br)C(OC)=C(OC=2C(Br)=C(Br)C(Br)=C(Br)C2O)C1,"InChI=1S/C13H6Br6O3/c1-21-12-5(15)2-4(14)3-6(12)22-13-10(19)8(17)7(16)9(18)11(13)20/h2-3,20H,1H3",PIKRCPZZFYHEJP-UHFFFAOYSA-N,11978698,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2646,"2,3,5-tribromo-6-(3,5-dibromo-2-methoxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C13H7Br5O3,502.9758245,BrC=1C=C(Br)C(OC)=C(OC=2C(Br)=CC(Br)=C(Br)C2O)C1,"InChI=1S/C13H7Br5O3/c1-20-12-7(16)2-5(14)3-9(12)21-13-8(17)4-6(15)10(18)11(13)19/h2-4,19H,1H3",FNTANFZTPSDZRK-UHFFFAOYSA-N,11978697,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2647,Dysidin,Dysidine,other linear non-peptide,Polychlorinated Leucines,C16H22Cl3NO4,668.335604,C(/C=C(\C[C@@H](C(Cl)(Cl)Cl)C)/OC)(=O)N1[C@@H](C(C)C)C(OC)=CC1=O,"InChI=1S/C16H22Cl3NO4/c1-9(2)15-12(24-5)8-14(22)20(15)13(21)7-11(23-4)6-10(3)16(17,18)19/h7-10,15H,6H2,1-5H3/b11-7+/t10-,15-/m0/s1",PXUALOWHEHOKSO-SOXOQJGTSA-N,5387252,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2648,Patellin 1,Patelline 1,other cyclic peptide,Cyanobactin,C37H60N6O7S,732.424419,C(OC(C=C)(C)C)(C)C1N2C(=O)C(NC(=O)C(C(C)C)NC(=O)C(C(OC(C=C)(C)C)C)NC(=O)C3(N=C(C(CC(C)C)NC1=O)SC3)[H])(CCC2)[H],"InChI=1S/C37H60N6O7S/c1-13-36(9,10)49-22(7)28-32(46)41-27(21(5)6)31(45)38-24-16-15-17-43(35(24)48)29(23(8)50-37(11,12)14-2)33(47)39-25(18-20(3)4)34-40-26(19-51-34)30(44)42-28/h13-14,20-29H,1-2,15-19H2,3-12H3,(H,38,45)(H,39,47)(H,41,46)(H,42,44)",MCFCYSXAWNYYIF-UHFFFAOYSA-N,15780823,Yes,Prochloron,sp. ,
CyanoMetDB_2649,Patellin 2,,other cyclic peptide,Cyanobactin,C37H60N6O7S,732.424419,O=C1N[C@@H]([C@@H](C)OC(C)(C)C=C)C(N[C@@H](C(C)C)C(N2CCC[C@H]2C(N[C@@H]([C@H](C)OC(C)(C)C=C)C(N[C@@H](CC(C)C)C3=N[C@@H]1CS3)=O)=O)=O)=O,"InChI=1S/C37H60N6O7S/c1-13-36(9,10)49-22(7)28-32(46)38-24(18-20(3)4)34-39-25(19-51-34)30(44)41-29(23(8)50-37(11,12)14-2)33(47)40-27(21(5)6)35(48)43-17-15-16-26(43)31(45)42-28/h13-14,20-29H,1-2,15-19H2,3-12H3,(H,38,46)(H,40,47)(H,41,44)(H,42,45)",PXBQBGADJRIZRZ-PTEVIDPCSA-N,"	24762149",Yes,Prochloron,sp. ,
CyanoMetDB_2650,Trunkamide A,,other cyclic peptide,Cyanobactin,C43H63N7O8S,837.4458828,C([C@@H]1C2=N[C@@](CS2)(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@@H](COC(C=C)(C)C)C(=O)N[C@@]([C@H](CC)C)(C(=O)N[C@@H](C)C(=O)N3[C@](C(=O)N1)(CCC3)[H])[H])[H])[H])C4=CC=CC=C4,"InChI=1S/C43H63N7O8S/c1-11-25(4)33-38(54)44-26(5)41(56)50-21-17-20-32(50)37(53)45-29(22-28-18-15-14-16-19-28)40-47-31(24-59-40)36(52)49-34(27(6)58-43(9,10)13-3)39(55)46-30(35(51)48-33)23-57-42(7,8)12-2/h12-16,18-19,25-27,29-34H,2-3,11,17,20-24H2,1,4-10H3,(H,44,54)(H,45,53)(H,46,55)(H,48,51)(H,49,52)/t25-,26-,27+,29+,30-,31-,32-,33-,34-/m0/s1",UTERRJKSLJLXTA-RZZCCKHXSA-N,9811230,Yes,Prochloron,sp. ,
CyanoMetDB_2651,Patellin 4,,other cyclic peptide,Cyanobactin,C47H76N8O9S,928.5455968,O=C1N2C(C(=O)NC(C(C)C)C(=O)N3C(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)NC(C(C)C)C4=NC(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)NC1CC(C)C)[H])(CS4)[H])[H])(CCC3)[H])(CCC2)[H],"InChI=1S/C47H76N8O9S/c1-15-46(11,12)63-28(9)36-41(59)48-30(23-25(3)4)44(61)54-21-17-19-32(54)39(57)51-35(27(7)8)45(62)55-22-18-20-33(55)40(58)53-37(29(10)64-47(13,14)16-2)42(60)50-34(26(5)6)43-49-31(24-65-43)38(56)52-36/h15-16,25-37H,1-2,17-24H2,3-14H3,(H,48,59)(H,50,60)(H,51,57)(H,52,56)(H,53,58)/t28-,29-,30?,31?,32?,33?,34?,35?,36+,37+/m1/s1",DAWDGQIAMZWWEL-ZDUWFZFDSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2652,Patellin 3,,other cyclic peptide,Cyanobactin,C48H78N8O9S,942.561249,O=C1N2[C@](C(=O)N[C@@H]([C@H](C)C)C(=O)N3[C@](C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@@H](CC(C)C)C4=N[C@](C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@H]1CC(C)C)[H])(CS4)[H])[H])(CCC3)[H])(CCC2)[H],"InChI=1S/C48H78N8O9S/c1-15-47(11,12)64-29(9)37-43(61)50-32(24-27(5)6)45(62)55-21-17-19-34(55)40(58)52-36(28(7)8)46(63)56-22-18-20-35(56)41(59)54-38(30(10)65-48(13,14)16-2)42(60)49-31(23-26(3)4)44-51-33(25-66-44)39(57)53-37/h15-16,26-38H,1-2,17-25H2,3-14H3,(H,49,60)(H,50,61)(H,52,58)(H,53,57)(H,54,59)/t29-,30-,31+,32+,33+,34+,35+,36+,37+,38+/m1/s1",FOCOTNVJSJLTEU-LYJDWRRBSA-N,24762150,Yes,Prochloron,sp. ,
CyanoMetDB_2653,Patellin 5,,other cyclic peptide,Cyanobactin,C49H72N8O9S,948.5142967,C([C@H]1C2=N[C@@](CS2)(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@@H]([C@@H](C)C)C(=O)N3[C@](C(=O)N[C@@H]([C@H](C)C)C(=O)N4[C@](C(=O)N[C@@H](COC(C=C)(C)C)C(=O)N1)(CCC4)[H])(CCC3)[H])[H])[H])C5=CC=CC=C5,"InChI=1S/C49H72N8O9S/c1-12-48(8,9)65-26-33-40(58)50-32(25-31-19-15-14-16-20-31)45-52-34(27-67-45)41(59)55-39(30(7)66-49(10,11)13-2)44(62)54-38(29(5)6)47(64)57-24-18-22-36(57)43(61)53-37(28(3)4)46(63)56-23-17-21-35(56)42(60)51-33/h12-16,19-20,28-30,32-39H,1-2,17-18,21-27H2,3-11H3,(H,50,58)(H,51,60)(H,53,61)(H,54,62)(H,55,59)/t30-,32+,33+,34+,35+,36+,37+,38+,39+/m1/s1",WZIREJOXXYJFCS-HQVOSAFNSA-N,15780827,Yes,Prochloron,sp. ,
CyanoMetDB_2654,Patellin 6,,other cyclic peptide,Cyanobactin,C50H74N8O9S,962.5299468,O=C1N2[C@](C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@@H]([C@H](C)C)C3=N[C@@](CS3)(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N5[C@](C(=O)N[C@H]1[C@H](C)C)(CCC5)[H])[H])[H])[H])(CCC2)[H],"InChI=1S/C50H74N8O9S/c1-13-49(9,10)66-30(7)39-44(62)51-33(26-32-20-16-15-17-21-32)47(64)57-24-18-22-35(57)42(60)54-38(29(5)6)48(65)58-25-19-23-36(58)43(61)56-40(31(8)67-50(11,12)14-2)45(63)53-37(28(3)4)46-52-34(27-68-46)41(59)55-39/h13-17,20-21,28-31,33-40H,1-2,18-19,22-27H2,3-12H3,(H,51,62)(H,53,63)(H,54,60)(H,55,59)(H,56,61)/t30-,31-,33+,34+,35+,36+,37+,38+,39+,40+/m1/s1",YDNNIZIPQWRRKH-OUJDMZAPSA-N,10350938,Yes,Prochloron,sp. ,
CyanoMetDB_2655,Ascidiacyclamide,,other cyclic peptide,Cyanobactin,C36H52N8O6S2,756.3451229,[C@@H](CC)(C)[C@]1(C2=N[C@@]([C@@H](C)O2)(C(=O)N[C@H]([C@H](C)C)C3=NC(=CS3)C(=O)N[C@@]([C@H](CC)C)(C4=N[C@](C(=O)N[C@H]([C@H](C)C)C5=NC(C(=O)N1)=CS5)([C@@H](C)O4)[H])[H])[H])[H],"InChI=1S/C36H52N8O6S2/c1-11-17(7)25-33-43-27(19(9)49-33)31(47)39-24(16(5)6)36-38-22(14-52-36)30(46)42-26(18(8)12-2)34-44-28(20(10)50-34)32(48)40-23(15(3)4)35-37-21(13-51-35)29(45)41-25/h13-20,23-28H,11-12H2,1-10H3,(H,39,47)(H,40,48)(H,41,45)(H,42,46)/t17-,18-,19+,20+,23+,24+,25-,26-,27-,28-/m0/s1",QBRRPBPLIGDANJ-AXCFFLBZSA-N,163527,Yes,Prochloron,sp. ,
CyanoMetDB_2656,Patellamide F,,other cyclic peptide,Cyanobactin,C37H46N8O6S2,762.2981727,O=C1NC(C2=NC(C(=O)NC(C3=NC(=CS3)C(=O)NC(C4=NC(C(=O)NC(C5=NC1=CS5)C(C)C)C(O4)C)C(C)C)CC=6C=CC=CC6)CO2)C(C)C,"InChI=1S/C37H46N8O6S2/c1-17(2)26-34-39-23(14-50-34)30(46)38-22(13-21-11-9-8-10-12-21)36-40-24(15-52-36)31(47)43-27(18(3)4)35-45-29(20(7)51-35)33(49)44-28(19(5)6)37-41-25(16-53-37)32(48)42-26/h8-12,15-20,22-23,26-29H,13-14H2,1-7H3,(H,38,46)(H,42,48)(H,43,47)(H,44,49)",DIJMIACMPAVWLR-UHFFFAOYSA-N,157454,Yes,Prochloron,sp. ,
CyanoMetDB_2657,"3,4,5-tribromo-2-(3,5-dibromo-2-hydroxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C12H5Br5O3,591.61555,BrC=1C=C(Br)C(O)=C(OC2=C(Br)C(Br)=C(Br)C=C2O)C1,"InChI=1S/C12H5Br5O3/c13-4-1-6(15)11(19)8(2-4)20-12-7(18)3-5(14)9(16)10(12)17/h1-3,18-19H",WMMMSBGZKIDZDQ-UHFFFAOYSA-N,11801671,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2658,"3,4,5-tribromo-2-(3,5-dibromo-2-methoxyphenoxy)phenol",,other linear non-peptide,Polybrominated diphenyl ethers (PBDEs),C13H7Br5O3,605.6312,BrC=1C=C(Br)C(OC)=C(OC2=C(Br)C(Br)=C(Br)C=C2O)C1,"InChI=1S/C13H7Br5O3/c1-20-12-7(16)2-5(14)3-9(12)21-13-8(19)4-6(15)10(17)11(13)18/h2-4,19H,1H3",LWXUPDPSLGLZAL-UHFFFAOYSA-N,23246249,Yes,Hormoscilla ,spongeliae,GUM202
CyanoMetDB_2659,Dysideathiazole,"(-)-Dysideathiazole; (2S,5S,7S)-Dysideathiazole",other linear non-peptide,Polychlorinated Leucines,C13H16Cl6N2OS,457.911453,[C@@H](C[C@@H](C(Cl)(Cl)Cl)C)(NC(C[C@@H](C(Cl)(Cl)Cl)C)=O)C1=NC=CS1,"InChI=1S/C13H16Cl6N2OS/c1-7(12(14,15)16)5-9(11-20-3-4-23-11)21-10(22)6-8(2)13(17,18)19/h3-4,7-9H,5-6H2,1-2H3,(H,21,22)/t7-,8-,9-/m0/s1",LPYBRIPPTDYUEU-CIUDSAMLSA-N,101657548,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2660,10-Dechlorodysideathiazole,(-)-10-Dechlorodysideathiazole,other linear non-peptide,Polychlorinated Leucines,C13H17Cl5N2OS,423.950424,[C@@H](C[C@@H](C(Cl)(Cl)Cl)C)(NC(C[C@@H](C(Cl)Cl)C)=O)C1=NC=CS1,"InChI=1S/C13H17Cl5N2OS/c1-7(11(14)15)5-10(21)20-9(12-19-3-4-22-12)6-8(2)13(16,17)18/h3-4,7-9,11H,5-6H2,1-2H3,(H,20,21)/t7-,8-,9-/m0/s1",UITZQFPPPVQMTF-CIUDSAMLSA-N,101657396,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2661,N-methyldysideathiazole,(-)-N-Methyldysideathiazole,other linear non-peptide,Polychlorinated Leucines,C14H18Cl6N2OS,471.927101,[C@H](N(C(C[C@@H](C(Cl)(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)(Cl)Cl)C)C1=NC=CS1,"InChI=1S/C14H18Cl6N2OS/c1-8(13(15,16)17)6-10(12-21-4-5-24-12)22(3)11(23)7-9(2)14(18,19)20/h4-5,8-10H,6-7H2,1-3H3/t8-,9-,10-/m0/s1",JECCGIIKQAYOFQ-GUBZILKMSA-N,101657549,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2662,10-Dechloro-N-methyldysideathiazole,(-)-10-Dechloro-N-methyldysideathiazole,other linear non-peptide,Polychlorinated Leucines,C14H19Cl5N2OS,437.966075,[C@H](N(C(C[C@@H](C(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)(Cl)Cl)C)C1=NC=CS1,"InChI=1S/C14H19Cl5N2OS/c1-8(12(15)16)6-11(22)21(3)10(13-20-4-5-23-13)7-9(2)14(17,18)19/h4-5,8-10,12H,6-7H2,1-3H3/t8-,9-,10-/m0/s1",PVPMFKJSAWTERQ-GUBZILKMSA-N,362172,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2663,"9,10-didechloro-N-methyldysideathiazole","(-)-9,10-Didechloro-N-methyldysideathiazole",other linear non-peptide,Polychlorinated Leucines,C14H20Cl4N2OS,404.005047,[C@H](N(C(C[C@@H](C(Cl)Cl)C)=O)C)(C[C@@H](C(Cl)Cl)C)C1=NC=CS1,"InChI=1S/C14H20Cl4N2OS/c1-8(12(15)16)6-10(14-19-4-5-22-14)20(3)11(21)7-9(2)13(17)18/h4-5,8-10,12-13H,6-7H2,1-3H3/t8-,9-,10-/m0/s1",JRFXZSKOZMIYDX-GUBZILKMSA-N,,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2664,Dysideapyrrolidone,"(+)-Dysideapyrrolidone; (2S,5S,7S,15S)-Dysideapyrrolidone",other linear non-peptide,Polychlorinated Leucines,C17H22Cl6N2O4,527.971076,C([C@H](NC(C[C@H](C(Cl)(Cl)Cl)C)=O)C[C@H](C(Cl)(Cl)Cl)C)(=O)N1[C@@H](C)C(OC)=CC1=O,"InChI=1S/C17H22Cl6N2O4/c1-8(16(18,19)20)5-11(24-13(26)6-9(2)17(21,22)23)15(28)25-10(3)12(29-4)7-14(25)27/h7-11H,5-6H2,1-4H3,(H,24,26)/t8-,9-,10+,11-/m1/s1",RVHNPGVMQFYYJY-CHWFTXMASA-N,101657550,Yes,Hormoscilla ,spongeliae,
CyanoMetDB_2665,Preulicyclamide,,other cyclic peptide,Cyanobactin,C33H41N7O6S2,695.255977,O=C1NC(C2=NC(=CS2)C(=O)NC(C(=O)N3CCCC3C(=O)NC(C(=O)NC(C4=NC1=CS4)C(C)CC)C(O)C)CC=5C=CC=CC5)C,"InChI=1S/C33H41N7O6S2/c1-5-17(2)25-32-37-22(16-48-32)27(42)34-18(3)31-36-23(15-47-31)28(43)35-21(14-20-10-7-6-8-11-20)33(46)40-13-9-12-24(40)29(44)39-26(19(4)41)30(45)38-25/h6-8,10-11,15-19,21,24-26,41H,5,9,12-14H2,1-4H3,(H,34,42)(H,35,43)(H,38,45)(H,39,44)",SPMIHOQDFUDWEE-UHFFFAOYSA-N,13818197,Yes,Prochloron,sp. ,
CyanoMetDB_2666,Prelissoclinamide 2,,other cyclic peptide,Cyanobactin,C33H43N7O6S2,697.271627,O=C1NC(C(=O)N2CCCC2C(=O)NC(C(=O)NC(C3=NC(C(=O)NC(C4=NC1=CS4)C)CS3)C(C)CC)C(O)C)CC=5C=CC=CC5,"InChI=1S/C33H43N7O6S2/c1-5-17(2)25-32-37-22(16-48-32)27(42)34-18(3)31-36-23(15-47-31)28(43)35-21(14-20-10-7-6-8-11-20)33(46)40-13-9-12-24(40)29(44)39-26(19(4)41)30(45)38-25/h6-8,10-11,15,17-19,21-22,24-26,41H,5,9,12-14,16H2,1-4H3,(H,34,42)(H,35,43)(H,38,45)(H,39,44)",PBVGQOXVBWQTTN-UHFFFAOYSA-N,102077357,Yes,Prochloron,sp. ,
CyanoMetDB_2667,Prepatellamide-B-formate,,other cyclic peptide,Cyanobactin,C39H50N8O8S2,822.3193021,O=COC(C)C1NC(=O)C(NC(=O)C=2N=C(SC2)C(NC(=O)C3N=C(OC3C)C(NC(=O)C=4N=C(SC4)C(NC1=O)CC=5C=CC=CC5)CC(C)C)C)C(C)CC,"InChI=1S/C39H50N8O8S2/c1-8-20(4)29-34(51)46-30(22(6)54-18-48)36(53)42-26(15-24-12-10-9-11-13-24)39-44-27(17-57-39)32(49)41-25(14-19(2)3)37-47-31(23(7)55-37)35(52)40-21(5)38-43-28(16-56-38)33(50)45-29/h9-13,16-23,25-26,29-31H,8,14-15H2,1-7H3,(H,40,52)(H,41,49)(H,42,53)(H,45,50)(H,46,51)",AYONPOKGXKLEQQ-UHFFFAOYSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2668,Lissoclinamide 7,,other cyclic peptide,Cyanobactin,C38H45N7O5S2,743.2923591,O=C1N2[C@](C3=N[C@@]([C@@H](C)O3)(C(=O)N[C@H]([C@@H](C)C)C4=N[C@@](CS4)(C(=O)N[C@H](CC5=CC=CC=C5)C6=N[C@](C(=O)N[C@H]1CC7=CC=CC=C7)(CS6)[H])[H])[H])(CCC2)[H],"InChI=1S/C38H45N7O5S2/c1-21(2)30-37-42-28(20-52-37)32(46)39-25(17-23-11-6-4-7-12-23)36-41-27(19-51-36)33(47)40-26(18-24-13-8-5-9-14-24)38(49)45-16-10-15-29(45)35-44-31(22(3)50-35)34(48)43-30/h4-9,11-14,21-22,25-31H,10,15-20H2,1-3H3,(H,39,46)(H,40,47)(H,43,48)/t22-,25-,26+,27+,28+,29+,30-,31+/m1/s1",RBBBWKUBQVARPL-SWQMWMPHSA-N,390558,Yes,Prochloron,sp. ,
CyanoMetDB_2669,Mollamide A,Mollamide,other cyclic peptide,Cyanobactin,C42H61N7O7S,807.4353181,O=C1N2[C@](C3=N[C@@](CS3)(C(=O)N[C@@]([C@H](CC)C)(C(=O)N4[C@](C(=O)N[C@@]([C@H](CC)C)(C(=O)N[C@@H](COC(C=C)(C)C)C(=O)N[C@H]1CC5=CC=CC=C5)[H])(CCC4)[H])[H])[H])(CCC2)[H],"InChI=1S/C42H61N7O7S/c1-8-25(4)33-38(53)44-29(23-56-42(6,7)10-3)35(50)43-28(22-27-16-12-11-13-17-27)40(54)49-21-15-19-32(49)39-45-30(24-57-39)36(51)47-34(26(5)9-2)41(55)48-20-14-18-31(48)37(52)46-33/h10-13,16-17,25-26,28-34H,3,8-9,14-15,18-24H2,1-2,4-7H3,(H,43,50)(H,44,53)(H,46,52)(H,47,51)/t25-,26-,28-,29-,30-,31-,32-,33-,34-/m0/s1",WOJHPNQVQSSJML-RYWOMTJGSA-N,15484996,Yes,Prochloron,sp. ,
CyanoMetDB_2670,Mayotamides B,,other cyclic peptide,Cyanobactin,C29H41N7O4S4,679.210291,O=C1N2[C@](C3=N[C@@](CS3)(C(=O)N[C@@H]([C@H](C)C)C4=NC(=CS4)C(=O)N[C@@H](CCSC)C5=N[C@](C(=O)N[C@H]1[C@H](C)C)(CS5)[H])[H])(CCC2)[H],"InChI=1S/C29H41N7O4S4/c1-14(2)21-28-33-17(13-44-28)23(37)30-16(8-10-41-5)26-31-18(11-42-26)25(39)35-22(15(3)4)29(40)36-9-6-7-20(36)27-32-19(12-43-27)24(38)34-21/h13-16,18-22H,6-12H2,1-5H3,(H,30,37)(H,34,38)(H,35,39)/t16-,18-,19-,20-,21-,22-/m0/s1",GALKRPSQRJNMSL-PLOPKLDOSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2671,Mayotamides A,,other cyclic peptide,Cyanobactin,C30H43N7O4S4,693.225941,O=C1N2[C@](C3=N[C@@](CS3)(C(=O)N[C@@]([C@H](CC)C)(C4=NC(=CS4)C(=O)N[C@@H](CCSC)C5=N[C@](C(=O)N[C@H]1[C@@H](C)C)(CS5)[H])[H])[H])(CCC2)[H],"InChI=1S/C30H43N7O4S4/c1-6-16(4)23-29-34-18(14-45-29)24(38)31-17(9-11-42-5)27-32-19(12-43-27)25(39)35-22(15(2)3)30(41)37-10-7-8-21(37)28-33-20(13-44-28)26(40)36-23/h14-17,19-23H,6-13H2,1-5H3,(H,31,38)(H,35,39)(H,36,40)/t16-,17-,19-,20-,21-,22-,23-/m0/s1",LSEYSXPYKIZRFF-CQETUWSJSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2672,Comoramide A,,other cyclic peptide,Cyanobactin,C34H48N6O6S,668.3356045,C([C@H]1C2=N[C@@](C(C)O2)(C(=O)N[C@@H](C)C3=N[C@](C(=O)N[C@@]([C@H](CC)C)(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N1)[H])[H])(CS3)[H])[H])C4=CC=CC=C4,"InChI=1S/C34H48N6O6S/c1-9-18(3)25-29(42)39-27(21(6)46-34(7,8)10-2)31(44)36-23(16-22-14-12-11-13-15-22)32-40-26(20(5)45-32)30(43)35-19(4)33-37-24(17-47-33)28(41)38-25/h10-15,18-21,23-27H,2,9,16-17H2,1,3-8H3,(H,35,43)(H,36,44)(H,38,41)(H,39,42)/t18-,19-,20?,21+,23-,24-,25-,26-,27-/m0/s1",RLQCQEZPODOOLK-LBHGNGPQSA-N,100916129,Yes,Prochloron,sp. ,
CyanoMetDB_2673,Comoramide B,,other cyclic peptide,Cyanobactin,C34H50N6O7S,686.346171,C([C@@H]1NC(=O)[C@]([C@H](OC(C=C)(C)C)C)(NC(=O)[C@]([C@H](CC)C)(NC(=O)[C@]2(N=C([C@H](C)NC(=O)[C@]([C@@H](C)O)(NC1=O)[H])SC2)[H])[H])[H])C3=CC=CC=C3,"InChI=1S/C34H50N6O7S/c1-9-18(3)25-30(44)40-27(21(6)47-34(7,8)10-2)32(46)36-23(16-22-14-12-11-13-15-22)28(42)39-26(20(5)41)31(45)35-19(4)33-37-24(17-48-33)29(43)38-25/h10-15,18-21,23-27,41H,2,9,16-17H2,1,3-8H3,(H,35,45)(H,36,46)(H,38,43)(H,39,42)(H,40,44)/t18-,19-,20+,21+,23-,24-,25-,26-,27-/m0/s1",AQGAZMKCGCSEOJ-VKMXIDDTSA-N,100916130,Yes,Prochloron,sp. ,
CyanoMetDB_2674,Nairaiamide A,,other cyclic peptide,Cyanobactin,C42H71N7O8,801.5364123,O=C1N2[C@](C(=O)N[C@@]([C@H](CC)C)(C(=O)N[C@@]([C@H](CC)C)(C(=O)N3[C@](C(=O)N[C@@H](C(C)C)C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@]1([C@H](CC)C)[H])[H])(CCC3)[H])[H])[H])(CCC2)[H],"InChI=1S/C42H71N7O8/c1-13-24(7)31-38(53)45-32(25(8)14-2)40(55)48-21-17-19-28(48)35(50)43-30(23(5)6)37(52)47-34(27(10)57-42(11,12)16-4)39(54)46-33(26(9)15-3)41(56)49-22-18-20-29(49)36(51)44-31/h16,23-34H,4,13-15,17-22H2,1-3,5-12H3,(H,43,50)(H,44,51)(H,45,53)(H,46,54)(H,47,52)/t24-,25-,26-,27+,28-,29-,30-,31-,32-,33-,34-/m0/s1",VQSXQFYRJRZCOR-UOHRRUQPSA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2675,Nairaiamide B,,other cyclic peptide,Cyanobactin,C43H73N7O8,815.5520624,O=C1N2[C@](C(=O)N[C@@]([C@H](CC)C)(C(=O)N[C@@]([C@H](CC)C)(C(=O)N3[C@](C(=O)N[C@@]([C@H](CC)C)(C(=O)N[C@@]([C@H](OC(C=C)(C)C)C)(C(=O)N[C@]1([C@H](CC)C)[H])[H])[H])(CCC3)[H])[H])[H])(CCC2)[H],"InChI=1S/C43H73N7O8/c1-13-24(6)31-38(53)46-33(26(8)15-3)41(56)49-22-18-21-30(49)37(52)45-32(25(7)14-2)39(54)48-35(28(10)58-43(11,12)17-5)40(55)47-34(27(9)16-4)42(57)50-23-19-20-29(50)36(51)44-31/h17,24-35H,5,13-16,18-23H2,1-4,6-12H3,(H,44,51)(H,45,52)(H,46,53)(H,47,55)(H,48,54)/t24-,25-,26-,27-,28+,29-,30-,31-,32-,33-,34-,35-/m0/s1",RIMDKZLFKQEDBI-GUWSJQKESA-N,,Yes,Prochloron,sp. ,
CyanoMetDB_2676,Dysamide U,,other linear non-peptide,Polychlorinated Leucines,C14H21Cl3N2O2,354.066862,C(\[C@@H](C(Cl)Cl)C)=C/1\C(=O)N(C)[C@@H](C[C@@H](CCl)C)C(=O)N1C,"InChI=1S/C14H21Cl3N2O2/c1-8(7-15)5-10-13(20)19(4)11(14(21)18(10)3)6-9(2)12(16)17/h6,8-10,12H,5,7H2,1-4H3/b11-6+/t8-,9-,10-/m0/s1",GKYGSNSRYKQYTK-LZEFRMTCSA-N,,Yes,,,
CyanoMetDB_2677,Chlorodysinosin A,,Aeruginosin,Aeruginosin,C26H43ClN6O10S,666.2449905,C([C@H](NC([C@@H](COS(=O)(=O)O)OC)=O)[C@@H](C(C)C)Cl)(=O)N1[C@@]2([C@](C[C@H]1C(NCCC=3CN(C(=N)N)CC3)=O)(C[C@H](O)[C@@H](O)C2)[H])[H],"InChI=1S/C26H43ClN6O10S/c1-13(2)21(27)22(31-24(37)20(42-3)12-43-44(39,40)41)25(38)33-16-10-19(35)18(34)9-15(16)8-17(33)23(36)30-6-4-14-5-7-32(11-14)26(28)29/h5,13,15-22,34-35H,4,6-12H2,1-3H3,(H3,28,29)(H,30,36)(H,31,37)(H,39,40,41)/t15-,16+,17+,18+,19+,20-,21-,22-/m1/s1",BVKDJAALSHFQTE-WNZJUFNWSA-N,16079152,no,Hormoscilla ,spongeliae,
CyanoMetDB_2678,Divamide C,,other cyclic peptide,,C88H137N22O30S3,2077.90331,CC[C@H](C)[C@H]1C(=O)N[C@H]2CS[C@H]([C@@H]3C(=O)N[C@H]4CS[C@H]([C@H](C(=O)N[C@H](C(=O)N1)C(C)C)NC(=O)[C@@H](NC(=O)[C@@H]5CCCN5C(=O)CNC(=O)[C@@H](NC(=O)[C@H](CNCCCC[C@H](NC(=O)[C@@H]([C@@H](SC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3)CO)CCC(=O)N)NC(=O)[C@H](CCC(=O)O)[N+](C)(C)C)C)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC2=O)[C@H](C(=O)O)O)[C@@H](C)O)C(=O)O)NC4=O)CC6=CC=C(C=C6)O)C(C)C)C)C,"InChI=1S/C88H136N22O30S3/c1-14-40(6)63-82(132)99-54-37-143-42(8)65-85(135)100-53-36-142-44(10)67(86(136)103-62(39(4)5)80(130)104-63)106-81(131)61(38(2)3)102-77(127)55-19-17-29-109(55)59(116)33-92-70(120)49(30-45-20-22-46(113)23-21-45)95-72(122)50(96-75(53)125)31-90-28-16-15-18-48(87(137)138)94-84(134)66(107-83(133)64(41(7)112)101-58(115)32-91-79(129)68(108-76(54)126)69(119)88(139)140)43(9)141-35-52(98-78(128)56(110(11,12)13)25-27-60(117)118)74(124)93-47(24-26-57(89)114)71(121)97-51(34-111)73(123)105-65/h20-23,38-44,47-56,61-69,90,111-112,119H,14-19,24-37H2,1-13H3,(H23-,89,91,92,93,94,95,96,97,98,99,100,101,102,103,104,105,106,107,108,113,114,115,117,118,120,121,122,123,124,125,126,127,128,129,130,131,132,133,134,135,136,137,138,139,140)/p+1/t40-,41+,42-,43-,44-,47-,48-,49-,50-,51-,52-,53-,54-,55-,56-,61-,62-,63-,64-,65+,66+,67+,68-,69+/m0/s1",HIYRPUQPBJGCCJ-MEIDKZPTSA-O,131801645,no,Prochloron,sp. ,
CyanoMetDB_2679,Anabaenopeptin AP806Ne,AP806Ne,Anabaenopeptin,,C41H58N8O9,806.4326755,O=C(NC(C(NC(CCC1=CC=CC=C1)C(NC2CC(N)=O)=O)=O)CC(C)C)C(CCCCNC(C(NC2=O)CC3=CC=CC=C3)=O)NC(NC(C(C)C)C(O)=O)=O,"InChI=1S/C41H58N8O9/c1-24(2)21-30-38(54)44-29(19-18-26-13-7-5-8-14-26)37(53)47-32(23-33(42)50)39(55)46-31(22-27-15-9-6-10-16-27)35(51)43-20-12-11-17-28(36(52)45-30)48-41(58)49-34(25(3)4)40(56)57/h5-10,13-16,24-25,28-32,34H,11-12,17-23H2,1-4H3,(H2,42,50)(H,43,51)(H,44,54)(H,45,52)(H,46,55)(H,47,53)(H,56,57)(H2,48,49,58)",DFDHIAXMGANISG-UHFFFAOYSA-N,,no,Nostoc,edaphicum,CCNP1411
CyanoMetDB_2680,Anabaenopeptin AP836Ne,AP836Ne,Anabaenopeptin,,C42H60N8O10,836.4432402,O=C(NC(C(NC(CCC1=CC=C(O)C=C1)C(N(C)C2CC(N)=O)=O)=O)CC(C)C)C(CCCCNC(C(NC2=O)CC3=CC=CC=C3)=O)NC(NC(C(C)C)C(O)=O)=O,"InChI=1S/C42H60N8O10/c1-24(2)21-31-38(55)45-30(19-16-26-14-17-28(51)18-15-26)40(57)50(5)33(23-34(43)52)39(56)47-32(22-27-11-7-6-8-12-27)36(53)44-20-10-9-13-29(37(54)46-31)48-42(60)49-35(25(3)4)41(58)59/h6-8,11-12,14-15,17-18,24-25,29-33,35,51H,9-10,13,16,19-23H2,1-5H3,(H2,43,52)(H,44,53)(H,45,55)(H,46,54)(H,47,56)(H,58,59)(H2,48,49,60)",XANITXOBWUJUPG-UHFFFAOYSA-N,,no,Nostoc,edaphicum,CCNP1413
CyanoMetDB_2681,Anabaenopeptin AP820Ne,AP820Ne,Anabaenopeptin,,C42H60N8O9,820.4483256,O=C(NC(C(NC(CCC1=CC=CC=C1)C(N(C)C2CC(N)=O)=O)=O)CC(C)C)C(CCCCNC(C(NC2=O)CC3=CC=CC=C3)=O)NC(NC(C(C)C)C(O)=O)=O,"InChI=1S/C42H60N8O9/c1-25(2)22-31-38(54)45-30(20-19-27-14-8-6-9-15-27)40(56)50(5)33(24-34(43)51)39(55)47-32(23-28-16-10-7-11-17-28)36(52)44-21-13-12-18-29(37(53)46-31)48-42(59)49-35(26(3)4)41(57)58/h6-11,14-17,25-26,29-33,35H,12-13,18-24H2,1-5H3,(H2,43,51)(H,44,52)(H,45,54)(H,46,53)(H,47,55)(H,57,58)(H2,48,49,59)",KXULYPSIHVLGGX-UHFFFAOYSA-N,,no,Nostoc,edaphicum,CCNP1412
CyanoMetDB_2682,Pseudanabaena galeata peptide 638,PG638,other linear peptide,,C28H46N8O7S,638.3210166,NC(NCCCC(NC(C(NC(CNC(C(CC1=CC=CC=C1)NC(C(N)CC(C)C)=O)=O)=O)CCS(C)=O)=O)C(O)=O)=N,"InChI=1S/C28H46N8O7S/c1-17(2)14-19(29)24(38)36-22(15-18-8-5-4-6-9-18)25(39)33-16-23(37)34-20(11-13-44(3)43)26(40)35-21(27(41)42)10-7-12-32-28(30)31/h4-6,8-9,17,19-22H,7,10-16,29H2,1-3H3,(H,33,39)(H,34,37)(H,35,40)(H,36,38)(H,41,42)(H4,30,31,32)",DWVSIQJXCNITJA-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2683,Galeapeptin GP598,GP598,other linear peptide,,C29H54N6O7,598.4053981,OC(C(C)NC(C(NC(C(C(C)C)NC(C(NC(C(CC(C)C)NC(C(C)N)=O)=O)CC(C)C)=O)=O)CC(C)C)=O)=O,"InChI=1S/C29H54N6O7/c1-14(2)11-20(25(37)31-19(10)29(41)42)34-28(40)23(17(7)8)35-27(39)22(13-16(5)6)33-26(38)21(12-15(3)4)32-24(36)18(9)30/h14-23H,11-13,30H2,1-10H3,(H,31,37)(H,32,36)(H,33,38)(H,34,40)(H,35,39)(H,41,42)",SJYMORTVOOWODL-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2684,Pseudanabaena galeata peptide 709,PG709,other linear peptide,,C31H51N9O8S,709.3581304,NC(NCCCC(NC(C(NC(CNC(C(CC1=CC=CC=C1)NC(C(NC(C(CO)N)=O)CC(C)C)=O)=O)=O)CCS(C)=O)=O)C(O)=O)=N,"InChI=1S/C31H51N9O9S/c1-18(2)14-23(39-26(43)20(32)17-41)29(46)40-24(15-19-8-5-4-6-9-19)27(44)36-16-25(42)37-21(11-13-50(3)49)28(45)38-22(30(47)48)10-7-12-35-31(33)34/h4-6,8-9,18,20-24,41H,7,10-17,32H2,1-3H3,(H,36,44)(H,37,42)(H,38,45)(H,39,43)(H,40,46)(H,47,48)(H4,33,34,35)",FMRVXNNVRNEJEG-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2685,Pseudanabaena galeata peptide 725,PG725,other linear peptide,,C31H51N9O9S,725.353045,NC(NCCCC(C(O)=O)NC(C(CCSC)NC(CNC(C(NC(C(CC(C)C)NC(C(N)CO)=O)=O)CC1=CC=CC=C1)=O)=O)=O)=N,"InChI=1S/C31H51N9O8S/c1-18(2)14-23(39-26(43)20(32)17-41)29(46)40-24(15-19-8-5-4-6-9-19)27(44)36-16-25(42)37-21(11-13-49-3)28(45)38-22(30(47)48)10-7-12-35-31(33)34/h4-6,8-9,18,20-24,41H,7,10-17,32H2,1-3H3,(H,36,44)(H,37,42)(H,38,45)(H,39,43)(H,40,46)(H,47,48)(H4,33,34,35)",HNXOOQJRISFLIX-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1314
CyanoMetDB_2686,Galeapeptin GP655,GP655,other linear peptide,,C31H57N7O8,655.4268619,CC(NC(C(CC(C)C)NC(C(NC(C(CC(C)C)NC(C(NC(C(N)C)=O)CC(C)C)=O)=O)C(C)C)=O)=O)C(NCC(O)=O)=O,"InChI=1S/C31H57N7O8/c1-15(2)11-21(28(43)34-20(10)27(42)33-14-24(39)40)37-31(46)25(18(7)8)38-30(45)23(13-17(5)6)36-29(44)22(12-16(3)4)35-26(41)19(9)32/h15-23,25H,11-14,32H2,1-10H3,(H,33,42)(H,34,43)(H,35,41)(H,36,44)(H,37,46)(H,38,45)(H,39,40)",GBPFVGPPJZLIEH-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2687,Galeapeptin GP715,GP715,other linear peptide,,C36H57N7O8,715.4268619,CC(C)C(NC(C(N)C)=O)C(NC(C(C)C)C(NC(CC1=CC=CC=C1)C(NC(CC(C)C)C(N2CCCC2C(NC(C)C(O)=O)=O)=O)=O)=O)=O,"InChI=1S/C36H57N7O8/c1-19(2)17-26(35(49)43-16-12-15-27(43)32(46)38-23(8)36(50)51)40-31(45)25(18-24-13-10-9-11-14-24)39-33(47)28(20(3)4)42-34(48)29(21(5)6)41-30(44)22(7)37/h9-11,13-14,19-23,25-29H,12,15-18,37H2,1-8H3,(H,38,46)(H,39,47)(H,40,45)(H,41,44)(H,42,48)(H,50,51)",BUTSMIULCXQVHR-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2688,Galeapeptin GP729,GP729,other linear peptide,,C37H59N7O8,729.4425119,CC(C(N1CCCC1C(NC(C(NC(C(NC(C(NC(CC(C)C)C(NC(C(O)=O)C)=O)=O)CC2=CC=CC=C2)=O)CC(C)C)=O)C(C)C)=O)=O)N,"InChI=1S/C37H59N7O8/c1-20(2)17-26(31(45)39-24(8)37(51)52)40-33(47)28(19-25-13-10-9-11-14-25)41-32(46)27(18-21(3)4)42-35(49)30(22(5)6)43-34(48)29-15-12-16-44(29)36(50)23(7)38/h9-11,13-14,20-24,26-30H,12,15-19,38H2,1-8H3,(H,39,45)(H,40,47)(H,41,46)(H,42,49)(H,43,48)(H,51,52)",MNDVCLHXEUOUAG-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2689,Galeapeptin GP767,GP767,other linear peptide,,C39H57N7O9,767.4217765,CC(NC(C(N)CC1=CC=C(C=C1)O)=O)C(NC(C)C(NC(CC2=CC=CC=C2)C(NC(CC(C)C)C(NC(C(NC(C)C(O)=O)=O)CC(C)C)=O)=O)=O)=O,"InChI=1S/C39H57N7O9/c1-21(2)17-30(36(51)43-25(7)39(54)55)45-37(52)31(18-22(3)4)46-38(53)32(20-26-11-9-8-10-12-26)44-34(49)24(6)41-33(48)23(5)42-35(50)29(40)19-27-13-15-28(47)16-14-27/h8-16,21-25,29-32,47H,17-20,40H2,1-7H3,(H,41,48)(H,42,50)(H,43,51)(H,44,49)(H,45,52)(H,46,53)(H,54,55)",LSQKNRHPSZKHIH-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2690,Galeapeptin GP795,GP795,other linear peptide,,C39H70N8O9,794.5265759,CC(C)C(NC(C(N)C)=O)C(NC(C(C)C)C(NC(C(NC(CC(C)C)C(N1CCCC1C(NC(CC(C)C)C(NC(C(O)=O)C)=O)=O)=O)=O)CC(C)C)=O)=O,"InChI=1S/C39H70N8O9/c1-19(2)16-26(33(49)41-25(12)39(55)56)42-35(51)29-14-13-15-47(29)38(54)28(18-21(5)6)44-34(50)27(17-20(3)4)43-36(52)30(22(7)8)46-37(53)31(23(9)10)45-32(48)24(11)40/h19-31H,13-18,40H2,1-12H3,(H,41,49)(H,42,51)(H,43,52)(H,44,50)(H,45,48)(H,46,53)(H,55,56)",JQOYSJNAVGXVIT-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2691,Galeapeptin GP818,GP818,other linear peptide,,C40H66N8O10,818.4901904,OC(C(C(NC(C(NC(C(C)C)C(NC(C(NC(C(NC(C(NC(C)C(O)=O)=O)C(C)C)=O)C(C)C)=O)CC1=CC=CC=C1)=O)=O)CC(C)C)=O)NC(C(C)N)=O)C,"InChI=1S/C40H66N8O10/c1-19(2)17-27(43-39(56)32(25(11)49)48-33(50)23(9)41)34(51)45-30(21(5)6)37(54)44-28(18-26-15-13-12-14-16-26)35(52)46-31(22(7)8)38(55)47-29(20(3)4)36(53)42-24(10)40(57)58/h12-16,19-25,27-32,49H,17-18,41H2,1-11H3,(H,42,53)(H,43,56)(H,44,54)(H,45,51)(H,46,52)(H,47,55)(H,48,50)(H,57,58)",KZIDNLOVZMPQGT-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2692,Galeapeptin GP828,GP828,other linear peptide,,C42H68N8O9,828.5109258,NC(C)C(NC(C(NC(C(NC(C(C)C)C(NC(C(NC(C(N1CCCC1C(NC(C(O)=O)C)=O)=O)CC2=CC=CC=C2)=O)CC(C)C)=O)=O)C(C)C)=O)CC(C)C)=O,"InChI=1S/C42H68N8O9/c1-22(2)19-29(36(52)47-31(21-28-15-12-11-13-16-28)41(57)50-18-14-17-32(50)38(54)44-27(10)42(58)59)46-39(55)33(24(5)6)49-40(56)34(25(7)8)48-37(53)30(20-23(3)4)45-35(51)26(9)43/h11-13,15-16,22-27,29-34H,14,17-21,43H2,1-10H3,(H,44,54)(H,45,51)(H,46,55)(H,47,52)(H,48,53)(H,49,56)(H,58,59)",MTYSRRFOIRFBQA-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1313
CyanoMetDB_2693,Galeapeptin GP998,GP998,other linear peptide,,C51H83N9O11,997.6212046,OC(C(NC(C(CC(C)C)NC(C(NC(C(NC(C(NC(C(NC(C(NC(C(N1C(CCC1)C(NC(C(C)C)=O)=O)C(C)C)=O)CC(C)C)=O)C)=O)CC2=CC=CC=C2)=O)C(C)C)=O)C(C)C)=O)=O)C)=O,"InChI=1S/C51H83N9O11/c1-26(2)23-35(45(64)53-33(14)51(70)71)55-48(67)39(28(5)6)58-49(68)40(29(7)8)57-46(65)37(25-34-19-16-15-17-20-34)54-43(62)32(13)52-44(63)36(24-27(3)4)56-50(69)41(30(9)10)60-22-18-21-38(60)47(66)59-42(61)31(11)12/h15-17,19-20,26-33,35-41H,18,21-25H2,1-14H3,(H,52,63)(H,53,64)(H,54,62)(H,55,67)(H,56,69)(H,57,65)(H,58,68)(H,70,71)(H,59,61,66)",RGGXLNKDXBSUQY-UHFFFAOYSA-N,,no,Pseudanabaena,galeata,CCNP1314
CyanoMetDB_2694,Molassamide,,Cyanopeptolin,,C48H66N8O13,962.4749343,OC1=CC=C(C[C@@H](N(C([C@H](N2[C@@H](O)CC[C@@H](NC(/C(NC3=O)=C/C)=O)C2=O)CC4=CC=CC=C4)=O)C)C(N[C@H](C(C)C)C(OC(C3NC([C@H](NC(C(NC(CCC)=O)C)=O)C(O)C)=O)C)=O)=O)C=C1,"InChI=1S/C48H66N8O13/c1-9-14-36(59)49-26(5)41(61)53-39(27(6)57)44(64)54-40-28(7)69-48(68)38(25(3)4)52-43(63)34(23-30-17-19-31(58)20-18-30)55(8)47(67)35(24-29-15-12-11-13-16-29)56-37(60)22-21-33(46(56)66)51-42(62)32(10-2)50-45(40)65/h10-13,15-20,25-28,33-35,37-40,57-58,60H,9,14,21-24H2,1-8H3,(H,49,59)(H,50,65)(H,51,62)(H,52,63)(H,53,61)(H,54,64)/b32-10-",KXSGCAPYMUMVSH-TWEUXXNYSA-N,,no,Leptolyngbya,sp.,DRTO-73
CyanoMetDB_2695,Kyanamide,,Cyanopeptolin,,C52H73N9O11,999.5429542,CCCCCC(N[C@@H](CCC(N)=O)C(N[C@@H]([C@H](OC([C@H](C(C)C)NC1=O)=O)C)C(N[C@@H](CC(C)C)C(N[C@H]2CC[C@@H](O)N([C@H](C(N(C)[C@H]1CC3=CNC4=C3C=CC=C4)=O)CC5=CC=CC=C5)C2=O)=O)=O)=O)=O,"InChI=1S/C52H73N9O11/c1-8-9-11-20-42(63)55-36(21-23-41(53)62)46(65)59-45-31(6)72-52(71)44(30(4)5)58-48(67)39(27-33-28-54-35-19-15-14-18-34(33)35)60(7)51(70)40(26-32-16-12-10-13-17-32)61-43(64)24-22-37(50(61)69)56-47(66)38(25-29(2)3)57-49(45)68/h10,12-19,28-31,36-40,43-45,54,64H,8-9,11,20-27H2,1-7H3,(H2,53,62)(H,55,63)(H,56,66)(H,57,68)(H,58,67)(H,59,65)/t31-,36+,37+,38+,39+,40+,43-,44+,45+/m1/s1",JVVDUOFFWLHVFE-NUOSYCILSA-N,,no,Caldora,penicillata,
CyanoMetDB_2696,Crocapeptin A1,,Cyanopeptolin,,C47H66N8O12,934.4800196,OC1=CC=C(C[C@@H](C(N[C@H](C(O2)=O)C(C)C)=O)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](NC(C([H])C[H])=O)CCC(N)=O)=O)[C@H]2C)=O)=O)C4=O)=O)C=C1,"InChI=1S/C47H66N8O12/c1-8-37(58)49-31(18-20-36(48)57)41(60)53-40-27(6)67-47(66)39(26(4)5)52-43(62)34(23-29-14-16-30(56)17-15-29)54(7)46(65)35(24-28-12-10-9-11-13-28)55-38(59)21-19-32(45(55)64)50-42(61)33(22-25(2)3)51-44(40)63/h9-17,25-27,31-35,38-40,56,59H,8,18-24H2,1-7H3,(H2,48,57)(H,49,58)(H,50,61)(H,51,63)(H,52,62)(H,53,60)/t27-,31+,32+,33+,34+,35+,38-,39+,40+/m1/s1",PYSMPQHECFDBOG-LLNGCRLTSA-N,,no,Chondromyces,crocatus,Cm c5
CyanoMetDB_2697,Precrocapeptin A2,,Cyanopeptolin,,C48H68N8O11,932.5007551,OC1=CC=C(C=C1)C[C@H](N(C([C@@H](NC([C@H](CCC2)N2C([C@@H](N3)CC(C)C)=O)=O)CC4=CC=CC=C4)=O)C)C(N[C@@H](C(C)C)C(O[C@H](C)[C@H](NC(C(CCC(N)=O)NC(C(C)C)=O)=O)C3=O)=O)=O,"InChI=1S/C48H68N8O11/c1-26(2)23-34-47(65)56-22-12-15-36(56)43(61)51-35(24-30-13-10-9-11-14-30)46(64)55(8)37(25-31-16-18-32(57)19-17-31)44(62)53-39(27(3)4)48(66)67-29(7)40(45(63)52-34)54-42(60)33(20-21-38(49)58)50-41(59)28(5)6/h9-11,13-14,16-19,26-29,33-37,39-40,57H,12,15,20-25H2,1-8H3,(H2,49,58)(H,50,59)(H,51,61)(H,52,63)(H,53,62)(H,54,60)/t29-,33?,34+,35+,36+,37+,39+,40+/m1/s1",LDMRMYQAHKZFAA-NFQAEIQHSA-N,,no,Chondromyces,crocatus,Cm c5
CyanoMetDB_2698,Crocapeptin A2,,Cyanopeptolin,,C48H68N8O12,948.4956697,OC1=CC=C(C[C@@H](C(N[C@H](C(O2)=O)C(C)C)=O)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](NC(C(C)C[H])=O)CCC(N)=O)=O)[C@H]2C)=O)=O)C4=O)=O)C=C1,"InChI=1S/C48H68N8O12/c1-25(2)22-34-43(62)51-33-19-21-38(59)56(46(33)65)36(24-29-12-10-9-11-13-29)47(66)55(8)35(23-30-14-16-31(57)17-15-30)44(63)53-39(26(3)4)48(67)68-28(7)40(45(64)52-34)54-42(61)32(18-20-37(49)58)50-41(60)27(5)6/h9-17,25-28,32-36,38-40,57,59H,18-24H2,1-8H3,(H2,49,58)(H,50,60)(H,51,62)(H,52,64)(H,53,63)(H,54,61)/t28-,32+,33+,34+,35+,36+,38-,39+,40+/m1/s1",QXZJIRDWOWKJFT-PMLDSXJZSA-N,,no,Chondromyces,crocatus,Cm c5
CyanoMetDB_2699,Crocapeptin A3,,Cyanopeptolin,,C49H70N8O12,962.5113198,OC1=CC=C(C[C@@H](C(N[C@H](C(O2)=O)C(C)C)=O)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](NC(C(C)CC)=O)CCC(N)=O)=O)[C@H]2C)=O)=O)C4=O)=O)C=C1,"InChI=1S/C49H70N8O12/c1-9-28(6)42(61)51-33(19-21-38(50)59)43(62)55-41-29(7)69-49(68)40(27(4)5)54-45(64)36(24-31-15-17-32(58)18-16-31)56(8)48(67)37(25-30-13-11-10-12-14-30)57-39(60)22-20-34(47(57)66)52-44(63)35(23-26(2)3)53-46(41)65/h10-18,26-29,33-37,39-41,58,60H,9,19-25H2,1-8H3,(H2,50,59)(H,51,61)(H,52,63)(H,53,65)(H,54,64)(H,55,62)/t28?,29-,33+,34+,35+,36+,37+,39-,40+,41+/m1/s1",FWWRDJAVEXRNBT-YONRGIGPSA-N,,no,Chondromyces,crocatus,Cm c5
CyanoMetDB_2700,Crocapeptin B,,Cyanopeptolin,,C50H73N9O12,991.5378689,OC1=CC=C(C[C@@H](C(N[C@H](C(O2)=O)CC(C)C)=O)N(C)C([C@H](CC3=CC=CC=C3)N4[C@H](O)CC[C@H](NC([C@H](CC(C)C)NC([C@@H](NC([C@@H](NC(C(C)C)=O)CCCNC(N)=O)=O)[C@H]2C)=O)=O)C4=O)=O)C=C1,"InChI=1S/C50H73N9O12/c1-27(2)23-36-44(64)54-35-20-21-40(61)59(47(35)67)39(26-31-13-10-9-11-14-31)48(68)58(8)38(25-32-16-18-33(60)19-17-32)45(65)56-37(24-28(3)4)49(69)71-30(7)41(46(66)55-36)57-43(63)34(53-42(62)29(5)6)15-12-22-52-50(51)70/h9-11,13-14,16-19,27-30,34-41,60-61H,12,15,20-26H2,1-8H3,(H,53,62)(H,54,64)(H,55,66)(H,56,65)(H,57,63)(H3,51,52,70)/t30-,34+,35+,36+,37+,38+,39+,40-,41+/m1/s1",HRDFOOGKRCDMOI-KFSITIDNSA-N,,no,Chondromyces,crocatus,Cm c5
CyanoMetDB_2701,Nostocyclopeptide Ncp-E4-L,Ncp-E4-L,other linear peptide,Nostocyclopeptide,C31H47N7O10,677.3384408,OC1=CC=C(CC(N)C(NCC(NC(CCC(N)=O)C(NC(C(CC)C)C(NC(CO)C(N2CCC(C)C2C(O)=O)=O)=O)=O)=O)=O)C=C1,"InChI=1S/C31H47N7O10/c1-4-16(2)25(29(45)36-22(15-39)30(46)38-12-11-17(3)26(38)31(47)48)37-28(44)21(9-10-23(33)41)35-24(42)14-34-27(43)20(32)13-18-5-7-19(40)8-6-18/h5-8,16-17,20-22,25-26,39-40H,4,9-15,32H2,1-3H3,(H2,33,41)(H,34,43)(H,35,42)(H,36,45)(H,37,44)(H,47,48)",YNQWIFGWOJAPAP-UHFFFAOYSA-N,,no,Nostoc,edaphicum,CCNP1413
CyanoMetDB_2702,Nostocyclopeptide Ncp-A1-L,Ncp-A1-L,other linear peptide,Nostocyclopeptide,C37H58N8O10,774.4275901,OC1=CC=C(CC(N)C(NCC(NC(CCC(N)=O)C(NC(C(CC)C)C(NC(CO)C(N2CCC(C)C2C(NC(C([H])=O)CC(C)C)=O)=O)=O)=O)=O)=O)C=C1,"InChI=1S/C37H58N8O10/c1-6-21(4)31(35(53)43-28(19-47)37(55)45-14-13-22(5)32(45)36(54)41-24(18-46)15-20(2)3)44-34(52)27(11-12-29(39)49)42-30(50)17-40-33(51)26(38)16-23-7-9-25(48)10-8-23/h7-10,18,20-22,24,26-28,31-32,47-48H,6,11-17,19,38H2,1-5H3,(H2,39,49)(H,40,51)(H,41,54)(H,42,50)(H,43,53)(H,44,52)",XKLDOLLFURDFQY-UHFFFAOYSA-N,,no,Nostoc,edaphicum,CCNP1411
CyanoMetDB_2703,Nostocyclopeptide Ncp-A2-L,Ncp-A2-L,other linear peptide,Nostocyclopeptide,C40H56N8O10,808.4119401,OC1=CC=C(CC(N)C(NCC(NC(C(NC(C(NC(C(N2CC(C)CC2C(NC(CC3=CC=CC=C3)C=O)=O)=O)CO)=O)C(CC)C)=O)CCC(N)=O)=O)=O)C=C1,"InChI=1S/C40H56N8O10/c1-4-24(3)35(47-37(55)30(14-15-33(42)52)45-34(53)19-43-36(54)29(41)18-26-10-12-28(51)13-11-26)39(57)46-31(22-50)40(58)48-20-23(2)16-32(48)38(56)44-27(21-49)17-25-8-6-5-7-9-25/h5-13,21,23-24,27,29-32,35,50-51H,4,14-20,22,41H2,1-3H3,(H2,42,52)(H,43,54)(H,44,56)(H,45,53)(H,46,57)(H,47,55)",FSGOVWIXUVQFFP-UHFFFAOYSA-N,,no,Nostoc,edaphicum,CCNP1412