Published May 12, 2020 | Version v1
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Rapid identification of xanthine oxidase-inhibiting component compounds from alfalfa extract by enzyme-interacting dereplication of UPLC-ESI-MS/MS profiling and molecular docking

Creators

  • 1. Department of Food Science, National Chiayi University, Chiayi City, Taiwan
  • 2. Natural Products Laboratory, Institute of Biology Leiden, Leiden University
  • 3. School of Pharmacy, Taipei Medical University, Taipei City, Taiwan

Description

Table S1. The residues located in the active site of 1N5X, which make the most important H-bond and hydrophobic interactions in screening nine potent compounds.

Figure S1. (A) UPLC-G2-QTOF/MS chromatogram of alfalfa crude extract. (B) apigenin as the standard.(C) MS/MS fragmentations of apigenin.

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