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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:28 UTC
Update Date2025-03-21 18:41:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00135101
Frequency18.6
Structure
Chemical FormulaC15H11NO3
Molecular Mass253.0739
SMILESNc1cccc2c(=O)c(-c3ccc(O)cc3)coc12
InChI KeyKGYLCORFJSSFHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classisoflavonoids
Subclass isoflav-2-enes
Direct Parent isoflavones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • chromones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • isoflavonoids
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary amines
  • pyranones and derivatives
  • Substituents
  • monocyclic benzene moiety
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • organic oxide
  • chromone
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • pyranone
  • organopnictogen compound
  • organoheterocyclic compound
  • isoflavone
  • benzopyran
  • heteroaromatic compound
  • oxacycle
  • organic oxygen compound
  • pyran
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound