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Record Information
HMDB Statusdetected
Creation Date2024-02-20 23:43:31 UTC
Update Date2025-03-21 17:59:47 UTC
HMDB IDHMDB0253637
Metabolite Identification
DeepMet IDDMID00023172
NameIsoflavone
Frequency170.0
Structure
Chemical FormulaC15H10O2
Molecular Mass222.0681
SMILESO=c1c(-c2ccccc2)coc2ccccc12
InChI KeyGOMNOOKGLZYEJT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classisoflavonoids
Subclass isoflav-2-enes
Direct Parent isoflavones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • chromones
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • isoflavonoids
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
  • Substituents
  • isoflavone
  • monocyclic benzene moiety
  • benzopyran
  • 1-benzopyran
  • heteroaromatic compound
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • chromone
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • hydrocarbon derivative
  • benzenoid
  • organoheterocyclic compound
  • organooxygen compound