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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:36 UTC
Update Date2025-03-21 18:36:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00109394
Frequency24.4
Structure
Chemical FormulaC17H16O4
Molecular Mass284.1049
SMILESCOc1ccc(C2COc3ccc(OC)cc3C2=O)cc1
InChI KeyFEDGJGYFFPAYOM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classisoflavonoids
Subclass o-methylated isoflavonoids
Direct Parent 4'-o-methylated isoflavonoids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 6-o-methylated isoflavonoids
  • alkyl aryl ethers
  • anisoles
  • aryl alkyl ketones
  • chromones
  • hydrocarbon derivatives
  • isoflavanols
  • isoflavanones
  • methoxybenzenes
  • organic oxides
  • oxacyclic compounds
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • aryl alkyl ketone
  • 1-benzopyran
  • isoflavanol
  • alkyl aryl ether
  • isoflavanone
  • ketone
  • organic oxide
  • chromone
  • aromatic heteropolycyclic compound
  • chromane
  • organoheterocyclic compound
  • 4p-methoxyisoflavonoid
  • isoflavan
  • benzopyran
  • methoxybenzene
  • oxacycle
  • 6-methoxyisoflavonoid-skeleton
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound
  • aryl ketone