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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:56 UTC
Update Date2025-03-25 00:46:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02157869
Frequency0.5
Structure
Chemical FormulaC16H10O7
Molecular Mass314.0427
SMILESO=C(O)c1c(-c2ccc(O)cc2)c2c(O)cc(O)cc2oc1=O
InChI KeyRCKMNEZUUMKTML-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classneoflavonoids
Subclass neoflavones
Direct Parent neoflavones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • 1-carboxy-2-haloaromatic compounds
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 7-hydroxycoumarins
  • benzene and substituted derivatives
  • coumarins and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactones
  • monocarboxylic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
    • Substituents
  • monocyclic benzene moiety
  • carboxylic acid
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • lactone
  • organic oxide
  • aromatic heteropolycyclic compound
  • pyranone
  • 1-carboxy-2-haloaromatic compound
  • organoheterocyclic compound
  • benzopyran
  • 7-hydroxycoumarin
  • 4-phenylcoumarin
  • heteroaromatic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • coumarin
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • pyran
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound