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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:54 UTC
Update Date2025-03-25 00:56:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02221936
Frequency0.5
Structure
Chemical FormulaC15H10O7
Molecular Mass302.0427
SMILESO=c1oc2cc(O)c(O)cc2cc1-c1cc(O)c(O)c(O)c1
InChI KeyLTNDMGZDVULDIW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classisoflavonoids
Subclass isoflav-3-enes
Direct Parent isoflav-3-enones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-benzopyrans
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • 6,7-dihydroxycoumarins
  • 7-hydroxycoumarins
  • benzene and substituted derivatives
  • coumarins and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • isoflavonoids
  • lactones
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
  • pyrogallols and derivatives
    • Substituents
  • monocyclic benzene moiety
  • 1-benzopyran
  • 1-hydroxy-2-unsubstituted benzenoid
  • isoflav-3-enone skeleton
  • lactone
  • organic oxide
  • aromatic heteropolycyclic compound
  • pyranone
  • organoheterocyclic compound
  • benzopyran
  • pyrogallol derivative
  • 7-hydroxycoumarin
  • benzenetriol
  • heteroaromatic compound
  • 6,7-dihydroxycoumarin
  • 1-hydroxy-4-unsubstituted benzenoid
  • coumarin
  • oxacycle
  • organic oxygen compound
  • pyran
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound