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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:59 UTC
Update Date2025-03-25 00:58:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02233252
Frequency0.5
Structure
Chemical FormulaC22H14O7
Molecular Mass390.074
SMILESO=c1cc(-c2ccc(O)c(O)c2)oc2ccc(-c3ccc(O)cc3)c(O)c(=O)c12
InChI KeyFOKCVGQBKFZSEP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classdiarylheptanoids
Subclass linear diarylheptanoids
Direct Parent linear diarylheptanoids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • cycloheptapyrans
  • heteroaromatic compounds
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • pyranones and derivatives
  • tropolones
    • Substituents
  • monocyclic benzene moiety
  • tropone
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • cycloheptapyran
  • tropolone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • phenol
  • linear 1,7-diphenylheptane skeleton
  • hydrocarbon derivative
  • benzenoid
  • organoheterocyclic compound
  • organooxygen compound