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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:50 UTC
Update Date2025-03-25 00:53:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02203138
Frequency0.5
Structure
Chemical FormulaC20H16O6
Molecular Mass352.0947
SMILESO=C1CC(c2ccc(O)cc2)OC2=C1C(=O)CC(c1ccc(O)cc1)O2
InChI KeyRPZUFRPJUXUZKT-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
  • benzene and substituted derivatives
  • dihydropyranones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
  • vinylogous esters
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • dihydropyranone
  • vinylogous ester
  • 1-hydroxy-2-unsubstituted benzenoid
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyran
  • pyranone
  • phenol
  • linear 1,7-diphenylheptane skeleton
  • hydrocarbon derivative
  • benzenoid
  • organoheterocyclic compound
  • organooxygen compound