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Record Information
HMDB Statuspredicted
Creation Date2024-02-21 00:24:07 UTC
Update Date2025-03-21 18:38:20 UTC
HMDB IDHMDB0141068
Metabolite Identification
DeepMet IDDMID00120240
Name(1E)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)hept-1-ene-3,5-dione
Frequency21.6
Structure
Chemical FormulaC19H18O5
Molecular Mass326.1154
SMILESO=C(C=Cc1ccc(O)c(O)c1)CC(=O)CCc1ccc(O)cc1
InChI KeyZGXQKVJJBRIYTA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classdiarylheptanoids
Subclass linear diarylheptanoids
Direct Parent linear diarylheptanoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acryloyl compounds
  • benzene and substituted derivatives
  • enones
  • hydrocarbon derivatives
  • hydroxycinnamic acids
  • ketones
  • organic oxides
    • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • alpha,beta-unsaturated ketone
  • hydroxycinnamic acid or derivatives
  • hydroxycinnamic acid
  • ketone
  • aromatic homomonocyclic compound
  • cinnamic acid or derivatives
  • organic oxide
  • organic oxygen compound
  • linear 1,7-diphenylheptane skeleton
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • acryloyl-group
  • organooxygen compound
  • enone