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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:21 UTC
Update Date2025-03-25 00:49:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177039
Frequency0.5
Structure
Chemical FormulaC18H18O4
Molecular Mass298.1205
SMILESCC(C(=O)O)c1ccc(C(=O)CCc2cccc(O)c2)cc1
InChI KeyWXOQNINVTIMIPB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classlinear 1,3-diarylpropanoids
Subclass chalcones and dihydrochalcones
Direct Parent retro-dihydrochalcones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl-phenylketones
  • aromatic monoterpenoids
  • aryl alkyl ketones
  • benzoyl derivatives
  • butyrophenones
  • carboxylic acids
  • cinnamylphenols
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • phenylpropanoic acids
    • Substituents
  • monoterpenoid
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • aryl alkyl ketone
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • cinnamylphenol
  • retro-dihydrochalcone
  • p-cymene
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • 2-phenylpropanoic-acid
  • 1-hydroxy-4-unsubstituted benzenoid
  • phenylketone
  • butyrophenone
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • alkyl-phenylketone
  • organooxygen compound
  • aromatic monoterpenoid
  • aryl ketone