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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:15 UTC
Update Date2025-03-25 00:59:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02236162
Frequency0.5
Structure
Chemical FormulaC17H16O4
Molecular Mass284.1049
SMILESCOc1ccc(C(CC(=O)O)C(=O)c2ccccc2)cc1
InChI KeyALGACEJWIFKKTJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classstilbenes
Subclass stilbenes
Direct Parent stilbenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • alkyl-phenylketones
  • anisoles
  • aryl alkyl ketones
  • benzoyl derivatives
  • butyrophenones
  • carboxylic acids
  • gamma-keto acids and derivatives
  • hydrocarbon derivatives
  • methoxybenzenes
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenoxy compounds
  • phenylpropanoic acids
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • aryl alkyl ketone
  • 3-phenylpropanoic-acid
  • benzoyl
  • alkyl aryl ether
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • methoxybenzene
  • phenylketone
  • gamma-keto acid
  • butyrophenone
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • anisole
  • keto acid
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • alkyl-phenylketone
  • organooxygen compound
  • aryl ketone
  • stilbene