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Record Information
HMDB Statuspredicted
Creation Date2024-02-20 23:33:48 UTC
Update Date2025-03-21 17:56:23 UTC
HMDB IDHMDB0125103
Metabolite Identification
DeepMet IDDMID00000983
Name3-(3-methoxyphenyl)prop-2-enoic acid
Frequency5839.1
Structure
Chemical FormulaC10H10O3
Molecular Mass178.063
SMILESCOc1cccc(C=CC(=O)O)c1
InChI KeyLZPNXAULYJPXEH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamic acids and derivatives
Subclass cinnamic acids and derivatives
Direct Parent cinnamic acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • methoxybenzenes
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • carboxylic acid
  • alkyl aryl ether
  • carboxylic acid derivative
  • methoxybenzene
  • aromatic homomonocyclic compound
  • cinnamic acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • phenoxy compound
  • organooxygen compound