Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:37 UTC
Update Date2025-03-21 17:57:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00005276
Frequency1019.8
Structure
Chemical FormulaC17H24O3
Molecular Mass276.1725
SMILESCCCCC(CC)COC(=O)C=Cc1ccc(O)cc1
InChI KeyDAFFYDOASOLDQY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamic acids and derivatives
Subclass hydroxycinnamic acids and derivatives
Direct Parent hydroxycinnamic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • carbonyl compounds
  • enoate esters
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • enoate ester
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • hydroxycinnamic acid
  • aromatic homomonocyclic compound
  • alpha,beta-unsaturated carboxylic ester
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound