Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:02 UTC
Update Date2025-03-21 17:58:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00013259
Frequency338.4
Structure
Chemical FormulaC17H24O3
Molecular Mass276.1725
SMILESCC(C)(C)c1cc(C=CC(=O)O)cc(C(C)(C)C)c1O
InChI KeyCTYWXRDQWMRIIM-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
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • phenols
  • phenylpropanes
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • hydroxycinnamic acid
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound