Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:13 UTC
Update Date2025-03-21 18:33:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00096124
Frequency28.8
Structure
Chemical FormulaC14H20O3
Molecular Mass236.1412
SMILESCCC(C(=O)O)c1ccc(C(O)C(C)C)cc1
InChI KeyQKOGQBZPYMUBPV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent aromatic monoterpenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • phenylpropanes
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • p-cymene
  • carboxylic acid derivative
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aromatic monoterpenoid