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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:13 UTC
Update Date2025-03-25 00:57:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227081
Frequency0.5
Structure
Chemical FormulaC15H22O3
Molecular Mass250.1569
SMILESCC(C)c1ccc(C(O)CCCCC(=O)O)cc1
InChI KeyHEJRMTWZXSRPQL-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
  • carbocyclic fatty acids
  • carbonyl compounds
  • carboxylic acids
  • cumenes
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • medium-chain fatty acids
  • medium-chain hydroxy acids and derivatives
  • monocarboxylic acids and derivatives
  • monocyclic monoterpenoids
  • organic oxides
  • phenylpropanes
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • fatty acyl
  • carbocyclic fatty acid
  • monocyclic benzene moiety
  • carbonyl group
  • monocyclic monoterpenoid
  • carboxylic acid
  • fatty acid
  • p-cymene
  • carboxylic acid derivative
  • medium-chain hydroxy acid
  • phenylpropane
  • organic oxide
  • cumene
  • medium-chain fatty acid
  • hydroxy fatty acid
  • alcohol
  • aromatic homomonocyclic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound
  • aromatic monoterpenoid