Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:49 UTC
Update Date2025-03-25 00:51:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189506
Frequency0.5
Structure
Chemical FormulaC23H36O3
Molecular Mass360.2664
SMILESCC(CCC(=O)O)C1CCC2C3=C(CCC21C)C1(C)CCC(O)CC1C3
InChI KeyQMIADWZYCHJKCR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass sesquiterpenoids
Direct Parent sesquiterpenoids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • carbocyclic fatty acids
  • carbonyl compounds
  • carboxylic acids
  • cyclic alcohols and derivatives
  • fatty acyls
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • methyl-branched fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • Substituents
  • alcohol
  • fatty acyl
  • carbocyclic fatty acid
  • carbonyl group
  • carboxylic acid
  • methyl-branched fatty acid
  • short-chain hydroxy acid
  • cyclic alcohol
  • carboxylic acid derivative
  • branched fatty acid
  • aliphatic homopolycyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • sesquiterpenoid
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organooxygen compound