Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:02 UTC
Update Date2025-03-25 00:50:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180872
Frequency0.5
Structure
Chemical FormulaC11H16O3
Molecular Mass196.1099
SMILESO=C(O)CCC(=O)C1CC2CCC1C2
InChI KeyFCIUQBGPESDWCH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent bicyclic monoterpenoids
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • carbocyclic fatty acids
  • carboxylic acids
  • fatty acyls
  • gamma-keto acids and derivatives
  • hydrocarbon derivatives
  • ketones
  • monocarboxylic acids and derivatives
  • organic oxides
  • short-chain keto acids and derivatives
  • Substituents
  • fatty acyl
  • carbocyclic fatty acid
  • carbonyl group
  • carboxylic acid
  • short-chain keto acid
  • carboxylic acid derivative
  • gamma-keto acid
  • aliphatic homopolycyclic compound
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • keto acid
  • hydrocarbon derivative
  • bicyclic monoterpenoid
  • organooxygen compound