Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:19 UTC
Update Date2025-03-25 00:48:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02167762
Frequency0.5
Structure
Chemical FormulaC10H18O3
Molecular Mass186.1256
SMILESCC(C)OC(=O)CCC(=O)C(C)C
InChI KeyOSVFDSHIQZAIGK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass gamma-keto acids and derivatives
Direct Parent gamma-keto acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • ketones
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • gamma-keto acid
  • ketone
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound