Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:35 UTC
Update Date2025-03-21 18:02:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00039887
Frequency86.9
Structure
Chemical FormulaC7H10O4
Molecular Mass158.0579
SMILESCC(=O)CCC(=O)OC(C)=O
InChI KeyLRPWJIMNGGZCPX-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 anhydrides
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • gamma-keto acid
  • ketone
  • organic oxide
  • organic oxygen compound
  • carboxylic acid anhydride
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound