Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:53:44 UTC
Update Date2025-03-21 22:00:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00470426
Frequency3.7
Structure
Chemical FormulaC5H6O4
Molecular Mass130.0266
SMILESCOC=C(C=O)C(=O)O
InChI KeyWDUOSHYKBBHPNV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous esters
Subclass vinylogous esters
Direct Parent vinylogous esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • short-chain aldehydes
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • short-chain aldehyde
  • carboxylic acid
  • vinylogous ester
  • aldehyde
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound