Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:06:08 UTC
Update Date2025-03-21 22:09:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00499928
Frequency3.4
Structure
Chemical FormulaC4H6O4
Molecular Mass118.0266
SMILESCOC=C(O)C(=O)O
InChI KeyOXKDYSHTZHKLKR-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
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid
  • organic oxygen compound
  • vinylogous ester
  • hydrocarbon derivative
  • carboxylic acid derivative
  • organooxygen compound