Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:09:35 UTC
Update Date2025-03-24 16:41:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00937485
Frequency1.5
Structure
Chemical FormulaC4H6O3
Molecular Mass102.0317
SMILESCOC(=O)C=CO
InChI KeyFVYNPFNRUNVROH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous acids
Subclass vinylogous acids
Direct Parent vinylogous acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • enoate esters
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • enoate ester
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • alpha,beta-unsaturated carboxylic ester
  • vinylogous acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound