Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:01:30 UTC
Update Date2025-03-21 22:04:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00488718
Frequency3.5
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESCCOC(=O)C=CO
InChI KeyNINSPLAPBBAHEW-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
  • 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
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound