Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:26:19 UTC
Update Date2025-03-21 20:55:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00405283
Frequency4.5
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESC=C(CO)C(=O)OC
InChI KeyRFUCOAQWQVDBEU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • carbonyl compounds
  • enoate esters
  • hydrocarbon derivatives
  • methyl esters
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • enoate ester
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid derivative
  • alpha,beta-unsaturated carboxylic ester
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • methyl ester
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organooxygen compound