Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:14:00 UTC
Update Date2025-03-24 16:44:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00947879
Frequency1.5
Structure
Chemical FormulaC3H3O3-
Molecular Mass87.0088
SMILESC=COC(=O)[O-]
InChI KeyFXPHJTKVWZVEGA-UHFFFAOYSA-M
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic carbonic acids and derivatives
Subclass carbonic acid monoesters
Direct Parent carbonic acid monoesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • enol esters
  • hydrocarbon derivatives
  • organic anions
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • organic anion
  • carbonic acid monoester
  • organic oxygen compound
  • hydrocarbon derivative
  • enol ester
  • organooxygen compound