Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:59:42 UTC
Update Date2025-03-24 14:07:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00769760
Frequency2.0
Structure
Chemical FormulaC4H6O5
Molecular Mass134.0215
SMILESO=CC(O)COC(=O)O
InChI KeyXHMQLEUNVTWKTP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxyaldehydes
  • carbonic acid monoesters
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • short-chain aldehydes
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • short-chain aldehyde
  • carbonic acid derivative
  • monosaccharide
  • aldehyde
  • organic oxide
  • carbonic acid monoester
  • alpha-hydroxyaldehyde
  • secondary alcohol
  • hydrocarbon derivative