Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:33:57 UTC
Update Date2025-03-24 22:16:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01139129
Frequency1.2
Structure
Chemical FormulaC6H12O3
Molecular Mass132.0786
SMILESCCCOCC(O)C=O
InChI KeyCVDSVJOKNIARNG-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
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • ether
  • monosaccharide
  • aldehyde
  • dialkyl ether
  • organic oxide
  • alpha-hydroxyaldehyde
  • secondary alcohol
  • hydrocarbon derivative