Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:31:27 UTC
Update Date2025-03-24 22:06:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01994016
Frequency0.6
Structure
Chemical FormulaC6H12O3
Molecular Mass132.0786
SMILESCCOC(C)C(=O)CO
InChI KeyDFQFQXAJWUFQSK-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
  • alcohols and polyols
  • alpha-hydroxy ketones
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • ether
  • monosaccharide
  • alpha-hydroxy ketone
  • dialkyl ether
  • ketone
  • organic oxide
  • hydrocarbon derivative