Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:38 UTC
Update Date2025-03-21 17:57:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00009971
Frequency477.7
Structure
Chemical FormulaC5H10O4
Molecular Mass134.0579
SMILESCCOC(=O)C(O)CO
InChI KeyFTOZMXOHOKRHNL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent sugar acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • beta hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • monosaccharide
  • hydroxy acid
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • glyceric_acid
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • 1,2-diol