Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:30:07 UTC
Update Date2025-03-24 22:14:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01130204
Frequency1.2
Structure
Chemical FormulaC4H8O5
Molecular Mass136.0372
SMILESO=COC(O)C(O)CO
InChI KeyWQKBMVRROXOLSF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • carbonyl compounds
  • hemiacetals
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound
  • 1,2-diol