Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:34:39 UTC
Update Date2025-03-21 17:56:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00002979
Frequency1989.8
Structure
Chemical FormulaC4H8O3S
Molecular Mass136.0194
SMILESO=C(O)CC(O)CS
InChI KeyQUOCENQUEWZJCO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfur compounds
  • secondary alcohols
  • short-chain hydroxy acids and derivatives
  • thia fatty acids
  • Substituents
  • alcohol
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • fatty acid
  • organosulfur compound
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • thia fatty acid
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • hydroxy fatty acid
  • alkylthiol
  • organooxygen compound