Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:28 UTC
Update Date2025-03-21 18:39:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00125771
Frequency20.4
Structure
Chemical FormulaC4H8O6S2
Molecular Mass215.9762
SMILESO=C(CC(O)CS)OS(=O)(=O)O
InChI KeyLVCFVRVGLNGGHR-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
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organosulfur compounds
  • secondary alcohols
  • sulfuric acid monoesters
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • sulfuric acid monoester
  • carbonyl group
  • organic sulfuric acid or derivatives
  • organosulfur compound
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • sulfuric acid ester
  • alkylthiol
  • organooxygen compound