Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:18:41 UTC
Update Date2025-03-21 18:35:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00107133
Frequency25.1
Structure
Chemical FormulaC3H4O6S
Molecular Mass167.9729
SMILESO=C(O)CC(=O)S(=O)(=O)O
InChI KeyMPQKENCGGOJSEJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfonic acids and derivatives
Subclass organosulfonic acids and derivatives
Direct Parent acylsulfonic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organic sulfonic acids and derivatives
  • sulfonyls
  • thiolactones
  • Substituents
  • acylsulfonic acid
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • sulfonyl
  • organic oxygen compound
  • hydrocarbon derivative
  • thiolactone
  • organooxygen compound