Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:10 UTC
Update Date2025-03-21 17:56:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00004255
Frequency1340.1
Structure
Chemical FormulaC4H9NO3S
Molecular Mass151.0303
SMILESCC(=O)NCCS(=O)O
InChI KeyKTGAFVQLLJNUSX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classsulfinic acids and derivatives
Subclass sulfinic acids
Direct Parent sulfinic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acetamides
  • alkanesulfinic acids and derivatives
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • secondary carboxylic acid amides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organosulfur compound
  • carboxamide group
  • carboxylic acid derivative
  • sulfinic acid
  • alkanesulfinic acid or derivatives
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound