Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:37:47 UTC
Update Date2025-03-24 14:30:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00861455
Frequency1.7
Structure
Chemical FormulaC4H5NO2S
Molecular Mass131.0041
SMILESO=C1CC(S)C(=O)N1
InChI KeyPCLITYPZCQBLAC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidones
Direct Parent pyrrolidine-2-ones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkylthiols
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dicarboximides
  • hydrocarbon derivatives
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • azacycle
  • organosulfur compound
  • carboxylic acid derivative
  • carboxylic acid imide
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • alkylthiol
  • organooxygen compound