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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:32:28 UTC
Update Date2025-03-21 18:42:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00139718
Frequency17.8
Structure
Chemical FormulaC4H9NO2S
Molecular Mass135.0354
SMILESCS(=O)C(=O)CCN
InChI KeyGOZAJNMMAGRFOV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • sulfoxides
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • thiolactone
  • organooxygen compound