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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:19:02 UTC
Update Date2025-03-21 19:11:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00248545
Frequency8.4
Structure
Chemical FormulaC4H9NO2S
Molecular Mass135.0354
SMILESCC(=O)S(=O)CCN
InChI KeyGRNMQPMNWZDDMV-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