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Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:35 UTC
Update Date2025-03-21 17:58:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00014474
Frequency304.4
Structure
Chemical FormulaC4H9NO2S
Molecular Mass135.0354
SMILESCS(=O)CCC(N)=O
InChI KeyDUDILWQIGVONEB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfoxides
Subclass sulfoxides
Direct Parent sulfoxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • sulfinyl compounds
    • Substituents
  • primary carboxylic acid amide
  • aliphatic acyclic compound
  • carbonyl group
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound