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Showing information for DMID00652784

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:10:47 UTC
Update Date2025-03-21 23:09:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00652784
Frequency2.4
Structure
Chemical FormulaC2H3NOS
Molecular Mass88.9935
SMILESCS(=O)C#N
InChI KeyWSQCLRGVECLGFB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classsulfoxides
Subclass sulfoxides
Direct Parent sulfoxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • cyanide salts
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • thiocyanates
    • Substituents
  • aliphatic acyclic compound
  • organic cyanide salt
  • thiocyanate
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound