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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:49:54 UTC
Update Date2025-03-24 14:04:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00746428
Frequency2.0
Structure
Chemical FormulaC4H7NO2S
Molecular Mass133.0197
SMILESN#CC(O)C(O)CS
InChI KeyYNBFUDWNLBJHFG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organic cyanides
Direct Parent cyanohydrins
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-diols
  • alkylthiols
  • alpha-hydroxynitriles
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • cyanohydrin
  • organosulfur compound
  • organic oxygen compound
  • alpha-hydroxynitrile
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound
  • 1,2-diol