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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:12 UTC
Update Date2025-03-25 00:50:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178981
Frequency0.5
Structure
Chemical FormulaC6H13NO2S
Molecular Mass163.0667
SMILESCSCCC(=NO)C(C)O
InChI KeyADBQLCXASONUFX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass oximes
Direct Parent ketoximes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylthioethers
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • sulfenyl compounds
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • sulfenyl compound
  • dialkylthioether
  • ketoxime
  • organosulfur compound
  • organic oxygen compound
  • thioether
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound