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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:05:33 UTC
Update Date2025-03-24 21:01:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01647150
Frequency0.8
Structure
Chemical FormulaC4H9NOS
Molecular Mass119.0405
SMILESCS(=O)C1CNC1
InChI KeyLJILJXHAHZLBPY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazetidines
Subclass azetidines
Direct Parent azetidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • sulfinyl compounds
  • sulfoxides
    • Substituents
  • secondary aliphatic amine
  • azacycle
  • secondary amine
  • organosulfur compound
  • azetidine
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine