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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:29:53 UTC
Update Date2025-03-24 21:39:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01848326
Frequency0.7
Structure
Chemical FormulaC5H13NOS
Molecular Mass135.0718
SMILESC[SH](=O)=CCCCN
InChI KeyPGLGEWWKRLRENE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiocarbonyl compounds
Subclass thioaldehydes
Direct Parent thioaldehyde s-oxides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • s-alkylsulfenates
    • Substituents
  • aliphatic acyclic compound
  • s-alkylsulfenate
  • organic oxide
  • organic oxygen compound
  • thioaldehyde-s-oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol