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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:36:41 UTC
Update Date2025-03-21 18:46:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00149508
Frequency16.3
Structure
Chemical FormulaC5H14NOS+
Molecular Mass136.0791
SMILESC[N+](C)(C)C(O)CS
InChI KeyCLKANLLSYAPHCO-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent tetraalkylammonium salts
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hemiaminals
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
    • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organosulfur compound
  • hemiaminal
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • alkylthiol
  • organooxygen compound
  • alkanolamine