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Record Information
HMDB Statusquantified
Creation Date2024-02-20 23:33:54 UTC
Update Date2025-03-21 17:56:25 UTC
HMDB IDHMDB0000097
Metabolite Identification
DeepMet IDDMID00001225
NameCholine
Frequency4736.0
Structure
Chemical FormulaC5H14NO+
Molecular Mass104.107
SMILESC[N+](C)(C)CCO
InChI KeyOEYIOHPDSNJKLS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent cholines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • alcohols and polyols
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • 1,2-aminoalcohol
  • organic oxygen compound
  • choline
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine
  • organooxygen compound
  • alkanolamine