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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:15:11 UTC
Update Date2025-03-24 20:40:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01526678
Frequency0.8
Structure
Chemical FormulaC7H16NO+
Molecular Mass130.1226
SMILESC=CC(CO)[N+](C)(C)C
InChI KeyNLGBTDMGGYVPTF-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
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • primary alcohols
  • tetraalkylammonium salts
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organic oxygen compound
  • choline
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • primary alcohol
  • amine
  • organooxygen compound