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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:12 UTC
Update Date2025-03-21 18:40:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129926
Frequency19.5
Structure
Chemical FormulaC17H36NO+
Molecular Mass270.2791
SMILESCCCCCCCCCCC=CC(O)C[N+](C)(C)C
InChI KeyXVAAORQVPKARHI-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
  • secondary alcohols
  • tetraalkylammonium salts
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organic oxygen compound
  • choline
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine
  • organooxygen compound