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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:15:25 UTC
Update Date2025-03-25 01:21:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02374479
Frequency0.5
Structure
Chemical FormulaC5H13NO2
Molecular Mass119.0946
SMILESC[N+](C)(C)CC([O-])O
InChI KeyZNTKZFZHESXDOR-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
  • alkoxides
  • amines
  • hydrocarbon derivatives
  • organic oxides
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
    • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organic oxide
  • organic oxygen compound
  • choline
  • organopnictogen compound
  • hydrocarbon derivative
  • organic salt
  • alkoxide
  • amine
  • organooxygen compound