Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:20 UTC
Update Date2025-03-21 18:41:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00137124
Frequency18.2
Structure
Chemical FormulaC6H16NO2+
Molecular Mass134.1176
SMILESCC(O)C(O)[N+](C)(C)C
InChI KeyLFYCFROESIVCOM-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
  • hemiaminals
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • tetraalkylammonium salts
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • hemiaminal
  • organic oxygen compound
  • choline
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • organooxygen compound
  • alkanolamine