Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:31:32 UTC
Update Date2025-03-24 21:13:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01709702
Frequency0.7
Structure
Chemical FormulaC6H16NO2+
Molecular Mass134.1176
SMILESCOC(O)C[N+](C)(C)C
InChI KeyNNBMMGRODVLLJR-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
  • hemiacetals
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organooxygen compounds
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organic oxygen compound
  • choline
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine
  • organooxygen compound