Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:48 UTC
Update Date2025-03-21 18:30:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00083294
Frequency34.6
Structure
Chemical FormulaC5H12NO+
Molecular Mass102.0913
SMILESC[N+]1(C)CC(O)C1
InChI KeyIPGMHIKXRFUSPJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent tetraalkylammonium salts
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-aminoalcohols
  • amines
  • azacyclic compounds
  • azetidines
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • tetraalkylammonium salt
  • azacycle
  • 1,2-aminoalcohol
  • azetidine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine
  • organoheterocyclic compound
  • organooxygen compound