Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:13 UTC
Update Date2025-03-21 17:57:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00008965
Frequency540.4
Structure
Chemical FormulaC6H16NO+
Molecular Mass118.1226
SMILESC[N+](C)(C)CCCO
InChI KeyAACHVWXCVWWMSI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent 1,3-aminoalcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • 1,3-aminoalcohol
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • organooxygen compound