Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:35:44 UTC
Update Date2025-03-21 17:57:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00005531
Frequency963.9
Structure
Chemical FormulaC6H14N+
Molecular Mass100.1121
SMILESC=CC[N+](C)(C)C
InChI KeyKGVWWFCEYXERAE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass quaternary ammonium salts
Direct Parent tetraalkylammonium salts
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organic salt
  • amine