Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:02 UTC
Update Date2025-03-25 00:46:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155906
Frequency0.5
Structure
Chemical FormulaC11H19N2+
Molecular Mass179.1543
SMILESC[N+](C)(C)C(CN)c1ccccc1
InChI KeyYLLDGELEOGFCEI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic cations
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • monocyclic benzene moiety
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • aralkylamine
  • aromatic homomonocyclic compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic cation
  • organic salt