Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:19 UTC
Update Date2025-03-21 18:02:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00039265
Frequency88.7
Structure
Chemical FormulaC11H18N+
Molecular Mass164.1434
SMILESC[N+](C)(C)CCc1ccccc1
InChI KeyXYUGFPLAOGMREF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent phenethylamines
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • amines
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • tetraalkylammonium salts
  • Substituents
  • tetraalkylammonium salt
  • quaternary ammonium salt
  • phenethylamine
  • aromatic homomonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • amine