Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:50:51 UTC
Update Date2025-03-24 14:36:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00892489
Frequency1.6
Structure
Chemical FormulaC7H12N+
Molecular Mass110.0964
SMILESC[N+]1(C)C=CC=CC1
InChI KeyJGBYFRPBZYYRGS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent dihydropyridines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • amines
  • azacyclic compounds
  • hydrocarbon derivatives
  • organic cations
  • organic salts
  • organopnictogen compounds
  • quaternary ammonium salts
  • Substituents
  • azacycle
  • quaternary ammonium salt
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • dihydropyridine
  • organic salt
  • amine