Hmdb loader

Showing information for DMID00103154

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:04 UTC
Update Date2025-03-21 18:34:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00103154
Frequency26.4
Structure
Chemical FormulaC13H17N4+
Molecular Mass229.1448
SMILESCc1ccc(C)[n+](Cc2cnc(C)nc2N)c1
InChI KeyYTEUNHNJLCKWPF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • methylpyridines
  • organic cations
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
    • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • methylpyridine
  • pyrimidine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • 2-halopyridine
  • organic nitrogen compound
  • organic cation
  • imidolactam
  • amine