Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:28 UTC
Update Date2025-03-25 00:53:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202334
Frequency0.5
Structure
Chemical FormulaC9H13N2+
Molecular Mass149.1073
SMILESC[N+]1(C)CCc2cccnc21
InChI KeyKFTAMDHUUQYEQV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass halopyridines
Direct Parent polyhalopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • methylpyridines
  • organic cations
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • methylpyridine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 2-halopyridine
  • organic nitrogen compound
  • organic cation