Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:59:21 UTC
Update Date2025-03-21 18:06:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00060632
Frequency51.6
Structure
Chemical FormulaC13H12N2
Molecular Mass196.1
SMILESCc1cnc(C)c2c1[nH]c1ccccc12
InChI KeyJTDZFYLVOCFRRG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass pyridoindoles
Direct Parent gamma carbolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • indoles
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyridines and derivatives
  • pyrroles
  • pyrrolopyridines
  • Substituents
  • azacycle
  • pyrrolopyridine
  • indole
  • polyhalopyridine
  • gamma-carboline
  • heteroaromatic compound
  • pyridine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound