Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:23:13 UTC
Update Date2025-03-24 20:44:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01546120
Frequency0.8
Structure
Chemical FormulaC8H7N
Molecular Mass117.0578
SMILESC1=CC2=CC=CC(=C1)N2
InChI KeyUGIQRSRAVBGBSE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass hydropyridines
Direct Parent dihydropyridines
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • organopnictogen compounds
  • Substituents
  • aliphatic heteropolycyclic compound
  • secondary aliphatic amine
  • azacycle
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • secondary amine
  • dihydropyridine
  • amine