Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:58:21 UTC
Update Date2025-03-21 18:05:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00058241
Frequency54.3
Structure
Chemical FormulaC5H4BrN
Molecular Mass156.9527
SMILESBrc1cccnc1
InChI KeyNYPYPOZNGOXYSU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridines and derivatives
Subclass pyridines and derivatives
Direct Parent pyridines and derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aryl bromides
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organobromides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organohalogen compound
  • aryl halide
  • pyridine
  • organonitrogen compound
  • organobromide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • aryl bromide