Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:13:08 UTC
Update Date2025-03-21 22:12:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00516105
Frequency3.3
Structure
Chemical FormulaC6H7N3O
Molecular Mass137.0589
SMILESNc1ccc(N)nc(=O)c1
InChI KeyOSNGILMLARRDGQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazepines
Subclass azepines
Direct Parent azepines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxide
  • azepine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound