Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:36 UTC
Update Date2025-03-21 18:30:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00082818
Frequency34.8
Structure
Chemical FormulaC8H7N3O
Molecular Mass161.0589
SMILESNc1ncnc2ccc(O)cc12
InChI KeyLKUQJWBEQDAUAN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinazolinamines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • Substituents
  • azacycle
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • pyrimidine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • quinazolinamine
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine
  • organooxygen compound