Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:46:29 UTC
Update Date2025-03-21 20:02:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00311303
Frequency6.3
Structure
Chemical FormulaC8H7N3
Molecular Mass145.064
SMILESNc1ccc2nccnc2c1
InChI KeyMSGRFBKVMUKEGZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinoxalines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • pyrazines
  • Substituents
  • quinoxaline
  • azacycle
  • heteroaromatic compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • amine