Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:02:40 UTC
Update Date2025-03-25 00:54:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02207347
Frequency0.5
Structure
Chemical FormulaC8H7N3O2
Molecular Mass177.0538
SMILESNc1ccc2[nH]c(=O)cnc2c1O
InChI KeyFVWIPQBSHMUGNI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinoxalines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrazines
  • Substituents
  • quinoxaline
  • lactam
  • azacycle
  • heteroaromatic compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • pyrazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound