Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:07 UTC
Update Date2025-03-21 18:35:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00108203
Frequency57.0
Structure
Chemical FormulaC8H6N2O3
Molecular Mass178.0378
SMILESO=c1nc[nH]c2cc(O)c(O)cc12
InChI KeyNDHAHRQOSZIMIN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazanaphthalenes
Subclass benzodiazines
Direct Parent quinazolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • pyrimidones
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • pyrimidone
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • quinazoline
  • organooxygen compound