Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:25 UTC
Update Date2025-03-21 18:34:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00101531
Frequency41.1
Structure
Chemical FormulaC8H7N3O2
Molecular Mass177.0538
SMILESNc1nc(=O)c2c(O)cccc2[nH]1
InChI KeyWAIMKTFXCZZFIX-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
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • diazanaphthalenes
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • vinylogous acids
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • pyrimidone
  • 1-hydroxy-4-unsubstituted benzenoid
  • pyrimidine
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • quinazolinamine
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound