Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:52 UTC
Update Date2025-03-25 00:50:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178230
Frequency0.5
Structure
Chemical FormulaC12H11N5O
Molecular Mass241.0964
SMILESCn1c(-c2ccccc2)nc2c(N)nc(=O)[nH]c21
InChI KeyYJYZNISMMZCJAL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent phenylimidazoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzene and substituted derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • n-substituted imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • purinones
  • pyrimidones
  • Substituents
  • monocyclic benzene moiety
  • pyrimidone
  • imidazopyrimidine
  • purinone
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • n-substituted imidazole
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • 2-phenylimidazole
  • hydrocarbon derivative
  • benzenoid
  • purine
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound