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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:47 UTC
Update Date2025-03-25 00:49:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178058
Frequency0.5
Structure
Chemical FormulaC11H11N7
Molecular Mass241.1076
SMILESCc1ncc(Cn2cnc3c(N)ncnc32)cn1
InChI KeyLGIVPQYBGXKGER-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purines and purine derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • n-substituted imidazoles
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • Substituents
  • azacycle
  • heteroaromatic compound
  • pyrimidine
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • purine
  • organic nitrogen compound
  • imidolactam
  • amine
  • azole
  • n-substituted imidazole