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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:48:55 UTC
Update Date2025-03-25 00:49:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176019
Frequency0.5
Structure
Chemical FormulaC11H11N5O2
Molecular Mass245.0913
SMILESCn1c(=O)c2nc3ncn(C)c3cc2n(C)c1=O
InChI KeyUDQJNPFOHWDCKG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyridopyrimidines
Subclass pyridopyrimidines
Direct Parent pyridopyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidazopyridines
  • lactams
  • methylpyridines
  • n-substituted imidazoles
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyrimidones
  • ureas
  • vinylogous amides
  • Substituents
  • lactam
  • polyhalopyridine
  • pyrimidone
  • imidazopyridine
  • pyrimidine
  • urea
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • pyridopyrimidine
  • organopnictogen compound
  • 2-halopyridine
  • azole
  • n-substituted imidazole
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • methylpyridine
  • pyridine
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound