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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:53 UTC
Update Date2025-03-25 00:50:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02178282
Frequency0.5
Structure
Chemical FormulaC10H13N5O3
Molecular Mass251.1018
SMILESCn1c(=O)[nH]c2c(=O)nc(N3CCOCC3)[nH]c21
InChI KeyCXRJEGKKIDKWCY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent hypoxanthines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aminopyrimidines and derivatives
  • azacyclic compounds
  • dialkyl ethers
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • morpholines
  • n-substituted imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • pyrimidones
  • vinylogous amides
  • Substituents
  • ether
  • pyrimidone
  • dialkyl ether
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • azole
  • n-substituted imidazole
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • oxazinane
  • aminopyrimidine
  • oxacycle
  • morpholine
  • organic oxygen compound
  • hypoxanthine
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound