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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:09 UTC
Update Date2025-03-25 00:45:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151481
Frequency0.5
Structure
Chemical FormulaC8H9N5O3
Molecular Mass223.0705
SMILESCn1c(=O)n(CC(=O)O)c2c(N)ncnc21
InChI KeyLSFUPERONADSMN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purinones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alpha amino acids and derivatives
  • amino acids
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • monocarboxylic acids and derivatives
  • n-substituted imidazoles
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • ureas
  • Substituents
  • carbonyl group
  • carboxylic acid
  • amino acid or derivatives
  • amino acid
  • alpha-amino acid or derivatives
  • carboxylic acid derivative
  • purinone
  • pyrimidine
  • urea
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • imidolactam
  • azole
  • n-substituted imidazole
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound