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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:27 UTC
Update Date2025-03-25 00:55:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02211635
Frequency0.5
Structure
Chemical FormulaC10H14N6O3
Molecular Mass266.1127
SMILESCC(=O)NCCCn1c(=O)[nH]c2[nH]c(N)nc(=O)c21
InChI KeyCELRHJKCMULUEJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent hypoxanthines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • amino acids and derivatives
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • n-substituted imidazoles
  • organic carbonic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • secondary carboxylic acid amides
  • vinylogous amides
  • Substituents
  • carbonyl group
  • amino acid or derivatives
  • pyrimidone
  • carboxylic acid derivative
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • acetamide
  • azole
  • n-substituted imidazole
  • vinylogous amide
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hypoxanthine
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound