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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:29 UTC
Update Date2025-03-25 00:59:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02234425
Frequency0.5
Structure
Chemical FormulaC6H8N5O+
Molecular Mass166.0723
SMILESC[n+]1cnc(N)c2[nH]c(=O)[nH]c21
InChI KeyJYQXSLQRWOCCPL-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidazopyrimidines
Subclass purines and purine derivatives
Direct Parent purinones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • imidolactams
  • organic carbonic acids and derivatives
  • organic cations
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • Substituents
  • carbonic acid derivative
  • azacycle
  • heteroaromatic compound
  • purinone
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • organic cation
  • imidolactam
  • amine
  • organooxygen compound
  • azole