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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:13 UTC
Update Date2025-03-25 00:46:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156277
Frequency0.5
Structure
Chemical FormulaC8H10N4
Molecular Mass162.0905
SMILESCc1c[nH]c2c(C)nc(N)nc12
InChI KeyCWOCSSWNTVUQGP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyrimidines
Subclass pyrrolopyrimidines
Direct Parent pyrrolopyrimidines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • pyrimidines and pyrimidine derivatives
  • pyrroles
    • Substituents
  • azacycle
  • heteroaromatic compound
  • pyrimidine
  • pyrrolopyrimidine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine