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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:39:25 UTC
Update Date2025-03-21 20:00:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00295340
Frequency6.8
Structure
Chemical FormulaC5H5N5
Molecular Mass135.0545
SMILESNc1c2ncnc1NC=N2
InChI KeyGFINGELHRFBQOD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidines and pyrimidine derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • formamidines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidolactams
  • organopnictogen compounds
  • primary amines
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • amidine
  • pyrimidine
  • propargyl-type 1,3-dipolar organic compound
  • formamidine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • imidolactam
  • amine