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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:52:37 UTC
Update Date2025-03-24 18:00:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01040480
Frequency1.3
Structure
Chemical FormulaC4H4N6
Molecular Mass136.0497
SMILESNc1nc2nc(n1)NC=N2
InChI KeyMDOFPUJSLCEAGO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass aminotriazines
Direct Parent aminotriazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • formamidines
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • amino-1,3,5-triazine
  • azacycle
  • aminotriazine
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • amidine
  • propargyl-type 1,3-dipolar organic compound
  • formamidine
  • aromatic heteropolycyclic compound
  • halo-s-triazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,3,5-triazine
  • primary amine
  • organic nitrogen compound
  • amine