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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:12:40 UTC
Update Date2025-03-21 22:12:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00515006
Frequency3.3
Structure
Chemical FormulaC3H6N6
Molecular Mass126.0654
SMILESNC(N)=Nc1nc[nH]n1
InChI KeyALWSHQSZLNPQDW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass triazoles
Direct Parent triazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • guanidines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • triazole
  • aromatic heteromonocyclic compound
  • 1,2,4-triazole
  • azacycle
  • guanidine
  • heteroaromatic compound
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound