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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:58:25 UTC
Update Date2025-03-25 00:31:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02058320
Frequency0.6
Structure
Chemical FormulaC5H5N5
Molecular Mass135.0545
SMILESNc1nnc2[nH]ccc2n1
InChI KeyCABMFEBGXNEGTJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,2,4-triazines
Direct Parent 1,2,4-triazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • pyrroles
    • Substituents
  • azacycle
  • heteroaromatic compound
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • 1,2,4-triazine
  • amine