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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:22:35 UTC
Update Date2025-03-24 20:43:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01544574
Frequency0.8
Structure
Chemical FormulaC5H8N4
Molecular Mass124.0749
SMILESNCCc1ncncn1
InChI KeyDVEFCIHJXKYQLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,3,5-triazines
Direct Parent halo-s-triazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • halo-s-triazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound