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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:01:07 UTC
Update Date2025-03-21 18:06:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00064807
Frequency47.4
Structure
Chemical FormulaC4H6N4O
Molecular Mass126.0542
SMILESCn1cnc(N)nc1=O
InChI KeyRHJJMHTYURSZGB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass aminotriazines
Direct Parent aminotriazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • halo-s-triazines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • triazinones
    • Substituents
  • carbonic acid derivative
  • amino-1,3,5-triazine
  • aromatic heteromonocyclic compound
  • azacycle
  • aminotriazine
  • heteroaromatic compound
  • organic oxide
  • organic oxygen compound
  • halo-s-triazine
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,3,5-triazine
  • primary amine
  • organic nitrogen compound
  • amine
  • triazinone
  • organooxygen compound