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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:33:09 UTC
Update Date2025-03-24 20:22:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01426760
Frequency0.9
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESCc1ncc(CO)nn1
InChI KeySKPLDSFIHXWLIC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,2,4-triazines
Direct Parent 1,2,4-triazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • aromatic alcohol
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,2,4-triazine
  • organooxygen compound