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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:07:04 UTC
Update Date2025-03-24 20:36:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01506570
Frequency0.8
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESCC(=O)C1=NNC=NC1
InChI KeyRFWRSBFFRMNLSV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtriazines
Subclass 1,2,4-triazines
Direct Parent 1,2,4-triazines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • formamidines
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • carbonyl group
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • formamidine
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,2,4-triazine
  • organooxygen compound