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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:36:43 UTC
Update Date2025-03-25 01:07:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02285323
Frequency0.5
Structure
Chemical FormulaC5H9N3O
Molecular Mass127.0746
SMILESCC(O)C1=NNC=NC1
InChI KeyFUNJFTFKMDXNPL-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
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • propargyl-type 1,3-dipolar organic compound
  • formamidine
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 1,2,4-triazine
  • organooxygen compound