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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:00:09 UTC
Update Date2025-03-25 01:16:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02339701
Frequency0.5
Structure
Chemical FormulaC5H8N2O
Molecular Mass112.0637
SMILESCC(O)C1=NC=NC1
InChI KeyDOJUDFYENHOYDW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass imidazoles
Direct Parent imidazoles
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • alcohol
  • azacycle
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • imidazole
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound