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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:27 UTC
Update Date2025-03-25 00:48:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165787
Frequency0.5
Structure
Chemical FormulaC5H7F3N2O
Molecular Mass168.051
SMILESCC1=NC(O)(C(F)(F)F)CN1
InChI KeyQGYHWULSKYAQOO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidolactams
Subclass imidolactams
Direct Parent imidolactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkanolamines
  • alkyl fluorides
  • amidines
  • azacyclic compounds
  • carboximidamides
  • fluorohydrins
  • hydrocarbon derivatives
  • imidazolines
  • organofluorides
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • halohydrin
  • alkyl fluoride
  • organofluoride
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • fluorohydrin
  • organohalogen compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • 2-imidazoline
  • imidazoline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam
  • organooxygen compound
  • alkanolamine