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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:12:19 UTC
Update Date2025-03-25 01:45:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02507765
Frequency0.5
Structure
Chemical FormulaC4H5ClN2O
Molecular Mass132.009
SMILESCC1=NC2OC2(Cl)N1
InChI KeyUHDUZUBUURRZHF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classimidolactams
Subclass imidolactams
Direct Parent imidolactams
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkyl chlorides
  • amidines
  • azacyclic compounds
  • carboximidamides
  • epoxides
  • hydrocarbon derivatives
  • imidazolines
  • organochlorides
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • azacycle
  • alkyl chloride
  • organochloride
  • oxirane
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • organohalogen compound
  • propargyl-type 1,3-dipolar organic compound
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • 2-imidazoline
  • imidazoline
  • organonitrogen compound
  • organopnictogen compound
  • alkyl halide
  • hydrocarbon derivative
  • organic nitrogen compound
  • imidolactam
  • organooxygen compound