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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:12 UTC
Update Date2025-03-25 00:45:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02151578
Frequency0.5
Structure
Chemical FormulaC14H5Cl15
Molecular Mass697.5719
SMILESClC1=C(Cl)C2(Cl)C(Cl)(Cl)C1(Cl)C(Cl)(Cl)C1(Cl)C3C(Cl)C(Cl)C(Cl)C3C2(Cl)C1(Cl)Cl
InChI KeySZCDJHXKMHELBF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classvinyl halides
Subclass vinyl chlorides
Direct Parent vinyl chlorides
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • alkyl chlorides
  • chloroalkenes
  • hydrocarbon derivatives
  • organochlorides
    • Substituents
  • alkyl chloride
  • chloroalkene
  • organochloride
  • haloalkene
  • alkyl halide
  • hydrocarbon derivative
  • vinyl chloride
  • aliphatic homopolycyclic compound