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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:09 UTC
Update Date2025-03-25 00:47:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02162768
Frequency0.5
Structure
Chemical FormulaC11H7Cl9O
Molecular Mass469.7694
SMILESO=C(Cl)C(Cl)C1C2(Cl)C3C(Cl)C(Cl)C(Cl)C3C1(Cl)C2(Cl)Cl
InChI KeyOIQDOHSVXFRFST-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganohalogen compounds
Classacyl halides
Subclass acyl chlorides
Direct Parent acyl chlorides
Geometric Descriptor aliphatic homopolycyclic compounds
Alternative Parents
  • alkyl chlorides
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organochlorides
    • Substituents
  • carbonyl group
  • alkyl chloride
  • organochloride
  • aliphatic homopolycyclic compound
  • organic oxide
  • organic oxygen compound
  • acyl chloride
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound