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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:03:29 UTC
Update Date2025-03-25 00:54:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02209289
Frequency0.5
Structure
Chemical FormulaC9H11Cl5O
Molecular Mass309.9253
SMILESCC1(C)OC2C(Cl)C(Cl)C(Cl)C2(Cl)C1Cl
InChI KeyRESCCFNENGOODP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkyl chlorides
  • dialkyl ethers
  • hydrocarbon derivatives
  • organochlorides
  • oxacyclic compounds
    • Substituents
  • ether
  • tetrahydrofuran
  • alkyl chloride
  • organochloride
  • organohalogen compound
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • alkyl halide
  • hydrocarbon derivative
  • organooxygen compound