Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:49:43 UTC
Update Date2025-03-21 18:02:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00037881
Frequency92.7
Structure
Chemical FormulaC8H2Cl8O
Molecular Mass393.7614
SMILESClC1=C(Cl)C2(Cl)C3OC3(Cl)C(Cl)C1(Cl)C2(Cl)Cl
InChI KeyKGXOOPGKSCLJSM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • alkyl chlorides
  • chloroalkenes
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • organochlorides
  • oxacyclic compounds
  • vinyl chlorides
  • Substituents
  • ether
  • alkyl chloride
  • chloroalkene
  • organochloride
  • oxirane
  • organohalogen compound
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • organic oxygen compound
  • vinyl halide
  • haloalkene
  • alkyl halide
  • hydrocarbon derivative
  • vinyl chloride
  • organooxygen compound