Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:24 UTC
Update Date2025-03-25 00:58:38 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231912
Frequency0.5
Structure
Chemical FormulaC14H16Cl2O2
Molecular Mass286.0527
SMILESCC1(C)OCC2C(c3ccc(Cl)c(Cl)c3)OCC21
InChI KeyOOIXEHOYPBECPD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classfurofurans
Subclass furofurans
Direct Parent furofurans
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl chlorides
  • dialkyl ethers
  • dichlorobenzenes
  • hydrocarbon derivatives
  • organochlorides
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • aryl chloride
  • chlorobenzene
  • monocyclic benzene moiety
  • ether
  • tetrahydrofuran
  • organochloride
  • organohalogen compound
  • dialkyl ether
  • aryl halide
  • oxacycle
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • furofuran
  • hydrocarbon derivative
  • 1,2-dichlorobenzene
  • benzenoid
  • halobenzene
  • organooxygen compound