Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:07:22 UTC
Update Date2025-03-25 00:56:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02218383
Frequency0.5
Structure
Chemical FormulaC16H14Cl2
Molecular Mass276.0473
SMILESClc1ccc(C2CCc3ccccc3C2)cc1Cl
InChI KeyXPYXYCBIGHFAFI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass phenylnaphthalenes
Direct Parent phenylnaphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • aryl chlorides
  • dichlorobenzenes
  • hydrocarbon derivatives
  • organochlorides
  • tetralins
  • Substituents
  • aryl chloride
  • chlorobenzene
  • tetralin
  • monocyclic benzene moiety
  • organochloride
  • aromatic homopolycyclic compound
  • organohalogen compound
  • aryl halide
  • phenylnaphthalene
  • hydrocarbon derivative
  • 1,2-dichlorobenzene
  • halobenzene