Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:19 UTC
Update Date2025-03-25 00:50:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179234
Frequency0.5
Structure
Chemical FormulaC16H10Cl2O3
Molecular Mass320.0007
SMILESOc1ccc2cc(O)c(Oc3ccc(Cl)cc3Cl)cc2c1
InChI KeyKHBFXZUSHOZYQM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthols and derivatives
Direct Parent naphthols and derivatives
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl chlorides
  • diarylethers
  • dichlorobenzenes
  • hydrocarbon derivatives
  • organochlorides
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • aryl chloride
  • chlorobenzene
  • diaryl ether
  • phenol ether
  • monocyclic benzene moiety
  • ether
  • organochloride
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • organohalogen compound
  • aryl halide
  • 1,3-dichlorobenzene
  • organic oxygen compound
  • hydrocarbon derivative
  • halobenzene
  • phenoxy compound
  • 2-naphthol
  • organooxygen compound