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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:09:57 UTC
Update Date2025-03-24 20:11:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01371272
Frequency1.0
Structure
Chemical FormulaC18H9I5O4
Molecular Mass923.5724
SMILESOc1ccc(Oc2c(I)cc(Oc3cc(I)c(O)c(I)c3)c(I)c2I)cc1
InChI KeyRIMJRCCGIJBFKK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent diphenylethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl iodides
  • diarylethers
  • halophenols
  • hydrocarbon derivatives
  • iodobenzenes
  • o-iodophenols
  • organoiodides
  • phenol ethers
  • phenoxy compounds
    • Substituents
  • diaryl ether
  • phenol ether
  • ether
  • 2-iodophenol
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • iodobenzene
  • organoiodide
  • aryl halide
  • aromatic homomonocyclic compound
  • 2-halophenol
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • aryl iodide
  • halobenzene
  • phenoxy compound
  • diphenylether
  • organooxygen compound