Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:18 UTC
Update Date2025-03-21 18:41:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134721
Frequency18.7
Structure
Chemical FormulaC12H8I2O3
Molecular Mass453.8563
SMILESOc1ccc(Oc2c(I)cc(O)cc2I)cc1
InChI KeyJUNHSRZXPDAEQG-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
  • m-iodophenols
  • organoiodides
  • phenol ethers
  • phenoxy compounds
  • Substituents
  • diaryl ether
  • 3-halophenol
  • phenol ether
  • ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • iodobenzene
  • organoiodide
  • aryl halide
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • aryl iodide
  • halobenzene
  • phenoxy compound
  • 3-iodophenol
  • diphenylether
  • organooxygen compound