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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:15 UTC
Update Date2025-03-25 00:54:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204114
Frequency0.5
Structure
Chemical FormulaC12H8F2O3
Molecular Mass238.0442
SMILESOc1ccc(Oc2c(F)ccc(O)c2F)cc1
InChI KeyOPUAXJGATPJALF-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 fluorides
  • diarylethers
  • fluorobenzenes
  • halophenols
  • hydrocarbon derivatives
  • o-fluorophenols
  • organofluorides
  • p-fluorophenols
  • phenol ethers
  • phenoxy compounds
    • Substituents
  • aryl fluoride
  • diaryl ether
  • phenol ether
  • 4-fluorophenol
  • ether
  • organofluoride
  • 1-hydroxy-2-unsubstituted benzenoid
  • organohalogen compound
  • 2-fluorophenol
  • aryl halide
  • aromatic homomonocyclic compound
  • 2-halophenol
  • fluorobenzene
  • 4-halophenol
  • organic oxygen compound
  • phenol
  • hydrocarbon derivative
  • halobenzene
  • phenoxy compound
  • diphenylether
  • organooxygen compound