Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:03 UTC
Update Date2025-03-25 00:56:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02219971
Frequency0.5
Structure
Chemical FormulaC13H10Br2O2
Molecular Mass355.9048
SMILESCc1cc(Oc2ccc(Br)cc2Br)ccc1O
InChI KeyAUJHDHDJCXMYNK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass diphenylethers
Direct Parent bromodiphenyl ethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl bromides
  • bromobenzenes
  • diarylethers
  • hydrocarbon derivatives
  • organobromides
  • ortho cresols
  • phenol ethers
  • phenoxy compounds
  • toluenes
  • Substituents
  • diaryl ether
  • phenol ether
  • ether
  • bromodiphenyl ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • bromobenzene
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • o-cresol
  • organobromide
  • phenol
  • hydrocarbon derivative
  • halobenzene
  • phenoxy compound
  • aryl bromide
  • toluene
  • organooxygen compound