Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:53 UTC
Update Date2025-03-25 00:50:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180535
Frequency0.5
Structure
Chemical FormulaC19H14Br2O
Molecular Mass415.9411
SMILESOc1ccc(C(c2ccc(Br)cc2)c2ccc(Br)cc2)cc1
InChI KeyNTPOQNJVAZRDMO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtriphenyl compounds
Subclass triphenyl compounds
Direct Parent triphenyl compounds
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • aryl bromides
  • bromobenzenes
  • hydrocarbon derivatives
  • organobromides
  • organooxygen compounds
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • bromobenzene
  • organohalogen compound
  • aryl halide
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • triphenyl compound
  • organobromide
  • phenol
  • hydrocarbon derivative
  • halobenzene
  • aryl bromide
  • organooxygen compound