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CHEBI:49509 - 2',6'-dichlorobiphenyl-2,3-diol

ChEBI IDCHEBI:49509
ChEBI Name2',6'-dichlorobiphenyl-2,3-diol
Stars
DefinitionA hydroxybiphenyl that is catechol in which the hydrogen at position 3 has been replaced by a 2,6-dichlorophenyl group.
Secondary ChEBI IDsCHEBI:32923, CHEBI:49508
Last Modified16 July 2016
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC12H8Cl2O2
Net Charge0
Average Mass255.100
Monoisotopic Mass253.99013
SMILESOc1cccc(-c2c(Cl)cccc2Cl)c1O
InChIInChI=1S/C12H8Cl2O2/c13-8-4-2-5-9(14)11(8)7-3-1-6-10(15)12(7)16/h1-6,15-16H
InChIKeyMCZUCSAAGDCHHN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2',6'-dichlorobiphenyl-2,3-diol (CHEBI:49509) has functional parent biphenyl-2,3-diol (CHEBI:16205)
2',6'-dichlorobiphenyl-2,3-diol (CHEBI:49509) is a catechols (CHEBI:33566)
2',6'-dichlorobiphenyl-2,3-diol (CHEBI:49509) is a dichlorobenzene (CHEBI:23697)
2',6'-dichlorobiphenyl-2,3-diol (CHEBI:49509) is a hydroxybiphenyls (CHEBI:24681)
IUPAC Name 
2',6'-dichloro-[1,1'-biphenyl]-2,3-diol
Synonym  Source
2',6'-DICHLORO-BIPHENYL-2,6-DIOLPDBeChem
Manual XrefsDatabases
BP6PDBeChem
DB03259DrugBank