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CHEBI:19391 - 2,6-dibromophenol

Default Structure
ChEBI IDCHEBI:19391
ChEBI Name2,6-dibromophenol
Stars
DefinitionA dibromophenol that is phenol in which both of the hydrogens that are ortho to the phenolic hydroxy group have been replaced by bromines.
Last Modified22 February 2018
DownloadsMolfile
FormulaC6H4Br2O
Net Charge0
Average Mass251.905
Monoisotopic Mass249.86289
SMILESOc1c(Br)cccc1Br
InChIInChI=1S/C6H4Br2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H
InChIKeySSIZLKDLDKIHEV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Neosiphonia sphaerocarpa (WORMS:146348) - PubMed (10656411)
Roles Classification
Biological Role:
marine metabolite  Any metabolite produced during a metabolic reaction in marine macro- and microorganisms.
ChEBI Ontology
Outgoing Relation(s)
2,6-dibromophenol (CHEBI:19391) has functional parent 1,3-dibromobenzene (CHEBI:37151)
2,6-dibromophenol (CHEBI:19391) has role marine metabolite (CHEBI:76507)
2,6-dibromophenol (CHEBI:19391) is a bromohydrocarbon (CHEBI:22926)
2,6-dibromophenol (CHEBI:19391) is a dibromophenol (CHEBI:33625)
Incoming Relation(s)
3,5-dibromo-4-hydroxybenzoate (CHEBI:27544) has functional parent 2,6-dibromophenol (CHEBI:19391)
3,5-dibromo-4-hydroxybenzoic acid (CHEBI:1395) has functional parent 2,6-dibromophenol (CHEBI:19391)
3,5-dibromo-4-hydroxybenzonitrile (CHEBI:17192) has functional parent 2,6-dibromophenol (CHEBI:19391)
3,5-dibromo-4-hydroxyphenylpyruvic acid (CHEBI:28128) has functional parent 2,6-dibromophenol (CHEBI:19391)
benzbromarone (CHEBI:3023) has functional parent 2,6-dibromophenol (CHEBI:19391)
IUPAC Name 
2,6-dibromophenol
Manual XrefsDatabases
c0533UM-BBD
C16247KEGG COMPOUND
Registry NumbersSources
Gmelin:1006446Gmelin
Beilstein:2043614Beilstein
CAS:608-33-3ChemIDplus
CAS:608-33-3NIST Chemistry WebBook
CAS:608-33-3KEGG COMPOUND