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CHEBI:90221 - 2,7-dibromo-4-hydroxymercurifluorescein

Default Structure
ChEBI IDCHEBI:90221
ChEBI Name2,7-dibromo-4-hydroxymercurifluorescein
Stars
DefinitionA xanthene dye that is fluorescein bearing bromine substituents at positions 2 and 7 as well as a hydroxymercurio substituent at position 4.
Last Modified5 November 2015
SubmitterSteve
DownloadsMolfile
FormulaC20H10Br2HgO6
Net Charge0
Average Mass706.692
Monoisotopic Mass705.85506
SMILESO=C(O)c1ccccc1-c1c2cc(Br)c(=O)cc-2oc2[c]([Hg][OH])c(O)c(Br)cc12
InChIInChI=1S/C20H9Br2O5.Hg.H2O/c21-13-5-11-17(7-15(13)23)27-18-8-16(24)14(22)6-12(18)19(11)9-3-1-2-4-10(9)20(25)26;;/h1-7,24H,(H,25,26);;1H2/q;+1;/p-1
InChIKeyOHCFGBLQZMYRTR-UHFFFAOYSA-M
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Applications:
fluorochrome  A fluorescent dye used to stain biological specimens.
antiseptic drug  A substance used locally on humans and other animals to destroy harmful microorganisms or to inhibit their activity (cf. disinfectants, which destroy microorganisms found on non-living objects, and antibiotics, which can be transported through the lymphatic system to destroy bacteria within the body).
histological dye  A dye used in microscopic or electron microscopic examination of cells and tissues to give contrast and to highlight particular features of interest, such as nuclei and cytoplasm.
dye 
ChEBI Ontology
Outgoing Relation(s)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) has functional parent fluorescein (lactone form) (CHEBI:31624)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) has role antiseptic drug (CHEBI:48218)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) has role fluorochrome (CHEBI:51217)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) has role histological dye (CHEBI:77178)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) is a arylmercury compound (CHEBI:22648)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) is a benzoic acids (CHEBI:22723)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) is a organobromine compound (CHEBI:37141)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) is a xanthene dye (CHEBI:37929)
2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221) is conjugate acid of 2,7-dibromo-4-hydroxymercurifluorescein(2−) (CHEBI:90220)
Incoming Relation(s)
2,7-dibromo-4-hydroxymercurifluorescein(2−) (CHEBI:90220) is conjugate base of 2,7-dibromo-4-hydroxymercurifluorescein (CHEBI:90221)
IUPAC Name 
[2,7-dibromo-9-(2-carboxyphenyl)-6-hydroxy-3-oxo-3H-xanthen-5-yl](hydroxy)mercury
Registry NumbersSources
Reaxys:24643996Reaxys