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CHEBI:52836 - 2',4',5',7'-tetrabromofluorescein(2−)

ChEBI IDCHEBI:52836
ChEBI Name2',4',5',7'-tetrabromofluorescein(2−)
Stars
ASCII Name2',4',5',7'-tetrabromofluorescein(2-)
DefinitionA carboxylic acid anion resulting from the removal of protons from the phenolic hydroxy group and the carboxy group of 2',4',5',7'-tetrabromofluorescein.
Last Modified29 July 2015
SubmitterSteve
DownloadsMolfile
FormulaC20H6Br4O5
Net Charge-2
Average Mass645.879
Monoisotopic Mass641.69597
SMILESO=C([O-])c1ccccc1-c1c2cc(Br)c(=O)c(Br)c-2oc2c(Br)c([O-])c(Br)cc12
InChIInChI=1S/C20H8Br4O5/c21-11-5-9-13(7-3-1-2-4-8(7)20(27)28)10-6-12(22)17(26)15(24)19(10)29-18(9)14(23)16(11)25/h1-6,25H,(H,27,28)/p-2
InChIKeyAZXGXVQWEUFULR-UHFFFAOYSA-L
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
2',4',5',7'-tetrabromofluorescein(2−) (CHEBI:52836) has role fluorochrome (CHEBI:51217)
2',4',5',7'-tetrabromofluorescein(2−) (CHEBI:52836) is a benzoates (CHEBI:22718)
2',4',5',7'-tetrabromofluorescein(2−) (CHEBI:52836) is a phenolate anion (CHEBI:50525)
2',4',5',7'-tetrabromofluorescein(2−) (CHEBI:52836) is conjugate base of 2',4',5',7'-tetrabromofluorescein (CHEBI:86277)
Incoming Relation(s)
eosin YS dye (CHEBI:52053) has part 2',4',5',7'-tetrabromofluorescein(2−) (CHEBI:52836)
2',4',5',7'-tetrabromofluorescein (CHEBI:86277) is conjugate acid of 2',4',5',7'-tetrabromofluorescein(2−) (CHEBI:52836)
IUPAC Name 
2-(2,4,5,7-tetrabromo-6-oxido-3-oxo-3H-xanthen-9-yl)benzoate
Synonyms  Source
Red 21(2−)ChEBI
eosin YS(2−)ChEBI
Registry NumbersSources
Gmelin:350839Gmelin
Reaxys:1443944Reaxys