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CHEBI:52654 - 6-carboxy-4',5'-dichloro-2',7'-dimethoxyfluorescein

ChEBI IDCHEBI:52654
ChEBI Name6-carboxy-4',5'-dichloro-2',7'-dimethoxyfluorescein
Stars
DefinitionA fluorescein compound having chloro substituents in the 4'- and 5'-positions, methoxy substituents in the 2'- and 7'-positions and a carboxy substituent at the 6-position.
Last Modified30 June 2009
SubmitterSteve
DownloadsMolfile
FormulaC23H14Cl2O9
Net Charge0
Average Mass505.262
Monoisotopic Mass504.00149
SMILESCOc1cc2c(c(Cl)c1O)Oc1c(cc(OC)c(O)c1Cl)C21OC(=O)c2ccc(C(=O)O)cc21
InChIInChI=1S/C23H14Cl2O9/c1-31-13-6-11-19(15(24)17(13)26)33-20-12(7-14(32-2)18(27)16(20)25)23(11)10-5-8(21(28)29)3-4-9(10)22(30)34-23/h3-7,26-27H,1-2H3,(H,28,29)
InChIKeyIDLISIVVYLGCKO-UHFFFAOYSA-N
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
6-carboxy-4',5'-dichloro-2',7'-dimethoxyfluorescein (CHEBI:52654) has functional parent fluorescein (lactone form) (CHEBI:31624)
6-carboxy-4',5'-dichloro-2',7'-dimethoxyfluorescein (CHEBI:52654) has role fluorochrome (CHEBI:51217)
6-carboxy-4',5'-dichloro-2',7'-dimethoxyfluorescein (CHEBI:52654) is a xanthenes (CHEBI:38835)
IUPAC Name 
4',5'-dichloro-3',6'-dihydroxy-2',7'-dimethoxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxylic acid
Synonym  Source
6-JOEChEBI