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CHEBI:59678 - 6-carboxy-2',7'-dichlorofluorescein

ChEBI IDCHEBI:59678
ChEBI Name6-carboxy-2',7'-dichlorofluorescein
Stars
Last Modified28 June 2010
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC21H10Cl2O7
Net Charge0
Average Mass445.210
Monoisotopic Mass443.98036
SMILESO=C(O)c1ccc2c(c1)C1(OC2=O)c2cc(Cl)c(O)cc2Oc2cc(O)c(Cl)cc21
InChIInChI=1S/C21H10Cl2O7/c22-13-4-11-17(6-15(13)24)29-18-7-16(25)14(23)5-12(18)21(11)10-3-8(19(26)27)1-2-9(10)20(28)30-21/h1-7,24-25H,(H,26,27)
InChIKeyHLRKQIBTEHWNND-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-carboxy-2',7'-dichlorofluorescein (CHEBI:59678) is a oxaspiro compound (CHEBI:37948)
Incoming Relation(s)
5(6)-carboxy-2',7'-dichlorofluorescein (CHEBI:51619) has part 6-carboxy-2',7'-dichlorofluorescein (CHEBI:59678)
IUPAC Name 
2',7'-dichloro-3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxylic acid