CHEBI:51975 - DY-682

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ChEBI Name DY-682 ChEBI ID CHEBI:51975 Definition An organic trisodium salt having 2-(3-{4-tert-butyl-7-[ethyl(3-sulfonatopropyl)amino]chromenium-2-yl}prop-2-en-1-ylidene)-3-(3-carboxypropyl)-3-methyl-1-(3-sulfonatopropyl)indoline-5-sulfonate as the counterion. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C37H46N2Na2O12S3 Net Charge 0 Average Mass 852.94200 Monoisotopic Mass 852.20083 InChI InChI=1S/C37H48N2O12S3.2Na/c1-6-38(19-9-21-52(42,43)44)26-14-16-29-30(36(2,3)4)24-27(51-33(29)23-26)11-7-12-34-37(5,18-8-13-35(40)41)31-25-28(54(48,49)50)15-17-32(31)39(34)20-10-22-53(45,46)47;;/h7,11-12,14-17,23-25H,6,8-10,13,18-22H2,1-5H3,(H3-,40,41,42,43,44,45,46,47,48,49,50);;/q;2*+1/p-2 InChIKey BHIZAGSEYSMDSQ-UHFFFAOYSA-L SMILES [Na+].[Na+].[H]C(=C([H])c1cc(c2ccc(cc2[o+]1)N(CC)CCCS([O-])(=O)=O)C(C)(C)C)C([H])=C1N(CCCS([O-])(=O)=O)c2ccc(cc2C1(C)CCCC(O)=O)S([O-])(=O)=O Roles Classification Application(s): fluorochrome A fluorescent dye used to stain biological specimens. View more via ChEBI Ontology ChEBI Ontology Outgoing DY-682 (CHEBI:51975) has role fluorochrome (CHEBI:51217) DY-682 (CHEBI:51975) is a DY-682(2−) (CHEBI:63296) DY-682 (CHEBI:51975) is a organic sodium salt (CHEBI:38700) IUPAC Name disodium 2-(3-{4-tert-butyl-7-[ethyl(3-sulfonatopropyl)amino]chromenium-2-yl}prop-2-en-1-ylidene)-3-(3-carboxypropyl)-3-methyl-1-(3-sulfonatopropyl)indoline-5-sulfonate Last Modified 28 November 2011