CHEBI:51976 - DY-700

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ChEBI Name DY-700
ChEBI ID CHEBI:51976
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C39H44N2O6S
Net Charge 0
Average Mass 668.84254
Monoisotopic Mass 668.29201
InChI InChI=1S/C39H44N2O6S/c1-6-40(7-2)29-20-22-31-35(25-29)47-34(27(3)38(31)28-15-10-8-11-16-28)17-14-18-36-39(4,5)32-26-30(48(44,45)46)21-23-33(32)41(36)24-13-9-12-19-37(42)43/h8,10-11,14-18,20-23,25-26H,6-7,9,12-13,19,24H2,1-5H3,(H-,42,43,44,45,46)
InChIKey YWNYFNQFSHZTFP-UHFFFAOYSA-N
SMILES [H]C(=C([H])c1[o+]c2cc(ccc2c(-c2ccccc2)c1C)N(CC)CC)C([H])=C1N(CCCCCC(O)=O)c2ccc(cc2C1(C)C)S([O-])(=O)=O
Roles Classification
Application(s): fluorochrome
A fluorescent dye used to stain biological specimens.
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ChEBI Ontology
Outgoing DY-700 (CHEBI:51976) has role fluorochrome (CHEBI:51217)
DY-700 (CHEBI:51976) is a oxonium betaine (CHEBI:51978)
IUPAC Names
1-(5-carboxypentyl)-2-{3-[7-(diethylamino)-3-methyl-4-phenyl-2H-chromen-2-ylidene]prop-1-en-1-yl}-3,3-dimethyl-3H-indolium-5-sulfonate
1-(5-carboxypentyl)-2-{3-[7-(diethylamino)-3-methyl-4-phenylchromenium-2-yl]prop-2-en-1-ylidene}-3,3-dimethylindoline-5-sulfonate
Last Modified
28 November 2011