CHEBI:52259 - QSY9 succinimidyl ester

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ChEBI Name QSY9 succinimidyl ester
ChEBI ID CHEBI:52259
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C43H39ClN4O13S3
Net Charge 0
Average Mass 951.43700
Monoisotopic Mass 950.13643
InChI InChI=1S/C43H38N4O13S3.ClH/c1-44(28-7-13-32(14-8-28)62(53,54)55)30-11-17-34-37(25-30)59-38-26-31(45(2)29-9-15-33(16-10-29)63(56,57)58)12-18-35(38)42(34)36-5-3-4-6-39(36)61(51,52)46-23-21-27(22-24-46)43(50)60-47-40(48)19-20-41(47)49;/h3-18,25-27H,19-24H2,1-2H3,(H-,53,54,55,56,57,58);1H
InChIKey PAOKYIAFAJVBKU-UHFFFAOYSA-N
SMILES [H+].[H+].[Cl-].CN(c1ccc(cc1)S([O-])(=O)=O)c1ccc2c(-c3ccccc3S(=O)(=O)N3CCC(CC3)C(=O)ON3C(=O)CCC3=O)c3ccc(cc3oc2c1)=[N+](C)c1ccc(cc1)S([O-])(=O)=O
Roles Classification
Application(s): fluorochrome
A fluorescent dye used to stain biological specimens.
dye

(via xanthene dye )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing QSY9 succinimidyl ester (CHEBI:52259) has part QSY9 succinimidyl ester(1+) (CHEBI:52891)
QSY9 succinimidyl ester (CHEBI:52259) has role fluorochrome (CHEBI:51217)
QSY9 succinimidyl ester (CHEBI:52259) is a organic chloride salt (CHEBI:36094)
QSY9 succinimidyl ester (CHEBI:52259) is a xanthene dye (CHEBI:37929)
IUPAC Name
N-(9-{2-[(4-{[(2,5-dioxopyrrolidin-1-yl)oxy]carbonyl}piperidin-1-yl)sulfonyl]phenyl}-6-[methyl(4-sulfophenyl)amino]-3H-xanthen-3-ylidene)-N-methyl-4-sulfoanilinium chloride
Synonym Source
QSY 9 ChEBI
Last Modified
31 July 2009