CHEBI:51952 - DY-636

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ChEBI Name DY-636
ChEBI ID CHEBI:51952
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C38H45N2NaO9S2
Net Charge 0
Average Mass 760.89200
Monoisotopic Mass 760.24642
InChI InChI=1S/C38H46N2O9S2.Na/c1-37(2,3)33-23-25(29-22-26-11-7-18-39-19-8-12-28(35(26)39)36(29)49-33)10-5-13-32-38(4,17-6-14-34(41)42)30-24-27(51(46,47)48)15-16-31(30)40(32)20-9-21-50(43,44)45;/h5,10,13,15-16,22-24H,6-9,11-12,14,17-21H2,1-4H3,(H2-,41,42,43,44,45,46,47,48);/q;+1/p-1
InChIKey SJHLXOGLOWIVBY-UHFFFAOYSA-M
SMILES [Na+].[H]C(=C([H])c1cc([o+]c2c3CCCN4CCCc(cc12)c34)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.
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ChEBI Ontology
Outgoing DY-636 (CHEBI:51952) has part DY-636(1−) (CHEBI:52823)
DY-636 (CHEBI:51952) has role fluorochrome (CHEBI:51217)
DY-636 (CHEBI:51952) is a organic sodium salt (CHEBI:38700)
IUPAC Name
sodium 2-[3-(11-tert-butyl-2,3,6,7-tetrahydro-1H,5H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-12-ium-9-yl)prop-2-en-1-ylidene]-3-(3-carboxypropyl)-3-methyl-1-(3-sulfonatopropyl)indoline-5-sulfonate
Last Modified
28 November 2011