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CHEBI:51949 - DY-634

ChEBI IDCHEBI:51949
ChEBI NameDY-634
Stars
DefinitionAn organic trisodium salt having 2-(3-{7-[bis(3-sulfonatopropyl)amino]-2-tert-butylchromenium-4-yl}prop-2-en-1-ylidene)-1-(3-carboxypropyl)-3-methyl-3-(3-sulfonatopropyl)indoline-5-sulfonate as the counterion.
Last Modified28 November 2011
SubmitterInma Spiteri
DownloadsMolfile
FormulaC38H47N2O15S4.3Na
Net Charge0
Average Mass969.031
Monoisotopic Mass968.15524
SMILES[H]C(C([H])=C1N(CCCC(=O)O)c2ccc(S(=O)(=O)[O-])cc2C1(C)CCCS(=O)(=O)[O-])=C([H])c1cc(C(C)(C)C)[o+]c2cc(N(CCCS(=O)(=O)[O-])CCCS(=O)(=O)[O-])ccc12.[Na+].[Na+].[Na+]
InChIInChI=1S/C38H50N2O15S4.3Na/c1-37(2,3)35-24-27(30-15-13-28(25-33(30)55-35)39(18-8-22-57(46,47)48)19-9-23-58(49,50)51)10-5-11-34-38(4,17-7-21-56(43,44)45)31-26-29(59(52,53)54)14-16-32(31)40(34)20-6-12-36(41)42;;;/h5,10-11,13-16,24-26H,6-9,12,17-23H2,1-4H3,(H4-,41,42,43,44,45,46,47,48,49,50,51,52,53,54);;;/q;3*+1/p-3
InChIKeyZIBLTIZVAOHTDS-UHFFFAOYSA-K
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
DY-634 (CHEBI:51949) has part DY-634(3−) (CHEBI:63292)
DY-634 (CHEBI:51949) has role fluorochrome (CHEBI:51217)
DY-634 (CHEBI:51949) is a organic sodium salt (CHEBI:38700)
IUPAC Name 
trisodium 2-(3-{7-[bis(3-sulfonatopropyl)amino]-2-tert-butylchromenium-4-yl}prop-2-en-1-ylidene)-1-(3-carboxypropyl)-3-methyl-3-(3-sulfonatopropyl)indoline-5-sulfonate