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CHEBI:51951 - DY-635

ChEBI IDCHEBI:51951
ChEBI NameDY-635
Stars
Last Modified28 November 2011
SubmitterInma Spiteri
DownloadsMolfile
FormulaC38H46N2O6S
Net Charge0
Average Mass658.861
Monoisotopic Mass658.30766
SMILES[H]C(C([H])=C1N(CCCCCC(=O)O)c2ccc(S(=O)(=O)[O-])cc2C1(C)C)=C([H])c1cc(C(C)(C)C)[o+]c2c3c4c(cc12)CCCN4CCC3
InChIInChI=1S/C38H46N2O6S/c1-37(2,3)33-23-25(29-22-26-13-10-19-39-20-11-14-28(35(26)39)36(29)46-33)12-9-15-32-38(4,5)30-24-27(47(43,44)45)17-18-31(30)40(32)21-8-6-7-16-34(41)42/h9,12,15,17-18,22-24H,6-8,10-11,13-14,16,19-21H2,1-5H3,(H-,41,42,43,44,45)
InChIKeyXWNKYHHWGYBOJU-UHFFFAOYSA-N
Roles Classification
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
DY-635 (CHEBI:51951) has role fluorochrome (CHEBI:51217)
DY-635 (CHEBI:51951) is a oxonium betaine (CHEBI:51978)
IUPAC Name 
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]-1-(5-carboxypentyl)-3,3-dimethylindoline-5-sulfonate