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CHEBI:51225 - Yo-Pro-1

ChEBI IDCHEBI:51225
ChEBI NameYo-Pro-1
Stars
DefinitionAn unsymmetrical C1 cyanine dye having 1,3-benzoxazol-2-yl and quinolinium-4-yl substituents.
Last Modified5 March 2012
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC24H29N3O.2I
Net Charge0
Average Mass629.324
Monoisotopic Mass629.04001
SMILES[H]C(=C1Oc2ccccc2N1C)c1cc[n+](CCC[N+](C)(C)C)c2ccccc12.[I-].[I-]
InChIInChI=1S/C24H29N3O.2HI/c1-25-22-12-7-8-13-23(22)28-24(25)18-19-14-16-26(15-9-17-27(2,3)4)21-11-6-5-10-20(19)21;;/h5-8,10-14,16,18H,9,15,17H2,1-4H3;2*1H/q+2;;/p-2
InChIKeyULHRKLSNHXXJLO-UHFFFAOYSA-L
Roles Classification
Applications:
fluorochrome  A fluorescent dye used to stain biological specimens.
dye 
ChEBI Ontology
Outgoing Relation(s)
Yo-Pro-1 (CHEBI:51225) has part Yo-Pro-1(2+) (CHEBI:52936)
Yo-Pro-1 (CHEBI:51225) has role fluorochrome (CHEBI:51217)
Yo-Pro-1 (CHEBI:51225) is a cyanine dye (CHEBI:37960)
Yo-Pro-1 (CHEBI:51225) is a organic iodide salt (CHEBI:50356)
Yo-Pro-1 (CHEBI:51225) is a quaternary ammonium salt (CHEBI:35273)
IUPAC Names 
4-[(3-methyl-1,3-benzoxazol-2(3H)-ylidene)methyl]-1-[3-(trimethylammonio)propyl]quinolinium diiodide
3-methyl-2-[{1-[3-(trimethylammonio)propyl]quinolin-4(1H)-ylidene}methyl]-1,3-benzoxazol-3-ium diiodide
Synonyms  Source
YO-Pro-1ChemIDplus
4-((3-methyl-2(3H)-benzoxazolylidene)methyl)-1-(3-(trimethylammonio)propyl)quinolinium diiodideChemIDplus
Registry NumbersSources
CAS:152068-09-2ChemIDplus