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CHEBI:52865 - LDS 751(1+)

ChEBI IDCHEBI:52865
ChEBI NameLDS 751(1+)
Stars
DefinitionA cationic C3 cyanine-type compound with 4-(dimethylamino)phenyl and 6-(dimethylamino)-1-ethylquinolinium-2-yl groups at either end.
Last Modified29 July 2009
SubmitterSteve
DownloadsMolfile
FormulaC25H30N3
Net Charge+1
Average Mass372.536
Monoisotopic Mass372.24342
SMILES[H]C(=Cc1ccc(N(C)C)cc1)C=C([H])c1ccc2cc(N(C)C)ccc2[n+]1CC
InChIInChI=1S/C25H30N3/c1-6-28-23(16-13-21-19-24(27(4)5)17-18-25(21)28)10-8-7-9-20-11-14-22(15-12-20)26(2)3/h7-19H,6H2,1-5H3/q+1
InChIKeyBCVRWZODRSBEQZ-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Application:
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
LDS 751(1+) (CHEBI:52865) has role fluorochrome (CHEBI:51217)
LDS 751(1+) (CHEBI:52865) is a quinolinium ion (CHEBI:52837)
LDS 751(1+) (CHEBI:52865) is a tertiary amine (CHEBI:32876)
Incoming Relation(s)
LDS 751 dye (CHEBI:52100) has part LDS 751(1+) (CHEBI:52865)
IUPAC Name 
6-(dimethylamino)-2-{4-[4-(dimethylamino)phenyl]buta-1,3-dien-1-yl}-1-ethylquinolinium
Synonym  Source
LDS 751 cationChEBI