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CHEBI:51932 - cascade blue

ChEBI IDCHEBI:51932
ChEBI Namecascade blue
Stars
Last Modified4 November 2019
SubmitterInma Spiteri
DownloadsMolfile
FormulaC33H40N3
Net Charge+1
Average Mass478.704
Monoisotopic Mass478.32167
SMILESCCNc1cc(C(=C2C=CC(=[N+](CC)CC)C=C2)c2ccc(N(CC)CC)cc2)cc2ccccc12
InChIInChI=1S/C33H40N3/c1-6-34-32-24-28(23-27-13-11-12-14-31(27)32)33(25-15-19-29(20-16-25)35(7-2)8-3)26-17-21-30(22-18-26)36(9-4)10-5/h11-24,34H,6-10H2,1-5H3/q+1
InChIKeyCZPLANDPABRVHX-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)
cascade blue (CHEBI:51932) has role fluorochrome (CHEBI:51217)
cascade blue (CHEBI:51932) is a aminonaphthalene (CHEBI:38034)
IUPAC Name 
N-(4-{[4-(diethylamino)phenyl][4-(ethylamino)-2-naphthyl]methylene}cyclohexa-2,5-dien-1-ylidene)-N-ethylethanaminium
Synonym  Source
CI Pigment Blue 1ChEBI
Registry NumbersSources
CAS:1325-87-7ChemIDplus