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CHEBI:87352 - alcian yellow

Default Structure
ChEBI IDCHEBI:87352
ChEBI Namealcian yellow
Stars
DefinitionAn organic chloride salt composed of {diazenediylbis[(4,1-phenylene)(6-methyl-1,3-benzothiazole-2,5-diyl)methylenesulfanediyl]}bis[(dimethylamino)-N,N-dimethylmethaniminium] and chloride ions in a 1:2 ratio.
Last Modified6 August 2015
SubmitterSteve
DownloadsMolfile
FormulaC40H46N8S4.2Cl
Net Charge0
Average Mass838.038
Monoisotopic Mass836.21053
SMILESCc1cc2sc(-c3ccc(N=Nc4ccc(-c5nc6cc(CSC(N(C)C)=[N+](C)C)c(C)cc6s5)cc4)cc3)nc2cc1CSC(N(C)C)=[N+](C)C.[Cl-].[Cl-]
InChIInChI=1S/C40H46N8S4.2ClH/c1-25-19-35-33(21-29(25)23-49-39(45(3)4)46(5)6)41-37(51-35)27-11-15-31(16-12-27)43-44-32-17-13-28(14-18-32)38-42-34-22-30(26(2)20-36(34)52-38)24-50-40(47(7)8)48(9)10;;/h11-22H,23-24H2,1-10H3;2*1H/q+2;;/p-2
InChIKeyPBTFWNIEMRWXLI-UHFFFAOYSA-L
Wikipedia
Roles Classification
Applications:
fluorochrome  A fluorescent dye used to stain biological specimens.
histological dye  A dye used in microscopic or electron microscopic examination of cells and tissues to give contrast and to highlight particular features of interest, such as nuclei and cytoplasm.
ChEBI Ontology
Outgoing Relation(s)
alcian yellow (CHEBI:87352) has part alcian yellow cation (CHEBI:87353)
alcian yellow (CHEBI:87352) has role fluorochrome (CHEBI:51217)
alcian yellow (CHEBI:87352) has role histological dye (CHEBI:77178)
alcian yellow (CHEBI:87352) is a iminium salt (CHEBI:35277)
alcian yellow (CHEBI:87352) is a organic chloride salt (CHEBI:36094)
IUPAC Name 
{diazenediylbis[(4,1-phenylene)(6-methyl-1,3-benzothiazole-2,5-diyl)methylenesulfanediyl]}bis[(dimethylamino)-N,N-dimethylmethaniminium] dichloride
Synonyms  Source
C.I. 12840ChEBI
C.I. Ingrain Yellow 1ChemIDplus
ingrain yellowChEBI
ingrain yellow 1ChEBI
Manual XrefsDatabases
Alcian_yellowWikipedia
Registry NumbersSources
CAS:61968-76-1ChemIDplus
Citations