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CHEBI:90179 - iodine green

ChEBI IDCHEBI:90179
ChEBI Nameiodine green
Stars
DefinitionAn iminium salt composed of (4-{[4-(dimethylamino)-3-methylphenyl][4-(trimethylazaniumyl)phenyl]methylidene}cyclohexa-2,5-dien-1-ylidene)(dimethyl)ammonium and chloride ions in a 1:2 ratio. A histological dye used for staining chromatin and amyloid.
Last Modified3 November 2015
SubmitterSteve
DownloadsMolfile
FormulaC27H35N3.2Cl
Net Charge0
Average Mass472.504
Monoisotopic Mass471.22080
SMILESCc1cc(C(=C2C=CC(=[N+](C)C)C=C2)c2ccc([N+](C)(C)C)cc2)ccc1N(C)C.[Cl-].[Cl-]
InChIInChI=1S/C27H35N3.2ClH/c1-20-19-23(13-18-26(20)29(4)5)27(21-9-14-24(15-10-21)28(2)3)22-11-16-25(17-12-22)30(6,7)8;;/h9-19H,1-8H3;2*1H/q+2;;/p-2
InChIKeyFRCAGVUKJQCWBD-UHFFFAOYSA-L
Roles Classification
Applications:
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.
fluorochrome  A fluorescent dye used to stain biological specimens.
ChEBI Ontology
Outgoing Relation(s)
iodine green (CHEBI:90179) has part iodine green(2+) (CHEBI:90181)
iodine green (CHEBI:90179) has role fluorochrome (CHEBI:51217)
iodine green (CHEBI:90179) has role histological dye (CHEBI:77178)
iodine green (CHEBI:90179) is a iminium salt (CHEBI:35277)
iodine green (CHEBI:90179) is a organic chloride salt (CHEBI:36094)
iodine green (CHEBI:90179) is a quaternary ammonium salt (CHEBI:35273)
IUPAC Name 
(4-{[4-(dimethylamino)-3-methylphenyl][4-(trimethylazaniumyl)phenyl]methylidene}cyclohexa-2,5-dien-1-ylidene)(dimethyl)ammonium dichloride
Synonym  Source
C.I. 42556ChEBI
Registry NumbersSources
CAS:33231-00-4ChemIDplus
Citations