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| Formula | C34H24N6O14S4.4Na |
| Net Charge | 0 |
| Average Mass | 960.822 |
| Monoisotopic Mass | 959.98241 |
| SMILES | Cc1cc(-c2ccc(N=Nc3ccc4c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c(N)c4c3O)c(C)c2)ccc1N=Nc1ccc2c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c(N)c2c1O.[Na+].[Na+].[Na+].[Na+] |
| InChI | InChI=1S/C34H28N6O14S4.4Na/c1-15-11-17(3-7-21(15)37-39-23-9-5-19-25(55(43,44)45)13-27(57(49,50)51)31(35)29(19)33(23)41)18-4-8-22(16(2)12-18)38-40-24-10-6-20-26(56(46,47)48)14-28(58(52,53)54)32(36)30(20)34(24)42;;;;/h3-14,41-42H,35-36H2,1-2H3,(H,43,44,45)(H,46,47,48)(H,49,50,51)(H,52,53,54);;;;/q;4*+1/p-4 |
| InChIKey | ATNOAWAQFYGAOY-UHFFFAOYSA-J |
| Wikipedia |
|---|
| Roles Classification |
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| Biological Roles: | teratogenic agent A role played by a chemical compound in biological systems with adverse consequences in embryo developments, leading to birth defects, embryo death or altered development, growth retardation and functional defect. sodium channel blocker An agent that inhibits sodium influx through cell membranes. |
| 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) |
| Evans blue (CHEBI:82467) has part Evans blue(4−) (CHEBI:87636) |
| Evans blue (CHEBI:82467) has role fluorochrome (CHEBI:51217) |
| Evans blue (CHEBI:82467) has role histological dye (CHEBI:77178) |
| Evans blue (CHEBI:82467) has role sodium channel blocker (CHEBI:38633) |
| Evans blue (CHEBI:82467) has role teratogenic agent (CHEBI:50905) |
| Evans blue (CHEBI:82467) is a organic sodium salt (CHEBI:38700) |
| IUPAC Name |
|---|
| tetrasodium 6,6'-{(3,3'-dimethyl[1,1'-biphenyl]-4,4'-diyl)bis[diazene-2,1-diyl]}bis(4-amino-5-hydroxynaphthalene-1,3-disulfonate) |
| Synonyms | Source |
|---|---|
| C.I. 23860 | ChEBI |
| azovan blue | ChEBI |
| direct blue 53 | ChEBI |
| 4,4'-Bis(1-amino-8-hydroxy-2,4-disulpho-7-naphthylazo)-3,3'-bitolyl, tetrasodium salt | ChemIDplus |
| C.I. direct blue 53 tetrasodium salt | ChemIDplus |
| 4,4'-Bis(7-(1-amino-8-hydroxy-2,4-disulpho)naphthylazo)-3,3'-bitolyl, tetrasodium salt | ChemIDplus |
| Manual Xrefs | Databases |
|---|---|
| C19422 | KEGG COMPOUND |
| Evans_Blue_(dye) | Wikipedia |
| Registry Numbers | Sources |
|---|---|
| Reaxys:7110511 | Reaxys |
| CAS:314-13-6 | KEGG COMPOUND |
| CAS:314-13-6 | ChemIDplus |
| Citations |
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