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CHEBI:82305 - Pontamine sky blue 5B
| Formula | C34H24N6O16S4.4Na |
| Net Charge | 0 |
| Average Mass | 992.820 |
| Monoisotopic Mass | 991.97224 |
| SMILES | COc1cc(-c2ccc(/N=N/c3c(S(=O)(=O)[O-])cc4cc(S(=O)(=O)[O-])cc(N)c4c3O)c(OC)c2)ccc1/N=N/c1c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(N)c2c1O.[Na+].[Na+].[Na+].[Na+] |
| InChI | InChI=1S/C34H28N6O16S4.4Na/c1-55-25-9-15(3-5-23(25)37-39-31-27(59(49,50)51)11-17-7-19(57(43,44)45)13-21(35)29(17)33(31)41)16-4-6-24(26(10-16)56-2)38-40-32-28(60(52,53)54)12-18-8-20(58(46,47)48)14-22(36)30(18)34(32)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/b39-37+,40-38+;;;; |
| InChIKey | OLSOUGWNONTDCK-GPTZEZBUSA-J |
| Roles Classification |
|---|
| Biological Role: | carcinogenic agent A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities. |
| 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) |
| Pontamine sky blue 5B (CHEBI:82305) has part Pontamine sky blue 5B(4−) (CHEBI:88196) |
| Pontamine sky blue 5B (CHEBI:82305) has role carcinogenic agent (CHEBI:50903) |
| Pontamine sky blue 5B (CHEBI:82305) has role fluorochrome (CHEBI:51217) |
| Pontamine sky blue 5B (CHEBI:82305) has role histological dye (CHEBI:77178) |
| Pontamine sky blue 5B (CHEBI:82305) is a organic sodium salt (CHEBI:38700) |
| IUPAC Name |
|---|
| tetrasodium 3,3'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(diazene-2,1-diyl)]bis(5-amino-4-hydroxynaphthalene-2,7-disulfonate) |
| Synonyms | Source |
|---|---|
| C.I. 24400 | ChemIDplus |
| Tetrasodium 3,3'-((3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(azo))bis(5-amino-4-hydroxynaphthalene-2,7-disulphonate) | ChemIDplus |
| Chicago blue 4B | ChEBI |
| CI Direct Blue 15 | KEGG COMPOUND |
| C.I. Direct Blue 15, tetrasodium salt | ChemIDplus |
| Citations |
|---|