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CHEBI:45558 - Reactive Red 6 hapten
| Formula | C35H25N9O22S6 |
| Net Charge | 0 |
| Average Mass | 1116.028 |
| Monoisotopic Mass | 1114.94384 |
| SMILES | O=S(=O)(O)c1ccc(O)c(/N=N/c2c(S(=O)(=O)O)cc3c(S(=O)(=O)O)c(Nc4ncnc(Nc5ccc6c(O)c(/N=N/c7cc(S(=O)(=O)O)ccc7O)c(S(=O)(=O)O)cc6c5S(=O)(=O)O)n4)ccc3c2O)c1 |
| InChI | InChI=1S/C35H25N9O22S6/c45-24-7-1-14(67(49,50)51)9-22(24)41-43-28-26(69(55,56)57)11-18-16(30(28)47)3-5-20(32(18)71(61,62)63)38-34-36-13-37-35(40-34)39-21-6-4-17-19(33(21)72(64,65)66)12-27(70(58,59)60)29(31(17)48)44-42-23-10-15(68(52,53)54)2-8-25(23)46/h1-13,45-48H,(H,49,50,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H2,36,37,38,39,40)/b43-41+,44-42+ |
| InChIKey | PJONDRDKCIFXDA-CHQNLTHESA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Reactive Red 6 hapten (CHEBI:45558) is a azobenzenes (CHEBI:22682) |
| Reactive Red 6 hapten (CHEBI:45558) is a bis(azo) compound (CHEBI:48960) |
| Reactive Red 6 hapten (CHEBI:45558) is a diamino-1,3,5-triazine (CHEBI:38170) |
| Reactive Red 6 hapten (CHEBI:45558) is a naphthalenesulfonic acid (CHEBI:36336) |
| Incoming Relation(s) |
| Reactive Red 6 hapten copper complex (CHEBI:72307) has part Reactive Red 6 hapten (CHEBI:45558) |
| Synonyms | Source |
|---|---|
| 5-hydroxy-2-[[4-[[5-hydroxy-6-(2-hydroxy-5-sulfo-phenyl)diazenyl-1,7-disulfo-naphthalen-2-yl]amino]-1,3,5-triazin-2-yl]amino]-6-(2-hydroxy-5-sulfo-phenyl)diazenyl-naphthalene-1,7-disulfonic acid | PDBeChem |
| Azo-Dye Hapten | DrugBank |
| RR6 azo-dye hapten | ChEBI |
| Citations |
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