| 名称 | 内容 |
|---|---|
| kegg编号 | C16001 |
| pubchemid | 47205312 |
| name | Reactive black 5 |
| formula | C26H21N5O19S6. 4Na |
| structure |  |
| Isomeric_Smiles | CN(CC(=O)NCC1=CC=NN1)C(=O)C2=CC=CO2 |
| Cannoical_Smiles | CN(CC(=O)NCC1=CC=NN1)C(=O)C2=CC=CO2 |
| Gotenzyme_Smiles | Nc1c(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)[O-])cc2)c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])c(/N=N/c3ccc(S(=O)(=O)CCOS(=O)(=O)[O-])cc3)c(O)c12.[Na+].[Na+].[Na+].[Na+] |
