| 名称 | 内容 |
|---|---|
| kegg编号 | C19307 |
| pubchemid | 124489979 |
| name | Trypan blue |
| formula | C34H24N6O14S4. 4Na |
| structure |  |
| Isomeric_Smiles | CC#C[C@@]1(CC[C@H]2[C@@]1(C[C@@H](C3=C4CCC(=O)C=C4CC[C@@H]23)C5=CC(=CC=C5)N(C)C)C)O |
| Cannoical_Smiles | CC#CC1(CCC2C1(CC(C3=C4CCC(=O)C=C4CCC23)C5=CC(=CC=C5)N(C)C)C)O |
| Gotenzyme_Smiles | Cc1cc(-c2ccc(/N=N/c3c(S(=O)(=O)[O-])cc4cc(S(=O)(=O)[O-])cc(N)c4c3O)c(C)c2)ccc1/N=N/c1c(S(=O)(=O)[O-])cc2cc(S(=O)(=O)[O-])cc(N)c2c1O.[Na+].[Na+].[Na+].[Na+] |
