| 名称 | 内容 |
|---|---|
| kegg编号 | C19382 |
| pubchemid | 124490054 |
| name | D and C Red No. 9 |
| formula | (C17H12ClN2O4S)2. Ba |
| structure |  |
| Isomeric_Smiles | C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2[C@@H](C[C@@]4([C@@H]3C[C@H]([C@@]4(C(=O)CO)O)O)C)O |
| Cannoical_Smiles | CC12CCC(=O)C=C1CCC3C2C(CC4(C3CC(C4(C(=O)CO)O)O)C)O |
| Gotenzyme_Smiles | Cc1cc(/N=N/c2c(O)ccc3ccccc23)c(S(=O)(=O)[O-])cc1Cl.Cc1cc(/N=N/c2c(O)ccc3ccccc23)c(S(=O)(=O)[O-])cc1Cl.[Ba+2] |
