| 名称 | 内容 |
|---|---|
| kegg编号 | C19370 |
| pubchemid | 124490042 |
| name | CI Acid Orange 3 |
| formula | C18H13N4O7S. Na |
| structure |  |
| Isomeric_Smiles | C[C@@H]1C[C@@H]2[C@@H]3CCC4=CC(=O)CC[C@@]4([C@@H]3C(=O)C[C@@]2([C@@H]1C(=O)C)C)C |
| Cannoical_Smiles | CC1CC2C3CCC4=CC(=O)CCC4(C3C(=O)CC2(C1C(=O)C)C)C |
| Gotenzyme_Smiles | O=[N+]([O-])c1ccc(Nc2ccc(Nc3ccccc3)c(S(=O)(=O)[O-])c2)c([N+](=O)[O-])c1.[Na+] |
