| 名称 | 内容 |
|---|---|
| kegg编号 | C17004 |
| pubchemid | 135626080 |
| name | Kalihinol A |
| formula | C22H33ClN2O2 |
| structure |  |
| Isomeric_Smiles | CC1=NN(C(=C1C#N)N=NC2=C(NN3C2=NC(=N3)C(C)CNC(=O)C4=CC=CC=C4S(=O)(=O)O)C(C)(C)C)C5=C(C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O |
| Cannoical_Smiles | CC1=NN(C(=C1C#N)N=NC2=C(NN3C2=NC(=N3)C(C)CNC(=O)C4=CC=CC=C4S(=O)(=O)O)C(C)(C)C)C5=C(C=CC(=C5)S(=O)(=O)O)S(=O)(=O)O |
| Gotenzyme_Smiles | [C-]#[N+][C@H]1[C@H]2[C@H]([C@]3(C)CC[C@@H](Cl)C(C)(C)O3)CC[C@@](C)([N+]#[C-])[C@@H]2CC[C@]1(C)O |
