| 名称 | 内容 |
|---|---|
| kegg编号 | C20207 |
| pubchemid | 163311950 |
| name | Grandinol |
| formula | C13H16O5 |
| structure |  |
| Isomeric_Smiles | CC1=C(C(=C(N=C1C)N2C[C@H]3[C@H]([C@@H]4CC[C@@]3(C2)O4)CO)C#N)C |
| Cannoical_Smiles | CC1=C(C(=C(N=C1C)N2CC3C(C4CCC3(C2)O4)CO)C#N)C |
| Gotenzyme_Smiles | Cc1c(O)c(C=O)c(O)c(C(=O)CC(C)C)c1O |
