| 名称 | 内容 |
|---|---|
| kegg编号 | C15062 |
| pubchemid | 17396059 |
| name | 17beta-Hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile |
| formula | C20H25NO2 |
| structure |  |
| Isomeric_Smiles | C1C(OC2=CC=CC=C2N1C(=O)C3=C(C=CS3)C4=CC=CC=C4)C(=O)N |
| Cannoical_Smiles | C1C(OC2=CC=CC=C2N1C(=O)C3=C(C=CS3)C4=CC=CC=C4)C(=O)N |
| Gotenzyme_Smiles | COc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@@]2(O)C#N |
