能提供下纽莫康定 B0的SMILES文件吗?
【已解决】
纽莫康定 B0的SMILES文件提供下,谢谢!!!
最佳答案
回答者:网友
O([H])[C@@]1([H])C([H])([H])C([H])([H])N2C([C@]([H])([C@@]([H])(C([H])([H])C(N([H])[H])=O)O[H])N([H])C([C@]([H])([C@@]([H])([C@]([H])(C3C([H])=C([H])C(=C([H])C=3[H])O[H])O[H])O[H])N([H])C(C3([H])C([H])([H])[C@]([H])(C([H])([H])N3C([C@]([H])([C@@]([H])(C([H])([H])[H])O[H])N([H])C([C@]([H])(C([H])([H])[C@]([H])([C@]([H])(N([H])C(C21[H])=O)O[H])O[H])N([H])C(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])C([H])([H])[H])=O)=O)=O)O[H])=O)=O)=O