能提供下罗红霉素钙盐 的SMILES文件吗?
【已解决】罗红霉素钙盐 的SMILES文件提供下,谢谢!!!
最佳答案
回答者:网友
[Ca+2].O1[C@](C([H])([H])[H])([C@@]([H])(C([H])([H])[H])O[H])C([H])([H])C([H])([H])[C@]1([H])[C@]1(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]([H])(C([H])([H])[C@@]([H])([C@]([H])(C([H])([H])[H])[C@@]([H])([C@@]([H])(/C(/[H])=C(\[H])/C([H])([H])[C@@]([H])(C([H])([H])[H])C([H])([H])[C@@]([H])(C([H])([H])[H])/C(=C(\[H])/C([C@@]([H])(C([H])([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])C(=O)[O-])=O)/[O-])C([H])([H])[H])O[H])O[H])O1