能提供下羧基苍术苷三钾盐的SMILES文件吗?
【已解决】羧基苍术苷三钾盐的SMILES文件提供下,谢谢!!!
最佳答案
回答者:网友
S(=O)(=O)(O[H])O[C@@]1([H])[C@@]([H])([C@@]([H])(C([H])([H])O[H])O[C@]([H])([C@]1([H])OC(C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])=O)O[C@]1([H])C([H])([H])C(C(=O)O[H])(C(=O)O[H])C2([H])C([H])([H])C([H])([H])[C@]34[C@]([H])(C(=C([H])[H])[C@@]([H])(C([H])([H])C([H])([H])[C@@]3([H])[C@@]2(C([H])([H])[H])C1([H])[H])C4([H])[H])O[H])OS(=O)(=O)O[H]