能提供下西红花苷(藏红花素,西红花苷I)的SMILES文件吗？
【已解决】西红花苷(藏红花素,西红花苷I)的SMILES文件提供下，谢谢！！！
最佳答案
回答者：网友
O1[C@]([H])(C([H])([H])O[H])[C@]([H])([C@@]([H])([C@]([H])([C@]1([H])OC([H])([H])[C@]1([H])[C@]([H])([C@@]([H])([C@]([H])([C@]([H])(OC(/C(=C(\[H])/C(/[H])=C(\[H])/C(=C(\[H])/C(/[H])=C(\[H])/C(/[H])=C(\C([H])([H])[H])/C(/[H])=C(\[H])/C(/[H])=C(\C([H])([H])[H])/C(=O)O[C@@]2([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[C@@]3([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(C([H])([H])O[H])O3)O[H])O[H])O[H])O2)O[H])O[H])O[H])/C([H])([H])[H])/C([H])([H])[H])=O)O1)O[H])O[H])O[H])O[H])O[H])O[H]
