提示: 按住Ctrl键可以同时选择多个官能团
SMILES: [Ca+2].[O-]C(=O)C(O)C.[O-]C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO Canonical SMILES: [O-]C(=O)C(O)C.OC[C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O.[Ca+2] InChI: InChI=1S/C6H12O7.C3H6O3.Ca/c7-1-2(8)3(9)4(10)5(11)6(12)13;1-2(4)3(5)6;/h2-5,7-11H,1H2,(H,12,13);2,4H,1H3,(H,5,6);/q;;+2/p-2/t2-,3-,4+,5-;;/m1../s1 InChIKey: PWKNEBQRTUXXLT-ZBHRUSISSA-L
CBID:126345 http://www.chembase.cn/molecule-126345.html