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SMILES: COc1ccc2c(c1)c(ccn2)[C@@H]([C@H]1C[C@@H]2CCN1C[C@@H]2C=C)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O Canonical SMILES: OC[C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O.COc1ccc2c(c1)c(ccn2)[C@@H]([C@H]1C[C@@H]2CCN1C[C@@H]2C=C)O InChI: InChI=1S/C20H24N2O2.C6H12O7/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;7-1-2(8)3(9)4(10)5(11)6(12)13/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;2-5,7-11H,1H2,(H,12,13)/t13-,14-,19+,20-;2-,3-,4+,5-/m01/s1 InChIKey: XHKUDCCTVQUHJQ-LCYSNFERSA-N
CBID:157720 http://www.chembase.cn/molecule-157720.html