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SMILES: c1(c(n(c(c1c1ccccc1)c1ccc(cc1)F)CC[C@H](CC(CC(=O)[O-])O)O)C(C)C)C(=O)Nc1ccccc1.c1(c(n(c(c1c1ccccc1)c1ccc(cc1)F)CC[C@H](CC(CC(=O)[O-])O)O)C(C)C)C(=O)Nc1ccccc1.[Ca+2].O.O.O Canonical SMILES: O[C@@H](CC(CC(=O)[O-])O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1.O[C@@H](CC(CC(=O)[O-])O)CCn1c(C(C)C)c(c(c1c1ccc(cc1)F)c1ccccc1)C(=O)Nc1ccccc1.O.O.O.[Ca+2] InChI: InChI=1S/2C33H35FN2O5.Ca.3H2O/c2*1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40;;;;/h2*3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40);;3*1H2/q;;+2;;;/p-2/t2*26-,27?;;;;/m11..../s1 InChIKey: SHZPNDRIDUBNMH-INLVCVPQSA-L
CBID:179688 http://www.chembase.cn/molecule-179688.html