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SMILES: s1c(nnc1C1CC1)NC(=O)CC[C@H]([C@@H]1[C@@]2([C@H]([C@H]3[C@@H]([C@@]4([C@H](C[C@@H]3O)C[C@@H](CC4)O)C)CC2)CC1)C)C Canonical SMILES: O[C@@H]1CC[C@]2([C@@H](C1)C[C@@H]([C@@H]1[C@@H]2CC[C@]2([C@H]1CC[C@@H]2[C@@H](CCC(=O)Nc1nnc(s1)C1CC1)C)C)O)C InChI: InChI=1S/C29H45N3O3S/c1-16(4-9-24(35)30-27-32-31-26(36-27)17-5-6-17)20-7-8-21-25-22(11-13-29(20,21)3)28(2)12-10-19(33)14-18(28)15-23(25)34/h16-23,25,33-34H,4-15H2,1-3H3,(H,30,32,35)/t16-,18+,19-,20-,21+,22+,23+,25+,28+,29-/m1/s1 InChIKey: ZAIPBWYDCQDCHE-YBQXDBLRSA-N
CBID:224603 http://www.chembase.cn/molecule-224603.html