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SMILES: [C@@H]12[C@]3([C@H]([C@@H]([C@@](C[C@H]([C@]1(C)[C@@H](CC3)C)OC(=O)CSC(C)(CNC(=O)[C@@H](C(C)C)N)C)(C=C)C)O)C)CCC2=O.Cl Canonical SMILES: C=C[C@]1(C)C[C@@H](OC(=O)CSC(CNC(=O)[C@@H](C(C)C)N)(C)C)[C@]2(C)[C@H](C)CC[C@]3([C@H]([C@@H]1O)C)[C@H]2C(=O)CC3.Cl InChI: InChI=1S/C31H52N2O5S.ClH/c1-10-29(8)15-22(38-23(35)16-39-28(6,7)17-33-27(37)24(32)18(2)3)30(9)19(4)11-13-31(20(5)26(29)36)14-12-21(34)25(30)31;/h10,18-20,22,24-26,36H,1,11-17,32H2,2-9H3,(H,33,37);1H/t19-,20+,22-,24-,25+,26+,29-,30+,31+;/m1./s1 InChIKey: MFBPRQKHDIVLOJ-AFFLPQGKSA-N
CBID:313005 http://www.chembase.cn/molecule-313005.html