basic_info |
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Product_Name: | 环克索龙 |
CAS: | 52247-86-6 |
中文同义词: | 环克索龙 ; 乙基 4-羟基-2,6,6-三甲基环己-2-烯-1-羧酸酯 |
EnglishSynonyms: | CICLOXOLONE |
pro_mdlNumber: | MFCD00866913 |
pro_acceptors: | 7 |
pro_donors: | 2 |
pro_smile: | CC1([C@@H]2CC[C@@]3([C@@H]([C@]2(CC[C@@H]1OC(=O)[C@H]4CCCC[C@H]4C(=O)O)C)C(=O)C=C5[C@]3(CC[C@@]6([C@H]5C[C@@](CC6)(C)C(=O)O)C)C)C)C |
InChi: | InChI=1S/C38H56O7/c1-33(2)27-12-15-38(7)29(36(27,5)14-13-28(33)45-31(42)23-11-9-8-10-22(23)30(40)41)26(39)20-24-25-21-35(4,32(43)44)17-16-34(25,3)18-19-37(24,38)6/h20,22-23,25,27-29H,8-19,21H2,1-7H3,(H,40,41)(H,43,44)/t22-,23+,25+,27+,28+,29-,34-,35+,36+,37-,38-/m1/s1 |
InChiKey: | InChIKey=IPIHZIYZLLMCRF-APMXPKBPSA-N |
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