basic_info |
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Product_Name: | 7ALPHA,17ALPHA-DIMETHYL-5BETA-ANDROSTANE-3ALPHA,17BETA-DIOL GLUCURONIDE |
EnglishSynonyms: | 7ALPHA,17ALPHA-DIMETHYL-5BETA-ANDROSTANE-3ALPHA,17BETA-DIOL GLUCURONIDE |
pro_mdlNumber: | MFCD16294782 |
pro_acceptors: | 8 |
pro_donors: | 5 |
pro_smile: | C[C@@H]1C[C@@H]2C[C@@H](CC[C@@]2([C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C)O)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)C(=O)O)O)O)O |
InChi: | InChI=1S/C27H44O8/c1-13-11-14-12-15(34-24-21(30)19(28)20(29)22(35-24)23(31)32)5-8-25(14,2)16-6-9-26(3)17(18(13)16)7-10-27(26,4)33/h13-22,24,28-30,33H,5-12H2,1-4H3,(H,31,32)/t13-,14-,15-,16+,17+,18-,19+,20+,21-,22+,24-,25+,26+,27+/m1/s1 |
InChiKey: | InChIKey=PCMAVZDVKFXHRU-JAOKJGKVSA-N |
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