basic_info |
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| Product_Name: | GEMFIBROZIL BETA-D-GLUCURONIDE |
| CAS: | 91683-38-4 |
| EnglishSynonyms: | GEMFIBROZIL ACYL GLUCURONIDE ; 1-[5-(2,5-DIMETHYLPHENOXY)-2,2-DIMETHYLPENTANOATE] BETA-D-GLUCOPYRANUROIC ACID ; GEMFIBROZIL 1-O-BETA-GLUCURONIDE ; GEMFIBROZIL BETA-D-GLUCURONIDE |
| pro_mdlNumber: | MFCD00870898 |
| pro_acceptors: | 9 |
| pro_donors: | 4 |
| pro_smile: | Cc1ccc(c(c1)OCCCC(C)(C)C(=O)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)C(=O)O)O)O)O)C |
| InChi: | InChI=1S/C21H30O9/c1-11-6-7-12(2)13(10-11)28-9-5-8-21(3,4)20(27)30-19-16(24)14(22)15(23)17(29-19)18(25)26/h6-7,10,14-17,19,22-24H,5,8-9H2,1-4H3,(H,25,26)/t14-,15-,16+,17-,19-/m0/s1 |
| InChiKey: | InChIKey=CJMNXSKEVNPQOK-LVEJAMMSSA-N |
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