basic_info |
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Product_Name: | QUININE SALICYLATE HYDRATE |
CAS: | 750-90-3 |
EnglishSynonyms: | QUININE SALICYLATE HYDRATE |
pro_mdlNumber: | MFCD22572968 |
pro_acceptors: | 4 |
pro_donors: | 1 |
pro_smile: | COc1ccc2c(c1)c(ccn2)[C@H]([C@@H]3C[C@@H]4CCN3C[C@H]4C=C)O.c1ccc(c(c1)C(=O)O)O.O |
InChi: | InChI=1S/C20H24N2O2.C7H6O3.H2O/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;8-6-4-2-1-3-5(6)7(9)10;/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1-4,8H,(H,9,10);1H2/t13-,14+,19+,20-;;/m1../s1 |
InChiKey: | InChIKey=UWOFDVWPHULIEP-PNZNKOTLSA-N |
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