basic_info |
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Product_Name: | 2-FLUORO-DA CEP |
EnglishSynonyms: | 2-FLUORO-DA CEP |
pro_mdlNumber: | MFCD08062056 |
pro_acceptors: | 14 |
pro_donors: | 0 |
pro_smile: | CC(C)CN(CC(C)C)/C=N/c1c2c(nc(n1)F)n(cn2)[C@H]3C[C@@H]([C@H](O3)COC(c4ccccc4)(c5ccc(cc5)OC)c6ccc(cc6)OC)OP(N(C(C)C)C(C)C)OCCC#N |
InChi: | InChI=1S/C49H64FN8O6P/c1-33(2)28-56(29-34(3)4)31-53-46-45-47(55-48(50)54-46)57(32-52-45)44-27-42(64-65(62-26-14-25-51)58(35(5)6)36(7)8)43(63-44)30-61-49(37-15-12-11-13-16-37,38-17-21-40(59-9)22-18-38)39-19-23-41(60-10)24-20-39/h11-13,15-24,31-36,42-44H,14,26-30H2,1-10H3/b53-31+/t42-,43+,44+,65?/m0/s1 |
InChiKey: | InChIKey=WYNFAHDPDDRPAO-ZQYPYDHFSA-N |
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