basic_info |
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Product_Name: | (2S,2'S)-DIMETHYL 2,2'-(2S,2'S)-2,2'-(4,4'-(BIPHENYL-4,4'-DIYL)BIS(1H-IMIDAZOLE-4,2-DIYL))BIS(PYRROLIDINE-2,1-DIYL)BIS(OXOMETHYLENE)DIPYRROLIDINE-1-CARBOXYLATE |
EnglishSynonyms: | (2S,2'S)-DIMETHYL 2,2'-(2S,2'S)-2,2'-(4,4'-(BIPHENYL-4,4'-DIYL)BIS(1H-IMIDAZOLE-4,2-DIYL))BIS(PYRROLIDINE-2,1-DIYL)BIS(OXOMETHYLENE)DIPYRROLIDINE-1-CARBOXYLATE |
pro_mdlNumber: | MFCD19053201 |
pro_acceptors: | 14 |
pro_donors: | 2 |
pro_smile: | COC(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2c3[nH]cc(n3)c4ccc(cc4)c5ccc(cc5)c6c[nH]c(n6)[C@@H]7CCCN7C(=O)[C@@H]8CCCN8C(=O)OC |
InChi: | InChI=1S/C40H46N8O6/c1-53-39(51)47-21-5-9-33(47)37(49)45-19-3-7-31(45)35-41-23-29(43-35)27-15-11-25(12-16-27)26-13-17-28(18-14-26)30-24-42-36(44-30)32-8-4-20-46(32)38(50)34-10-6-22-48(34)40(52)54-2/h11-18,23-24,31-34H,3-10,19-22H2,1-2H3,(H,41,43)(H,42,44)/t31-,32-,33-,34-/m0/s1 |
InChiKey: | InChIKey=HUENFCNNGDUDTB-CUPIEXAXSA-N |
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