basic_info |
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| Product_Name: | ISOPROPYL (2S,2'S)-1,1'-((2S,2'S)-2,2'-(4,4'-(BIPHENYL-4,4'-DIYL)BIS(1H-IMIDAZOLE-4,2-DIYL))BIS(PYRROLIDINE-2,1-DIYL))BIS(3-METHYL-1-OXOBUTANE-2,1-DIYL)DICARBAMATE |
| EnglishSynonyms: | ISOPROPYL (2S,2'S)-1,1'-((2S,2'S)-2,2'-(4,4'-(BIPHENYL-4,4'-DIYL)BIS(1H-IMIDAZOLE-4,2-DIYL))BIS(PYRROLIDINE-2,1-DIYL))BIS(3-METHYL-1-OXOBUTANE-2,1-DIYL)DICARBAMATE |
| pro_mdlNumber: | MFCD19053206 |
| pro_acceptors: | 14 |
| pro_donors: | 4 |
| pro_smile: | CC(C)[C@@H](C(=O)N1CCC[C@H]1c2[nH]cc(n2)c3ccc(cc3)c4ccc(cc4)c5c[nH]c(n5)[C@@H]6CCCN6C(=O)[C@H](C(C)C)NC(=O)OC(C)C)NC(=O)OC(C)C |
| InChi: | InChI=1S/C44H58N8O6/c1-25(2)37(49-43(55)57-27(5)6)41(53)51-21-9-11-35(51)39-45-23-33(47-39)31-17-13-29(14-18-31)30-15-19-32(20-16-30)34-24-46-40(48-34)36-12-10-22-52(36)42(54)38(26(3)4)50-44(56)58-28(7)8/h13-20,23-28,35-38H,9-12,21-22H2,1-8H3,(H,45,47)(H,46,48)(H,49,55)(H,50,56)/t35-,36-,37-,38-/m0/s1 |
| InChiKey: | InChIKey=AIPBHNBVGPSKEX-ZQWQDMLBSA-N |
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