basic_info |
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Product_Name: | (2E)-3-(2-甲基-1H-咪唑-5-基)丙-2-烯酸酯 |
CAS: | 88446-86-0 |
中文同义词: | (2E)-3-(2-甲基-1H-咪唑-5-基)丙-2-烯酸酯 |
EnglishSynonyms: | SARCOCHENODEOXYCHOLIC ACID |
pro_mdlNumber: | MFCD01724814 |
pro_acceptors: | 6 |
pro_donors: | 3 |
pro_smile: | C[C@H](CCC(=O)N(C)CC(=O)O)[C@H]1CCC2[C@@]1(CCC3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C |
InChi: | InChI=1S/C27H45NO5/c1-16(5-8-23(31)28(4)15-24(32)33)19-6-7-20-25-21(10-12-27(19,20)3)26(2)11-9-18(29)13-17(26)14-22(25)30/h16-22,25,29-30H,5-15H2,1-4H3,(H,32,33)/t16-,17+,18-,19-,20?,21?,22-,25+,26+,27-/m1/s1 |
InChiKey: | InChIKey=YZYBIGOLMMAZFK-OAWMYSKNSA-N |
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