basic_info |
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Product_Name: | 3-BETA-ACO-8,19-EPOXY-5,19-DIHYDROXY-5-BETA,14-BETA,17-ALPHA-CARD-20(22)-ENOLIDE |
EnglishSynonyms: | 3-BETA-ACO-8,19-EPOXY-5,19-DIHYDROXY-5-BETA,14-BETA,17-ALPHA-CARD-20(22)-ENOLIDE |
pro_mdlNumber: | MFCD00671017 |
pro_acceptors: | 7 |
pro_donors: | 2 |
pro_smile: | CC(=O)OC1CC[C@@]23C4CCC5(C(CCC5[C@@]4(CCC2(C1)O)OC3O)C6=CC(=O)OC6)C |
InChi: | InChI=1S/C25H34O7/c1-14(26)31-16-5-8-24-19-6-7-22(2)17(15-11-20(27)30-13-15)3-4-18(22)25(19,32-21(24)28)10-9-23(24,29)12-16/h11,16-19,21,28-29H,3-10,12-13H2,1-2H3/t16?,17?,18?,19?,21?,22?,23?,24-,25+/m0/s1 |
InChiKey: | InChIKey=XLUGVKZDVVAUBL-AIHFSYQHSA-N |
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