Basic Information |
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Product Name: | ABBLIS AB1008344 |
English Synonyms: | ABBLIS AB1008344 |
MDL Number.: | MFCD00210360 |
H bond acceptor: | 23 |
H bond donor: | 14 |
Smile: | C[C@@]12CCC[C@@]([C@H]1CC[C@]34[C@H]2CC[C@](C3)(C(=C)C4)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)(C)C(=O)O[C@H]8[C@@H]([C@@H]([C@H]([C@H](O8)CO)O)O)O |
InChi: | InChI=1S/C44H70O23/c1-17-11-43-9-5-22-41(2,7-4-8-42(22,3)40(59)66-37-32(57)29(54)25(50)19(13-46)61-37)23(43)6-10-44(17,16-43)67-38-33(58)34(27(52)21(15-48)62-38)64-39-35(30(55)26(51)20(14-47)63-39)65-36-31(56)28(53)24(49)18(12-45)60-36/h18-39,45-58H,1,4-16H2,2-3H3/t18-,19-,20-,21-,22+,23+,24-,25+,26-,27-,28+,29-,30+,31-,32-,33-,34+,35-,36+,37+,38+,39+,41-,42-,43-,44+/m1/s1 |
InChiKey: | InChIKey=NLSIFOOJILMUEI-KJUJJNEISA-N |
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