Basic Information |
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Product Name: | ABBLIS AB1009486 |
English Synonyms: | ABBLIS AB1009486 |
MDL Number.: | MFCD11865018 |
H bond acceptor: | 22 |
H bond donor: | 13 |
Smile: | C[C@H]1[C@H]2[C@H](C[C@@H]3[C@@]2(CC[C@H]4[C@H]3CC=C5[C@@]4(CC[C@@H](C5)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O[C@@H]7[C@H]([C@H]([C@@H]([C@H](O7)C)O)O)O)O)O[C@@H]8[C@H]([C@H]([C@@H]([C@H](O8)C)O)O)O)C)C)O[C@@]1(CC[C@H](C)CO[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)CO)O)O)O)O |
InChi: | InChI=1S/C51H84O22/c1-20(19-65-45-39(60)38(59)35(56)30(17-52)69-45)9-14-51(64)21(2)32-29(73-51)16-28-26-8-7-24-15-25(10-12-49(24,5)27(26)11-13-50(28,32)6)68-48-44(72-47-41(62)37(58)34(55)23(4)67-47)42(63)43(31(18-53)70-48)71-46-40(61)36(57)33(54)22(3)66-46/h7,20-23,25-48,52-64H,8-19H2,1-6H3/t20-,21-,22+,23+,25-,26+,27-,28-,29-,30+,31+,32-,33+,34+,35+,36-,37-,38-,39+,40-,41-,42-,43+,44+,45+,46+,47+,48+,49-,50-,51+/m0/s1 |
InChiKey: | InChIKey=LVTJOONKWUXEFR-NDWSBZQQSA-N |
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