Basic Information |
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Product Name: | SAIKOSAPONINB |
English Synonyms: | SAIKOSAPONINB |
MDL Number.: | MFCD17019232 |
H bond acceptor: | 13 |
H bond donor: | 9 |
Smile: | C[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2CC[C@]3([C@H]([C@]2(C)CO)CC[C@@]4([C@@H]3C=CC5=C6CC(CC[C@@]6([C@H](C[C@]54C)O)CO)(C)C)C)C)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O |
InChi: | InChI=1S/C42H68O13/c1-21-29(47)32(50)34(55-35-33(51)31(49)30(48)24(18-43)53-35)36(52-21)54-28-11-12-38(4)25(39(28,5)19-44)10-13-40(6)26(38)9-8-22-23-16-37(2,3)14-15-42(23,20-45)27(46)17-41(22,40)7/h8-9,21,24-36,43-51H,10-20H2,1-7H3/t21-,24-,25-,26-,27+,28+,29+,30-,31+,32+,33-,34-,35+,36+,38+,39+,40-,41-,42-/m1/s1 |
InChiKey: | InChIKey=FVCGWSDJNMAZAF-FDMOATHESA-N |
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