Basic Information |
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Product Name: | BACOSIDE B |
English Synonyms: | BACOSIDE B |
MDL Number.: | MFCD03788768 |
H bond acceptor: | 13 |
H bond donor: | 8 |
Smile: | CC(=CCC[C@@](C)([C@@H]1[C@H]2CC[C@H]3[C@]([C@@]2(CC1=O)C)(CC[C@@H]4[C@@]3(CCC(C4(C)C)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)OC6[C@@H]([C@H]([C@H](CO6)O)O)O)O)O)CO)C)O)C |
InChi: | InChI=1S/C41H68O13/c1-21(2)9-8-14-40(7,50)29-22-10-11-27-38(5,39(22,6)17-23(29)44)15-12-26-37(3,4)28(13-16-41(26,27)20-43)53-36-33(49)31(47)34(25(18-42)52-36)54-35-32(48)30(46)24(45)19-51-35/h9,22,24-36,42-43,45-50H,8,10-20H2,1-7H3/t22-,24+,25-,26+,27+,28?,29-,30+,31-,32-,33-,34-,35?,36+,38-,39-,40+,41-/m1/s1 |
InChiKey: | InChIKey=LKCTWIIDXXXXAR-ONFVQLDPSA-N |
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