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- 22 of 22 defined stereocentres
(1R,2aR,3R,4R,5aS,6aS,6bR,10S,12aR,12bS,14aS,14bR)-4-Hydroxy-1-methoxy-2a,12a-dimethyl-3-(2-methyl-1-propen-1-yl)-3,4,5a,6,6a,6b,7,9,10,11,12,12a,12b,13,14,14b-hexadecahydro-2aH-2,5-dioxacyclopenta[1, 7]indeno[2,1-a]phenanthren-10-yl 2-O-[6-deoxy-4-O-(4-methoxybenzoyl)-alpha-L-mannopyranosyl]-beta-D-glucopyranoside
O=C(O[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O[C@H]1C)O[C@@H]8[C@@H](O)[C@H](O)[C@H](O[C@H]8O[C@@H]3C/C2=C/C[C@@H]7[C@@H]([C@@]2(C)CC3)CC[C@]46[C@H]5[C@@](O[C@H]4OC)([C@@H](\C=C(/C)C)[C@@H](O[C@H]5C[C@H]67)O)C)CO)c9ccc(OC)cc9
InChI=1S/C48H68O16/c1-22(2)18-31-42(55)60-32-20-30-28-13-10-25-19-27(14-16-46(25,4)29(28)15-17-48(30)40(32)47(31,5)64-45(48)57-7)59-44-39(35(51)34(50)33(21-49)61-44)63-43-37(53)36(52)38(23(3)58-43)62-41(54)24-8-11-26(56-6)12-9-24/h8-12,18,23,27-40,42-45,49-53,55H,13-17,19-21H2,1-7H3/t23-,27-,28+,29-,30-,31-,32-,33+,34+,35-,36-,37+,38-,39+,40+,42+,43-,44+,45+,46-,47-,48-/m0/s1
QHQXGHMCSYZYOX-AJSGWFERSA-N
CSID:8756950, http://www.chemspider.com/Chemical-Structure.8756950.html (accessed 01:30, May 3, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
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