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- 17 of 17 defined stereocentres
(2S,3R,4S,5R)-2-{[(2S,3R,4S,5S)-3-Acetoxy-2-({(3S,8R,9S,10R,13S,14S,16S,17S)-3,17-dihydroxy-10,13-dimethyl-17-[(2S)-3-oxo-2-heptanyl]-2,3,4,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a ]phenanthren-16-yl}oxy)-5-hydroxytetrahydro-2H-pyran-4-yl]oxy}-4,5-dihydroxytetrahydro-2H-pyran-3-yl 4-methoxybenzoate
CCCCC(=O)[C@@H](C)[C@]1([C@H](C[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)O[C@H]5[C@@H]([C@H]([C@H](CO5)O)O[C@H]6[C@@H]([C@H]([C@@H](CO6)O)O)OC(=O)c7ccc(cc7)OC)OC(=O)C)O
InChI=1S/C46H66O15/c1-7-8-9-33(49)24(2)46(54)36(21-32-30-15-12-27-20-28(48)16-18-44(27,4)31(30)17-19-45(32,46)5)59-43-40(58-25(3)47)38(35(51)23-57-43)61-42-39(37(52)34(50)22-56-42)60-41(53)26-10-13-29(55-6)14-11-26/h10-14,24,28,30-32,34-40,42-43,48,50-52,54H,7-9,15-23H2,1-6H3/t24-,28+,30-,31+,32+,34-,35+,36+,37+,38+,39-,40-,42+,43+,44+,45+,46-/m1/s1
DFTUSALDAXRDKX-IMWNOVQYSA-N
CSID:20580604, http://www.chemspider.com/Chemical-Structure.20580604.html (accessed 18:44, Apr 24, 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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