Try beta.chemspider
- 18 of 18 defined stereocentres
(3alpha,5beta,8alpha,9beta,10alpha,14beta,17alpha,18alpha)-28-Hydroxy-28-oxoolean-12-en-3-yl 2-O-beta-L-glucopyranosyl-beta-L-glucopyranosiduronic acid
CC1(C)C[C@@H]2C3=CC[C@H]4[C@]5(C)CC[C@@H](O[C@H]6O[C@H]([C@H](O)[C@@H](O)[C@@H]6O[C@H]6O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]6O)C(O)=O)C(C)(C)[C@H]5CC[C@]4(C)[C@@]3(C)CC[C@@]2(CC1)C(O)=O
InChI=1S/C42H66O14/c1-37(2)14-16-42(36(51)52)17-15-40(6)20(21(42)18-37)8-9-24-39(5)12-11-25(38(3,4)23(39)10-13-41(24,40)7)54-35-32(29(47)28(46)31(55-35)33(49)50)56-34-30(48)27(45)26(44)22(19-43)53-34/h8,21-32,34-35,43-48H,9-19H2,1-7H3,(H,49,50)(H,51,52)/t21-,22+,23-,24+,25-,26+,27-,28-,29-,30+,31-,32+,34-,35+,39-,40+,41+,42-/m1/s1
WJQOMUVKRDJBGZ-ZHEDZTFKSA-N
CSID:82965913, http://www.chemspider.com/Chemical-Structure.82965913.html (accessed 18:34, Apr 26, 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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