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- 17 of 19 defined stereocentres
1-O-[(3beta,5xi,18xi)-3-(beta-D-Glucopyranuronosyloxy)-23-hydroxy-28-oxoolean-12-en-28-yl]-beta-D-glucopyranose
O=C(O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)[C@@]75C(/C4=C/C[C@@H]3[C@@]6(C)CC[C@H](O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)[C@@](C)(CO)C6CC[C@@]3(C)[C@]4(C)CC5)CC(C)(C)CC7
InChI=1S/C42H66O15/c1-37(2)13-15-42(36(53)57-34-30(49)27(46)26(45)22(18-43)54-34)16-14-40(5)20(21(42)17-37)7-8-24-38(3)11-10-25(39(4,19-44)23(38)9-12-41(24,40)6)55-35-31(50)28(47)29(48)32(56-35)33(51)52/h7,21-32,34-35,43-50H,8-19H2,1-6H3,(H,51,52)/t21?,22-,23?,24-,25+,26-,27+,28+,29+,30-,31-,32+,34+,35-,38+,39+,40-,41-,42+/m1/s1
RZQHWSDMLZHIRN-OZFRVWKHSA-N
CSID:8254640, http://www.chemspider.com/Chemical-Structure.8254640.html (accessed 23:28, Jun 2, 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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