Try beta.chemspider
- 20 of 20 defined stereocentres
(2beta,3beta)-2,23,28-Trihydroxy-28-oxoolean-12-en-3-yl 3-O-beta-D-glucopyranuronosyl-beta-D-galactopyranoside
O=C(O)[C@H]7O[C@@H](O[C@H]6[C@@H](O)[C@H](O[C@@H](O[C@@H]2[C@@](C)(CO)[C@@H]3CC[C@@]1(C)[C@]5(C(=C/C[C@@H]1[C@@]3(C)C[C@@H]2O)\[C@@H]4CC(C)(C)CC[C@]4(C(=O)O)CC5)C)[C@@H]6O)CO)[C@H](O)[C@@H](O)[C@@H]7O
InChI=1S/C42H66O16/c1-37(2)11-13-42(36(53)54)14-12-40(5)19(20(42)15-37)7-8-24-38(3)16-21(45)32(39(4,18-44)23(38)9-10-41(24,40)6)58-35-29(50)30(25(46)22(17-43)55-35)56-34-28(49)26(47)27(48)31(57-34)33(51)52/h7,20-32,34-35,43-50H,8-18H2,1-6H3,(H,51,52)(H,53,54)/t20-,21-,22+,23+,24+,25-,26-,27-,28+,29+,30-,31-,32-,34+,35-,38-,39-,40+,41+,42-/m0/s1
XJIFZGGAACMSEV-UNEDHRRJSA-N
CSID:9731679, http://www.chemspider.com/Chemical-Structure.9731679.html (accessed 11:21, 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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