Try beta.chemspider
- Double-bond stereo
- 15 of 19 defined stereocentres
(3beta,5xi,9xi,12beta,13xi,17xi,20E)-12-Hydroxydammara-20(22),24-dien-3-yl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
O([C@@H]5[C@@H](O)[C@H](O)[C@H](O[C@H]5O[C@H]3CC[C@]2(C)C4C[C@@H](O)C1C(C(=C/C\C=C(/C)C)/C)CC[C@@]1(C)[C@]4(C)CCC2C3(C)C)CO)[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)CO
InChI=1S/C42H70O12/c1-21(2)10-9-11-22(3)23-12-16-42(8)30(23)24(45)18-28-40(6)15-14-29(39(4,5)27(40)13-17-41(28,42)7)53-38-36(34(49)32(47)26(20-44)52-38)54-37-35(50)33(48)31(46)25(19-43)51-37/h10-11,23-38,43-50H,9,12-20H2,1-8H3/b22-11+/t23?,24-,25-,26-,27?,28?,29+,30?,31-,32-,33+,34+,35-,36-,37+,38+,40+,41-,42-/m1/s1
NJUXRKMKOFXMRX-GEYPWSCQSA-N
CSID:8322677, http://www.chemspider.com/Chemical-Structure.8322677.html (accessed 19:53, Apr 29, 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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