Try beta.chemspider
- 21 of 23 defined stereocentres
(3beta,5beta,8xi,9xi)-3-{[beta-D-Glucopyranosyl-(1->6)-beta-D-glucopyranosyl-(1->4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyl]oxy}-14-hydroxy-19-oxocard-20(22)-enolide
O=C\1OC/C(=C/1)[C@H]2CC[C@@]8(O)[C@]2(C)CCC6C8CC[C@@H]7C[C@@H](O[C@@H]5O[C@H]([C@H](O[C@@H]4O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@H](O)[C@H]4O)[C@@H](OC)[C@@H]5O)C)CC[C@]67C=O
InChI=1S/C42H64O19/c1-18-35(61-38-33(51)31(49)29(47)26(60-38)16-56-37-32(50)30(48)28(46)25(14-43)59-37)36(54-3)34(52)39(57-18)58-21-6-10-41(17-44)20(13-21)4-5-24-23(41)7-9-40(2)22(8-11-42(24,40)53)19-12-27(45)55-15-19/h12,17-18,20-26,28-39,43,46-53H,4-11,13-16H2,1-3H3/t18-,20+,21-,22+,23?,24?,25+,26+,28+,29+,30-,31-,32+,33+,34-,35-,36-,37+,38-,39-,40+,41+,42-/m0/s1
WPNLWBRKPZXVGD-OHQANJSTSA-N
CSID:8163794, http://www.chemspider.com/Chemical-Structure.8163794.html (accessed 00:45, Apr 30, 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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