Try beta.chemspider
- 20 of 21 defined stereocentres
1-O-[(5beta,9beta,10alpha,13alpha)-13-{[2-O-(6-Deoxy-beta-D-glucopyranosyl)-beta-D-glucopyranosyl]oxy}-18-oxokaur-16-en-18-yl]-beta-D-glucopyranose
C[C@H]1O[C@@H](O[C@H]2[C@H](O[C@@]34CC5(CC3=C)CC[C@@H]3[C@@](C)(CCC[C@@]3(C)[C@@H]5CC4)C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)O[C@H](CO)[C@@H](O)[C@@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
InChI=1S/C38H60O17/c1-16-12-37-10-6-20-35(3,8-5-9-36(20,4)34(49)54-32-29(48)26(45)23(42)18(13-39)51-32)21(37)7-11-38(16,15-37)55-33-30(27(46)24(43)19(14-40)52-33)53-31-28(47)25(44)22(41)17(2)50-31/h17-33,39-48H,1,5-15H2,2-4H3/t17-,18-,19-,20+,21+,22-,23-,24-,25+,26+,27+,28-,29-,30-,31+,32+,33+,35-,36-,37?,38+/m1/s1
CANAPGLEBDTCAF-ZWUCQZHCSA-N
CSID:81422646, http://www.chemspider.com/Chemical-Structure.81422646.html (accessed 05:12, Apr 27, 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
Advertisement
Spotlight