Try beta.chemspider
- Double-bond stereo
- 14 of 14 defined stereocentres
(2S,3R,4S,5E)-4-Hydroxy-3,5-dimethyl-1-[(1R,2S,4aR,6S,8R,8aS)-1,3,6,8-tetramethyl-1-(3-oxopropanoyl)-1,2,4a,5,6,7,8,8a-octahydro-2-naphthalenyl]-5-octen-2-yl beta-D-glucopyranoside
CC/C=C(\C)/[C@H]([C@@H](C)[C@H](C[C@H]1C(=C[C@H]2C[C@H](C[C@H]([C@@H]2[C@@]1(C)C(=O)CC=O)C)C)C)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O
InChI=1S/C33H54O9/c1-8-9-18(3)28(37)21(6)24(41-32-31(40)30(39)29(38)25(16-35)42-32)15-23-19(4)14-22-13-17(2)12-20(5)27(22)33(23,7)26(36)10-11-34/h9,11,14,17,20-25,27-32,35,37-40H,8,10,12-13,15-16H2,1-7H3/b18-9+/t17-,20+,21-,22+,23-,24-,25+,27-,28+,29+,30-,31+,32+,33+/m0/s1
BKXWBAOGONGQJL-LFYCWKIZSA-N
CSID:4948158, http://www.chemspider.com/Chemical-Structure.4948158.html (accessed 05:29, Apr 25, 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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