Try beta.chemspider
- Double-bond stereo
- 4 of 9 defined stereocentres
Methyl (2E,5xi,9xi,13xi,17xi,18xi)-2-(2,3-dimethoxybenzylidene)-3-oxolup-20(29)-en-28-oate
CC(=C)[C@H]1C2C(CC[C@@]3(C2CCC4[C@]3(CCC5[C@@]4(C/C(=C\c6c(c(ccc6)OC)OC)/C(=O)[C@]5(C)C)C)C)C)(CC1)C(=O)OC
InChI=1S/C40H56O5/c1-24(2)27-16-19-40(35(42)45-10)21-20-38(6)28(32(27)40)14-15-31-37(5)23-26(22-25-12-11-13-29(43-8)33(25)44-9)34(41)36(3,4)30(37)17-18-39(31,38)7/h11-13,22,27-28,30-32H,1,14-21,23H2,2-10H3/b26-22+/t27-,28?,30?,31?,32?,37-,38+,39+,40?/m0/s1
WPSBODQYFORBIF-PQJUIOAWSA-N
CSID:21781510, http://www.chemspider.com/Chemical-Structure.21781510.html (accessed 17:22, May 16, 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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