Try beta.chemspider
- Double-bond stereo
- 8 of 9 defined stereocentres
(3beta,5alpha,9beta,14xi)-4,4,8-Trimethyl-9,19-cycloergost-24(28)-en-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)acrylate
C[C@H](CCC(=C)C(C)C)[C@H]1CCC2[C@@]1(CC[C@]34[C@]2(CC[C@@H]5[C@]3(C4)CC[C@@H](C5(C)C)OC(=O)/C=C/c6ccc(c(c6)OC)O)C)C
InChI=1S/C41H60O4/c1-26(2)27(3)10-11-28(4)30-14-16-34-38(30,7)22-23-41-25-40(41)21-19-35(37(5,6)33(40)18-20-39(34,41)8)45-36(43)17-13-29-12-15-31(42)32(24-29)44-9/h12-13,15,17,24,26,28,30,33-35,42H,3,10-11,14,16,18-23,25H2,1-2,4-9H3/b17-13+/t28-,30-,33+,34?,35+,38-,39+,40-,41+/m1/s1
ZIWPYEIAPMTNTE-WTHHACQLSA-N
CSID:23089072, http://www.chemspider.com/Chemical-Structure.23089072.html (accessed 22:25, Apr 28, 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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