Try beta.chemspider
- Double-bond stereo
- 6 of 6 defined stereocentres
- Non-standard isotope
(1R,3S,5Z)-5-[(2E)-2-{(1R,3aS,7aR)-1-[(2R)-7-Hydroxy-7-(~2~H_3_)methyl(8,8,8-~2~H_3_)-2-octanyl]-7a-methyloctahydro-4H-inden-4-ylidene}ethylidene]-4-methylene-1,3-cyclohexanediol (non-preferred name)
C[C@H](CCCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])O)[C@H]1CC[C@H]2/C(=C/C=C\3/C[C@H](C[C@@H](C3=C)O)O)/CCC[C@]12C [2H]C([2H])([2H])C(CCCC[C@@H](C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](C[C@@H](C3=C)O)O)C)(C([2H])([2H])[2H])O
InChI=1S/C28H46O3/c1-19(9-6-7-15-27(3,4)31)24-13-14-25-21(10-8-16-28(24,25)5)11-12-22-17-23(29)18-26(30)20(22)2/h11-12,19,23-26,29-31H,2,6-10,13-18H2,1,3-5H3/b21-11+,22-12-/t19-,23-,24-,25+,26+,28-/m1/s1/i3D3,4D3
WKTIGYIYJKESCJ-XPSQXMIMSA-N
CSID:58783765, http://www.chemspider.com/Chemical-Structure.58783765.html (accessed 18:22, 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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