Try beta.chemspider
- Double-bond stereo
- 10 of 10 defined stereocentres
- Non-standard isotope
(3S,5Z,7E)-(25,26,26,26,27,27,27-~2~H_7_)-9,10-Secocholesta-5,7,10-trien-3-yl beta-D-glucopyranosiduronic acid
[2H]C(CCC[C@@H](C)[C@H]1CC[C@H]2/C(/CCC[C@@]21C)=C/C=C1/C[C@H](CCC/1=C)O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)(C([2H])([2H])[2H])C([2H])([2H])[2H]
InChI=1S/C33H52O7/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-33(25,26)5)12-13-23-18-24(14-11-20(23)3)39-32-29(36)27(34)28(35)30(40-32)31(37)38/h12-13,19,21,24-30,32,34-36H,3,6-11,14-18H2,1-2,4-5H3,(H,37,38)/b22-12+,23-13-/t21-,24+,25-,26+,27+,28+,29-,30+,32-,33-/m1/s1/i1D3,2D3,19D
HSMHKPFJPOTDCW-PAPHHEQCSA-N
CSID:107442045, http://www.chemspider.com/Chemical-Structure.107442045.html (accessed 12:39, May 3, 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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