Try beta.chemspider
- 9 of 11 defined stereocentres
- Non-standard isotope
(1beta,3alpha,5beta,8xi,9xi,12alpha)-1,3,12-Trihydroxy(2,2,3,4,4-~2~H_5_)cholan-24-oic acid
[2H][C@]1(O)C([2H])([2H])[C@H]2CCC3C(C[C@H](O)[C@]4(C)[C@H](CC[C@H]43)[C@H](C)CCC(O)=O)[C@@]2(C)[C@H](O)C1([2H])[2H]
InChI=1S/C24H40O5/c1-13(4-9-22(28)29)17-7-8-18-16-6-5-14-10-15(25)11-20(26)23(14,2)19(16)12-21(27)24(17,18)3/h13-21,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15+,16?,17-,18+,19?,20-,21+,23+,24-/m1/s1/i10D2,11D2,15D
DAKYVYUAVGJDRK-GZSYRDAGSA-N
CSID:107444608, http://www.chemspider.com/Chemical-Structure.107444608.html (accessed 14:28, Apr 26, 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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