Try beta.chemspider
- 7 of 9 defined stereocentres
- Non-standard isotope
(3alpha,5beta,9xi,17xi)-3-Hydroxy(2,2,3,4,4-~2~H_5_)cholan-24-oic acid
C[C@H](CCC(=O)O)C1CC[C@H]2[C@@H]3CC[C@@H]4C([2H])([2H])[C@@]([2H])(C([2H])([2H])C[C@]4(C)C3CC[C@]12C)O [2H][C@]1(C(C[C@]2([C@@H](C1([2H])[2H])CC[C@@H]3C2CC[C@]4([C@H]3CCC4[C@H](C)CCC(=O)O)C)C)([2H])[2H])O
InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16-,17-,18+,19?,20+,21?,23+,24-/m1/s1/i10D2,14D2,17D
SMEROWZSTRWXGI-VRVMTDSBSA-N
CSID:58782213, http://www.chemspider.com/Chemical-Structure.58782213.html (accessed 08:28, Apr 24, 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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