Try beta.chemspider
- 10 of 10 defined stereocentres
- Non-standard isotope
(3beta,5alpha,6beta,8alpha,9beta,10alpha,13alpha,14beta,17alpha,20S)-3,6-Dihydroxy(2,2,3,4,4-~2~H_5_)cholan-24-oic acid
[2H][C@@]1(O)C([2H])([2H])[C@@H]2[C@H](O)C[C@@H]3[C@H]4CC[C@@H]([C@@H](C)CCC(O)=O)[C@]4(C)CC[C@H]3[C@]2(C)CC1([2H])[2H]
InChI=1S/C24H40O4/c1-14(4-7-22(27)28)17-5-6-18-16-13-21(26)20-12-15(25)8-10-24(20,3)19(16)9-11-23(17,18)2/h14-21,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16+,17-,18+,19+,20+,21+,23-,24-/m0/s1/i8D2,12D2,15D
DGABKXLVXPYZII-JKPHBGBASA-N
CSID:78076037, http://www.chemspider.com/Chemical-Structure.78076037.html (accessed 14:33, May 17, 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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