Try beta.chemspider
- 9 of 9 defined stereocentres
Methyl (5alpha,7beta,8alpha,9beta,10alpha,13alpha,14beta,17alpha,20S)-7-hydroxy-3-oxocholan-24-oate
C[C@@H](CCC(=O)OC)[C@@H]1CC[C@H]2[C@]1(CC[C@@H]3[C@@H]2[C@H](C[C@@H]4[C@]3(CCC(=O)C4)C)O)C
InChI=1S/C25H40O4/c1-15(5-8-22(28)29-4)18-6-7-19-23-20(10-12-25(18,19)3)24(2)11-9-17(26)13-16(24)14-21(23)27/h15-16,18-21,23,27H,5-14H2,1-4H3/t15-,16+,18-,19+,20+,21-,23+,24+,25-/m0/s1
XHRLTYUHWGHDCJ-HVTKZUMLSA-N
CSID:64872661, http://www.chemspider.com/Chemical-Structure.64872661.html (accessed 21:40, Apr 25, 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
Advertisement
Spotlight