Try beta.chemspider
- 6 of 8 defined stereocentres
(13alpha,17xi)-3,7,12-Trioxocholan-24-oic acid
C[C@H](CCC(=O)O)C1CC[C@@H]2[C@]1(C(=O)C[C@H]3[C@H]2C(=O)CC4[C@@]3(CCC(=O)C4)C)C
InChI=1S/C24H34O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-14,16-18,22H,4-12H2,1-3H3,(H,28,29)/t13-,14?,16?,17+,18+,22+,23+,24+/m1/s1
OHXPGWPVLFPUSM-NJIATAJUSA-N
CSID:24541162, http://www.chemspider.com/Chemical-Structure.24541162.html (accessed 17:43, 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
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