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- 8 of 9 defined stereocentres
Methyl (5beta,7beta,20xi)-7-hydroxy-3-oxocholan-24-oate
CC(CCC(=O)OC)[C@H]1CC[C@H]2[C@@H]3[C@@H](O)C[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C
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-RZEBXXHESA-N
CSID:76871172, http://www.chemspider.com/Chemical-Structure.76871172.html (accessed 19:40, Apr 30, 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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