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- 2 of 10 defined stereocentres
Methyl (3alpha,12alpha)-3-(benzoyloxy)-12-hydroxycholan-24-oate
CC(CCC(=O)OC)C1CCC2C1([C@H](CC3C2CCC4C3(CC[C@H](C4)OC(=O)c5ccccc5)C)O)C
InChI=1S/C32H46O5/c1-20(10-15-29(34)36-4)25-13-14-26-24-12-11-22-18-23(37-30(35)21-8-6-5-7-9-21)16-17-31(22,2)27(24)19-28(33)32(25,26)3/h5-9,20,22-28,33H,10-19H2,1-4H3/t20?,22?,23-,24?,25?,26?,27?,28+,31?,32?/m1/s1
WODXMQWAKLTMLB-ARQJWGRZSA-N
CSID:4453359, http://www.chemspider.com/Chemical-Structure.4453359.html (accessed 02:57, Apr 27, 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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