- 9 of 10 defined stereocentres
(3alpha,5beta)-3-Hydroxy-1-sulfocholan-24-oic acid
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(C(C[C@H](C4)O)S(=O)(=O)O)C)C
InChI=1S/C24H40O6S/c1-14(4-9-22(26)27)18-7-8-19-17-6-5-15-12-16(25)13-21(31(28,29)30)24(15,3)20(17)10-11-23(18,19)2/h14-21,25H,4-13H2,1-3H3,(H,26,27)(H,28,29,30)/t14-,15-,16+,17+,18-,19+,20+,21?,23-,24+/m1/s1
NPAXEJXDVZWQSV-VKUMYMQBSA-N
CSID:20016713, http://www.chemspider.com/Chemical-Structure.20016713.html (accessed 16:59, Mar 28, 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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