- 9 of 11 defined stereocentres
3-[Dimethyl(3-{[(3alpha,7alpha,8xi,9beta,12alpha,13alpha,17xi)-3,7,12-trihydroxy-24-oxocholan-24-yl]amino}propyl)ammonio]-1-propanesulfonate
C[C@H](CCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-])C1CC[C@@H]2[C@]1([C@H](C[C@@H]3[C@@H]2[C@@H](CC4[C@@]3(CC[C@H](C4)O)C)O)O)C
InChI=1S/C32H58N2O7S/c1-21(8-11-29(38)33-14-6-15-34(4,5)16-7-17-42(39,40)41)24-9-10-25-30-26(20-28(37)32(24,25)3)31(2)13-12-23(35)18-22(31)19-27(30)36/h21-28,30,35-37H,6-20H2,1-5H3,(H-,33,38,39,40,41)/t21-,22?,23-,24?,25+,26-,27-,28+,30-,31+,32+/m1/s1
UMCMPZBLKLEWAF-BJNYANQISA-N
CSID:26563819, http://www.chemspider.com/Chemical-Structure.26563819.html (accessed 03:23, Apr 20, 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