Try beta.chemspider
- 11 of 11 defined stereocentres
N-[(3alpha,5beta,7alpha,8xi,12alpha)-3,7-Dihydroxy-24-oxo-12-(sulfooxy)cholan-24-yl]glycine
C[C@H](CCC(=O)NCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)OS(=O)(=O)O)C
InChI=1S/C26H43NO9S/c1-14(4-7-22(30)27-13-23(31)32)17-5-6-18-24-19(12-21(26(17,18)3)36-37(33,34)35)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-29H,4-13H2,1-3H3,(H,27,30)(H,31,32)(H,33,34,35)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1
JZLKXIMBAHDSBJ-FRVQLJSFSA-N
CSID:20171650, http://www.chemspider.com/Chemical-Structure.20171650.html (accessed 19:12, May 5, 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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