Try beta.chemspider
- Charge
- 17 of 19 defined stereocentres
Sodium (3beta,5xi,12alpha)-12,17,22-trihydroxy-18-oxo-18,20-epoxylanost-9(11)-en-3-yl 2-O-(6-deoxy-beta-D-glucopyranosyl)-4-O-sulfonato-beta-D-xylopyranoside
[Na+].O=S([O-])(=O)O[C@H]7[C@H](O)[C@@H](O[C@@H]1O[C@H](C)[C@@H](O)[C@H](O)[C@H]1O)[C@H](O[C@H]5CC[C@@]4(/C3=C/[C@H](O)[C@]62C(=O)O[C@@](C)(C(O)CCC(C)C)[C@@]6(O)CC[C@@]2(C)[C@@H]3CCC4C5(C)C)C)OC7
InChI=1S/C41H66O17S.Na/c1-19(2)9-12-25(42)39(8)40(49)16-15-38(7)21-10-11-24-36(4,5)27(13-14-37(24,6)22(21)17-26(43)41(38,40)35(48)57-39)55-34-32(29(45)23(18-53-34)58-59(50,51)52)56-33-31(47)30(46)28(44)20(3)54-33;/h17,19-21,23-34,42-47,49H,9-16,18H2,1-8H3,(H,50,51,52);/q;+1/p-1/t20-,21-,23-,24?,25?,26+,27+,28-,29+,30+,31-,32-,33+,34+,37-,38+,39+,40+,41-;/m1./s1
YYTQEGATMJLHSO-XTPKKZBPSA-M
CSID:9403375, http://www.chemspider.com/Chemical-Structure.9403375.html (accessed 02:35, Jul 4, 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
No predicted properties have been calculated for this compound.
Click to predict properties on the Chemicalize site
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