Try beta.chemspider
- Charge
- Double-bond stereo
- 27 of 27 defined stereocentres
Sodium (3beta,9beta,16beta,22E)-16-acetoxy-18-oxo-18,20-epoxylanosta-7,22,24-trien-3-yl 3-O-methyl-beta-D-glucopyranosyl-(1->3)-beta-D-xylopyranosyl-(1->4)-6-deoxy-beta-D-glucopyranosyl-(1->2)-4-O-sul fonato-beta-D-xylopyranoside
C[C@H]1O[C@H]([C@@H]([C@H]([C@@H]1O[C@@H]2OC[C@H]([C@@H]([C@H]2O)O[C@@H]3O[C@@H]([C@H]([C@@H]([C@H]3O)OC)O)CO)O)O)O)O[C@H]4[C@@H](OC[C@H]([C@@H]4O)OS(=O)(=O)[O-])O[C@@H]5[C@@]([C@H]6[C@@]([C@H]7C(=CC6)[C@]8([C@]9(C(=O)O[C@]([C@H]9[C@H](C8)OC(=O)C)(/C=C/C=C(C)C)C)CC7)C)(CC5)C)(C)C.[Na+]
InChI=1S/C55H84O25S.Na/c1-24(2)12-11-17-54(9)45-30(73-26(4)57)20-53(8)28-13-14-33-51(5,6)34(16-18-52(33,7)27(28)15-19-55(45,53)50(65)79-54)75-49-44(36(60)32(23-71-49)80-81(66,67)68)78-47-38(62)37(61)41(25(3)72-47)76-46-39(63)42(29(58)22-70-46)77-48-40(64)43(69-10)35(59)31(21-56)74-48;/h11-13,17,25,27,29-49,56,58-64H,14-16,18-23H2,1-10H3,(H,66,67,68);/q;+1/p-1/b17-11+;/t25-,27-,29-,30+,31-,32-,33+,34+,35-,36+,37-,38-,39-,40-,41-,42+,43+,44-,45-,46+,47+,48+,49+,52-,53+,54+,55-;/m1./s1
VSKBFJOYUHPBSQ-QVCUFHOCSA-M
CSID:16738019, http://www.chemspider.com/Chemical-Structure.16738019.html (accessed 17:54, Jun 29, 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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