Try beta.chemspider
- Charge
- 26 of 27 defined stereocentres
Sodium (3beta)-16,18-dioxo-18,20-epoxylanosta-9(11),25-dien-3-yl 3-O-methyl-6-O-sulfonato-beta-D-glucopyranosyl-(1->3)-beta-D-glucopyranosyl-(1->4)-(4xi)-6-deoxy-beta-D-xylo-hexopyranosyl-(1->2)-beta- D-xylopyranoside
C[C@@H]1C([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](CO[C@H]2O[C@H]3CC[C@]4([C@H](C3(C)C)CC[C@@H]5C4=CC[C@@]67[C@]5(CC(=O)[C@@H]6[C@](OC7=O)(C)CCCC(=C)C)C)C)O)O)O)O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O[C@H]9[C@@H]([C@H]([C@@H]([C@H](O9)COS(=O)(=O)[O-])O)OC)O)O.[Na+]
InChI=1S/C54H84O25S.Na/c1-23(2)11-10-16-53(8)44-27(56)19-52(7)26-12-13-31-50(4,5)32(15-17-51(31,6)25(26)14-18-54(44,52)49(65)79-53)75-48-43(33(58)28(57)21-70-48)78-45-37(62)36(61)40(24(3)72-45)76-47-39(64)42(34(59)29(20-55)73-47)77-46-38(63)41(69-9)35(60)30(74-46)22-71-80(66,67)68;/h14,24,26,28-48,55,57-64H,1,10-13,15-22H2,2-9H3,(H,66,67,68);/q;+1/p-1/t24-,26-,28-,29-,30-,31+,32+,33+,34-,35-,36-,37-,38-,39-,40?,41+,42+,43-,44-,45+,46+,47+,48+,51-,52+,53+,54-;/m1./s1
CAEUHVNKGQKLOV-HSUAORTJSA-M
CSID:29212826, http://www.chemspider.com/Chemical-Structure.29212826.html (accessed 02:49, 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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