Try beta.chemspider
- Charge
- Double-bond stereo
- 17 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-glycero-hexopyranosyl-(1->3)-beta-D-glycero-pentopyranosyl-(1->4)-6-deoxy-beta-D-glycero-hexop yranosyl-(1->2)-4-O-sulfonato-beta-D-glycero-pentopyranoside
CC1[C@H](C(C([C@@H](O1)OC2[C@@H](OC[C@H](C2O)OS(=O)(=O)[O-])O[C@H]3CC[C@@]4([C@@H]5CC[C@]67[C@H]([C@H](C[C@]6(C5=CC[C@H]4C3(C)C)C)OC(=O)C)[C@](OC7=O)(C)/C=C/C=C(C)C)C)O)O)O[C@H]8C(C([C@@H](CO8)O)O[C@H]9C(C([C@@H](C(O9)CO)O)OC)O)O.[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-MTFRRDCCSA-M
CSID:34981776, http://www.chemspider.com/Chemical-Structure.34981776.html (accessed 13:54, Jul 6, 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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