![LYSIMANOSIDE;#1;3-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSIDE]-13,28-EPOXY-3,16,22-OLE](/api/spectrum/AJ10KcSdxPY/structure.png?h=300&w=458 "LYSIMANOSIDE;#1;3-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSIDE]-13,28-EPOXY-3,16,22-OLE")
| SpectraBase Compound ID | H50jRgYoA8H |
|---|---|
| InChI | InChI=1S/C52H86O22/c1-46(2)14-28-51(29(56)15-46)21-68-52(28)13-9-27-48(5)11-10-31(47(3,4)26(48)8-12-49(27,6)50(52,7)16-30(51)57)72-44-40(74-43-39(65)36(62)33(59)23(17-53)69-43)35(61)25(20-67-44)71-45-41(37(63)34(60)24(18-54)70-45)73-42-38(64)32(58)22(55)19-66-42/h22-45,53-65H,8-21H2,1-7H3/t22-,23-,24-,25+,26+,27-,28-,29+,30-,31+,32+,33-,34-,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,48+,49-,50+,51-,52+/m1/s1 |
| InChIKey | LZJIQGPOPWOWTO-MUBKLSMESA-N |
| Mol Weight | 1063.2 g/mol |
| Molecular Formula | C52H86O22 |
| Exact Mass | 1062.561074 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AJ10KcSdxPY |
|---|---|
| Name | LYSIMANOSIDE;#1;3-O-[BETA-D-XYLOPYRANOSYL-(1->2)-BETA-D-GLUCOPYRANOSYL-(1->4)-[BETA-D-GLUCOPYRANOSYL-(1->2)]-ALPHA-L-ARABINOPYRANOSIDE]-13,28-EPOXY-3,16,22-OLE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C52H86O22 |
| InChI | InChI=1S/C52H86O22/c1-46(2)14-28-51(29(56)15-46)21-68-52(28)13-9-27-48(5)11-10-31(47(3,4)26(48)8-12-49(27,6)50(52,7)16-30(51)57)72-44-40(74-43-39(65)36(62)33(59)23(17-53)69-43)35(61)25(20-67-44)71-45-41(37(63)34(60)24(18-54)70-45)73-42-38(64)32(58)22(55)19-66-42/h22-45,53-65H,8-21H2,1-7H3/t22-,23-,24-,25+,26+,27-,28-,29+,30-,31+,32+,33-,34-,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,48+,49-,50+,51-,52+/m1/s1 |
| InChIKey | LZJIQGPOPWOWTO-MUBKLSMESA-N |
| Literature Reference Author | X.XIA,X.WEI,L.LIN |
| Literature Reference Citation | PHARMACOG.J.,5,119(2013) |
| Literature Reference DOI | 10.1016/j.phcgj.2013.05.001 |
| Molecular Weight | 1063.242 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWBT15046 |