![#4;(25R)-3-BETA-[(O-BETA-D-GLUCOPYARNOSYL-(1->2)-O-[BETA-D-GLUCOPYARNOSYL-(1->3)]-BETA-D-GLUCOPYARNOSYL-(1->4)-BETA-D-GALACTOPYRANOSYL)-OXY]-2-ALPHA-HYDROXY-5-](/api/spectrum/2xJZZ1rUQhi/structure.png?h=300&w=458 "#4;(25R)-3-BETA-[(O-BETA-D-GLUCOPYARNOSYL-(1->2)-O-[BETA-D-GLUCOPYARNOSYL-(1->3)]-BETA-D-GLUCOPYARNOSYL-(1->4)-BETA-D-GALACTOPYRANOSYL)-OXY]-2-ALPHA-HYDROXY-5-")
| SpectraBase Compound ID | 9a6lwMzokeY |
|---|---|
| InChI | InChI=1S/C51H82O25/c1-18-7-8-51(67-17-18)19(2)32-26(76-51)10-23-21-6-5-20-9-25(24(56)12-49(20,3)22(21)11-31(57)50(23,32)4)68-45-41(66)38(63)42(30(16-55)72-45)73-48-44(75-47-40(65)37(62)34(59)28(14-53)70-47)43(35(60)29(15-54)71-48)74-46-39(64)36(61)33(58)27(13-52)69-46/h18-30,32-48,52-56,58-66H,5-17H2,1-4H3/t18-,19+,20+,21-,22+,23+,24-,25-,26+,27+,28-,29-,30+,32+,33+,34-,35-,36-,37+,38+,39+,40-,41+,42-,43+,44-,45+,46-,47+,48+,49+,50-,51+/m1/s1 |
| InChIKey | ZIALSUYQMJXFAT-BQHRZFEFSA-N |
| Mol Weight | 1095.2 g/mol |
| Molecular Formula | C51H82O25 |
| Exact Mass | 1094.514518 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2xJZZ1rUQhi |
|---|---|
| Name | #4;(25R)-3-BETA-[(O-BETA-D-GLUCOPYARNOSYL-(1->2)-O-[BETA-D-GLUCOPYARNOSYL-(1->3)]-BETA-D-GLUCOPYARNOSYL-(1->4)-BETA-D-GALACTOPYRANOSYL)-OXY]-2-ALPHA-HYDROXY-5- |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C51H82O25 |
| InChI | InChI=1S/C51H82O25/c1-18-7-8-51(67-17-18)19(2)32-26(76-51)10-23-21-6-5-20-9-25(24(56)12-49(20,3)22(21)11-31(57)50(23,32)4)68-45-41(66)38(63)42(30(16-55)72-45)73-48-44(75-47-40(65)37(62)34(59)28(14-53)70-47)43(35(60)29(15-54)71-48)74-46-39(64)36(61)33(58)27(13-52)69-46/h18-30,32-48,52-56,58-66H,5-17H2,1-4H3/t18-,19+,20+,21-,22+,23+,24-,25-,26+,27+,28-,29-,30+,32+,33+,34-,35-,36-,37+,38+,39+,40-,41+,42-,43+,44-,45+,46-,47+,48+,49+,50-,51+/m1/s1 |
| InChIKey | ZIALSUYQMJXFAT-BQHRZFEFSA-N |
| Literature Reference Author | A.YOKOSUKA,Y.MIMAKI |
| Literature Reference Citation | PHYTOCHEM.,70,807(2009) |
| Literature Reference DOI | 10.1016/j.phytochem.2009.02.013 |
| Molecular Weight | 1095.197 g/mol |
| Sample ID | 64698 |
| Solvent | C5D5N |