| SpectraBase Compound ID | JyLEDcAntzt |
|---|---|
| InChI | InChI=1S/C50H74O17/c1-25(60-28(4)52)32-17-19-50(57)33-15-14-30-20-31(16-18-48(30,5)34(33)21-38(49(32,50)6)65-46(56)29-12-10-9-11-13-29)63-39-22-35(58-7)44(26(2)61-39)66-40-23-36(59-8)45(27(3)62-40)67-47-43(55)42(54)41(53)37(24-51)64-47/h9-14,25-27,31-45,47,51,53-55,57H,15-24H2,1-8H3/t25-,26-,27+,31+,32-,33?,34+,35+,36-,37-,38-,39+,40-,41-,42+,43-,44-,45+,47+,48+,49+,50+/m1/s1 |
| InChIKey | LPVZJRLEFPWLNQ-NPELULKDSA-N |
| Mol Weight | 947.1 g/mol |
| Molecular Formula | C50H74O17 |
| Exact Mass | 946.492601 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D0qkSYvKWHw |
|---|---|
| Name | #2;RUSSELIOSIDE-F;12-BETA-O-BENZOYL-20-O-ACETYL-BOUCERIN-3-O-BETA-D-GLUCOPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CYMAROPYRANOSYL-(1->4)-BETA-D-CY |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C50H74O17 |
| InChI | InChI=1S/C50H74O17/c1-25(60-28(4)52)32-17-19-50(57)33-15-14-30-20-31(16-18-48(30,5)34(33)21-38(49(32,50)6)65-46(56)29-12-10-9-11-13-29)63-39-22-35(58-7)44(26(2)61-39)66-40-23-36(59-8)45(27(3)62-40)67-47-43(55)42(54)41(53)37(24-51)64-47/h9-14,25-27,31-45,47,51,53-55,57H,15-24H2,1-8H3/t25-,26-,27+,31+,32-,33?,34+,35+,36-,37-,38-,39+,40-,41-,42+,43-,44-,45+,47+,48+,49+,50+/m1/s1 |
| InChIKey | LPVZJRLEFPWLNQ-NPELULKDSA-N |
| Literature Reference Author | E.ABDEL-SATTAR,A.A.AHMED,M.E.F.HAGAZY,M.A.FARAG,M.A.A.AL-YAH YA |
| Literature Reference Citation | PHYTOCHEM.,68,1459(2007) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.03.009 |
| Molecular Weight | 947.127 g/mol |
| Sample ID | 62350 |
| Solvent | DMSO-D6 |