| SpectraBase Compound ID | I4rwn2XTqw1 |
|---|---|
| InChI | InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-41-36(52)34(50)38(29(17-46)58-41)59-42-37(53)39(32(48)22(4)56-42)60-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19?,20?,21-,22-,24?,25?,26?,27?,28?,29-,30?,31-,32-,33+,34-,35+,36-,37+,38-,39+,40-,41-,42-,43?,44?,45?/m1/s1 |
| InChIKey | HCPPBRALVBYRBU-LDTCFTLTSA-N |
| Mol Weight | 869.1 g/mol |
| Molecular Formula | C45H72O16 |
| Exact Mass | 868.482036 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K1ValvFq5Vi |
|---|---|
| Name | DIOSGENYL-ALPHA-L-RHAMNOPYRANOSYL-(1->3)-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H72O16 |
| InChI | InChI=1S/C45H72O16/c1-19-9-14-45(54-18-19)20(2)30-28(61-45)16-27-25-8-7-23-15-24(10-12-43(23,5)26(25)11-13-44(27,30)6)57-41-36(52)34(50)38(29(17-46)58-41)59-42-37(53)39(32(48)22(4)56-42)60-40-35(51)33(49)31(47)21(3)55-40/h7,19-22,24-42,46-53H,8-18H2,1-6H3/t19?,20?,21-,22-,24?,25?,26?,27?,28?,29-,30?,31-,32-,33+,34-,35+,36-,37+,38-,39+,40-,41-,42-,43?,44?,45?/m1/s1 |
| InChIKey | HCPPBRALVBYRBU-LDTCFTLTSA-N |
| Literature Reference Author | H.YU,X.W.HAN,X.M.LIU,B.YU,Y.Z.HUI,X.BAO |
| Literature Reference Citation | MAGN.RES.CHEM.,38,704(2000) |
| Literature Reference DOI | 10.1002/1097-458x(200008)38:8<704::aid-mrc709>3.0.co;2-8 |
| Molecular Weight | 869.057 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWSI3456 |