![3,9,10-TRIACETOXY-8-ALPHA-[4'-O-(BETA-GLUCOPYRANOSYLTETRAACETATE)-BENZYL]-2-METHOXYBERBINE](/api/spectrum/GxR75a4gHA7/structure.png?h=300&w=458 "3,9,10-TRIACETOXY-8-ALPHA-[4'-O-(BETA-GLUCOPYRANOSYLTETRAACETATE)-BENZYL]-2-METHOXYBERBINE")
| SpectraBase Compound ID | 1f2oyPHl73k |
|---|---|
| InChI | InChI=1S/C45H49NO17/c1-22(47)55-21-39-42(59-26(5)51)43(60-27(6)52)44(61-28(7)53)45(63-39)62-32-12-9-29(10-13-32)17-35-40-31(11-14-36(56-23(2)48)41(40)58-25(4)50)18-34-33-20-37(54-8)38(57-24(3)49)19-30(33)15-16-46(34)35/h9-14,19-20,34-35,39,42-45H,15-18,21H2,1-8H3/t34-,35+,39+,42+,43-,44+,45+/m0/s1 |
| InChIKey | FOUDLMURTADNHY-IBAOCQDFSA-N |
| Mol Weight | 875.9 g/mol |
| Molecular Formula | C45H49NO17 |
| Exact Mass | 875.300049 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GxR75a4gHA7 |
|---|---|
| Name | 3,9,10-TRIACETOXY-8-ALPHA-[4'-O-(BETA-GLUCOPYRANOSYLTETRAACETATE)-BENZYL]-2-METHOXYBERBINE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C45H49NO17 |
| InChI | InChI=1S/C45H49NO17/c1-22(47)55-21-39-42(59-26(5)51)43(60-27(6)52)44(61-28(7)53)45(63-39)62-32-12-9-29(10-13-32)17-35-40-31(11-14-36(56-23(2)48)41(40)58-25(4)50)18-34-33-20-37(54-8)38(57-24(3)49)19-30(33)15-16-46(34)35/h9-14,19-20,34-35,39,42-45H,15-18,21H2,1-8H3/t34-,35+,39+,42+,43-,44+,45+/m0/s1 |
| InChIKey | FOUDLMURTADNHY-IBAOCQDFSA-N |
| Literature Reference Author | L.M.X.LOPES |
| Literature Reference Citation | PHYTOCHEM.,31,4005(1992) |
| Literature Reference DOI | 10.1016/S0031-9422(00)97573-3 |
| Molecular Weight | 875.881 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU28886 |