| SpectraBase Compound ID | Hi0jf1i7BHl |
|---|---|
| InChI | InChI=1S/C45H49NO17/c1-22(47)55-21-41-42(59-26(5)51)43(60-27(6)52)44(61-28(7)53)45(63-41)62-40-20-34-31(18-39(40)58-25(4)50)16-36-33-19-37(54-8)38(57-24(3)49)17-30(33)13-14-46(36)35(34)15-29-9-11-32(12-10-29)56-23(2)48/h9-12,17-20,35-36,41-45H,13-16,21H2,1-8H3/t35-,36+,41+,42+,43-,44+,45+/m1/s1 |
| InChIKey | XDYLPKPKCCYHGJ-BJBWXGAZSA-N |
| Mol Weight | 875.9 g/mol |
| Molecular Formula | C45H49NO17 |
| Exact Mass | 875.300049 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 5Esz6KJwdNA |
|---|---|
| Name | (-)-3,11-DIACETOXY-8-ALPHA-(4'-ACETOXYBENZYL)-10-O-(BETA-GLUCOPYRANOSYLTETRAACETATE)-2-METHOXYBERBINE |
| Compound Number | 4 |
| 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)55-21-41-42(59-26(5)51)43(60-27(6)52)44(61-28(7)53)45(63-41)62-40-20-34-31(18-39(40)58-25(4)50)16-36-33-19-37(54-8)38(57-24(3)49)17-30(33)13-14-46(36)35(34)15-29-9-11-32(12-10-29)56-23(2)48/h9-12,17-20,35-36,41-45H,13-16,21H2,1-8H3/t35-,36+,41+,42+,43-,44+,45+/m1/s1 |
| InChIKey | XDYLPKPKCCYHGJ-BJBWXGAZSA-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 | UWLU28885 |