| SpectraBase Compound ID | 9oRWAXLRNIG |
|---|---|
| InChI | InChI=1S/C43H48O25/c1-60-22-8-15(2-5-19(22)48)3-7-27(51)61-14-26-31(54)33(56)36(59)41(65-26)67-39-34(57)29(52)25(13-45)64-43(39)68-40-35(58)30(53)24(12-44)63-42(40)66-38-32(55)28-21(50)10-17(46)11-23(28)62-37(38)16-4-6-18(47)20(49)9-16/h2-11,24-26,29-31,33-36,39-50,52-54,56-59H,12-14H2,1H3/b7-3+/t24-,25-,26-,29+,30-,31-,33+,34+,35+,36-,39-,40-,41+,42+,43+/m1/s1 |
| InChIKey | AZGSHRDQKXNYSL-XVVDWLNNSA-N |
| Mol Weight | 964.8 g/mol |
| Molecular Formula | C43H48O25 |
| Exact Mass | 964.248467 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GfGYn4heAcc |
|---|---|
| Name | QUERCETIN-3-O-(6-FERULOYL-BETA-GLUCOPYRANOSYL)-(1->2)-O-BETA-GALACTOPYRANOSYL-(1->2)-O-BETA-GLUCOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C43H48O25 |
| InChI | InChI=1S/C43H48O25/c1-60-22-8-15(2-5-19(22)48)3-7-27(51)61-14-26-31(54)33(56)36(59)41(65-26)67-39-34(57)29(52)25(13-45)64-43(39)68-40-35(58)30(53)24(12-44)63-42(40)66-38-32(55)28-21(50)10-17(46)11-23(28)62-37(38)16-4-6-18(47)20(49)9-16/h2-11,24-26,29-31,33-36,39-50,52-54,56-59H,12-14H2,1H3/b7-3+/t24-,25-,26-,29+,30-,31-,33+,34+,35+,36-,39-,40-,41+,42+,43+/m1/s1 |
| InChIKey | AZGSHRDQKXNYSL-XVVDWLNNSA-N |
| Literature Reference Author | I.MERFORT,V.WRAY,H.H.BARAKAT,S.A.M.HUSSEIN,M.A.M.NAWWAR,G.WI LLUHN |
| Literature Reference Citation | PHYTOCHEM.,46,359(1997) |
| Literature Reference DOI | 10.1016/s0031-9422(97)00296-3 |
| Molecular Weight | 964.839 g/mol |
| Sample ID | 44876 |
| Solvent | CD3OD |