| SpectraBase Compound ID | 4QXQkKdSgDS |
|---|---|
| InChI | InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1 |
| InChIKey | FBBKXUQEUJYJAW-LXUWXYTASA-N |
| Mol Weight | 758.6 g/mol |
| Molecular Formula | C35H34O19 |
| Exact Mass | 758.169429 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B0QhFNXN765 |
|---|---|
| Name | QUERCETIN-3-O-(2-E-CAFFEOYL)-ALPHA-L-ARABINOPYRANOSYL-(1->2)-BETA-D-GALACTOPYRANOSIDE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C35H34O19 |
| InChI | InChI=1S/C35H34O19/c36-11-23-27(46)29(48)33(54-34-32(26(45)21(43)12-49-34)52-24(44)6-2-13-1-4-16(38)18(40)7-13)35(51-23)53-31-28(47)25-20(42)9-15(37)10-22(25)50-30(31)14-3-5-17(39)19(41)8-14/h1-10,21,23,26-27,29,32-43,45-46,48H,11-12H2/b6-2+/t21-,23+,26-,27-,29-,32+,33+,34-,35-/m0/s1 |
| InChIKey | FBBKXUQEUJYJAW-LXUWXYTASA-N |
| Literature Reference Author | A.BRACA,J.M.PRIETO,N.D.TOMMASI,F.TOME,I.MORELLI |
| Literature Reference Citation | PHYTOCHEM.,65,2921(2004) |
| Literature Reference DOI | 10.1016/j.phytochem.2004.07.013 |
| Molecular Weight | 758.644 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN30080 |