| SpectraBase Compound ID | 7X1ApJW9ZcE |
|---|---|
| InChI | InChI=1S/C28H30O17/c1-9(30)41-26-22(38)20(36)17(7-29)44-28(26)45-25-21(37)18-14(33)5-11(42-27-23(39)19(35)15(34)8-40-27)6-16(18)43-24(25)10-2-3-12(31)13(32)4-10/h2-6,15,17,19-20,22-23,26-29,31-36,38-39H,7-8H2,1H3/t15?,17-,19?,20+,22+,23?,26-,27?,28+/m1/s1 |
| InChIKey | KHNQNAFACHGRJW-ZNOIVVBDSA-N |
| Mol Weight | 638.53 g/mol |
| Molecular Formula | C28H30O17 |
| Exact Mass | 638.148299 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9izBZvmZsRK |
|---|---|
| Name | QUERCETIN-3-O-BETA-(2''-ACETYL)-GALACTOPYRANOSIDE-7-O-ALPHA-ARABINOPYRANOSIDE |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H30O17 |
| InChI | InChI=1S/C28H30O17/c1-9(30)41-26-22(38)20(36)17(7-29)44-28(26)45-25-21(37)18-14(33)5-11(42-27-23(39)19(35)15(34)8-40-27)6-16(18)43-24(25)10-2-3-12(31)13(32)4-10/h2-6,15,17,19-20,22-23,26-29,31-36,38-39H,7-8H2,1H3/t15?,17-,19?,20+,22+,23?,26-,27?,28+/m1/s1 |
| InChIKey | KHNQNAFACHGRJW-ZNOIVVBDSA-N |
| Literature Reference Author | G.FICO,A.BRACA,A.R.BILIA,F.TOME,I.MORELLI |
| Literature Reference Citation | J.NAT.PROD.,63,1563(2000) |
| Literature Reference DOI | 10.1021/np000246h |
| Molecular Weight | 638.536 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWRU8658 |