| SpectraBase Compound ID | KlsxZAUWePP |
|---|---|
| InChI | InChI=1S/C31H28O15/c1-42-29-18(35)11-19-22(24(29)38)25(39)30(28(44-19)14-5-8-16(33)17(34)10-14)46-31-27(41)26(40)23(37)20(45-31)12-43-21(36)9-4-13-2-6-15(32)7-3-13/h2-11,20,23,26-27,31-35,37-38,40-41H,12H2,1H3/b9-4+/t20-,23-,26+,27-,31+/m0/s1 |
| InChIKey | KJWWXDAOVGVYQG-FHEYKYOXSA-N |
| Mol Weight | 640.55 g/mol |
| Molecular Formula | C31H28O15 |
| Exact Mass | 640.14282 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CDoR3Aoiydh |
|---|---|
| Name | 6-METHOXY-QUERCETIN-3-O-BETA-D-6''-(PARA-COUMAROYL)-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H28O15 |
| InChI | InChI=1S/C31H28O15/c1-42-29-18(35)11-19-22(24(29)38)25(39)30(28(44-19)14-5-8-16(33)17(34)10-14)46-31-27(41)26(40)23(37)20(45-31)12-43-21(36)9-4-13-2-6-15(32)7-3-13/h2-11,20,23,26-27,31-35,37-38,40-41H,12H2,1H3/b9-4+/t20-,23-,26+,27-,31+/m0/s1 |
| InChIKey | KJWWXDAOVGVYQG-FHEYKYOXSA-N |
| Literature Reference Author | F.D.P.D.ANDRADE,L.C.D.SANTOS,A.L.DOKKEDAL,W.VILEGAS |
| Literature Reference Citation | PHYTOCHEM.,51,411(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00028-X |
| Molecular Weight | 640.554 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWUC317 |