| SpectraBase Compound ID | E5WLbtIpyCz |
|---|---|
| InChI | InChI=1S/C30H32O20/c31-7-15-20(38)23(41)25(43)29(48-15)46-10-4-13(34)19-14(5-10)47-27(9-1-2-11(32)12(33)3-9)28(22(19)40)50-30-26(44)24(42)21(39)16(49-30)8-45-18(37)6-17(35)36/h1-5,15-16,20-21,23-26,29-34,38-39,41-44H,6-8H2,(H,35,36)/t15-,16+,20-,21+,23+,24-,25-,26+,29-,30-/m1/s1 |
| InChIKey | ZLQYEKDHCDLAGO-XWWVXUSCSA-N |
| Mol Weight | 712.6 g/mol |
| Molecular Formula | C30H32O20 |
| Exact Mass | 712.148693 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DnN7snFMgWg |
|---|---|
| Name | QUERCETIN-3-O-(6''-O-MALONYL-BETA-D-GLUCOPYRANOSIDE)-7-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H32O20 |
| InChI | InChI=1S/C30H32O20/c31-7-15-20(38)23(41)25(43)29(48-15)46-10-4-13(34)19-14(5-10)47-27(9-1-2-11(32)12(33)3-9)28(22(19)40)50-30-26(44)24(42)21(39)16(49-30)8-45-18(37)6-17(35)36/h1-5,15-16,20-21,23-26,29-34,38-39,41-44H,6-8H2,(H,35,36)/t15-,16+,20-,21+,23+,24-,25-,26+,29-,30-/m1/s1 |
| InChIKey | ZLQYEKDHCDLAGO-XWWVXUSCSA-N |
| Literature Reference Author | K.GLUCHOFF-FIASSON,J.L.FIASSON,H.WATON |
| Literature Reference Citation | PHYTOCHEM.,45,1063(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00091-5 |
| Molecular Weight | 712.572 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSP431 |