| SpectraBase Compound ID | 9BmrpP7D3TU |
|---|---|
| InChI | InChI=1S/C33H40O22/c34-6-15-19(38)23(42)27(46)31(53-15)49-10-4-13-18(14(5-10)52-33-29(48)25(44)21(40)17(8-36)55-33)22(41)26(45)30(50-13)9-1-2-12(11(37)3-9)51-32-28(47)24(43)20(39)16(7-35)54-32/h1-5,15-17,19-21,23-25,27-29,31-40,42-48H,6-8H2/t15-,16+,17-,19-,20+,21-,23+,24-,25+,27-,28+,29-,31-,32+,33-/m0/s1 |
| InChIKey | QRXWFKWOCWBGIW-CZBAZIPBSA-N |
| Mol Weight | 788.7 g/mol |
| Molecular Formula | C33H40O22 |
| Exact Mass | 788.201123 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6VREE67IJ9p |
|---|---|
| Name | QUERCETIN-5,7,4'-TRI-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H40O22 |
| InChI | InChI=1S/C33H40O22/c34-6-15-19(38)23(42)27(46)31(53-15)49-10-4-13-18(14(5-10)52-33-29(48)25(44)21(40)17(8-36)55-33)22(41)26(45)30(50-13)9-1-2-12(11(37)3-9)51-32-28(47)24(43)20(39)16(7-35)54-32/h1-5,15-17,19-21,23-25,27-29,31-40,42-48H,6-8H2/t15-,16+,17-,19-,20+,21-,23+,24-,25+,27-,28+,29-,31-,32+,33-/m0/s1 |
| InChIKey | QRXWFKWOCWBGIW-CZBAZIPBSA-N |
| Literature Reference Author | Y.TAMURA,K.I.NAKAJIMA,K.I.NAGAYASU,C.TAKABAYASHI |
| Literature Reference Citation | PHYTOCHEM.,59,275(2002) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00477-0 |
| Molecular Weight | 788.667 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN2572 |