| SpectraBase Compound ID | AK7WPQY9h8H |
|---|---|
| InChI | InChI=1S/C28H24O16/c29-8-18-21(37)23(39)26(43-27(40)10-4-15(34)20(36)16(35)5-10)28(42-18)44-25-22(38)19-14(33)6-11(30)7-17(19)41-24(25)9-1-2-12(31)13(32)3-9/h1-7,18,21,23,26,28-37,39H,8H2/t18-,21-,23+,26-,28-/m1/s1 |
| InChIKey | PXGWEUQZDRUMRE-JURZZKALSA-N |
| Mol Weight | 616.48 g/mol |
| Molecular Formula | C28H24O16 |
| Exact Mass | 616.106435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LnhWAtFnvEn |
|---|---|
| Name | QUERCETIN-3-(2''-GALLOYL)-GLUCOSIDE |
| Compound Number | TABLE-#14/#5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H24O16 |
| InChI | InChI=1S/C28H24O16/c29-8-18-21(37)23(39)26(43-27(40)10-4-15(34)20(36)16(35)5-10)28(42-18)44-25-22(38)19-14(33)6-11(30)7-17(19)41-24(25)9-1-2-12(31)13(32)3-9/h1-7,18,21,23,26,28-37,39H,8H2/t18-,21-,23+,26-,28-/m1/s1 |
| InChIKey | PXGWEUQZDRUMRE-JURZZKALSA-N |
| Literature Reference Author | P.K.AGRAWAL,R.P.RASTOGI |
| Literature Reference Citation | HETEROCYCLES,16,2181(1981) |
| Literature Reference DOI | 10.3987/R-1981-12-2181 |
| Molecular Weight | 616.489 g/mol |
| Solvent | Unknown |
| Source File Reference | UWED9293 |