| SpectraBase Compound ID | 1TkeTqFayJq |
|---|---|
| InChI | InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15-,17+,18-,20+,21-,24-,25+,26+/m0/s1 |
| InChIKey | NKFZLEYLWAFYEH-FDLNWENCSA-N |
| Mol Weight | 596.49 g/mol |
| Molecular Formula | C26H28O16 |
| Exact Mass | 596.137735 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 94ZnqWOsa8 |
|---|---|
| Name | QUERCETIN-3-SAMBUBIOSIDE;QUERCETIN-3-O-BETA-D-XYLOPYRANOSYL-(1->2)-O-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H28O16 |
| InChI | InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15-,17+,18-,20+,21-,24-,25+,26+/m0/s1 |
| InChIKey | NKFZLEYLWAFYEH-FDLNWENCSA-N |
| Literature Reference Author | R.F.WEBBY |
| Literature Reference Citation | PHYTOCHEM.,30,2443(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83680-J |
| Molecular Weight | 596.499 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI25297 |