| SpectraBase Compound ID | IfzBluWUhe0 |
|---|---|
| InChI | InChI=1S/C33H38O21/c1-9-17(36)20(39)24(43)31(49-9)48-8-15-18(37)21(40)25(44)33(52-15)53-28-19(38)16-13(35)6-12(7-14(16)51-27(28)10-2-4-11(34)5-3-10)50-32-26(45)22(41)23(42)29(54-32)30(46)47/h2-7,9,15,17-18,20-26,29,31-37,39-45H,8H2,1H3,(H,46,47)/t9-,15+,17-,18+,20+,21-,22+,23+,24+,25+,26-,29+,31+,32-,33-/m0/s1 |
| InChIKey | AVISVHAJGJXBKQ-PIJRHGGQSA-N |
| Mol Weight | 770.6 g/mol |
| Molecular Formula | C33H38O21 |
| Exact Mass | 770.190558 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5cQblQwOqWc |
|---|---|
| Name | KAEMPFEROL-3-O-BETA-RUTINOSIDE-7-O-BETA-GLUCURONIDE |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H38O21 |
| InChI | InChI=1S/C33H38O21/c1-9-17(36)20(39)24(43)31(49-9)48-8-15-18(37)21(40)25(44)33(52-15)53-28-19(38)16-13(35)6-12(7-14(16)51-27(28)10-2-4-11(34)5-3-10)50-32-26(45)22(41)23(42)29(54-32)30(46)47/h2-7,9,15,17-18,20-26,29,31-37,39-45H,8H2,1H3,(H,46,47)/t9-,15+,17-,18+,20+,21-,22+,23+,24+,25+,26-,29+,31+,32-,33-/m0/s1 |
| InChIKey | AVISVHAJGJXBKQ-PIJRHGGQSA-N |
| Literature Reference Author | J.BUDZIANOWSKI |
| Literature Reference Citation | PHYTOCHEM.,30,1679(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84233-I |
| Molecular Weight | 770.652 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU27514 |