| SpectraBase Compound ID | EPEjWKw8BTN |
|---|---|
| InChI | InChI=1S/C33H40O20/c1-10-19(37)23(41)26(44)31(48-10)47-9-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-14(36)6-12(35)7-15(18)50-29(30)11-2-4-13(5-3-11)49-32-27(45)24(42)20(38)16(8-34)51-32/h2-7,10,16-17,19-21,23-28,31-39,41-46H,8-9H2,1H3/t10-,16-,17+,19-,20-,21+,23+,24+,25-,26+,27-,28+,31+,32-,33-/m1/s1 |
| InChIKey | FYJOVKRHRUYSLY-BOVHWYBSSA-N |
| Mol Weight | 756.7 g/mol |
| Molecular Formula | C33H40O20 |
| Exact Mass | 756.211294 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8q4yG2DBMo6 |
|---|---|
| Name | KAEMPFEROL-3-RUTINOSIDE-4'-GLUCOSIDE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H40O20 |
| InChI | InChI=1S/C33H40O20/c1-10-19(37)23(41)26(44)31(48-10)47-9-17-21(39)25(43)28(46)33(52-17)53-30-22(40)18-14(36)6-12(35)7-15(18)50-29(30)11-2-4-13(5-3-11)49-32-27(45)24(42)20(38)16(8-34)51-32/h2-7,10,16-17,19-21,23-28,31-39,41-46H,8-9H2,1H3/t10-,16-,17+,19-,20-,21+,23+,24+,25-,26+,27-,28+,31+,32-,33-/m1/s1 |
| InChIKey | FYJOVKRHRUYSLY-BOVHWYBSSA-N |
| Literature Reference Author | P.Y.CHEN,Y.C.KUO,C.H.CHEN,Y.H.KUO,C.K.LEE |
| Literature Reference Citation | MOLECULES,14,1789(2009) |
| Literature Reference DOI | 10.3390/molecules14051789 |
| Molecular Weight | 756.669 g/mol |
| Sample ID | 69461 |
| Solvent | CD3OD |