![FERNANDOSIDE;(+)-LYONIRESINOL-3A-[6-(4-HYDROXY-3-METHOXY-BENZOYL)]-O-BETA-GLUCOPYRANOSIDE](/api/spectrum/8ddtATbg0Mp/structure.png?h=300&w=458 "FERNANDOSIDE;(+)-LYONIRESINOL-3A-[6-(4-HYDROXY-3-METHOXY-BENZOYL)]-O-BETA-GLUCOPYRANOSIDE")
| SpectraBase Compound ID | I220JqDDOtA |
|---|---|
| InChI | InChI=1S/C36H44O16/c1-45-22-9-16(6-7-21(22)38)35(44)50-15-26-30(40)32(42)33(43)36(52-26)51-14-20-19(13-37)8-17-10-25(48-4)31(41)34(49-5)28(17)27(20)18-11-23(46-2)29(39)24(12-18)47-3/h6-7,9-12,19-20,26-27,30,32-33,36-43H,8,13-15H2,1-5H3/t19-,20-,26+,27+,30+,32-,33+,36+/m1/s1 |
| InChIKey | LVQMXTVSQMYOHE-ZWYQKBCSSA-N |
| Mol Weight | 732.7 g/mol |
| Molecular Formula | C36H44O16 |
| Exact Mass | 732.262935 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8ddtATbg0Mp |
|---|---|
| Name | FERNANDOSIDE;(+)-LYONIRESINOL-3A-[6-(4-HYDROXY-3-METHOXY-BENZOYL)]-O-BETA-GLUCOPYRANOSIDE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H44O16 |
| InChI | InChI=1S/C36H44O16/c1-45-22-9-16(6-7-21(22)38)35(44)50-15-26-30(40)32(42)33(43)36(52-26)51-14-20-19(13-37)8-17-10-25(48-4)31(41)34(49-5)28(17)27(20)18-11-23(46-2)29(39)24(12-18)47-3/h6-7,9-12,19-20,26-27,30,32-33,36-43H,8,13-15H2,1-5H3/t19-,20-,26+,27+,30+,32-,33+,36+/m1/s1 |
| InChIKey | LVQMXTVSQMYOHE-ZWYQKBCSSA-N |
| Literature Reference Author | T.KANCHANAPOOM,R.KASAI,K.YAMASAKI |
| Literature Reference Citation | PHYTOCHEM.,57,1245(2001) |
| Literature Reference DOI | 10.1016/S0031-9422(01)00212-6 |
| Molecular Weight | 732.736 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWVN2436 |