| SpectraBase Compound ID | H7RMR9ubQGP |
|---|---|
| InChI | InChI=1S/C33H42O16/c1-16-26(39)27(40)31(46-17(2)35)33(45-16)49-30-28(41)32(44-12-11-19-6-9-22(42-3)21(37)13-19)47-24(15-34)29(30)48-25(38)10-7-18-5-8-20(36)23(14-18)43-4/h5-10,13-14,16,24,26-34,36-37,39-41H,11-12,15H2,1-4H3/b10-7+/t16-,24-,26-,27+,28-,29-,30-,31+,32-,33-/m0/s1 |
| InChIKey | MDKYHRJMEVATEZ-KZDDUIGHSA-N |
| Mol Weight | 694.7 g/mol |
| Molecular Formula | C33H42O16 |
| Exact Mass | 694.247285 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3o4LzjIitCm |
|---|---|
| Name | 1-O-(3-HYDROXY-4-METHOXYPHENETHYL)-4-O-FERULOYL-3-O-(2-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H42O16 |
| InChI | InChI=1S/C33H42O16/c1-16-26(39)27(40)31(46-17(2)35)33(45-16)49-30-28(41)32(44-12-11-19-6-9-22(42-3)21(37)13-19)47-24(15-34)29(30)48-25(38)10-7-18-5-8-20(36)23(14-18)43-4/h5-10,13-14,16,24,26-34,36-37,39-41H,11-12,15H2,1-4H3/b10-7+/t16-,24-,26-,27+,28-,29-,30-,31+,32-,33-/m0/s1 |
| InChIKey | MDKYHRJMEVATEZ-KZDDUIGHSA-N |
| Literature Reference Author | A.YAMAMOTO,S.NITTA,T.MIYASE,A.UENO,L.J.WU |
| Literature Reference Citation | PHYTOCHEM.,32,421(1993) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95007-6 |
| Molecular Weight | 694.687 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWMS4531 |