| SpectraBase Compound ID | JrGms4DukuC |
|---|---|
| InChI | InChI=1S/C38H40N2O13/c1-5-20-23(16-26-31-22(12-13-39-26)21-8-6-7-9-25(21)40-31)24(36(46)49-4)17-51-37(20)53-38-35(45)34(44)33(43)29(52-38)18-50-30(41)11-10-19-14-27(47-2)32(42)28(15-19)48-3/h5-15,17,20,23,29,33-35,37-38,40,42-45H,1,16,18H2,2-4H3/b11-10+/t20-,23+,29-,33-,34+,35-,37+,38+/m0/s1 |
| InChIKey | YNILQZYTLAIKRM-YISWOXCKSA-N |
| Mol Weight | 732.7 g/mol |
| Molecular Formula | C38H40N2O13 |
| Exact Mass | 732.253039 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 76D4L7jbF4H |
|---|---|
| Name | (E)-O-(6')-CINNAMOYL-4''-HYDROXY-3'',5''-DIMETHOXY-LYALOSIDE |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C38H40N2O13 |
| InChI | InChI=1S/C38H40N2O13/c1-5-20-23(16-26-31-22(12-13-39-26)21-8-6-7-9-25(21)40-31)24(36(46)49-4)17-51-37(20)53-38-35(45)34(44)33(43)29(52-38)18-50-30(41)11-10-19-14-27(47-2)32(42)28(15-19)48-3/h5-15,17,20,23,29,33-35,37-38,40,42-45H,1,16,18H2,2-4H3/b11-10+/t20-,23+,29-,33-,34+,35-,37+,38+/m0/s1 |
| InChIKey | YNILQZYTLAIKRM-YISWOXCKSA-N |
| Literature Reference Author | J.VALVERDE,G.TAMAYO,M.HESSE |
| Literature Reference Citation | PHYTOCHEM.,52,1485(1999) |
| Literature Reference DOI | 10.1016/S0031-9422(99)00215-0 |
| Molecular Weight | 732.741 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN214 |