| SpectraBase Compound ID | 5TeZACuaWxr |
|---|---|
| InChI | InChI=1S/C46H48N2O17/c1-9-28-31(20-34-39-30(16-17-47-34)29-12-10-11-13-33(29)48-39)32(44(54)57-8)21-59-45(28)65-46-43(63-26(5)52)42(62-25(4)51)41(61-24(3)50)37(64-46)22-58-38(53)15-14-27-18-35(55-6)40(60-23(2)49)36(19-27)56-7/h9-19,21,28,31,37,41-43,45-46,48H,1,20,22H2,2-8H3/b15-14+/t28-,31+,37-,41-,42+,43-,45+,46+/m0/s1 |
| InChIKey | VGKSSFJTWUYLDQ-OOCDXSCISA-N |
| Mol Weight | 900.9 g/mol |
| Molecular Formula | C46H48N2O17 |
| Exact Mass | 900.295298 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 94dDAK8Sovn |
|---|---|
| Name | (E)-TETRA-(O-ACETYL)-O-(6')-CINNAMOYL-4''-HYDROXY-3'';5''-DIMETHOXY-LYALOSIDE |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H48N2O17 |
| InChI | InChI=1S/C46H48N2O17/c1-9-28-31(20-34-39-30(16-17-47-34)29-12-10-11-13-33(29)48-39)32(44(54)57-8)21-59-45(28)65-46-43(63-26(5)52)42(62-25(4)51)41(61-24(3)50)37(64-46)22-58-38(53)15-14-27-18-35(55-6)40(60-23(2)49)36(19-27)56-7/h9-19,21,28,31,37,41-43,45-46,48H,1,20,22H2,2-8H3/b15-14+/t28-,31+,37-,41-,42+,43-,45+,46+/m0/s1 |
| InChIKey | VGKSSFJTWUYLDQ-OOCDXSCISA-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 | 900.890 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVN215 |