| SpectraBase Compound ID | 7FUSvhnOIgl |
|---|---|
| InChI | InChI=1S/C42H54O19/c1-54-29-14-21(4-8-26(29)45)7-11-34(48)61-40-38(52)36(50)33(18-44)60-42(40)58-20-25(13-23-6-10-28(47)31(16-23)56-3)24(12-22-5-9-27(46)30(15-22)55-2)19-57-41-39(53)37(51)35(49)32(17-43)59-41/h4-11,14-16,24-25,32-33,35-47,49-53H,12-13,17-20H2,1-3H3/b11-7+/t24?,25?,32-,33-,35-,36-,37+,38+,39-,40-,41-,42-/m1/s1 |
| InChIKey | YJLKNRTVXKFZDT-LMOKARMMSA-N |
| Mol Weight | 862.9 g/mol |
| Molecular Formula | C42H54O19 |
| Exact Mass | 862.325929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BWH9w0cHHAO |
|---|---|
| Name | SDG+FEA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H54O19 |
| InChI | InChI=1S/C42H54O19/c1-54-29-14-21(4-8-26(29)45)7-11-34(48)61-40-38(52)36(50)33(18-44)60-42(40)58-20-25(13-23-6-10-28(47)31(16-23)56-3)24(12-22-5-9-27(46)30(15-22)55-2)19-57-41-39(53)37(51)35(49)32(17-43)59-41/h4-11,14-16,24-25,32-33,35-47,49-53H,12-13,17-20H2,1-3H3/b11-7+/t24?,25?,32-,33-,35-,36-,37+,38+,39-,40-,41-,42-/m1/s1 |
| InChIKey | YJLKNRTVXKFZDT-LMOKARMMSA-N |
| Literature Reference Author | K.STRUIJS,J.P.VINCKEN,R.VERHOEF,A.G.J.VORAGEN,H.GRUPPEN |
| Literature Reference Citation | PHYTOCHEM.,69,1250(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2007.11.010 |
| Molecular Weight | 862.879 g/mol |
| Sample ID | 44003 |
| Solvent | CD3OD |