| SpectraBase Compound ID | KVSh7s6oKir |
|---|---|
| InChI | InChI=1S/C39H42O14/c1-15-7-8-49-25(40)5-6-26(41)50-13-17-18-11-23-34(3,19-9-22(19)37(23,47)14-51-30(15)42)24-12-36(46)21-10-20(21)35(4)29(36)28(38(18,24)52-32(17)44)27-16(2)31(43)53-39(27,48)33(35)45/h7,19-24,33,45-48H,5-6,8-14H2,1-4H3/b15-7+/t19-,20-,21+,22+,23-,24+,33-,34+,35+,36+,37+,38+,39+/m1/s1 |
| InChIKey | VAOZXVGMCZGLOH-BQPKVCGRSA-N |
| Mol Weight | 734.8 g/mol |
| Molecular Formula | C39H42O14 |
| Exact Mass | 734.257456 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | nITmWhyHH0 |
|---|---|
| Name | HENRIOL-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C39H42O14 |
| InChI | InChI=1S/C39H42O14/c1-15-7-8-49-25(40)5-6-26(41)50-13-17-18-11-23-34(3,19-9-22(19)37(23,47)14-51-30(15)42)24-12-36(46)21-10-20(21)35(4)29(36)28(38(18,24)52-32(17)44)27-16(2)31(43)53-39(27,48)33(35)45/h7,19-24,33,45-48H,5-6,8-14H2,1-4H3/b15-7+/t19-,20-,21+,22+,23-,24+,33-,34+,35+,36+,37+,38+,39+/m1/s1 |
| InChIKey | VAOZXVGMCZGLOH-BQPKVCGRSA-N |
| Literature Reference Author | C.J.LI,D.M.ZHANG,Y.M.LUO,S.S.YU,Y.LU |
| Literature Reference Citation | PHYTOCHEM.,69,2867(2008) |
| Literature Reference DOI | 10.1016/j.phytochem.2008.08.022 |
| Molecular Weight | 734.754 g/mol |
| Sample ID | 63784 |
| Solvent | ACETONE-D6 |