| SpectraBase Compound ID | A50ZHz3K3nm |
|---|---|
| InChI | InChI=1S/C32H50O3/c1-19(2)21-10-11-24-30(21,7)16-17-32(9)27-22(12-15-31(24,32)8)29(6)14-13-26(35-20(3)33)28(4,5)25(29)18-23(27)34/h19,21,24-26H,10-18H2,1-9H3/t21-,24-,25+,26+,29-,30-,31+,32-/m1/s1 |
| InChIKey | NBQILXAQDYJQIE-RNDQJGEISA-N |
| Mol Weight | 482.7 g/mol |
| Molecular Formula | C32H50O3 |
| Exact Mass | 482.375995 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H4XVEQicIzI |
|---|---|
| Name | SUPINENOLONE-E-ACETATE |
| Compound Number | 7B |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H50O3 |
| InChI | InChI=1S/C32H50O3/c1-19(2)21-10-11-24-30(21,7)16-17-32(9)27-22(12-15-31(24,32)8)29(6)14-13-26(35-20(3)33)28(4,5)25(29)18-23(27)34/h19,21,24-26H,10-18H2,1-9H3/t21-,24-,25+,26+,29-,30-,31+,32-/m1/s1 |
| InChIKey | NBQILXAQDYJQIE-RNDQJGEISA-N |
| Literature Reference Author | R.TANAKA,S.MATSUNAGA |
| Literature Reference Citation | PHYTOCHEM.,30,4093(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)83474-Y |
| Molecular Weight | 482.747 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU28246 |