| SpectraBase Compound ID | 3VE7JWriCG8 |
|---|---|
| InChI | InChI=1S/C30H44O3/c1-17(2)18-9-10-21-27(18,5)13-14-29(7)25-19(31)15-22-26(3,4)23(33)11-12-28(22,6)24(25)20(32)16-30(21,29)8/h17-18,21-22H,9-16H2,1-8H3/t18-,21-,22+,27-,28+,29-,30+/m1/s1 |
| InChIKey | HAGQVUXLNARQFF-JLEISJNOSA-N |
| Mol Weight | 452.7 g/mol |
| Molecular Formula | C30H44O3 |
| Exact Mass | 452.329045 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | g92nTVeqMo |
|---|---|
| Name | SUPINENOLONE-D |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H44O3 |
| InChI | InChI=1S/C30H44O3/c1-17(2)18-9-10-21-27(18,5)13-14-29(7)25-19(31)15-22-26(3,4)23(33)11-12-28(22,6)24(25)20(32)16-30(21,29)8/h17-18,21-22H,9-16H2,1-8H3/t18-,21-,22+,27-,28+,29-,30+/m1/s1 |
| InChIKey | HAGQVUXLNARQFF-JLEISJNOSA-N |
| Literature Reference Author | R.TANAKA,S.MATSUNAGA |
| Literature Reference Citation | PHYTOCHEM.,30,293(1991) |
| Literature Reference DOI | 10.1016/0031-9422(91)84140-N |
| Molecular Weight | 452.678 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWKP6646 |