| SpectraBase Compound ID | 3JkXYNfvFmf |
|---|---|
| InChI | InChI=1S/C24H30O7/c1-22(2,28)21(27)19(26)18-16-12-8-9-24(18,5)31-20-11-6-7-15(25)29-13(11)10-14(17(16)20)30-23(12,3)4/h6-7,10,12,16,18-19,21,26-28H,8-9H2,1-5H3/t12-,16-,18+,19?,21?,24+/m1/s1 |
| InChIKey | LLJXTHZJHBECKT-AUKYPPAKSA-N |
| Mol Weight | 430.5 g/mol |
| Molecular Formula | C24H30O7 |
| Exact Mass | 430.199153 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3K1jSWLgrQI |
|---|---|
| Name | (-)-2'-BETA-(3-METHYL-1-XI,2-XI,3-TRIHYDROXYBUTYL)-2'-DEOXYBRUCEOL |
| Compound Number | 5 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H30O7 |
| InChI | InChI=1S/C24H30O7/c1-22(2,28)21(27)19(26)18-16-12-8-9-24(18,5)31-20-11-6-7-15(25)29-13(11)10-14(17(16)20)30-23(12,3)4/h6-7,10,12,16,18-19,21,26-28H,8-9H2,1-5H3/t12-,16-,18+,19?,21?,24+/m1/s1 |
| InChIKey | LLJXTHZJHBECKT-AUKYPPAKSA-N |
| Literature Reference Author | S.D.SARKER,J.A.ARMSTRONG,A.I.GRAY,P.G.WATERMAN |
| Literature Reference Citation | PHYTOCHEM.,37,1287(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)90400-X |
| Molecular Weight | 430.498 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS23459 |