| SpectraBase Compound ID | 96a9TV7GuXe |
|---|---|
| InChI | InChI=1S/C24H39NO4/c1-6-25-12-22(2)8-7-18(28-4)24-14-9-13-16(27-3)11-23(29-5,19(14)20(13)26)15(21(24)25)10-17(22)24/h13-21,26H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20-,21?,22+,23+,24-/m1/s1 |
| InChIKey | PUJPMGBYYYNBII-BJAPEXKCSA-N |
| Mol Weight | 405.6 g/mol |
| Molecular Formula | C24H39NO4 |
| Exact Mass | 405.287909 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | KIaoP3NVAOn |
|---|---|
| Name | 8-O-METHYLSACHACONITINE |
| Compound Number | 8 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C24H39NO4 |
| InChI | InChI=1S/C24H39NO4/c1-6-25-12-22(2)8-7-18(28-4)24-14-9-13-16(27-3)11-23(29-5,19(14)20(13)26)15(21(24)25)10-17(22)24/h13-21,26H,6-12H2,1-5H3/t13-,14-,15+,16+,17-,18+,19-,20-,21?,22+,23+,24-/m1/s1 |
| InChIKey | PUJPMGBYYYNBII-BJAPEXKCSA-N |
| Literature Reference Author | M.REINA,A.MADINAVEITIA,G.DELAFUENTE |
| Literature Reference Citation | PHYTOCHEM.,45,1707(1997) |
| Literature Reference DOI | 10.1016/S0031-9422(97)00194-5 |
| Molecular Weight | 405.578 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSP421 |