| SpectraBase Compound ID | 3ASKQj2AtJS |
|---|---|
| InChI | InChI=1S/C19H22O6/c1-9-5-11(20)6-14-12(9)4-3-10(2)19(14)8-15(24-18(19)23)13-7-16(21)25-17(13)22/h5,7,10,12,14-15,17,22H,3-4,6,8H2,1-2H3/t10-,12+,14+,15-,17?,19-/m0/s1 |
| InChIKey | KAMWCRZUHLCLNE-WYVVQCOWSA-N |
| Mol Weight | 346.38 g/mol |
| Molecular Formula | C19H22O6 |
| Exact Mass | 346.141638 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BeDxEIphJPc |
|---|---|
| Name | ISOCAJUCARINOLIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C19H22O6 |
| InChI | InChI=1S/C19H22O6/c1-9-5-11(20)6-14-12(9)4-3-10(2)19(14)8-15(24-18(19)23)13-7-16(21)25-17(13)22/h5,7,10,12,14-15,17,22H,3-4,6,8H2,1-2H3/t10-,12+,14+,15-,17?,19-/m0/s1 |
| InChIKey | KAMWCRZUHLCLNE-WYVVQCOWSA-N |
| Literature Reference Author | Y.ICHIHARA,K.TAKEYA,Y.HITOTSUYANAGI,H.MORITA,S.OKUYAMA,M.SUG ANUMA,H.FUJIKI,M.MOT |
| Literature Reference Citation | PLANTA.MED.,58,549(1992) |
| Literature Reference DOI | 10.1055/s-2006-961547 |
| Molecular Weight | 346.380 g/mol |
| Solvent | CDCl3:CD3OD=4:1 |
| Source File Reference | UIAP389 |