| SpectraBase Compound ID | 3H46bEtGRGN |
|---|---|
| InChI | InChI=1S/C28H38O6/c1-14-11-21(33-25(32)17(14)13-29)15(2)18-5-6-19-16-12-24-28(34-24)23(31)8-7-22(30)27(28,4)20(16)9-10-26(18,19)3/h7-8,15-16,18-21,23-24,29,31H,5-6,9-13H2,1-4H3/t15-,16-,18+,19-,20-,21?,23-,24+,26+,27-,28+/m0/s1 |
| InChIKey | DBRXOUCRJQVYJQ-KDUZADKNSA-N |
| Mol Weight | 470.6 g/mol |
| Molecular Formula | C28H38O6 |
| Exact Mass | 470.266839 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EUkQUjUMWdf |
|---|---|
| Name | WITHAFERINE-A |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H38O6 |
| InChI | InChI=1S/C28H38O6/c1-14-11-21(33-25(32)17(14)13-29)15(2)18-5-6-19-16-12-24-28(34-24)23(31)8-7-22(30)27(28,4)20(16)9-10-26(18,19)3/h7-8,15-16,18-21,23-24,29,31H,5-6,9-13H2,1-4H3/t15-,16-,18+,19-,20-,21?,23-,24+,26+,27-,28+/m0/s1 |
| InChIKey | DBRXOUCRJQVYJQ-KDUZADKNSA-N |
| Literature Reference Author | D.ALFONSO,I.KAPETANIDIS,G.BERNARDINELLI |
| Literature Reference Citation | J.NAT.PROD.,54,1576(1991) |
| Literature Reference DOI | 10.1021/np50078a013 |
| Molecular Weight | 470.606 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWED17466 |