| SpectraBase Compound ID | LIj4dVVKb4l |
|---|---|
| InChI | InChI=1S/C20H28O5/c1-9(2)5-15(22)24-14-8-20(4)7-11-17(14)18(25-19(11)23)16-10(3)13(21)6-12(16)20/h9,11-14,17-18,21H,5-8H2,1-4H3/t11?,12-,13?,14-,17-,18+,20-/m1/s1 |
| InChIKey | WJTCOCPCPLYSKO-USSBPABASA-N |
| Mol Weight | 348.44 g/mol |
| Molecular Formula | C20H28O5 |
| Exact Mass | 348.193674 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Cyl9GZEIgO2 |
|---|---|
| Name | ROTUNDOPONTILIDE-A |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C20H28O5 |
| InChI | InChI=1S/C20H28O5/c1-9(2)5-15(22)24-14-8-20(4)7-11-17(14)18(25-19(11)23)16-10(3)13(21)6-12(16)20/h9,11-14,17-18,21H,5-8H2,1-4H3/t11?,12-,13?,14-,17-,18+,20-/m1/s1 |
| InChIKey | WJTCOCPCPLYSKO-USSBPABASA-N |
| Literature Reference Author | M.N.TODOROVA,E.T.TSANKOVA,A.B.TRENDAFILOVA,C.V.GUSSEV |
| Literature Reference Citation | PHYTOCHEM.,41,553(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00640-0 |
| Molecular Weight | 348.439 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU3954 |