| SpectraBase Compound ID | 2NNrU9ONl81 |
|---|---|
| InChI | InChI=1S/C22H24O7/c1-13(28-20(24)11-8-14-6-9-15(27-2)10-7-14)21(25)16-12-17(16)22(26)18-4-3-5-19(23)29-18/h3,5-11,13,16-18,22,26H,4,12H2,1-2H3/b11-8-/t13-,16-,17-,18+,22-/m0/s1 |
| InChIKey | XGNLXIVLBLLTIG-JKMWVEESSA-N |
| Mol Weight | 400.43 g/mol |
| Molecular Formula | C22H24O7 |
| Exact Mass | 400.152203 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HOEkjwNl9DB |
|---|---|
| Name | BREVIPOLIDE_I |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H24O7 |
| InChI | InChI=1S/C22H24O7/c1-13(28-20(24)11-8-14-6-9-15(27-2)10-7-14)21(25)16-12-17(16)22(26)18-4-3-5-19(23)29-18/h3,5-11,13,16-18,22,26H,4,12H2,1-2H3/b11-8-/t13-,16-,17-,18+,22-/m0/s1 |
| InChIKey | XGNLXIVLBLLTIG-JKMWVEESSA-N |
| Literature Reference Author | G.A.SUAREZ-ORTIZ,C.M.CERDA-GARCIA-ROJAS,A.HERNANDEZ-ROJAS,R. PEREDA-MIRANDA |
| Literature Reference Citation | J.NAT.PROD.,76,72(2013) |
| Literature Reference DOI | 10.1021/np300740h |
| Molecular Weight | 400.428 g/mol |
| Sample ID | 41033 |
| Solvent | CDCl3 |