| SpectraBase Compound ID | HJrwRl4ejiP |
|---|---|
| InChI | InChI=1S/C21H22O7/c1-12(27-19(24)10-7-13-5-8-14(22)9-6-13)20(25)15-11-16(15)21(26)17-3-2-4-18(23)28-17/h2,4-10,12,15-17,21-22,26H,3,11H2,1H3/b10-7+/t12-,15-,16-,17+,21-/m0/s1 |
| InChIKey | BJDMHAYLPGRUFH-HIELJHRRSA-N |
| Mol Weight | 386.4 g/mol |
| Molecular Formula | C21H22O7 |
| Exact Mass | 386.136553 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | B961E0tZyWG |
|---|---|
| Name | BREVIPOLIDE_G |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C21H22O7 |
| InChI | InChI=1S/C21H22O7/c1-12(27-19(24)10-7-13-5-8-14(22)9-6-13)20(25)15-11-16(15)21(26)17-3-2-4-18(23)28-17/h2,4-10,12,15-17,21-22,26H,3,11H2,1H3/b10-7+/t12-,15-,16-,17+,21-/m0/s1 |
| InChIKey | BJDMHAYLPGRUFH-HIELJHRRSA-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 | 386.401 g/mol |
| Sample ID | 41031 |
| Solvent | CDCl3 |