| SpectraBase Compound ID | 4SduAWs8jcN |
|---|---|
| InChI | InChI=1S/C25H34O7/c1-5-22(28)16-14-15-18-24(32-21(3)27)23(31-20(2)26)17-12-10-8-6-7-9-11-13-19-25(29)30-4/h7-10,12,14-18,23-24H,5-6,11,13,19H2,1-4H3/b9-7-,10-8-,16-14+,17-12+,18-15-/t23-,24+/m0/s1 |
| InChIKey | JPOQCKMIOBGSRK-GOXPKERHSA-N |
| Mol Weight | 446.5 g/mol |
| Molecular Formula | C25H34O7 |
| Exact Mass | 446.230453 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5GlVmEyUitq |
|---|---|
| Name | METHYL-(12R*),(13S*)-DIACETOXY-18-KETO-5Z,8Z,10E,14Z,16E-EICOSAPENTAENOATE |
| Compound Number | 20 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H34O7 |
| InChI | InChI=1S/C25H34O7/c1-5-22(28)16-14-15-18-24(32-21(3)27)23(31-20(2)26)17-12-10-8-6-7-9-11-13-19-25(29)30-4/h7-10,12,14-18,23-24H,5-6,11,13,19H2,1-4H3/b9-7-,10-8-,16-14+,17-12+,18-15-/t23-,24+/m0/s1 |
| InChIKey | JPOQCKMIOBGSRK-GOXPKERHSA-N |
| Literature Reference Author | Z.D.JIANG,W.H.GERWICK |
| Literature Reference Citation | PHYTOCHEM.,30,1187(1991) |
| Literature Reference DOI | 10.1016/S0031-9422(00)95200-2 |
| Molecular Weight | 446.541 g/mol |
| Solvent | C6D6 |
| Source File Reference | UWLU34201 |