| SpectraBase Compound ID | ElhMizknwbp |
|---|---|
| InChI | InChI=1S/C25H30O6/c1-3-19(2)16-17-22(27)21(26)15-13-11-9-7-5-4-6-8-10-12-14-20-18-23(28)24(31-20)25(29)30/h4-17,19-20,23-24,28H,3,18H2,1-2H3,(H,29,30)/b6-4+,7-5+,10-8+,11-9+,14-12+,15-13+,17-16+ |
| InChIKey | UWFRQOWLUPERFN-BXNBMOSESA-N |
| Mol Weight | 426.51 g/mol |
| Molecular Formula | C25H30O6 |
| Exact Mass | 426.204239 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | w8lPLvAyln |
|---|---|
| Name | COCHLIOBOLIC-ACID |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H30O6 |
| InChI | InChI=1S/C25H30O6/c1-3-19(2)16-17-22(27)21(26)15-13-11-9-7-5-4-6-8-10-12-14-20-18-23(28)24(31-20)25(29)30/h4-17,19-20,23-24,28H,3,18H2,1-2H3,(H,29,30)/b6-4+,7-5+,10-8+,11-9+,14-12+,15-13+,17-16+ |
| InChIKey | UWFRQOWLUPERFN-BXNBMOSESA-N |
| Literature Reference Author | N.ROBINSON,T.M.GIBSON,M.I.CHICARELLI-ROBINSON,L.CAMERON,P.J. HYLANDS,D.WILKINSON, |
| Literature Reference Citation | J.NAT.PROD.,60,6(1997) |
| Literature Reference DOI | 10.1021/np9605293 |
| Molecular Weight | 426.510 g/mol |
| Solvent | CD3OD |
| Source File Reference | UWGE2705 |