| SpectraBase Compound ID | 7h7FFE6COmQ |
|---|---|
| InChI | InChI=1S/C31H44O5/c1-25(2)19-8-12-28(5)20(27(19,4)11-10-22(25)32)9-13-31-21-16-26(3,24(34)35-7)14-15-30(21,18-36-31)23(33)17-29(28,31)6/h10-11,19-21H,8-9,12-18H2,1-7H3/t19?,20?,21?,26-,27-,28+,29-,30+,31-/m0/s1 |
| InChIKey | PHVQYMCNLSSBBV-FYHFHIAJSA-N |
| Mol Weight | 496.7 g/mol |
| Molecular Formula | C31H44O5 |
| Exact Mass | 496.318875 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | K0IJ6ybWoN1 |
|---|---|
| Name | 13-BETA,28-EPOXY-3,16-DIOXO-OLEAN-2-EN-30-OIC-ACID,METHYLESTER |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H44O5 |
| InChI | InChI=1S/C31H44O5/c1-25(2)19-8-12-28(5)20(27(19,4)11-10-22(25)32)9-13-31-21-16-26(3,24(34)35-7)14-15-30(21,18-36-31)23(33)17-29(28,31)6/h10-11,19-21H,8-9,12-18H2,1-7H3/t19?,20?,21?,26-,27-,28+,29-,30+,31-/m0/s1 |
| InChIKey | PHVQYMCNLSSBBV-FYHFHIAJSA-N |
| Literature Reference Author | A.L.OKUNADE,D.F.WIEMER |
| Literature Reference Citation | PHYTOCHEM.,24,1203(1985) |
| Literature Reference DOI | 10.1016/S0031-9422(00)81101-2 |
| Molecular Weight | 496.687 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBK391 |