| SpectraBase Compound ID | E1sWrKRZowu |
|---|---|
| InChI | InChI=1S/C26H36O6/c1-9-16(5)13-22(27)31-23-19(14-21-26(8,32-21)24(23)28)18(7)20(12-11-15(3)4)30-25(29)17(6)10-2/h10-11,13,19-21,23H,7,9,12,14H2,1-6,8H3/b16-13+,17-10-/t19?,20?,21-,23-,26-/m0/s1 |
| InChIKey | FBRGSUPWSQWJRW-LLKCLLNGSA-N |
| Mol Weight | 444.6 g/mol |
| Molecular Formula | C26H36O6 |
| Exact Mass | 444.251189 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2aSOaTXTFiI |
|---|---|
| Name | 1-ALPHA-(3''-ETHYL-CIS-CROTONOYLOXY)-8-ANGELOYLOXY-3-BETA,4-BETA-EPOXY-BISABOLA-7(14),10-DIENE |
| Compound Number | 1 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H36O6 |
| InChI | InChI=1S/C26H36O6/c1-9-16(5)13-22(27)31-23-19(14-21-26(8,32-21)24(23)28)18(7)20(12-11-15(3)4)30-25(29)17(6)10-2/h10-11,13,19-21,23H,7,9,12,14H2,1-6,8H3/b16-13+,17-10-/t19?,20?,21-,23-,26-/m0/s1 |
| InChIKey | FBRGSUPWSQWJRW-LLKCLLNGSA-N |
| Literature Reference Author | W.LI,X.HUANG,X.W.YANG |
| Literature Reference Citation | FITOTERAPIA,83,318(2012) |
| Literature Reference DOI | 10.1016/j.fitote.2011.11.011 |
| Molecular Weight | 444.568 g/mol |
| Sample ID | 71791 |
| Solvent | CDCl3 |