| SpectraBase Compound ID | 2ouR0FMIIZP |
|---|---|
| InChI | InChI=1S/C31H48O3/c1-20(9-8-10-21(2)26(33)34-7)22-13-15-29(6)24-12-11-23-27(3,4)25(32)14-16-30(23)19-31(24,30)18-17-28(22,29)5/h10,20,22-24H,8-9,11-19H2,1-7H3/b21-10+/t20-,22-,23+,24+,28-,29+,30-,31+/m1/s1 |
| InChIKey | WYGNOIJKFWFCPY-IWRTWTPBSA-N |
| Mol Weight | 468.7 g/mol |
| Molecular Formula | C31H48O3 |
| Exact Mass | 468.360345 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BXnG2c4xaSo |
|---|---|
| Name | METHYL-3-OXO-CYCLOART-24E-EN-26-OATE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C31H48O3 |
| InChI | InChI=1S/C31H48O3/c1-20(9-8-10-21(2)26(33)34-7)22-13-15-29(6)24-12-11-23-27(3,4)25(32)14-16-30(23)19-31(24,30)18-17-28(22,29)5/h10,20,22-24H,8-9,11-19H2,1-7H3/b21-10+/t20-,22-,23+,24+,28-,29+,30-,31+/m1/s1 |
| InChIKey | WYGNOIJKFWFCPY-IWRTWTPBSA-N |
| Literature Reference Author | V.ANJANEYULU,J.S.BABU,J.D.CONNOLLY |
| Literature Reference Citation | PHYTOCHEM.,35,1301(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)94842-8 |
| Molecular Weight | 468.720 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMS24537 |