| SpectraBase Compound ID | Aoyct9QoLxG |
|---|---|
| InChI | InChI=1S/C32H54O2/c1-9-24(20(2)3)11-10-21(4)26-14-15-28-25-12-13-27-22(5)30(34-23(6)33)17-19-32(27,8)29(25)16-18-31(26,28)7/h10-11,20-22,24-30H,9,12-19H2,1-8H3/b11-10+/t21-,22+,24+,25+,26-,27+,28+,29+,30+,31-,32+/m1/s1 |
| InChIKey | MREHEAFQRVSCEN-NKNIHNBHSA-N |
| Mol Weight | 470.8 g/mol |
| Molecular Formula | C32H54O2 |
| Exact Mass | 470.412381 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 45SeMHbjOni |
|---|---|
| Name | (22-E)-24-ETHYL-4-ALPHA-METHYL-5-ALPHA-CHOLEST-22-EN-3-BETA-YL-ACETATE |
| Compound Number | 2A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C32H54O2 |
| InChI | InChI=1S/C32H54O2/c1-9-24(20(2)3)11-10-21(4)26-14-15-28-25-12-13-27-22(5)30(34-23(6)33)17-19-32(27,8)29(25)16-18-31(26,28)7/h10-11,20-22,24-30H,9,12-19H2,1-8H3/b11-10+/t21-,22+,24+,25+,26-,27+,28+,29+,30+,31-,32+/m1/s1 |
| InChIKey | MREHEAFQRVSCEN-NKNIHNBHSA-N |
| Literature Reference Author | A.P.RAUTER,M.M.FILIPE,C.PRATA,J.P.NORONHA,M.A.M.SAMPAYO,J.JU STINO,J.BERMEJO |
| Literature Reference Citation | FITOTERAPIA,76,433(2005) |
| Literature Reference DOI | 10.1016/j.fitote.2005.03.003 |
| Molecular Weight | 470.780 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ46735 |