| SpectraBase Compound ID | gVclbaNnxh |
|---|---|
| InChI | InChI=1S/C30H50O/c1-8-28(5,20(2)3)16-13-21(4)25-11-12-26-24-10-9-22-19-23(31)14-17-29(22,6)27(24)15-18-30(25,26)7/h9,13,16,20-21,23-27,31H,8,10-12,14-15,17-19H2,1-7H3/b16-13+/t21-,23+,24+,25-,26+,27+,28-,29+,30-/m1/s1 |
| InChIKey | ROHWXHQLSICXOM-CRICZEMXSA-N |
| Mol Weight | 426.7 g/mol |
| Molecular Formula | C30H50O |
| Exact Mass | 426.386166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7SkVTKEcN3I |
|---|---|
| Name | (22E)-(24S)-24-ETHYL-24-METHYL-CHOLESTA-5,22-DIEN-3-BETA-OL |
| Compound Number | 1A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H50O |
| InChI | InChI=1S/C30H50O/c1-8-28(5,20(2)3)16-13-21(4)25-11-12-26-24-10-9-22-19-23(31)14-17-29(22,6)27(24)15-18-30(25,26)7/h9,13,16,20-21,23-27,31H,8,10-12,14-15,17-19H2,1-7H3/b16-13+/t21-,23+,24+,25-,26+,27+,28-,29+,30-/m1/s1 |
| InChIKey | ROHWXHQLSICXOM-CRICZEMXSA-N |
| Literature Reference Author | S.ECHIGO,L.CASTELLANOS,C.DUQUE,H.UEKUSA,N.HARA,Y.FUJIMOTO |
| Literature Reference Citation | J.BRAZ.CHEM.SOC.,22,997(2011) |
| Literature Reference DOI | 10.1590/s0103-50532011000500026 |
| Molecular Weight | 426.726 g/mol |
| Source File Reference | UWBT5652 |