| SpectraBase Compound ID | 2JUbOp69vCf |
|---|---|
| InChI | InChI=1S/C26H38O/c1-17(2)6-7-18(3)22-10-11-23-21-9-8-19-16-20(27)12-14-25(19,4)24(21)13-15-26(22,23)5/h6-7,12,14,16-18,21-24H,8-11,13,15H2,1-5H3/b7-6+/t18-,21+,22-,23+,24+,25+,26-/m1/s1 |
| InChIKey | JSHASXVESQAJJO-MZXJRKPGSA-N |
| Mol Weight | 366.6 g/mol |
| Molecular Formula | C26H38O |
| Exact Mass | 366.292266 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6N4lC3cEoDQ |
|---|---|
| Name | (22-E)-24-CHOLESTA-1,4,22-TRIEN-3-ONE |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H38O |
| InChI | InChI=1S/C26H38O/c1-17(2)6-7-18(3)22-10-11-23-21-9-8-19-16-20(27)12-14-25(19,4)24(21)13-15-26(22,23)5/h6-7,12,14,16-18,21-24H,8-11,13,15H2,1-5H3/b7-6+/t18-,21+,22-,23+,24+,25+,26-/m1/s1 |
| InChIKey | JSHASXVESQAJJO-MZXJRKPGSA-N |
| Literature Reference Author | X.H.YAN,H.L.LIU,H.HUANG,X.B.LI,Y.W.GUO |
| Literature Reference Citation | J.NAT.PROD.,74,175(2011) |
| Literature Reference DOI | 10.1021/np100562n |
| Molecular Weight | 366.587 g/mol |
| Sample ID | 37531 |
| Solvent | CDCl3 |