| SpectraBase Compound ID | LxEhaKFBXEc |
|---|---|
| InChI | InChI=1S/C27H42O2/c1-18(2)7-6-14-27(5,29)24-11-10-22-21-9-8-19-17-20(28)12-15-25(19,3)23(21)13-16-26(22,24)4/h8,18,20-24,28-29H,7,9-13,15-17H2,1-5H3/t20-,21-,22-,23-,24-,25-,26-,27?/m0/s1 |
| InChIKey | FLXZNMYQYIFXFN-HRQFAISJSA-N |
| Mol Weight | 398.6 g/mol |
| Molecular Formula | C27H42O2 |
| Exact Mass | 398.318481 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GbZNAiFUgCz |
|---|---|
| Name | CHOLEST-5-EN-22-YN-3-BETA,20(R)-DIOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C27H42O2 |
| InChI | InChI=1S/C27H42O2/c1-18(2)7-6-14-27(5,29)24-11-10-22-21-9-8-19-17-20(28)12-15-25(19,3)23(21)13-16-26(22,24)4/h8,18,20-24,28-29H,7,9-13,15-17H2,1-5H3/t20-,21-,22-,23-,24-,25-,26-,27?/m0/s1 |
| InChIKey | FLXZNMYQYIFXFN-HRQFAISJSA-N |
| Literature Reference Author | A.BURGER,F.COLOBERT,C.HETRU,B.LUU |
| Literature Reference Citation | TETRAHEDRON,44,1141(1988) |
| Literature Reference DOI | 10.1016/S0040-4020(01)85894-4 |
| Molecular Weight | 398.629 g/mol |
| Solvent | CD2Cl2 |
| Source File Reference | UWBK1294 |