| SpectraBase Compound ID | ZUVqEJVz0R |
|---|---|
| InChI | InChI=1S/C28H42O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-16-26(30)25-15-20(29)11-13-28(25,6)24(21)12-14-27(22,23)5/h7-8,16-19,22-25H,9-15H2,1-6H3/b8-7+/t18-,19-,22-,23+,24+,25?,27-,28-/m1/s1 |
| InChIKey | AGFWEYQAOQMEEO-QFZVKWHESA-N |
| Mol Weight | 410.6 g/mol |
| Molecular Formula | C28H42O2 |
| Exact Mass | 410.318481 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6JYvtFOlfaZ |
|---|---|
| Name | CHYATHISTERONE;ERGOSTA-7,22-DIENE-3,6-DIONE |
| Compound Number | 2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C28H42O2 |
| InChI | InChI=1S/C28H42O2/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-16-26(30)25-15-20(29)11-13-28(25,6)24(21)12-14-27(22,23)5/h7-8,16-19,22-25H,9-15H2,1-6H3/b8-7+/t18-,19-,22-,23+,24+,25?,27-,28-/m1/s1 |
| InChIKey | AGFWEYQAOQMEEO-QFZVKWHESA-N |
| Literature Reference Author | N.KAWAHARA,S.SEKITA,M.SATAKE |
| Literature Reference Citation | PHYTOCHEM.,37,213(1994) |
| Literature Reference DOI | 10.1016/0031-9422(94)85028-3 |
| Molecular Weight | 410.640 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU23044 |