| SpectraBase Compound ID | KSVuvqtmMkB |
|---|---|
| InChI | InChI=1S/C22H36O3/c1-16(11-14-23)7-9-19-17(2)8-10-20-21(4,15-25-18(3)24)12-6-13-22(19,20)5/h11,19-20,23H,2,6-10,12-15H2,1,3-5H3/b16-11+/t19-,20-,21+,22+/m0/s1 |
| InChIKey | ZSQKSEACUBGYHI-LCSZQOBJSA-N |
| Mol Weight | 348.5 g/mol |
| Molecular Formula | C22H36O3 |
| Exact Mass | 348.266445 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DB5Tijy4pjR |
|---|---|
| Name | 19-ACETYL-AGATHADIOL |
| Compound Number | 13 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H36O3 |
| InChI | InChI=1S/C22H36O3/c1-16(11-14-23)7-9-19-17(2)8-10-20-21(4,15-25-18(3)24)12-6-13-22(19,20)5/h11,19-20,23H,2,6-10,12-15H2,1,3-5H3/b16-11+/t19-,20-,21+,22+/m0/s1 |
| InChIKey | ZSQKSEACUBGYHI-LCSZQOBJSA-N |
| Literature Reference Author | W.C.SU,J.M.FANG,Y.S.CHENG |
| Literature Reference Citation | PHYTOCHEM.,37,1109(1994) |
| Literature Reference DOI | 10.1016/S0031-9422(00)89538-2 |
| Molecular Weight | 348.526 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU24011 |