| SpectraBase Compound ID | IrL6ueOicBF |
|---|---|
| InChI | InChI=1S/C25H38O5/c1-15(2)10-20(27)30-17-12-23(5)18(22(3,4)21(17)28)8-9-24-11-16(6-7-19(23)24)25(29,13-24)14-26/h10,16-19,26,29H,6-9,11-14H2,1-5H3/t16-,17-,18?,19?,23+,24+,25+/m1/s1 |
| InChIKey | PFDDHGHYPYBSLT-BNGWBHRBSA-N |
| Mol Weight | 418.6 g/mol |
| Molecular Formula | C25H38O5 |
| Exact Mass | 418.271924 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4nNzpHOsgZx |
|---|---|
| Name | 16R-2-ALPHA-(3-METHYL-2-BUTENOYLOXY)-17,16-DIHYDROXYPHYLLOClADANE-3-ONE |
| Compound Number | 5A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C25H38O5 |
| InChI | InChI=1S/C25H38O5/c1-15(2)10-20(27)30-17-12-23(5)18(22(3,4)21(17)28)8-9-24-11-16(6-7-19(23)24)25(29,13-24)14-26/h10,16-19,26,29H,6-9,11-14H2,1-5H3/t16-,17-,18?,19?,23+,24+,25+/m1/s1 |
| InChIKey | PFDDHGHYPYBSLT-BNGWBHRBSA-N |
| Literature Reference Author | G.LIU,P.RUEEDI |
| Literature Reference Citation | PHYTOCHEM.,41,1563(1996) |
| Literature Reference DOI | 10.1016/0031-9422(95)00816-0 |
| Molecular Weight | 418.574 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU4466 |