| SpectraBase Compound ID | 3Y50vk1BWfY |
|---|---|
| InChI | InChI=1S/C33H46O6/c1-8-9-10-11-12-13-14-15-25(34)38-28-20(2)18-32-21(3)16-24-26(30(24,4)5)23(27(32)35)17-22-19-37-31(6,7)39-29(22)33(28,32)36/h12-15,17-18,21,23-24,26,28-29,36H,8-11,16,19H2,1-7H3/b13-12+,15-14+/t21?,23-,24?,26?,28?,29?,32+,33?/m1/s1 |
| InChIKey | XPARFQCLLRZMAP-XCVLTSJSSA-N |
| Mol Weight | 538.7 g/mol |
| Molecular Formula | C33H46O6 |
| Exact Mass | 538.329439 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9he3Qwv9anB |
|---|---|
| Name | 3-O-(2'E,4'Z-DECADIENOYL)-INGENOL-5,20-ACETONIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H46O6 |
| InChI | InChI=1S/C33H46O6/c1-8-9-10-11-12-13-14-15-25(34)38-28-20(2)18-32-21(3)16-24-26(30(24,4)5)23(27(32)35)17-22-19-37-31(6,7)39-29(22)33(28,32)36/h12-15,17-18,21,23-24,26,28-29,36H,8-11,16,19H2,1-7H3/b13-12+,15-14+/t21?,23-,24?,26?,28?,29?,32+,33?/m1/s1 |
| InChIKey | XPARFQCLLRZMAP-XCVLTSJSSA-N |
| Literature Reference Author | T.MATSUMOTO,J.-C.CYONG,H.YAMADA |
| Literature Reference Citation | PLANTA.MED.,58,255(1992) |
| Literature Reference DOI | 10.1055/s-2006-961447 |
| Molecular Weight | 538.725 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP319 |