| SpectraBase Compound ID | 7KNRKMeoi94 |
|---|---|
| InChI | InChI=1S/C30H42O6/c1-6-7-8-9-10-11-12-13-23(32)36-27-18(2)16-29-19(3)14-22-24(28(22,4)5)21(26(29)34)15-20(17-31)25(33)30(27,29)35/h10-13,15-16,19,21-22,24-25,27,31,33,35H,6-9,14,17H2,1-5H3/b11-10+,13-12+/t19?,21-,22?,24?,25?,27?,29+,30?/m0/s1 |
| InChIKey | XMXZQPNIMGCMHC-GPGAKOQRSA-N |
| Mol Weight | 498.7 g/mol |
| Molecular Formula | C30H42O6 |
| Exact Mass | 498.298139 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1mU93mg8QFz |
|---|---|
| Name | 3-O-(2'E,4'Z-DECADIENOYL)-INGENOL |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C30H42O6 |
| InChI | InChI=1S/C30H42O6/c1-6-7-8-9-10-11-12-13-23(32)36-27-18(2)16-29-19(3)14-22-24(28(22,4)5)21(26(29)34)15-20(17-31)25(33)30(27,29)35/h10-13,15-16,19,21-22,24-25,27,31,33,35H,6-9,14,17H2,1-5H3/b11-10+,13-12+/t19?,21-,22?,24?,25?,27?,29+,30?/m0/s1 |
| InChIKey | XMXZQPNIMGCMHC-GPGAKOQRSA-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 | 498.660 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UIAP318 |