| SpectraBase Compound ID | MMfYzWJC7Q |
|---|---|
| InChI | InChI=1S/C26H32O6/c1-16-5-9-22-25(3,12-11-23(28)26(22,4)15-31-17(2)27)20(16)14-30-19-8-6-18-7-10-24(29)32-21(18)13-19/h6-8,10,13,20,22-23,28H,1,5,9,11-12,14-15H2,2-4H3/t20-,22+,23-,25+,26+/m1/s1 |
| InChIKey | SRHUJPJGKASGRN-PTMODEPLSA-N |
| Mol Weight | 440.5 g/mol |
| Molecular Formula | C26H32O6 |
| Exact Mass | 440.219889 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | AJqIaKbSjKs |
|---|---|
| Name | 14-ACETOXYCOLLADONIN |
| Compound Number | 3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H32O6 |
| InChI | InChI=1S/C26H32O6/c1-16-5-9-22-25(3,12-11-23(28)26(22,4)15-31-17(2)27)20(16)14-30-19-8-6-18-7-10-24(29)32-21(18)13-19/h6-8,10,13,20,22-23,28H,1,5,9,11-12,14-15H2,2-4H3/t20-,22+,23-,25+,26+/m1/s1 |
| InChIKey | SRHUJPJGKASGRN-PTMODEPLSA-N |
| Literature Reference Author | G.APPENDINO,H.C.OEZEN,S.TAGLIAPIETRA,M.CISERO |
| Literature Reference Citation | PHYTOCHEM.,31,3211(1992) |
| Literature Reference DOI | 10.1016/0031-9422(92)83477-G |
| Molecular Weight | 440.536 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWMZ21528 |