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ISOEMERICELLIN
SpectraBase Compound ID 41gvNkeqJv
InChI InChI=1S/C25H28O5/c1-14(2)6-7-17-8-9-19-22(23(17)27)24(28)21-18(13-26)25(29-11-10-15(3)4)16(5)12-20(21)30-19/h6,8-10,12,26-27H,7,11,13H2,1-5H3
InChIKey MDBQNLFOBADTEY-UHFFFAOYSA-N
Mol Weight 408.49 g/mol
Molecular Formula C25H28O5
Exact Mass 408.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Xtfu0mz6ri
Name ISOEMERICELLIN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28O5
InChI InChI=1S/C25H28O5/c1-14(2)6-7-17-8-9-19-22(23(17)27)24(28)21-18(13-26)25(29-11-10-15(3)4)16(5)12-20(21)30-19/h6,8-10,12,26-27H,7,11,13H2,1-5H3
InChIKey MDBQNLFOBADTEY-UHFFFAOYSA-N
Literature Reference Author G.BRINGMANN,G.LANG,S.STEFFENS,E.GUENTHER,K.SCHAUMANN
Literature Reference Citation PHYTOCHEM.,63,437(2003)
Literature Reference DOI 10.1016/S0031-9422(03)00189-4
Molecular Weight 408.494 g/mol
Solvent CDCl3
Source File Reference UWVN27003