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DESMODIANONE-A;5,7,2'-TRIHYDROXY-6,6''-DIMETHYL-6''-(4-METHYLPENT-3-ENYL)-PYRANO-(2'',3'':4',5')-ISOFLAVANONE
SpectraBase Compound ID 1d1vEnGwUs7
InChI InChI=1S/C26H28O6/c1-14(2)6-5-8-26(4)9-7-16-10-17(20(28)12-21(16)32-26)18-13-31-22-11-19(27)15(3)24(29)23(22)25(18)30/h6-7,9-12,18,27-29H,5,8,13H2,1-4H3
InChIKey MTAXKRLEJKCTMO-UHFFFAOYSA-N
Mol Weight 436.5 g/mol
Molecular Formula C26H28O6
Exact Mass 436.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D762t59kwnb
Name DESMODIANONE-A;5,7,2'-TRIHYDROXY-6,6''-DIMETHYL-6''-(4-METHYLPENT-3-ENYL)-PYRANO-(2'',3'':4',5')-ISOFLAVANONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H28O6
InChI InChI=1S/C26H28O6/c1-14(2)6-5-8-26(4)9-7-16-10-17(20(28)12-21(16)32-26)18-13-31-22-11-19(27)15(3)24(29)23(22)25(18)30/h6-7,9-12,18,27-29H,5,8,13H2,1-4H3
InChIKey MTAXKRLEJKCTMO-UHFFFAOYSA-N
Literature Reference Author G.D.MONACHE,B.BOTTA,V.VINVIGUERRA,J.F.D.MELLO,A.D.A.CHIAPPET A
Literature Reference Citation PHYTOCHEM.,41,537(1996)
Literature Reference DOI 10.1016/0031-9422(95)00653-2
Molecular Weight 436.505 g/mol
Solvent ACETONE-D6
Source File Reference UWLU3946