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MAGNOVATIN_A;REL-(7-S,8-R,8'-R)-3,4:3',4'-BIS-(METHYLENEDIOXY)-LIGNAN-7-OL
SpectraBase Compound ID JE1pf7IFd9N
InChI InChI=1S/C20H22O5/c1-12(7-14-3-5-16-18(8-14)24-10-22-16)13(2)20(21)15-4-6-17-19(9-15)25-11-23-17/h3-6,8-9,12-13,20-21H,7,10-11H2,1-2H3/t12-,13-,20+/m1/s1
InChIKey SDXLCXZRXWWAGW-IZDJOXEWSA-N
Mol Weight 342.39 g/mol
Molecular Formula C20H22O5
Exact Mass 342.146724 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Sge2qBK5Dt
Name MAGNOVATIN_A;REL-(7-S,8-R,8'-R)-3,4:3',4'-BIS-(METHYLENEDIOXY)-LIGNAN-7-OL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22O5
InChI InChI=1S/C20H22O5/c1-12(7-14-3-5-16-18(8-14)24-10-22-16)13(2)20(21)15-4-6-17-19(9-15)25-11-23-17/h3-6,8-9,12-13,20-21H,7,10-11H2,1-2H3/t12-,13-,20+/m1/s1
InChIKey SDXLCXZRXWWAGW-IZDJOXEWSA-N
Literature Reference Author L.F.L.BARROS,A.BARISON,M.J.SALVADOR,R.DEMELLO-SILVA,E.C.CABR AL,M.N.EBERLIN,M.E.A
Literature Reference Citation J.NAT.PROD.,72,1529(2009)
Literature Reference DOI 10.1021/np900203y
Molecular Weight 342.392 g/mol
Sample ID 33420
Solvent CDCl3