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REL-(7S,8R,7'S,8'S)-3,4,3'-TRIMETHOXY-4'-HYDROXY-7,7'-EPOXYLIGNAN
SpectraBase Compound ID 2wGi6qKoYdp
InChI InChI=1S/C21H26O5/c1-12-13(2)21(15-7-9-17(23-3)19(11-15)25-5)26-20(12)14-6-8-16(22)18(10-14)24-4/h6-13,20-22H,1-5H3/t12-,13+,20+,21+/m0/s1
InChIKey YPQNDHHCUQGPFN-GQSHPZAJSA-N
Mol Weight 358.43 g/mol
Molecular Formula C21H26O5
Exact Mass 358.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CknlTuFh3C1
Name REL-(7S,8R,7'S,8'S)-3,4,3'-TRIMETHOXY-4'-HYDROXY-7,7'-EPOXYLIGNAN
Compound Number 3B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O5
InChI InChI=1S/C21H26O5/c1-12-13(2)21(15-7-9-17(23-3)19(11-15)25-5)26-20(12)14-6-8-16(22)18(10-14)24-4/h6-13,20-22H,1-5H3/t12-,13+,20+,21+/m0/s1
InChIKey YPQNDHHCUQGPFN-GQSHPZAJSA-N
Literature Reference Author A.A.D.S.FILHO,S.ALBUQUERQUE,M.L.A.ESILVA,M.N.EBERLIN,D.M.TOM AZELA,J.K.BASTOS
Literature Reference Citation J.NAT.PROD.,67,42(2004)
Literature Reference DOI 10.1021/np0302697
Molecular Weight 358.434 g/mol
Solvent CDCl3
Source File Reference UWSP912