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REL-(7-R,8-S,1'-R,2'-S)-2'-HYDROXY-3,4,5-TRIMETHOXY-3'-OXO-DELTA(1,3,5,4',8')-8.1',7.0.2'-NEOLIGNAN
SpectraBase Compound ID Gk0jWb8WRdf
InChI InChI=1S/C21H26O6/c1-6-9-20-10-7-8-17(22)21(20,23)27-18(13(20)2)14-11-15(24-3)19(26-5)16(12-14)25-4/h6-8,11-13,18,23H,1,9-10H2,2-5H3/t13-,18-,20-,21-/m1/s1
InChIKey QVEDXFLSTDBEMG-SRXWUYEGSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LHO2XM899O2
Name REL-(7-R,8-S,1'-R,2'-S)-2'-HYDROXY-3,4,5-TRIMETHOXY-3'-OXO-DELTA(1,3,5,4',8')-8.1',7.0.2'-NEOLIGNAN
Compound Number 5E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-6-9-20-10-7-8-17(22)21(20,23)27-18(13(20)2)14-11-15(24-3)19(26-5)16(12-14)25-4/h6-8,11-13,18,23H,1,9-10H2,2-5H3/t13-,18-,20-,21-/m1/s1
InChIKey QVEDXFLSTDBEMG-SRXWUYEGSA-N
Literature Reference Author A.L.L.LORDELLO,M.YOSHIDA
Literature Reference Citation PHYTOCHEM.,46,741(1997)
Literature Reference DOI 10.1016/s0031-9422(97)00343-9
Molecular Weight 374.434 g/mol
Sample ID 44939
Solvent CDCl3