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(7-S,8-R,1'-R,3'-R,4'-S)-4'-HYDROXY-3',5'-DIMETHOXY-3,4-METHYLENEDIOXY-2'-OXO-DELTA(1,3,5,5',8')-8.1',7.3'-NEOLIGNAN

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(7-S,8-R,1'-R,3'-R,4'-S)-4'-HYDROXY-3',5'-DIMETHOXY-3,4-METHYLENEDIOXY-2'-OXO-DELTA(1,3,5,5',8')-8.1',7.3'-NEOLIGNAN
SpectraBase Compound ID 7ZvkGiAIUuS
InChI InChI=1S/C21H24O6/c1-5-8-20-10-16(24-3)18(22)21(25-4,19(20)23)17(12(20)2)13-6-7-14-15(9-13)27-11-26-14/h5-7,9-10,12,17-18,22H,1,8,11H2,2-4H3/t12-,17-,18+,20-,21+/m1/s1
InChIKey VMLKPGBVBAIQOW-REMQMKFTSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FUQFuTZ6a4P
Name (7-S,8-R,1'-R,3'-R,4'-S)-4'-HYDROXY-3',5'-DIMETHOXY-3,4-METHYLENEDIOXY-2'-OXO-DELTA(1,3,5,5',8')-8.1',7.3'-NEOLIGNAN
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-5-8-20-10-16(24-3)18(22)21(25-4,19(20)23)17(12(20)2)13-6-7-14-15(9-13)27-11-26-14/h5-7,9-10,12,17-18,22H,1,8,11H2,2-4H3/t12-,17-,18+,20-,21+/m1/s1
InChIKey VMLKPGBVBAIQOW-REMQMKFTSA-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 372.418 g/mol
Sample ID 44941
Solvent CDCl3