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(7-R,8-S)-4-O-(GLYCER-2-YL)-7,9,9'-TRIHYDROXY-3,3'-DIMETHOXY-8-O-4'-NEOLIGNAN
SpectraBase Compound ID 7f5cfvUhitX
InChI InChI=1S/C23H32O9/c1-29-20-10-15(4-3-9-24)5-7-19(20)32-22(14-27)23(28)16-6-8-18(21(11-16)30-2)31-17(12-25)13-26/h5-8,10-11,17,22-28H,3-4,9,12-14H2,1-2H3/t22-,23+/m0/s1
InChIKey YRKCVXOIVFVIBY-XZOQPEGZSA-N
Mol Weight 452.5 g/mol
Molecular Formula C23H32O9
Exact Mass 452.204633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JllnLQ2FPWr
Name (7-R,8-S)-4-O-(GLYCER-2-YL)-7,9,9'-TRIHYDROXY-3,3'-DIMETHOXY-8-O-4'-NEOLIGNAN
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H32O9
InChI InChI=1S/C23H32O9/c1-29-20-10-15(4-3-9-24)5-7-19(20)32-22(14-27)23(28)16-6-8-18(21(11-16)30-2)31-17(12-25)13-26/h5-8,10-11,17,22-28H,3-4,9,12-14H2,1-2H3/t22-,23+/m0/s1
InChIKey YRKCVXOIVFVIBY-XZOQPEGZSA-N
Literature Reference Author L.FANG,D.DU,G.Z.DING,Y.K.SI,S.S.YU,Y.LIU,W.J.WANG,S.G.MA,S.X U,J.QU,J.M.FANG,Y.X.
Literature Reference Citation J.NAT.PROD.,73,818(2010)
Literature Reference DOI 10.1021/np900712v
Molecular Weight 452.502 g/mol
Sample ID 35450
Solvent CD3OD