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REL-(7R,8S,7'S,8'R)-4,9,4',9'-TETRAHYDROXY-3,3'-DIMETHOXY-7,7'-EPOXYLIGNAN-9-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 6xE74W8lf43
InChI InChI=1S/C26H34O12/c1-34-18-7-12(3-5-16(18)29)24-14(9-27)15(25(38-24)13-4-6-17(30)19(8-13)35-2)11-36-26-23(33)22(32)21(31)20(10-28)37-26/h3-8,14-15,20-33H,9-11H2,1-2H3/t14-,15+,20-,21-,22+,23-,24+,25-,26-/m0/s1
InChIKey LLWYSUZPBAAOMS-MRLHULQQSA-N
Mol Weight 538.5 g/mol
Molecular Formula C26H34O12
Exact Mass 538.205027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9PufYCA8qFi
Name REL-(7R,8S,7'S,8'R)-4,9,4',9'-TETRAHYDROXY-3,3'-DIMETHOXY-7,7'-EPOXYLIGNAN-9-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H34O12
InChI InChI=1S/C26H34O12/c1-34-18-7-12(3-5-16(18)29)24-14(9-27)15(25(38-24)13-4-6-17(30)19(8-13)35-2)11-36-26-23(33)22(32)21(31)20(10-28)37-26/h3-8,14-15,20-33H,9-11H2,1-2H3/t14-,15+,20-,21-,22+,23-,24+,25-,26-/m0/s1
InChIKey LLWYSUZPBAAOMS-MRLHULQQSA-N
Literature Reference Author J.SUN,H.XUN,J.YU,F.TANG,Y.D.YUE,X.F.GUO
Literature Reference Citation MOLECULES,20,15686(2015)
Literature Reference DOI 10.3390/molecules200915686
Molecular Weight 538.549 g/mol
Solvent DMSO-D6
Source File Reference UWPA5087