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RHEMANEOLIGNAN-B;(7'S,8'S)-3,3'-DIMETHOXY-1-(3-METHYL-1-ACRYLATE)-1'-(1,2,3-TRIHYDROXYPROPYL)-4-O-4'-NEOLIGNAN
SpectraBase Compound ID ClQb2FaMWFe
InChI InChI=1S/C21H24O8/c1-26-18-10-13(5-9-20(24)28-3)4-7-16(18)29-17-8-6-14(11-19(17)27-2)21(25)15(23)12-22/h4-11,15,21-23,25H,12H2,1-3H3/b9-5+/t15-,21-/m1/s1
InChIKey IVDMSWPOHFCIHO-FCFRGYFYSA-N
Mol Weight 404.42 g/mol
Molecular Formula C21H24O8
Exact Mass 404.147118 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6TMzrA2X3hA
Name RHEMANEOLIGNAN-B;(7'S,8'S)-3,3'-DIMETHOXY-1-(3-METHYL-1-ACRYLATE)-1'-(1,2,3-TRIHYDROXYPROPYL)-4-O-4'-NEOLIGNAN
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H24O8
InChI InChI=1S/C21H24O8/c1-26-18-10-13(5-9-20(24)28-3)4-7-16(18)29-17-8-6-14(11-19(17)27-2)21(25)15(23)12-22/h4-11,15,21-23,25H,12H2,1-3H3/b9-5+/t15-,21-/m1/s1
InChIKey IVDMSWPOHFCIHO-FCFRGYFYSA-N
Literature Reference Author M.LI,X.WANG,X.ZHENG,J.WANG,W.ZHAO,K.SONG,X.ZHAO,Y.ZHANG,H.KU ANG,W.FENG
Literature Reference Citation MOLECULES,20,15192(2015)
Literature Reference DOI 10.3390/molecules200815192
Molecular Weight 404.417 g/mol
Solvent DMSO-D6
Source File Reference UWPA5022