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THREO-CAROLIGNAN-H;THREO-1-(4-HYDROXY-3-METHOXYPHENYL)-2-[4-[3-(4-HYDROXY-3-METHOXYCINNAMOYLOXY)-PROPYL]-2-METHOXYPHENOXY]-1,3-PROPANODIOL
SpectraBase Compound ID L6JCZ6yMdP5
InChI InChI=1S/C30H34O10/c1-36-25-15-20(6-10-22(25)32)8-13-29(34)39-14-4-5-19-7-12-24(27(16-19)38-3)40-28(18-31)30(35)21-9-11-23(33)26(17-21)37-2/h6-13,15-17,28,30-33,35H,4-5,14,18H2,1-3H3/b13-8+/t28-,30-/m0/s1
InChIKey ILVXJJSXHREWRQ-AJRRAYIOSA-N
Mol Weight 554.6 g/mol
Molecular Formula C30H34O10
Exact Mass 554.215197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EukqDMZWEQP
Name THREO-CAROLIGNAN-H;THREO-1-(4-HYDROXY-3-METHOXYPHENYL)-2-[4-[3-(4-HYDROXY-3-METHOXYCINNAMOYLOXY)-PROPYL]-2-METHOXYPHENOXY]-1,3-PROPANODIOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H34O10
InChI InChI=1S/C30H34O10/c1-36-25-15-20(6-10-22(25)32)8-13-29(34)39-14-4-5-19-7-12-24(27(16-19)38-3)40-28(18-31)30(35)21-9-11-23(33)26(17-21)37-2/h6-13,15-17,28,30-33,35H,4-5,14,18H2,1-3H3/b13-8+/t28-,30-/m0/s1
InChIKey ILVXJJSXHREWRQ-AJRRAYIOSA-N
Literature Reference Author A.M.L.SECA,A.M.S.SILVA,A.J.D.SILVESTRE,J.A.S.CAVALEIRO,F.M.J .DOMINGUES,C.PASCOAL
Literature Reference Citation PHYTOCHEM.,56,759(2001)
Literature Reference DOI 10.1016/S0031-9422(00)00473-8
Molecular Weight 554.594 g/mol
Solvent CDCl3
Source File Reference UWVN2030