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(2S,3S)-2-(4-HYDROXY-3,5-DIMETHOXYBENZYL)-3-(5-METHOXY-3,4-METHYLENEDIOXYBENZYL)-BUTYROLACTONE
SpectraBase Compound ID C4r6T8Fv0Mq
InChI InChI=1S/C22H24O8/c1-25-16-6-13(7-17(26-2)20(16)23)5-15-14(10-28-22(15)24)4-12-8-18(27-3)21-19(9-12)29-11-30-21/h6-9,14-15,23H,4-5,10-11H2,1-3H3/t14-,15+/m1/s1
InChIKey PXGBYNPVEFKJGA-CABCVRRESA-N
Mol Weight 416.43 g/mol
Molecular Formula C22H24O8
Exact Mass 416.147118 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2h17lSBsLcs
Name (2S,3S)-2-(4-HYDROXY-3,5-DIMETHOXYBENZYL)-3-(5-METHOXY-3,4-METHYLENEDIOXYBENZYL)-BUTYROLACTONE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24O8
InChI InChI=1S/C22H24O8/c1-25-16-6-13(7-17(26-2)20(16)23)5-15-14(10-28-22(15)24)4-12-8-18(27-3)21-19(9-12)29-11-30-21/h6-9,14-15,23H,4-5,10-11H2,1-3H3/t14-,15+/m1/s1
InChIKey PXGBYNPVEFKJGA-CABCVRRESA-N
Literature Reference Author N.LI,J.L.WU,J.I.SAKAI,M.ANDO
Literature Reference Citation J.NAT.PROD.,66,1421(2003)
Literature Reference DOI 10.1021/np030247k
Molecular Weight 416.428 g/mol
Solvent CDCl3
Source File Reference UWKP3230