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TRANS-2-(4-HYDROXY-3,5-DIMETHOXYBENZYL)-3-(ALPHA-HYDROXY-3,4-METHYLENEDIOXYBENZYL)-BUTANOLIDE;EPIMER-#1
SpectraBase Compound ID 5gm9xFlGY8d
InChI InChI=1S/C21H22O8/c1-25-17-6-11(7-18(26-2)20(17)23)5-13-14(9-27-21(13)24)19(22)12-3-4-15-16(8-12)29-10-28-15/h3-4,6-8,13-14,19,22-23H,5,9-10H2,1-2H3/t13-,14+,19?/m1/s1
InChIKey GKLCKTAHWKLKNQ-YCENCERGSA-N
Mol Weight 402.4 g/mol
Molecular Formula C21H22O8
Exact Mass 402.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cv6aZoOt8hr
Name TRANS-2-(4-HYDROXY-3,5-DIMETHOXYBENZYL)-3-(ALPHA-HYDROXY-3,4-METHYLENEDIOXYBENZYL)-BUTANOLIDE;EPIMER-#1
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O8
InChI InChI=1S/C21H22O8/c1-25-17-6-11(7-18(26-2)20(17)23)5-13-14(9-27-21(13)24)19(22)12-3-4-15-16(8-12)29-10-28-15/h3-4,6-8,13-14,19,22-23H,5,9-10H2,1-2H3/t13-,14+,19?/m1/s1
InChIKey GKLCKTAHWKLKNQ-YCENCERGSA-N
Literature Reference Author B.BOTTA,G.DELLEMONACHE,P.RICCIARDI,A.VITALI,V.VINCIGUERRA,D. MISITI,J.P.KUTNEY,N.
Literature Reference Citation HETEROCYCLES,43,2443(1996)
Literature Reference DOI 10.3987/COM-96-7568
Molecular Weight 402.401 g/mol
Solvent Unknown
Source File Reference UWCP6432