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[(5S,6R,7S,8R)-6-(acetyloxymethyl)-5-methoxy-8-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxol-7-yl]methyl acetate

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[(5S,6R,7S,8R)-6-(acetyloxymethyl)-5-methoxy-8-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxol-7-yl]methyl acetate
SpectraBase Compound ID 9bOCF3R8XTK
InChI InChI=1S/C27H32O10/c1-14(28)34-11-19-20(12-35-15(2)29)26(32-5)18-10-22-21(36-13-37-22)9-17(18)25(19)16-7-23(30-3)27(33-6)24(8-16)31-4/h7-10,19-20,25-26H,11-13H2,1-6H3/t19-,20+,25-,26-/m1/s1
InChIKey TVGDMYCAOBDLQI-KYVQNOJUSA-N
Mol Weight 516.5 g/mol
Molecular Formula C27H32O10
Exact Mass 516.199547 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FEWt0SQoQoU
Name [(5S,6R,7S,8R)-6-(acetyloxymethyl)-5-methoxy-8-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxol-7-yl]methyl acetate
Compound Number 69
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32O10
InChI InChI=1S/C27H32O10/c1-14(28)34-11-19-20(12-35-15(2)29)26(32-5)18-10-22-21(36-13-37-22)9-17(18)25(19)16-7-23(30-3)27(33-6)24(8-16)31-4/h7-10,19-20,25-26H,11-13H2,1-6H3/t19-,20+,25-,26-/m1/s1
InChIKey TVGDMYCAOBDLQI-KYVQNOJUSA-N
Literature Reference Author A.SANFELICIANO,J.M.M.DELCORRAL,M.GORDALIZA,M.A.CASTRO
Literature Reference Citation MAGN.RES.CHEM.,31,868(1993)
Literature Reference DOI 10.1002/mrc.1260310915
Molecular Weight 516.545 g/mol
Solvent CDCl3
Source File Reference UWPR118