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BENZYL-2,3-BIS-O-(4-METHOXYBENZYL)-4,6-O-BENZYLIDENE-1-SULFONYL-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 37CIniFIX9q
InChI InChI=1S/C36H38O9S/c1-39-29-17-13-25(14-18-29)21-41-33-32-31(23-43-35(45-32)28-11-7-4-8-12-28)44-36(46(37,38)24-27-9-5-3-6-10-27)34(33)42-22-26-15-19-30(40-2)20-16-26/h3-20,31-36H,21-24H2,1-2H3/t31-,32-,33+,34-,35-,36+/m0/s1
InChIKey PSUGPYNRXFQGHP-ACXDWINASA-N
Mol Weight 646.8 g/mol
Molecular Formula C36H38O9S
Exact Mass 646.223654 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F5BmohipYuC
Name BENZYL-2,3-BIS-O-(4-METHOXYBENZYL)-4,6-O-BENZYLIDENE-1-SULFONYL-BETA-D-GLUCOPYRANOSIDE
Compound Number 30
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38O9S
InChI InChI=1S/C36H38O9S/c1-39-29-17-13-25(14-18-29)21-41-33-32-31(23-43-35(45-32)28-11-7-4-8-12-28)44-36(46(37,38)24-27-9-5-3-6-10-27)34(33)42-22-26-15-19-30(40-2)20-16-26/h3-20,31-36H,21-24H2,1-2H3/t31-,32-,33+,34-,35-,36+/m0/s1
InChIKey PSUGPYNRXFQGHP-ACXDWINASA-N
Literature Reference Author P.PASETTO,R.W.FRANCK
Literature Reference Citation J.ORG.CHEM.,68,8042(2003)
Literature Reference DOI 10.1021/jo034607k
Molecular Weight 646.752 g/mol
Solvent CDCl3
Source File Reference UWVN20921