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METHYL_2,3,5-TRI-O-BENZYL-1-C-(1,3-DITHIANE-2-YL)-L-ARABINOSE;ALPHA_ANOMER
SpectraBase Compound ID 54oeZEmXeHF
InChI InChI=1S/C31H36O5S2/c1-32-31(30-37-18-11-19-38-30)29(35-22-26-16-9-4-10-17-26)28(34-21-25-14-7-3-8-15-25)27(36-31)23-33-20-24-12-5-2-6-13-24/h2-10,12-17,27-30H,11,18-23H2,1H3
InChIKey GBBORZGAXLEPEN-UHFFFAOYSA-N
Mol Weight 552.7 g/mol
Molecular Formula C31H36O5S2
Exact Mass 552.200417 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6duwXhR9mcc
Name METHYL_2,3,5-TRI-O-BENZYL-1-C-(1,3-DITHIANE-2-YL)-L-ARABINOSE;BETA_ANOMER
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H36O5S2
InChI InChI=1S/C31H36O5S2/c1-32-31(30-37-18-11-19-38-30)29(35-22-26-16-9-4-10-17-26)28(34-21-25-14-7-3-8-15-25)27(36-31)23-33-20-24-12-5-2-6-13-24/h2-10,12-17,27-30H,11,18-23H2,1H3
InChIKey GBBORZGAXLEPEN-UHFFFAOYSA-N
Literature Reference Author A.C.ARAUJO,A.P.RAUTER,F.NICOTRA,C.AIROLDI,B.COSTA,L.CIPOLLA
Literature Reference Citation J.MED.CHEM.,54,1266(2011)
Literature Reference DOI 10.1021/jm101244n
Molecular Weight 552.744 g/mol
Solvent CDCl3
Source File Reference UWMZ48126