John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5o1u7N4AJXS

(accessed ).
METHYL_(2,3-DIFLUOROBENZYL_5-ACETAMIDO-4,7,8-TRI-O-ACETYL-9-(4-CHLOROBENZAMIDO)-3,5,9-TRIDEOXY-D-GLYCERO-ALPHA-D-GALACTO-2-NONULOPYRANOSID)-ONATE
SpectraBase Compound ID 5o1u7N4AJXS
InChI InChI=1S/C32H35ClF2N2O12/c1-16(38)37-27-24(46-17(2)39)13-32(31(43)44-5,45-15-21-7-6-8-23(34)26(21)35)49-29(27)28(48-19(4)41)25(47-18(3)40)14-36-30(42)20-9-11-22(33)12-10-20/h6-12,24-25,27-29H,13-15H2,1-5H3,(H,36,42)(H,37,38)/t24-,25+,27+,28-,29+,32+/m0/s1
InChIKey XEWVPULFXJPOGZ-RQBGULOZSA-N
Mol Weight 713.1 g/mol
Molecular Formula C32H35ClF2N2O12
Exact Mass 712.184659 g/mol
Enantiomer InChIKey XEWVPULFXJPOGZ-AVIFTUTJSA-N
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Low Molecular Weight Antagonists of the Myelin-Associated Glycoprotein: Synthesis, Docking, and Biological Evaluation Journal of Medicinal Chemistry 2010
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