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METHYL_(PENTAFLUOROBENZYL_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 xjyAvOmb8r
InChI InChI=1S/C32H32ClF5N2O12/c1-13(41)40-27-20(49-14(2)42)10-32(31(46)47-5,48-12-19-22(34)24(36)26(38)25(37)23(19)35)52-29(27)28(51-16(4)44)21(50-15(3)43)11-39-30(45)17-6-8-18(33)9-7-17/h6-9,20-21,27-29H,10-12H2,1-5H3,(H,39,45)(H,40,41)/t20-,21+,27+,28-,29+,32+/m0/s1
InChIKey QGGXSXNLTKBVBB-QJAZABNASA-N
Mol Weight 767.1 g/mol
Molecular Formula C32H32ClF5N2O12
Exact Mass 766.156393 g/mol
Enantiomer InChIKey QGGXSXNLTKBVBB-UYWKTCJHSA-N
Copyright Copyright © 2016-2024 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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