Ixazomib S Isomer
Impurity
This molecule is a impurity of Ixazomib.
Technical Data
Cat. No.ANT-IXZ-002
CASNA
Mol. FormulaC20H23BCl2N2O9
Mol. Weight517.12 g/mol
IUPAC2-[4-(carboxymethyl)-2-[(1S)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid
SMILESO=C1C(CC(O)=O)(CC(O)=O)OB([C@H](NC(CNC(C2=CC(Cl)=CC=C2Cl)=O)=O)CC(C)C)O1
InChIInChI=1S/C20H23BCl2N2O9/c1-10(2)5-14(21-33-19(32)20(34-21,7-16(27)28)8-17(29)30)25-15(26)9-24-18(31)12-6-11(22)3-4-13(12)23/h3-4,6,10,14H,5,7-9H2,1-2H3,(H,24,31)(H,25,26)(H,27,28)(H,29,30)/t14-/m1/s1
InChI KeyMBOMYENWWXQSNW-CQSZACIVSA-N
Description
Overview
Ixazomib S Isomer, Ixazomib, NA, 2-[4-(carboxymethyl)-2-[(1S)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid
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Synonyms
NAIxazomib Impurity 49Ixazomib Citrate, (S)-(S)-2,2'-(2-(1-(2-(2,5-dichlorobenzamido)acetamido)-3-methylbutyl)-5-oxo-1,3,2-dioxaborolane-4,4-diyl)diacetic acid2-[4-(Carboxymethyl)-2-[(1S)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]-5-oxo-1,3,2-dioxaborolan-4-yl]acetic acid



