Atracurium Impurity A1 (trans-Monoquatenary)

CAT No.

ALN-A021009

CAS No.

Mol. F.

C52H69N2O12 : C2F3O2

Mol. Wt.

914.1 : 113.0

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Technical Data

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Product Overview

Chemical Name : (1R,2S)-1-(3,4-Dimethoxybenzyl)-2-(3-((5-((3-((R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)propanoyl)oxy)pentyl)oxy)-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium 2,2,2-trifluoroacetate

Smiles : COC1=CC([C@@H](CC(C=C2)=CC(OC)=C2OC)N(CCC(OCCCCCOC(CC[N@@+](CC3)(C)[C@H](CC(C=C4)=CC(OC)=C4OC)C(C=C5OC)=C3C=C5OC)=O)=O)CC6)=C6C=C1OC.[O-]C(C(F)(F)F)=O

Inchi : InChI=1S/C53H72N2O12.2ClH/c1-54(22-18-38-32-48(62-7)50(64-9)34-40(38)42(54)28-36-14-16-44(58-3)46(30-36)60-5)24-20-52(56)66-26-12-11-13-27-67-53(57)21-25-55(2)23-19-39-33-49(63-8)51(65-10)35-41(39)43(55)29-37-15-17-45(59-4)47(31-37)61-6;;/h14-17,30-35,42-43H,11-13,18-29H2,1-10H3;2*1H/q+2;;/p-2/t42-,43-,54-,55+;;/m1../s1

Synonym : N-Desmethyl-transatracurium Besylate

Technical Data

Reference

Agata Bu0142azewicz, Zbigniew Fijau0142eka,b, Mau0142gorzata Warowna-Grzeskiewicz ,Magdalena JadachnJournal of Chromatography A, 1217 (2010) 1266u20131272

Nisha Mistry,Andrew D. Roberts, George E. Tranter,Peter Francis, Ian Barylski, Ismail M. Ismail,§ Jeremy K. Nicholson,| and John C. Lindon – Anal. Chem. 1999, 71, 2838-2843

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