DIMETHYLTUBOCURARINIUM CHLORIDE

33335-58-9

MFCD00867703

C40 H48 N2 O6 . 2 Cl

723.733

InChI=1S/C40H48N2O6.2ClH/c1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36;;/h9-14,21-24,31-32H,15-20H2,1-8H3;2*1H/q+2;;/p-2/t31-,32+;;/m0../s1

InChIKey=IRPSJVWFSWAZSZ-OIUSMDOTSA-L

C[N+]1(CCc2cc(c3cc2[C@@H]1Cc4ccc(cc4)Oc5c6c(cc(c5OC)OC)CC[N+]([C@@H]6Cc7ccc(c(c7)O3)OC)(C)C)OC)C.[Cl-].[Cl-]

H bond donor:0

H bond acceptor:8

XLogP3:9.0

Bulk/Fine:F