Laudexium metilsulfate
[CAS# 3253-60-9]

Identification

• Name: Laudexium metilsulfate
• Synonyms: 2-[10-(6,7-Dimethoxy-2-Methyl-1-Veratryl-3,4-Dihydro-1H-Isoquinolin-2-Ium-2-Yl)Decyl]-6,7-Dimethoxy-2-Methyl-1-Veratryl-3,4-Dihydro-1H-Isoquinolin-2-Ium; Methyl Sulfate; Laudolissin; Laudolissin Methosulphate
• Molecular Formula: C₅₄H₈₀N₂O₁₆S₂
• Molecular Weight: 1077.35
• CAS Registry Number: 3253-60-9
• SMILES: C1=C(OC)C(=CC2=C1C([N+](CC2)(CCCCCCCCCC[N+]4(C(C3=C(C=C(OC)C(=C3)OC)CC4)CC5=CC=C(C(=C5)OC)OC)C)C)CC6=CC(=C(OC)C=C6)OC)OC.CO[S](=O)(=O)[O-].CO[S](=O)(=O)[O-]
• InChI: 1S/C52H74N2O8.2CH4O4S/c1-53(27-23-39-33-49(59-7)51(61-9)35-41(39)43(53)29-37-19-21-45(55-3)47(31-37)57-5)25-17-15-13-11-12-14-16-18-26-54(2)28-24-40-34-50(60-8)52(62-10)36-42(40)44(54)30-38-20-22-46(56-4)48(32-38)58-6;2*1-5-6(2,3)4/h19-22,31-36,43-44H,11-18,23-30H2,1-10H3;2*1H3,(H,2,3,4)/q+2;;/p-2
• InChIKey: LADQAYSLFLCKOD-UHFFFAOYSA-L