Subecholine
trimethyl-[2-[8-oxo-8-[2-(trimethylazaniumyl)ethoxy]octanoyl]oxyethyl]azanium diiodide
Also Known As: subecholine|Corconium|Suberyldicholine|Suberyldicholine diiodide|suberyldi-choline diiodide|SUBERYLDICHOLINEDIIODIDE|Bis-(2-trimethylaminoethyl)suberate diiodide|SID:135727809|Ethanaminium, 2,2'-((1,8-dioxo-1,8-octanediyl)bis(oxy))bis(N,N,N-trimethyl-, diiodide|AZOCINE,OCTAHYDRO-1-(1,4-BENZODIOXAN-2-YLMETHYL)|2,2'-[(1,8-dioxooctane-1,8-diyl)bis(oxy)]bis(n,n,n-trimethylethanaminium) diiodide|trimethyl-[2-[8-oxo-8-[2-(trimethylazaniumyl)ethoxy]octanoyl]oxyethyl]azanium;diiodide|2,2'-(Octanedioylbis(oxy))bis(N,N,N-trimethylethan-1-aminium) iodide|2,2'-[(1,8-Dioxo-1,8-octanediyl)bis(oxy)]bis(N,N,N-trimethylethan aminium) diiodide|2,2'-[(1,8-Dioxooctane-1,8-diyl)bis(oxy)]bis(N,N,N-trimethylethan-1-aminium) diiodide|trimethyl-[2-[8-oxo-8-[2-(trimethylazaniumyl)ethoxy]octanoyl]oxyethyl]azanium diiodide
| Molecular Formula | C18H38I2N2O4 |
|---|---|
| Molecular Weight | 600.0921 g/mol |
| LogP | -4.1662 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 600.0921 |
| Monoisotopic Mass | 600.0921 |
| Heavy Atoms | 26 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 4372-39-8 |
|---|---|
| SMILES | C[N+](C)(C)CCOC(=O)CCCCCCC(=O)OCC[N+](C)(C)C.[I-].[I-] |
| InChIKey | NLKOQMGXIGBXQR-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Subecholine (CAS 4372-39-8), with molecular formula C18H38I2N2O4 and molecular weight 600.0921 g/mol. IUPAC: trimethyl-[2-[8-oxo-8-[2-(trimethylazaniumyl)ethoxy]octanoyl]oxyethyl]azanium diiodide.
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