[2-icosanoyloxy-3-[2-(methylamino)ethoxy-oxidanyl-phosphoryl]oxy-propyl] icosanoate

Systemtic Name: [2-icosanoyloxy-3-[2-(methylamino)ethoxy-oxidanyl-phosphoryl]oxy-propyl] icosanoate Openeye Name: [3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxy-2-icosanoyloxy-propyl] icosanoate CAS Name: eicosanoic acid [3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxy-2-(1-oxoeicosoxy)propyl] ester IUPAC Name: [3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxy-2-icosanoyloxypropyl] icosanoate Traditional Name: arachidic acid [2-eicosanoyloxy-3-[hydroxy-[2-(methylamino)ethoxy]phosphoryl]oxy-propyl] ester Formula: C46H92NO8P MolecularWeight: 818.198341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC)OC(=O)CCCCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC)OC(=O)CCCCCCCCCCCCCCCCCCC

InChI

InChI=1S/C46H92NO8P/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-45(48)52-42-44(43-54-56(50,51)53-41-40-47-3)55-46(49)39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h44,47H,4-43H2,1-3H3,(H,50,51)