[2-hexadecanoyloxy-3-[oxidanyl-[2-(4-oxidanylidenebutanoylamino)ethoxy]phosphoryl]oxy-propyl] hexadecanoate

Systemtic Name: [2-hexadecanoyloxy-3-[oxidanyl-[2-(4-oxidanylidenebutanoylamino)ethoxy]phosphoryl]oxy-propyl] hexadecanoate Openeye Name: [2-hexadecanoyloxy-3-[hydroxy-[2-(4-oxobutanoylamino)ethoxy]phosphoryl]oxy-propyl] hexadecanoate CAS Name: hexadecanoic acid [3-[2-(1,4-dioxobutylamino)ethoxy-hydroxyphosphoryl]oxy-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: [2-hexadecanoyloxy-3-[hydroxy-[2-(4-oxobutanoylamino)ethoxy]phosphoryl]oxypropyl] hexadecanoate Traditional Name: palmitic acid [2-hexadecanoyloxy-3-[hydroxy-[2-(4-ketobutanoylamino)ethoxy]phosphoryl]oxy-propyl] ester Formula: C41H78NO10P MolecularWeight: 776.032481

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)CCC=O)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)CCC=O)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C41H78NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-40(45)49-36-38(37-51-53(47,48)50-35-33-42-39(44)30-29-34-43)52-41(46)32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h34,38H,3-33,35-37H2,1-2H3,(H,42,44)(H,47,48)