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

Systemtic Name: [3-[2-(butanoylamino)ethoxy-oxidanyl-phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate Openeye Name: [3-[2-(butanoylamino)ethoxy-hydroxy-phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate CAS Name: hexadecanoic acid [3-[hydroxy-[2-(1-oxobutylamino)ethoxy]phosphoryl]oxy-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: [3-[2-(butanoylamino)ethoxy-hydroxyphosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate Traditional Name: palmitic acid [3-[2-butyramidoethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxy-propyl] ester Formula: C41H80NO9P MolecularWeight: 762.048961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C41H80NO9P/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-32-40(44)48-36-38(37-50-52(46,47)49-35-34-42-39(43)31-6-3)51-41(45)33-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h38H,4-37H2,1-3H3,(H,42,43)(H,46,47)