[(2R)-3-[2-ethanoylsulfanylethoxy(oxidanyl)phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate

Systemtic Name: [(2R)-3-[2-ethanoylsulfanylethoxy(oxidanyl)phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate Openeye Name: [(2R)-3-[2-acetylsulfanylethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxy-propyl] hexadecanoate CAS Name: hexadecanoic acid [(2R)-3-[2-(acetylthio)ethoxy-hydroxyphosphoryl]oxy-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: [(2R)-3-[2-acetylsulfanylethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate Traditional Name: palmitic acid [(2R)-3-[2-(acetylthio)ethoxy-hydroxy-phosphoryl]oxy-2-hexadecanoyloxy-propyl] ester Formula: C39H75O9PS MolecularWeight: 751.046161

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCSC(=O)C)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCSC(=O)C)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C39H75O9PS/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-38(41)45-34-37(35-47-49(43,44)46-32-33-50-36(3)40)48-39(42)31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h37H,4-35H2,1-3H3,(H,43,44)/t37-/m1/s1