[(2R)-1-bis(phenylmethoxy)phosphoryloxy-3-hexadecoxy-propan-2-yl] hexadecanoate

Systemtic Name: [(2R)-1-bis(phenylmethoxy)phosphoryloxy-3-hexadecoxy-propan-2-yl] hexadecanoate Openeye Name: [(1R)-1-(dibenzyloxyphosphoryloxymethyl)-2-hexadecoxy-ethyl] hexadecanoate CAS Name: hexadecanoic acid [(2R)-1-bis(phenylmethoxy)phosphoryloxy-3-hexadecoxypropan-2-yl] ester IUPAC Name: [(2R)-1-bis(phenylmethoxy)phosphoryloxy-3-hexadecoxypropan-2-yl] hexadecanoate Traditional Name: palmitic acid [(1R)-1-(cetyloxymethyl)-2-dibenzoxyphosphoryloxy-ethyl] ester Formula: C49H83O7P MolecularWeight: 815.152881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COP(=O)(OCC1=CC=CC=C1)OCC2=CC=CC=C2)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC[C@H](COP(=O)(OCC1=CC=CC=C1)OCC2=CC=CC=C2)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C49H83O7P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-35-41-52-44-48(56-49(50)40-34-26-24-22-20-18-16-14-12-10-8-6-4-2)45-55-57(51,53-42-46-36-30-28-31-37-46)54-43-47-38-32-29-33-39-47/h28-33,36-39,48H,3-27,34-35,40-45H2,1-2H3/t48-/m1/s1