[1-[2,3-bis(oxidanyl)propoxy-oxidanyl-phosphoryl]oxy-3-hexadecanoyloxy-propan-2-yl] octadecanoate

Systemtic Name: [1-[2,3-bis(oxidanyl)propoxy-oxidanyl-phosphoryl]oxy-3-hexadecanoyloxy-propan-2-yl] octadecanoate Openeye Name: [1-[[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxymethyl]-2-hexadecanoyloxy-ethyl] octadecanoate CAS Name: octadecanoic acid [1-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-(1-oxohexadecoxy)propan-2-yl] ester IUPAC Name: [1-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-hexadecanoyloxypropan-2-yl] octadecanoate Traditional Name: stearic acid [1-[[glyceryloxy(hydroxy)phosphoryl]oxymethyl]-2-hexadecanoyloxy-ethyl] ester Formula: C40H79O10P MolecularWeight: 751.023021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC(CO)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COP(=O)(O)OCC(CO)O

InChI

InChI=1S/C40H79O10P/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-32-40(44)50-38(36-49-51(45,46)48-34-37(42)33-41)35-47-39(43)31-29-27-25-23-21-19-16-14-12-10-8-6-4-2/h37-38,41-42H,3-36H2,1-2H3,(H,45,46)