[1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-tricosanoyloxy-propan-2-yl] tetracosanoate

Systemtic Name: [1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-tricosanoyloxy-propan-2-yl] tetracosanoate Openeye Name: [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-tricosanoyloxy-ethyl] tetracosanoate CAS Name: tetracosanoic acid [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-(1-oxotricosoxy)propan-2-yl] ester IUPAC Name: [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-tricosanoyloxypropan-2-yl] tetracosanoate Traditional Name: lignoceric acid [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-tricosanoyloxy-ethyl] ester Formula: C52H104NO8P MolecularWeight: 902.357821

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCCCCCCCC)COP(=O)(O)OCCN

InChI

InChI=1S/C52H104NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-52(55)61-50(49-60-62(56,57)59-47-46-53)48-58-51(54)44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h50H,3-49,53H2,1-2H3,(H,56,57)