[3-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-2-hexadecanoyloxy-propyl] octadecanoate

Systemtic Name: [3-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-2-hexadecanoyloxy-propyl] octadecanoate Openeye Name: [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxy-propyl] octadecanoate CAS Name: octadecanoic acid [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-(1-oxohexadecoxy)propyl] ester IUPAC Name: [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxypropyl] octadecanoate Traditional Name: stearic acid [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxy-propyl] ester Formula: C39H78NO8P MolecularWeight: 720.012281

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C39H78NO8P/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40)48-39(42)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h37H,3-36,40H2,1-2H3,(H,43,44)