[3-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-2-pentadecanoyloxy-propyl] henicosanoate

Systemtic Name: [3-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-2-pentadecanoyloxy-propyl] henicosanoate Openeye Name: [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-pentadecanoyloxy-propyl] henicosanoate CAS Name: heneicosanoic acid [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-(1-oxopentadecoxy)propyl] ester IUPAC Name: [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-pentadecanoyloxypropyl] henicosanoate Traditional Name: heneicosanoic acid [3-[2-aminoethoxy(hydroxy)phosphoryl]oxy-2-pentadecanoyloxy-propyl] ester Formula: C41H82NO8P MolecularWeight: 748.065441

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCN)OC(=O)CCCCCCCCCCCCCC

InChI

InChI=1S/C41H82NO8P/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-24-25-27-29-31-33-40(43)47-37-39(38-49-51(45,46)48-36-35-42)50-41(44)34-32-30-28-26-23-16-14-12-10-8-6-4-2/h39H,3-38,42H2,1-2H3,(H,45,46)