[1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-tridecanoyloxy-propan-2-yl] icosanoate

Systemtic Name: [1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-tridecanoyloxy-propan-2-yl] icosanoate Openeye Name: [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-tridecanoyloxy-ethyl] icosanoate CAS Name: eicosanoic acid [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-(1-oxotridecoxy)propan-2-yl] ester IUPAC Name: [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-tridecanoyloxypropan-2-yl] icosanoate Traditional Name: arachidic acid [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-tridecanoyloxy-ethyl] ester Formula: C38H76NO8P MolecularWeight: 705.985701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCC)COP(=O)(O)OCCN

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCC)COP(=O)(O)OCCN

InChI

InChI=1S/C38H76NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-23-25-27-29-31-38(41)47-36(35-46-48(42,43)45-33-32-39)34-44-37(40)30-28-26-24-22-14-12-10-8-6-4-2/h36H,3-35,39H2,1-2H3,(H,42,43)