2-azanyl-3-[[2-[(Z)-octadec-9-enoyl]oxy-3-tetracosanoyloxy-propoxy]-oxidanyl-phosphoryl]oxy-propanoic acid

Systemtic Name: 2-azanyl-3-[[2-[(Z)-octadec-9-enoyl]oxy-3-tetracosanoyloxy-propoxy]-oxidanyl-phosphoryl]oxy-propanoic acid Openeye Name: 2-amino-3-[hydroxy-[2-[(Z)-octadec-9-enoyl]oxy-3-tetracosanoyloxy-propoxy]phosphoryl]oxy-propanoic acid CAS Name: 2-amino-3-[hydroxy-[2-[(Z)-1-oxooctadec-9-enoxy]-3-(1-oxotetracosoxy)propoxy]phosphoryl]oxypropanoic acid IUPAC Name: 2-amino-3-[hydroxy-[2-[(Z)-octadec-9-enoyl]oxy-3-tetracosanoyloxypropoxy]phosphoryl]oxypropanoic acid Traditional Name: 2-amino-3-[hydroxy-[2-[(Z)-octadec-9-enoyl]oxy-3-tetracosanoyloxy-propoxy]phosphoryl]oxy-propionic acid Formula: C48H92NO10P MolecularWeight: 874.218541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(C(=O)O)N)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(C(=O)O)N)OC(=O)CCCCCCC/C=C\CCCCCCCC

InChI

InChI=1S/C48H92NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-27-29-31-33-35-37-39-46(50)56-41-44(42-57-60(54,55)58-43-45(49)48(52)53)59-47(51)40-38-36-34-32-30-28-25-18-16-14-12-10-8-6-4-2/h18,25,44-45H,3-17,19-24,26-43,49H2,1-2H3,(H,52,53)(H,54,55)/b25-18-