2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl phosphate

Systemtic Name: 2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl phosphate Openeye Name: 2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl phosphate CAS Name: 2,3-bis[(9Z,12Z)-1-oxooctadeca-9,12-dienoxy]propyl phosphate IUPAC Name: 2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl phosphate Traditional Name: 2,3-bis[[(9Z,12Z)-octadeca-9,12-dienoyl]oxy]propyl phosphate Formula: C39H67O8P-2 MolecularWeight: 694.918241

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)OCC(COP(=O)([O-])[O-])OC(=O)CCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCC(COP(=O)([O-])[O-])OC(=O)CCCCCCC/C=C\C/C=C\CCCCC

InChI

InChI=1S/C39H69O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(40)45-35-37(36-46-48(42,43)44)47-39(41)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,37H,3-10,15-16,21-36H2,1-2H3,(H2,42,43,44)/p-2/b13-11-,14-12-,19-17-,20-18-