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

Systemtic Name: [2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(12Z)-octadeca-9,12-dienoyl]oxy-propyl] (12Z)-octadeca-9,12-dienoate Openeye Name: [2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(12Z)-octadeca-9,12-dienoyl]oxy-propyl] (12Z)-octadeca-9,12-dienoate CAS Name: (12Z)-octadeca-9,12-dienoic acid [2-[(9Z,12Z)-1-oxooctadeca-9,12-dienoxy]-3-[(12Z)-1-oxooctadeca-9,12-dienoxy]propyl] ester IUPAC Name: [2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(12Z)-octadeca-9,12-dienoyl]oxypropyl] (12Z)-octadeca-9,12-dienoate Traditional Name: (12Z)-octadeca-9,12-dienoic acid [2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxy-3-[(12Z)-octadeca-9,12-dienoyl]oxy-propyl] ester Formula: C57H98O6 MolecularWeight: 879.38442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCCCCC)OC(=O)CCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCC/C=C\CC=CCCCCCCCC(=O)OCC(OC(=O)CCCCCCC/C=C\C/C=C\CCCCC)COC(=O)CCCCCCCC=CC/C=C\CCCCC

InChI

InChI=1S/C57H98O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h16-21,25-30,54H,4-15,22-24,31-53H2,1-3H3/b19-16-,20-17-,21-18-,28-25?,29-26?,30-27-