[(2R)-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-heptadecanoyloxy-propyl] (8Z,11Z,14Z)-icosa-8,11,14-trienoate

Systemtic Name: [(2R)-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-heptadecanoyloxy-propyl] (8Z,11Z,14Z)-icosa-8,11,14-trienoate Openeye Name: [(2R)-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-heptadecanoyloxy-propyl] (8Z,11Z,14Z)-icosa-8,11,14-trienoate CAS Name: (8Z,11Z,14Z)-eicosa-8,11,14-trienoic acid [(2R)-2-[(9Z,12Z)-1-oxoheptadeca-9,12-dienoxy]-3-(1-oxoheptadecoxy)propyl] ester IUPAC Name: [(2R)-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-heptadecanoyloxypropyl] (8Z,11Z,14Z)-icosa-8,11,14-trienoate Traditional Name: (8Z,11Z,14Z)-eicosa-8,11,14-trienoic acid [(2R)-2-[(9Z,12Z)-heptadeca-9,12-dienoyl]oxy-3-heptadecanoyloxy-propyl] ester Formula: C57H100O6 MolecularWeight: 881.4003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCC=CCC=CCC=CCCCCC)OC(=O)CCCCCCCC=CCC=CCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCC

InChI

InChI=1S/C57H100O6/c1-4-7-10-13-16-19-22-25-28-29-30-33-35-38-41-44-47-50-56(59)62-53-54(63-57(60)51-48-45-42-39-36-32-27-24-21-18-15-12-9-6-3)52-61-55(58)49-46-43-40-37-34-31-26-23-20-17-14-11-8-5-2/h15-16,18-19,24-25,27-28,30,33,54H,4-14,17,20-23,26,29,31-32,34-53H2,1-3H3/b18-15-,19-16-,27-24-,28-25-,33-30-/t54-/m1/s1