[(2R)-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-nonadecanoyloxy-propyl] (Z)-docos-13-enoate

Systemtic Name: [(2R)-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-nonadecanoyloxy-propyl] (Z)-docos-13-enoate Openeye Name: [(2R)-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-nonadecanoyloxy-propyl] (Z)-docos-13-enoate CAS Name: (Z)-13-docosenoic acid [(2R)-2-[(11Z,14Z)-1-oxoeicosa-11,14-dienoxy]-3-(1-oxononadecoxy)propyl] ester IUPAC Name: [(2R)-2-[(11Z,14Z)-icosa-11,14-dienoyl]oxy-3-nonadecanoyloxypropyl] (Z)-docos-13-enoate Traditional Name: (Z)-docos-13-enoic acid [(2R)-2-[(11Z,14Z)-eicosa-11,14-dienoyl]oxy-3-nonadecanoyloxy-propyl] ester Formula: C64H118O6 MolecularWeight: 983.61812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCC=CCCCCCCCC)OC(=O)CCCCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC

InChI

InChI=1S/C64H118O6/c1-4-7-10-13-16-19-22-25-28-31-32-34-36-39-42-45-48-51-54-57-63(66)69-60-61(59-68-62(65)56-53-50-47-44-41-38-35-30-27-24-21-18-15-12-9-6-3)70-64(67)58-55-52-49-46-43-40-37-33-29-26-23-20-17-14-11-8-5-2/h17,20,25-26,28-29,61H,4-16,18-19,21-24,27,30-60H2,1-3H3/b20-17-,28-25-,29-26-/t61-/m1/s1