[(2R)-2-henicosanoyloxy-3-heptadecanoyloxy-propyl] (10Z,13Z,16Z)-docosa-10,13,16-trienoate

Systemtic Name: [(2R)-2-henicosanoyloxy-3-heptadecanoyloxy-propyl] (10Z,13Z,16Z)-docosa-10,13,16-trienoate Openeye Name: [(2R)-2-henicosanoyloxy-3-heptadecanoyloxy-propyl] (10Z,13Z,16Z)-docosa-10,13,16-trienoate CAS Name: (10Z,13Z,16Z)-docosa-10,13,16-trienoic acid [(2R)-2-(1-oxoheneicosoxy)-3-(1-oxoheptadecoxy)propyl] ester IUPAC Name: [(2R)-2-henicosanoyloxy-3-heptadecanoyloxypropyl] (10Z,13Z,16Z)-docosa-10,13,16-trienoate Traditional Name: (10Z,13Z,16Z)-docosa-10,13,16-trienoic acid [(2R)-2-heneicosanoyloxy-3-heptadecanoyloxy-propyl] ester Formula: C63H116O6 MolecularWeight: 969.59154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCCC)COC(=O)CCCCCCCCC=CCC=CCC=CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCC)COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC

InChI

InChI=1S/C63H116O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-35-38-41-44-47-50-53-56-62(65)68-59-60(58-67-61(64)55-52-49-46-43-40-37-27-24-21-18-15-12-9-6-3)69-63(66)57-54-51-48-45-42-39-36-33-31-29-26-23-20-17-14-11-8-5-2/h16,19,25,28,32,34,60H,4-15,17-18,20-24,26-27,29-31,33,35-59H2,1-3H3/b19-16-,28-25-,34-32-/t60-/m1/s1