1-octadecanoyloxypropan-2-yl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate

Systemtic Name: 1-octadecanoyloxypropan-2-yl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate Openeye Name: (1-methyl-2-octadecanoyloxy-ethyl) (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate CAS Name: (5E,8E,11E,14E)-eicosa-5,8,11,14-tetraenoic acid 1-(1-oxooctadecoxy)propan-2-yl ester IUPAC Name: 1-octadecanoyloxypropan-2-yl (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate Traditional Name: (5E,8E,11E,14E)-eicosa-5,8,11,14-tetraenoic acid (1-methyl-2-stearoyloxy-ethyl) ester Formula: C41H72O4 MolecularWeight: 629.00798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(C)OC(=O)CCCC=CCC=CCC=CCC=CCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(C)OC(=O)CCC/C=C/C/C=C/C/C=C/C/C=C/CCCCC

InChI

InChI=1S/C41H72O4/c1-4-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-37-41(43)45-39(3)38-44-40(42)36-34-32-30-28-26-24-22-19-17-15-13-11-9-7-5-2/h12,14,18,20,23,25,29,31,39H,4-11,13,15-17,19,21-22,24,26-28,30,32-38H2,1-3H3/b14-12+,20-18+,25-23+,31-29+