[3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxy-2-octanoyloxy-propyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate

Systemtic Name: [3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxy-2-octanoyloxy-propyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate Openeye Name: [3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxy-2-octanoyloxy-propyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate CAS Name: (5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoic acid [3-[(5Z,8Z,11Z,14Z,17Z)-1-oxoeicosa-5,8,11,14,17-pentaenoxy]-2-(1-oxooctoxy)propyl] ester IUPAC Name: [3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]oxy-2-octanoyloxypropyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate Traditional Name: (5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoic acid [2-caprylyloxy-3-[(5Z,8Z,11Z,14Z,17Z)-eicosa-5,8,11,14,17-pentaenoyl]oxy-propyl] ester Formula: C51H78O6 MolecularWeight: 787.16142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC(COC(=O)CCCC=CCC=CCC=CCC=CCC=CCC)COC(=O)CCCC=CCC=CCC=CCC=CCC=CCC

Isomeric SMILES

CCCCCCCC(=O)OC(COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

InChI

InChI=1S/C51H78O6/c1-4-7-10-13-15-17-19-21-23-25-27-29-31-33-35-38-40-43-49(52)55-46-48(57-51(54)45-42-37-12-9-6-3)47-56-50(53)44-41-39-36-34-32-30-28-26-24-22-20-18-16-14-11-8-5-2/h7-8,10-11,15-18,21-24,27-30,33-36,48H,4-6,9,12-14,19-20,25-26,31-32,37-47H2,1-3H3/b10-7-,11-8-,17-15-,18-16-,23-21-,24-22-,29-27-,30-28-,35-33-,36-34-