[(2R)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-propyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate

Systemtic Name: [(2R)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-propyl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate Openeye Name: [(2R)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-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 [(2R)-2-(1-oxoheptadecoxy)-3-[(Z)-1-oxohexadec-9-enoxy]propyl] ester IUPAC Name: [(2R)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxypropyl] (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 [(2R)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-propyl] ester Formula: C56H96O6 MolecularWeight: 865.35784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCCCC)COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC

InChI

InChI=1S/C56H96O6/c1-4-7-10-13-16-19-22-25-27-28-29-32-34-37-40-43-46-49-55(58)61-52-53(51-60-54(57)48-45-42-39-36-33-30-24-21-18-15-12-9-6-3)62-56(59)50-47-44-41-38-35-31-26-23-20-17-14-11-8-5-2/h7,10,16,19,21,24-25,27,29,32,37,40,53H,4-6,8-9,11-15,17-18,20,22-23,26,28,30-31,33-36,38-39,41-52H2,1-3H3/b10-7-,19-16-,24-21-,27-25-,32-29-,40-37-/t53-/m1/s1