[(2S)-2-[(Z)-docos-13-enoyl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-propyl] (Z)-docos-13-enoate

Systemtic Name: [(2S)-2-[(Z)-docos-13-enoyl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-propyl] (Z)-docos-13-enoate Openeye Name: [(2S)-2-[(Z)-docos-13-enoyl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-propyl] (Z)-docos-13-enoate CAS Name: (Z)-13-docosenoic acid [(2S)-2-[(Z)-1-oxodocos-13-enoxy]-3-[(9Z,12Z,15Z)-1-oxooctadeca-9,12,15-trienoxy]propyl] ester IUPAC Name: [(2S)-2-[(Z)-docos-13-enoyl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxypropyl] (Z)-docos-13-enoate Traditional Name: (Z)-docos-13-enoic acid [(2S)-2-[(Z)-docos-13-enoyl]oxy-3-[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy-propyl] ester Formula: C65H116O6 MolecularWeight: 993.61294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCC=CCC=CCC)OC(=O)CCCCCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\C/C=C\CC)OC(=O)CCCCCCCCCCC/C=C\CCCCCCCC

InChI

InChI=1S/C65H116O6/c1-4-7-10-13-16-19-22-25-28-30-32-34-37-40-43-46-49-52-55-58-64(67)70-61-62(60-69-63(66)57-54-51-48-45-42-39-36-27-24-21-18-15-12-9-6-3)71-65(68)59-56-53-50-47-44-41-38-35-33-31-29-26-23-20-17-14-11-8-5-2/h9,12,18,21,25-29,36,62H,4-8,10-11,13-17,19-20,22-24,30-35,37-61H2,1-3H3/b12-9-,21-18-,28-25-,29-26-,36-27-/t62-/m1/s1