[3-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxy-propyl] octadecanoate

Systemtic Name: [3-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxy-propyl] octadecanoate Openeye Name: [3-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxy-propyl] octadecanoate CAS Name: octadecanoic acid [2-[(Z)-1-oxooctadec-9-enoxy]-3-(1-oxooctadecoxy)propyl] ester IUPAC Name: [3-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxypropyl] octadecanoate Traditional Name: stearic acid [2-[(Z)-octadec-9-enoyl]oxy-3-stearoyloxy-propyl] ester Formula: C57H108O6 MolecularWeight: 889.46382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC

InChI

InChI=1S/C57H108O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-55(58)61-52-54(63-57(60)51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3)53-62-56(59)50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2/h27,30,54H,4-26,28-29,31-53H2,1-3H3/b30-27-