[(2R)-1-hexadecanoyloxy-3-[(Z)-octadec-9-enoyl]oxy-propan-2-yl] octadecanoate

Systemtic Name: [(2R)-1-hexadecanoyloxy-3-[(Z)-octadec-9-enoyl]oxy-propan-2-yl] octadecanoate Openeye Name: [(1R)-1-(hexadecanoyloxymethyl)-2-[(Z)-octadec-9-enoyl]oxy-ethyl] octadecanoate CAS Name: octadecanoic acid [(2R)-1-(1-oxohexadecoxy)-3-[(Z)-1-oxooctadec-9-enoxy]propan-2-yl] ester IUPAC Name: [(2R)-1-hexadecanoyloxy-3-[(Z)-octadec-9-enoyl]oxypropan-2-yl] octadecanoate Traditional Name: stearic acid [(1R)-1-(hexadecanoyloxymethyl)-2-[(Z)-octadec-9-enoyl]oxy-ethyl] ester Formula: C55H104O6 MolecularWeight: 861.41066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCC)COC(=O)CCCCCCC/C=C\CCCCCCCC

InChI

InChI=1S/C55H104O6/c1-4-7-10-13-16-19-22-25-27-30-33-36-39-42-45-48-54(57)60-51-52(50-59-53(56)47-44-41-38-35-32-29-24-21-18-15-12-9-6-3)61-55(58)49-46-43-40-37-34-31-28-26-23-20-17-14-11-8-5-2/h25,27,52H,4-24,26,28-51H2,1-3H3/b27-25-/t52-/m1/s1