[(2S)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-propyl] nonadecanoate

Systemtic Name: [(2S)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-propyl] nonadecanoate Openeye Name: [(2S)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-propyl] nonadecanoate CAS Name: nonadecanoic acid [(2S)-2-(1-oxoheptadecoxy)-3-[(Z)-1-oxohexadec-9-enoxy]propyl] ester IUPAC Name: [(2S)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxypropyl] nonadecanoate Traditional Name: nonadecanoic acid [(2S)-2-heptadecanoyloxy-3-[(Z)-hexadec-9-enoyl]oxy-propyl] ester Formula: C55H104O6 MolecularWeight: 861.41066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCC=CCCCCCC)OC(=O)CCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(=O)OC[C@@H](COC(=O)CCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCCCCCCC

InChI

InChI=1S/C55H104O6/c1-4-7-10-13-16-19-22-25-27-28-31-33-36-39-42-45-48-54(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)49-46-43-40-37-34-30-26-23-20-17-14-11-8-5-2/h21,24,52H,4-20,22-23,25-51H2,1-3H3/b24-21-/t52-/m1/s1