4-[1-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxy-ethoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxy-ethoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[1-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxy-ethoxy]-4-oxo-butanoic acid CAS Name: 4-oxo-4-[2-[(Z)-1-oxooctadec-9-enoxy]-1-(1-oxooctadecoxy)ethoxy]butanoic acid IUPAC Name: 4-[1-octadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxyethoxy]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-[(Z)-octadec-9-enoyl]oxy-1-stearoyloxy-ethoxy]butyric acid Formula: C42H76O8 MolecularWeight: 709.04804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C42H76O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39(45)48-37-42(50-41(47)36-35-38(43)44)49-40(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h17,19,42H,3-16,18,20-37H2,1-2H3,(H,43,44)/b19-17-