4-[1,3-di(octadecanoyloxy)propan-2-yloxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1,3-di(octadecanoyloxy)propan-2-yloxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-octadecanoyloxy-1-(octadecanoyloxymethyl)ethoxy]-4-oxo-butanoic acid CAS Name: 4-[1,3-bis(1-oxooctadecoxy)propan-2-yloxy]-4-oxobutanoic acid IUPAC Name: 4-[1,3-di(octadecanoyloxy)propan-2-yloxy]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-stearoyloxy-1-(stearoyloxymethyl)ethoxy]butyric acid Formula: C43H80O8 MolecularWeight: 725.0905

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCC(=O)O

InChI

InChI=1S/C43H80O8/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-41(46)49-37-39(51-43(48)36-35-40(44)45)38-50-42(47)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h39H,3-38H2,1-2H3,(H,44,45)