4-(1-octadecanoyloxy-3-oxidanyl-propan-2-yl)oxy-2-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(1-octadecanoyloxy-3-oxidanyl-propan-2-yl)oxy-2-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 2-hydroxy-4-[1-(hydroxymethyl)-2-octadecanoyloxy-ethoxy]-4-oxo-butanoic acid CAS Name: 2-hydroxy-4-[1-hydroxy-3-(1-oxooctadecoxy)propan-2-yl]oxy-4-oxobutanoic acid IUPAC Name: 2-hydroxy-4-(1-hydroxy-3-octadecanoyloxypropan-2-yl)oxy-4-oxobutanoic acid Traditional Name: 2-hydroxy-4-keto-4-(1-methylol-2-stearoyloxy-ethoxy)butyric acid Formula: C25H46O8 MolecularWeight: 474.62794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CC(C(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(CO)OC(=O)CC(C(=O)O)O

InChI

InChI=1S/C25H46O8/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)32-20-21(19-26)33-24(29)18-22(27)25(30)31/h21-22,26-27H,2-20H2,1H3,(H,30,31)