potassium [2-(4-octadecanoyloxy-3-oxidanyl-oxolan-2-yl)-2-oxidanyl-ethyl] octadecanoate

Systemtic Name: potassium [2-(4-octadecanoyloxy-3-oxidanyl-oxolan-2-yl)-2-oxidanyl-ethyl] octadecanoate Openeye Name: potassium [2-hydroxy-2-(3-hydroxy-4-octadecanoyloxy-tetrahydrofuran-2-yl)ethyl] octadecanoate CAS Name: potassium octadecanoic acid [2-hydroxy-2-[3-hydroxy-4-(1-oxooctadecoxy)-2-oxolanyl]ethyl] ester IUPAC Name: potassium [2-hydroxy-2-(3-hydroxy-4-octadecanoyloxyoxolan-2-yl)ethyl] octadecanoate Traditional Name: potassium stearic acid [2-hydroxy-2-(3-hydroxy-4-stearoyloxy-tetrahydrofuran-2-yl)ethyl] ester Formula: C42H80KO7+ MolecularWeight: 736.1787

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCC(C1C(C(CO1)OC(=O)CCCCCCCCCCCCCCCCC)O)O.[K+]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCC(C1C(C(CO1)OC(=O)CCCCCCCCCCCCCCCCC)O)O.[K+]

InChI

InChI=1S/C42H80O7.K/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39(44)47-35-37(43)42-41(46)38(36-48-42)49-40(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h37-38,41-43,46H,3-36H2,1-2H3;/q;+1