2-(hexadecanoylamino)-4-octadecylsulfanyl-butanoic acid

Systemtic Name: 2-(hexadecanoylamino)-4-octadecylsulfanyl-butanoic acid Openeye Name: 2-(hexadecanoylamino)-4-octadecylsulfanyl-butanoic acid CAS Name: 4-(octadecylthio)-2-(1-oxohexadecylamino)butanoic acid IUPAC Name: 2-(hexadecanoylamino)-4-octadecylsulfanylbutanoic acid Traditional Name: 2-palmitamido-4-(stearylthio)butyric acid Formula: C38H75NO3S MolecularWeight: 626.072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCSCCC(C(=O)O)NC(=O)CCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCSCCC(C(=O)O)NC(=O)CCCCCCCCCCCCCCC

InChI

InChI=1S/C38H75NO3S/c1-3-5-7-9-11-13-15-17-18-19-21-23-25-27-29-31-34-43-35-33-36(38(41)42)39-37(40)32-30-28-26-24-22-20-16-14-12-10-8-6-4-2/h36H,3-35H2,1-2H3,(H,39,40)(H,41,42)