3-[2-(hexadecanoylamino)-3-oxidanyl-propyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-(hexadecanoylamino)-3-oxidanyl-propyl]sulfanylpropanoic acid Openeye Name: 3-[2-(hexadecanoylamino)-3-hydroxy-propyl]sulfanylpropanoic acid CAS Name: 3-[[3-hydroxy-2-(1-oxohexadecylamino)propyl]thio]propanoic acid IUPAC Name: 3-[2-(hexadecanoylamino)-3-hydroxypropyl]sulfanylpropanoic acid Traditional Name: 3-[(3-hydroxy-2-palmitamido-propyl)thio]propionic acid Formula: C22H43NO4S MolecularWeight: 417.64612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)NC(CO)CSCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)NC(CO)CSCCC(=O)O

InChI

InChI=1S/C22H43NO4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-21(25)23-20(18-24)19-28-17-16-22(26)27/h20,24H,2-19H2,1H3,(H,23,25)(H,26,27)