2-acetamido-3-[2-(2-methyl-1-oxidanyl-propyl)-3-oxidanyl-5-oxidanylidene-4-propyl-pyrrolidin-2-yl]carbonylsulfanyl-propanoic acid

Systemtic Name: 2-acetamido-3-[2-(2-methyl-1-oxidanyl-propyl)-3-oxidanyl-5-oxidanylidene-4-propyl-pyrrolidin-2-yl]carbonylsulfanyl-propanoic acid Openeye Name: 2-acetamido-3-[3-hydroxy-2-(1-hydroxy-2-methyl-propyl)-5-oxo-4-propyl-pyrrolidine-2-carbonyl]sulfanyl-propanoic acid CAS Name: 2-acetamido-3-[[[3-hydroxy-2-(1-hydroxy-2-methylpropyl)-5-oxo-4-propyl-2-pyrrolidinyl]-oxomethyl]thio]propanoic acid IUPAC Name: 2-acetamido-3-[3-hydroxy-2-(1-hydroxy-2-methylpropyl)-5-oxo-4-propylpyrrolidine-2-carbonyl]sulfanylpropanoic acid Traditional Name: 2-acetamido-3-[[3-hydroxy-2-(1-hydroxy-2-methyl-propyl)-5-keto-4-propyl-prolyl]thio]propionic acid Formula: C17H28N2O7S MolecularWeight: 404.47842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(NC1=O)(C(C(C)C)O)C(=O)SCC(C(=O)O)NC(=O)C)O

Isomeric SMILES

CCCC1C(C(NC1=O)(C(C(C)C)O)C(=O)SCC(C(=O)O)NC(=O)C)O

InChI

InChI=1S/C17H28N2O7S/c1-5-6-10-13(22)17(19-14(10)23,12(21)8(2)3)16(26)27-7-11(15(24)25)18-9(4)20/h8,10-13,21-22H,5-7H2,1-4H3,(H,18,20)(H,19,23)(H,24,25)