1-[2-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-4-(methylthio)-1-oxobutyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]-4-methylsulfanylbutanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]-4-(methylthio)butanoyl]amino]propanoyl]proline Formula: C18H30N4O7S MolecularWeight: 446.5184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C(CCSC)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C(CCSC)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C18H30N4O7S/c1-10(17(27)22-8-3-4-13(22)18(28)29)20-16(26)12(7-9-30-2)21-15(25)11(19)5-6-14(23)24/h10-13H,3-9,19H2,1-2H3,(H,20,26)(H,21,25)(H,23,24)(H,28,29)