2-[2-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[2-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoic acid Openeye Name: 2-[2-[[2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]-4-methylsulfanyl-butanoyl]amino]propanoylamino]-4-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-4-(methylthio)-1-oxobutyl]amino]-1-oxopropyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[2-[[2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]-4-methylsulfanylbutanoyl]amino]propanoylamino]-4-methylpentanoic acid Traditional Name: 2-[2-[[2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]-4-(methylthio)butanoyl]amino]propanoylamino]-4-methyl-valeric acid Formula: C19H34N4O7S MolecularWeight: 462.56086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H34N4O7S/c1-10(2)9-14(19(29)30)23-16(26)11(3)21-18(28)13(7-8-31-4)22-17(27)12(20)5-6-15(24)25/h10-14H,5-9,20H2,1-4H3,(H,21,28)(H,22,27)(H,23,26)(H,24,25)(H,29,30)