3-azanyl-4-[[3-methyl-1-oxidanylidene-1-[[3-oxidanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]butan-2-yl]amino]butan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-azanyl-4-[[3-methyl-1-oxidanylidene-1-[[3-oxidanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)amino]butan-2-yl]amino]butan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-amino-4-[[1-[[2-hydroxy-1-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]carbamoyl]propyl]carbamoyl]-2-methyl-propyl]amino]-4-oxo-butanoic acid CAS Name: 3-amino-4-[[1-[[3-hydroxy-1-[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)amino]-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-amino-4-[[1-[[3-hydroxy-1-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)amino]-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-amino-4-[[1-[[2-hydroxy-1-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]carbamoyl]propyl]carbamoyl]-2-methyl-propyl]amino]-4-keto-butyric acid Formula: C16H28N4O8S MolecularWeight: 436.48052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C(C)O)C(=O)NC(CS)C(=O)O)NC(=O)C(CC(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)NC(C(C)O)C(=O)NC(CS)C(=O)O)NC(=O)C(CC(=O)O)N

InChI

InChI=1S/C16H28N4O8S/c1-6(2)11(19-13(24)8(17)4-10(22)23)14(25)20-12(7(3)21)15(26)18-9(5-29)16(27)28/h6-9,11-12,21,29H,4-5,17H2,1-3H3,(H,18,26)(H,19,24)(H,20,25)(H,22,23)(H,27,28)