2-[2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-3-oxidanyl-butanoyl]amino]ethanoylamino]pentanedioic acid

Systemtic Name: 2-[2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-3-oxidanyl-butanoyl]amino]ethanoylamino]pentanedioic acid Openeye Name: 2-[[2-[[2-[(2-amino-3-methyl-butanoyl)amino]-3-hydroxy-butanoyl]amino]acetyl]amino]pentanedioic acid CAS Name: 2-[[2-[[2-[(2-amino-3-methyl-1-oxobutyl)amino]-3-hydroxy-1-oxobutyl]amino]-1-oxoethyl]amino]pentanedioic acid IUPAC Name: 2-[[2-[[2-[(2-amino-3-methylbutanoyl)amino]-3-hydroxybutanoyl]amino]acetyl]amino]pentanedioic acid Traditional Name: 2-[[2-[[2-[(2-amino-3-methyl-butanoyl)amino]-3-hydroxy-butanoyl]amino]acetyl]amino]glutaric acid Formula: C16H28N4O8 MolecularWeight: 404.41552

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N4O8/c1-7(2)12(17)14(25)20-13(8(3)21)15(26)18-6-10(22)19-9(16(27)28)4-5-11(23)24/h7-9,12-13,21H,4-6,17H2,1-3H3,(H,18,26)(H,19,22)(H,20,25)(H,23,24)(H,27,28)