1-[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-3-methyl-pentanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[2-[(2-azanyl-3-oxidanyl-butanoyl)amino]-3-methyl-pentanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-3-methyl-pentanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[2-[(2-amino-3-hydroxy-1-oxobutyl)amino]-3-methyl-1-oxopentyl]amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[2-[(2-amino-3-hydroxybutanoyl)amino]-3-methylpentanoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[2-[(2-amino-3-hydroxy-butanoyl)amino]-3-methyl-pentanoyl]amino]propanoyl]proline Formula: C18H32N4O6 MolecularWeight: 400.46988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H32N4O6/c1-5-9(2)14(21-15(24)13(19)11(4)23)16(25)20-10(3)17(26)22-8-6-7-12(22)18(27)28/h9-14,23H,5-8,19H2,1-4H3,(H,20,25)(H,21,24)(H,27,28)