1-[2-[[4-azanyl-2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[4-azanyl-2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-butanoyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[4-amino-2-[(2-amino-3-phenyl-propanoyl)amino]-4-oxo-butanoyl]amino]-3-methyl-butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[4-amino-2-[(2-amino-1-oxo-3-phenylpropyl)amino]-1,4-dioxobutyl]amino]-3-methyl-1-oxobutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[4-amino-2-[(2-amino-3-phenylpropanoyl)amino]-4-oxobutanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[4-amino-4-keto-2-(phenylalanylamino)butanoyl]amino]-3-methyl-butanoyl]proline Formula: C23H33N5O6 MolecularWeight: 475.53802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCC1C(=O)O)NC(=O)C(CC(=O)N)NC(=O)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)C(C(=O)N1CCCC1C(=O)O)NC(=O)C(CC(=O)N)NC(=O)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C23H33N5O6/c1-13(2)19(22(32)28-10-6-9-17(28)23(33)34)27-21(31)16(12-18(25)29)26-20(30)15(24)11-14-7-4-3-5-8-14/h3-5,7-8,13,15-17,19H,6,9-12,24H2,1-2H3,(H2,25,29)(H,26,30)(H,27,31)(H,33,34)