1-[5-azanyl-2-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[5-azanyl-2-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[5-amino-2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-4-hydroxy-4-oxo-butanoyl]amino]-5-oxo-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[5-amino-2-[[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-4-hydroxy-1,4-dioxobutyl]amino]-1,5-dioxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[5-amino-2-[[2-[(2-amino-3-phenylpropanoyl)amino]-4-hydroxy-4-oxobutanoyl]amino]-5-oxopentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[5-amino-2-[[4-hydroxy-4-keto-2-(phenylalanylamino)butanoyl]amino]-5-keto-pentanoyl]proline Formula: C23H31N5O8 MolecularWeight: 505.52094

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCC(=O)N)NC(=O)C(CC(=O)O)NC(=O)C(CC2=CC=CC=C2)N)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCC(=O)N)NC(=O)C(CC(=O)O)NC(=O)C(CC2=CC=CC=C2)N)C(=O)O

InChI

InChI=1S/C23H31N5O8/c24-14(11-13-5-2-1-3-6-13)20(32)27-16(12-19(30)31)21(33)26-15(8-9-18(25)29)22(34)28-10-4-7-17(28)23(35)36/h1-3,5-6,14-17H,4,7-12,24H2,(H2,25,29)(H,26,33)(H,27,32)(H,30,31)(H,35,36)