3-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-4-[2-[2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]butanoic acid

Systemtic Name: 3-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanylidene-4-[2-[2-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)carbamoyl]pyrrolidin-1-yl]carbonylpyrrolidin-1-yl]butanoic acid Openeye Name: 3-[(2-amino-3-phenyl-propanoyl)amino]-4-[2-[2-[(1-benzyl-2-hydroxy-2-oxo-ethyl)carbamoyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-4-oxo-butanoic acid CAS Name: 3-[(2-amino-1-oxo-3-phenylpropyl)amino]-4-[2-[[2-[[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-oxomethyl]-1-pyrrolidinyl]-oxomethyl]-1-pyrrolidinyl]-4-oxobutanoic acid IUPAC Name: 3-[(2-amino-3-phenylpropanoyl)amino]-4-[2-[2-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)carbamoyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[2-[2-[(1-benzyl-2-hydroxy-2-keto-ethyl)carbamoyl]pyrrolidine-1-carbonyl]pyrrolidino]-4-keto-3-(phenylalanylamino)butyric acid Formula: C32H39N5O8 MolecularWeight: 621.68076

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2CCCN2C(=O)C(CC(=O)O)NC(=O)C(CC3=CC=CC=C3)N)C(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C2CCCN2C(=O)C(CC(=O)O)NC(=O)C(CC3=CC=CC=C3)N)C(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C32H39N5O8/c33-22(17-20-9-3-1-4-10-20)28(40)34-23(19-27(38)39)30(42)37-16-8-14-26(37)31(43)36-15-7-13-25(36)29(41)35-24(32(44)45)18-21-11-5-2-6-12-21/h1-6,9-12,22-26H,7-8,13-19,33H2,(H,34,40)(H,35,41)(H,38,39)(H,44,45)