3-[2-[2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]-2-methanoyl-pyrrolidin-1-yl]propanoic acid

Systemtic Name: 3-[2-[2-[(2-azanyl-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]-2-methanoyl-pyrrolidin-1-yl]propanoic acid Openeye Name: 3-[2-[2-[(2-amino-3-phenyl-propanoyl)amino]-3-phenyl-propanoyl]-2-formyl-pyrrolidin-1-yl]propanoic acid CAS Name: 3-[2-[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-1-oxo-3-phenylpropyl]-2-formyl-1-pyrrolidinyl]propanoic acid IUPAC Name: 3-[2-[2-[(2-amino-3-phenylpropanoyl)amino]-3-phenylpropanoyl]-2-formylpyrrolidin-1-yl]propanoic acid Traditional Name: 3-[2-formyl-2-[3-phenyl-2-(phenylalanylamino)propanoyl]pyrrolidino]propionic acid Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CCC(=O)O)(C=O)C(=O)C(CC2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

C1CC(N(C1)CCC(=O)O)(C=O)C(=O)C(CC2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)N

InChI

InChI=1S/C26H31N3O5/c27-21(16-19-8-3-1-4-9-19)25(34)28-22(17-20-10-5-2-6-11-20)24(33)26(18-30)13-7-14-29(26)15-12-23(31)32/h1-6,8-11,18,21-22H,7,12-17,27H2,(H,28,34)(H,31,32)