2-[[1-[5-azanyl-2-[[1-[5-azanyl-5-oxidanylidene-2-(pyrrolidin-2-ylcarbonylamino)pentanoyl]pyrrolidin-2-yl]carbonylamino]-5-oxidanylidene-pentanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[1-[5-azanyl-2-[[1-[5-azanyl-5-oxidanylidene-2-(pyrrolidin-2-ylcarbonylamino)pentanoyl]pyrrolidin-2-yl]carbonylamino]-5-oxidanylidene-pentanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[1-[5-amino-2-[[1-[5-amino-5-oxo-2-(pyrrolidine-2-carbonylamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxo-pentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[1-[5-amino-2-[[[1-[5-amino-1,5-dioxo-2-[[oxo(2-pyrrolidinyl)methyl]amino]pentyl]-2-pyrrolidinyl]-oxomethyl]amino]-1,5-dioxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[1-[5-amino-2-[[1-[5-amino-5-oxo-2-(pyrrolidine-2-carbonylamino)pentanoyl]pyrrolidine-2-carbonyl]amino]-5-oxopentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[1-[5-amino-2-[[1-[5-amino-5-keto-2-(prolylamino)pentanoyl]prolyl]amino]-5-keto-pentanoyl]prolyl]amino]-3-phenyl-propionic acid Formula: C34H48N8O9 MolecularWeight: 712.79312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(=O)NC(CCC(=O)N)C(=O)N2CCCC2C(=O)NC(CCC(=O)N)C(=O)N3CCCC3C(=O)NC(CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1CC(NC1)C(=O)NC(CCC(=O)N)C(=O)N2CCCC2C(=O)NC(CCC(=O)N)C(=O)N3CCCC3C(=O)NC(CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C34H48N8O9/c35-27(43)14-12-22(38-29(45)21-9-4-16-37-21)32(48)41-17-5-10-25(41)30(46)39-23(13-15-28(36)44)33(49)42-18-6-11-26(42)31(47)40-24(34(50)51)19-20-7-2-1-3-8-20/h1-3,7-8,21-26,37H,4-6,9-19H2,(H2,35,43)(H2,36,44)(H,38,45)(H,39,46)(H,40,47)(H,50,51)