2-[[1-[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-4-methyl-pentanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[1-[2-[(2-azanyl-3-oxidanyl-propanoyl)amino]-4-methyl-pentanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[1-[2-[(2-amino-3-hydroxy-propanoyl)amino]-4-methyl-pentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[[1-[2-[(2-amino-3-hydroxy-1-oxopropyl)amino]-4-methyl-1-oxopentyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[1-[2-[(2-amino-3-hydroxypropanoyl)amino]-4-methylpentanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[1-[2-[(2-amino-3-hydroxy-propanoyl)amino]-4-methyl-pentanoyl]prolyl]amino]-3-phenyl-propionic acid Formula: C23H34N4O6 MolecularWeight: 462.53926

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34N4O6/c1-14(2)11-17(25-20(29)16(24)13-28)22(31)27-10-6-9-19(27)21(30)26-18(23(32)33)12-15-7-4-3-5-8-15/h3-5,7-8,14,16-19,28H,6,9-13,24H2,1-2H3,(H,25,29)(H,26,30)(H,32,33)