4-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-5-[(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-5-[(3-methyl-1-oxidanyl-1-oxidanylidene-butan-2-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-[[2-[(2-amino-3-phenyl-propanoyl)amino]-4-hydroxy-4-oxo-butanoyl]amino]-5-[(1-carboxy-2-methyl-propyl)amino]-5-oxo-pentanoic acid CAS Name: 4-[[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-4-hydroxy-1,4-dioxobutyl]amino]-5-[(1-hydroxy-3-methyl-1-oxobutan-2-yl)amino]-5-oxopentanoic acid IUPAC Name: 4-[[2-[(2-amino-3-phenylpropanoyl)amino]-4-hydroxy-4-oxobutanoyl]amino]-5-[(1-hydroxy-3-methyl-1-oxobutan-2-yl)amino]-5-oxopentanoic acid Traditional Name: 5-[(1-carboxy-2-methyl-propyl)amino]-4-[[4-hydroxy-4-keto-2-(phenylalanylamino)butanoyl]amino]-5-keto-valeric acid Formula: C23H32N4O9 MolecularWeight: 508.52158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CC1=CC=CC=C1)N

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(CCC(=O)O)NC(=O)C(CC(=O)O)NC(=O)C(CC1=CC=CC=C1)N

InChI

InChI=1S/C23H32N4O9/c1-12(2)19(23(35)36)27-21(33)15(8-9-17(28)29)25-22(34)16(11-18(30)31)26-20(32)14(24)10-13-6-4-3-5-7-13/h3-7,12,14-16,19H,8-11,24H2,1-2H3,(H,25,34)(H,26,32)(H,27,33)(H,28,29)(H,30,31)(H,35,36)