4-azanyl-2-[[5-azanyl-2-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[[5-azanyl-2-[[2-[(2-azanyl-3-phenyl-propanoyl)amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[[5-amino-2-[[2-[(2-amino-3-phenyl-propanoyl)amino]-4-hydroxy-4-oxo-butanoyl]amino]-5-oxo-pentanoyl]amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[5-amino-2-[[2-[(2-amino-1-oxo-3-phenylpropyl)amino]-4-hydroxy-1,4-dioxobutyl]amino]-1,5-dioxopentyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[[5-amino-2-[[2-[(2-amino-3-phenylpropanoyl)amino]-4-hydroxy-4-oxobutanoyl]amino]-5-oxopentanoyl]amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[[5-amino-2-[[4-hydroxy-4-keto-2-(phenylalanylamino)butanoyl]amino]-5-keto-pentanoyl]amino]-4-keto-butyric acid Formula: C22H30N6O9 MolecularWeight: 522.5084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N6O9/c23-12(8-11-4-2-1-3-5-11)19(33)27-14(10-18(31)32)21(35)26-13(6-7-16(24)29)20(34)28-15(22(36)37)9-17(25)30/h1-5,12-15H,6-10,23H2,(H2,24,29)(H2,25,30)(H,26,35)(H,27,33)(H,28,34)(H,31,32)(H,36,37)