4-azanyl-5-[[1-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]propanoyl-(2-methanoyloxy-2-methyl-propanoyl)amino]-[3-[2,5-bis(oxidanylidene)pyrrol-1-yl]propanoyl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-azanyl-5-[[1-[[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]propanoyl-(2-methanoyloxy-2-methyl-propanoyl)amino]-[3-[2,5-bis(oxidanylidene)pyrrol-1-yl]propanoyl]amino]-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-amino-5-[[2-[[2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]propanoyl-(2-formyloxy-2-methyl-propanoyl)amino]-[3-(2,5-dioxopyrrol-1-yl)propanoyl]amino]-1-methyl-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 4-amino-5-[[1-[[[2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-1-oxopropyl]-(2-formyloxy-2-methyl-1-oxopropyl)amino]-[3-(2,5-dioxo-1-pyrrolyl)-1-oxopropyl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 4-amino-5-[[1-[[2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]propanoyl-(2-formyloxy-2-methylpropanoyl)amino]-[3-(2,5-dioxopyrrol-1-yl)propanoyl]amino]-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 4-amino-5-[[2-[[2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]propanoyl-(2-formyloxy-2-methyl-propanoyl)amino]-(3-maleimidopropanoyl)amino]-2-keto-1-methyl-ethyl]amino]-5-keto-valeric acid Formula: C28H39N7O14 MolecularWeight: 697.64776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C(=O)CCN1C(=O)C=CC1=O)N(C(=O)C(C)NC(=O)C(CCC(=O)O)N)C(=O)C(C)(C)OC=O)NC(=O)C(CCC(=O)O)N

Isomeric SMILES

CC(C(=O)N(C(=O)CCN1C(=O)C=CC1=O)N(C(=O)C(C)NC(=O)C(CCC(=O)O)N)C(=O)C(C)(C)OC=O)NC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C28H39N7O14/c1-14(31-23(44)16(29)5-9-21(40)41)25(46)34(20(39)11-12-33-18(37)7-8-19(33)38)35(27(48)28(3,4)49-13-36)26(47)15(2)32-24(45)17(30)6-10-22(42)43/h7-8,13-17H,5-6,9-12,29-30H2,1-4H3,(H,31,44)(H,32,45)(H,40,41)(H,42,43)