1-[2-[[5-azanyl-2-[[2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-3-oxidanyl-butanoyl]amino]-3-oxidanyl-butanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[5-azanyl-2-[[2-[[2-[(2-azanyl-3-methyl-butanoyl)amino]-3-oxidanyl-butanoyl]amino]-3-oxidanyl-butanoyl]amino]-5-oxidanylidene-pentanoyl]amino]-5-oxidanyl-5-oxidanylidene-pentanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[5-amino-2-[[2-[[2-[(2-amino-3-methyl-butanoyl)amino]-3-hydroxy-butanoyl]amino]-3-hydroxy-butanoyl]amino]-5-oxo-pentanoyl]amino]-5-hydroxy-5-oxo-pentanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[[5-amino-2-[[2-[[2-[(2-amino-3-methyl-1-oxobutyl)amino]-3-hydroxy-1-oxobutyl]amino]-3-hydroxy-1-oxobutyl]amino]-1,5-dioxopentyl]amino]-5-hydroxy-1,5-dioxopentyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[5-amino-2-[[2-[[2-[(2-amino-3-methylbutanoyl)amino]-3-hydroxybutanoyl]amino]-3-hydroxybutanoyl]amino]-5-oxopentanoyl]amino]-5-hydroxy-5-oxopentanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[5-amino-2-[[2-[[2-[(2-amino-3-methyl-butanoyl)amino]-3-hydroxy-butanoyl]amino]-3-hydroxy-butanoyl]amino]-5-keto-pentanoyl]amino]-5-hydroxy-5-keto-pentanoyl]proline Formula: C28H47N7O12 MolecularWeight: 673.71248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(C(C)O)C(=O)NC(C(C)O)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)O)C(=O)N1CCCC1C(=O)O)N

Isomeric SMILES

CC(C)C(C(=O)NC(C(C)O)C(=O)NC(C(C)O)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)O)C(=O)N1CCCC1C(=O)O)N

InChI

InChI=1S/C28H47N7O12/c1-12(2)20(30)24(42)33-22(14(4)37)26(44)34-21(13(3)36)25(43)31-15(7-9-18(29)38)23(41)32-16(8-10-19(39)40)27(45)35-11-5-6-17(35)28(46)47/h12-17,20-22,36-37H,5-11,30H2,1-4H3,(H2,29,38)(H,31,43)(H,32,41)(H,33,42)(H,34,44)(H,39,40)(H,46,47)