1-[6-azanyl-2-[[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-oxidanyl-propanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[6-azanyl-2-[[2-[[2-[(2-azanyl-4-methyl-pentanoyl)amino]-3-oxidanyl-propanoyl]amino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[6-amino-2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-hydroxy-propanoyl]amino]-4-hydroxy-4-oxo-butanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[6-amino-2-[[2-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-3-hydroxy-1-oxopropyl]amino]-4-hydroxy-1,4-dioxobutyl]amino]-1-oxohexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[6-amino-2-[[2-[[2-[(2-amino-4-methylpentanoyl)amino]-3-hydroxypropanoyl]amino]-4-hydroxy-4-oxobutanoyl]amino]hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[6-amino-2-[[2-[[2-[(2-amino-4-methyl-pentanoyl)amino]-3-hydroxy-propanoyl]amino]-4-hydroxy-4-keto-butanoyl]amino]hexanoyl]proline Formula: C24H42N6O9 MolecularWeight: 558.62508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC(CO)C(=O)NC(CC(=O)O)C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)O)N

Isomeric SMILES

CC(C)CC(C(=O)NC(CO)C(=O)NC(CC(=O)O)C(=O)NC(CCCCN)C(=O)N1CCCC1C(=O)O)N

InChI

InChI=1S/C24H42N6O9/c1-13(2)10-14(26)20(34)29-17(12-31)22(36)28-16(11-19(32)33)21(35)27-15(6-3-4-8-25)23(37)30-9-5-7-18(30)24(38)39/h13-18,31H,3-12,25-26H2,1-2H3,(H,27,35)(H,28,36)(H,29,34)(H,32,33)(H,38,39)