1-[6-azanyl-2-[[2-[[2-[[2-[2-[(2-azanyl-4-methyl-pentanoyl)amino]propanoylamino]-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-[2-[(2-azanyl-4-methyl-pentanoyl)amino]propanoylamino]-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-[2-[(2-amino-4-methyl-pentanoyl)amino]propanoylamino]-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-[[2-[(2-amino-4-methyl-1-oxopentyl)amino]-1-oxopropyl]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-[2-[(2-amino-4-methylpentanoyl)amino]propanoylamino]-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-[2-[(2-amino-4-methyl-pentanoyl)amino]propanoylamino]-4-methyl-pentanoyl]amino]-3-hydroxy-propanoyl]amino]-4-hydroxy-4-keto-butanoyl]amino]hexanoyl]proline Formula: C33H58N8O11 MolecularWeight: 742.86062

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C33H58N8O11/c1-17(2)13-20(35)28(46)36-19(5)27(45)38-22(14-18(3)4)29(47)40-24(16-42)31(49)39-23(15-26(43)44)30(48)37-21(9-6-7-11-34)32(50)41-12-8-10-25(41)33(51)52/h17-25,42H,6-16,34-35H2,1-5H3,(H,36,46)(H,37,48)(H,38,45)(H,39,49)(H,40,47)(H,43,44)(H,51,52)