6-azanyl-2-[[4-azanyl-2-[[2-[[2-[[1-[2-(2-azanylpropanoylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-4-oxidanylidene-butanoyl]amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[4-azanyl-2-[[2-[[2-[[1-[2-(2-azanylpropanoylamino)propanoyl]pyrrolidin-2-yl]carbonylamino]-3-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-4-oxidanylidene-butanoyl]amino]hexanoic acid Openeye Name: 6-amino-2-[[4-amino-2-[[2-[[2-[[1-[2-(2-aminopropanoylamino)propanoyl]pyrrolidine-2-carbonyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-4-oxo-butanoyl]amino]hexanoic acid CAS Name: 6-amino-2-[[4-amino-2-[[2-[[2-[[[1-[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-methyl-1-oxopentyl]amino]-3-methyl-1-oxobutyl]amino]-1,4-dioxobutyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[4-amino-2-[[2-[[2-[[1-[2-(2-aminopropanoylamino)propanoyl]pyrrolidine-2-carbonyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]-4-oxobutanoyl]amino]hexanoic acid Traditional Name: 2-[[2-[[2-[[2-[[1-[2-(alanylamino)propanoyl]prolyl]amino]-3-methyl-pentanoyl]amino]-3-methyl-butanoyl]amino]-4-amino-4-keto-butanoyl]amino]-6-amino-hexanoic acid Formula: C32H57N9O9 MolecularWeight: 711.84988

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(C(C)C)C(=O)NC(CC(=O)N)C(=O)NC(CCCCN)C(=O)O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(C)N

Isomeric SMILES

CCC(C)C(C(=O)NC(C(C)C)C(=O)NC(CC(=O)N)C(=O)NC(CCCCN)C(=O)O)NC(=O)C1CCCN1C(=O)C(C)NC(=O)C(C)N

InChI

InChI=1S/C32H57N9O9/c1-7-17(4)25(40-28(45)22-12-10-14-41(22)31(48)19(6)36-26(43)18(5)34)30(47)39-24(16(2)3)29(46)38-21(15-23(35)42)27(44)37-20(32(49)50)11-8-9-13-33/h16-22,24-25H,7-15,33-34H2,1-6H3,(H2,35,42)(H,36,43)(H,37,44)(H,38,46)(H,39,47)(H,40,45)(H,49,50)