4-[[6-azanyl-1-oxidanylidene-1-[[1-oxidanylidene-1-[[3-oxidanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butan-2-yl]amino]propan-2-yl]amino]hexan-2-yl]amino]-3-[2,6-bis(azanyl)hexanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[6-azanyl-1-oxidanylidene-1-[[1-oxidanylidene-1-[[3-oxidanyl-1-oxidanylidene-1-[(1-oxidanyl-1-oxidanylidene-3-phenyl-propan-2-yl)amino]butan-2-yl]amino]propan-2-yl]amino]hexan-2-yl]amino]-3-[2,6-bis(azanyl)hexanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-amino-1-[[2-[[1-[(1-benzyl-2-hydroxy-2-oxo-ethyl)carbamoyl]-2-hydroxy-propyl]amino]-1-methyl-2-oxo-ethyl]carbamoyl]pentyl]amino]-3-(2,6-diaminohexanoylamino)-4-oxo-butanoic acid CAS Name: 4-[[6-amino-1-[[1-[[3-hydroxy-1-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-[(2,6-diamino-1-oxohexyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[[6-amino-1-[[1-[[3-hydroxy-1-[(1-hydroxy-1-oxo-3-phenylpropan-2-yl)amino]-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxohexan-2-yl]amino]-3-(2,6-diaminohexanoylamino)-4-oxobutanoic acid Traditional Name: 4-[[5-amino-1-[[2-[[1-[(1-benzyl-2-hydroxy-2-keto-ethyl)carbamoyl]-2-hydroxy-propyl]amino]-2-keto-1-methyl-ethyl]carbamoyl]pentyl]amino]-3-(2,6-diaminohexanoylamino)-4-keto-butyric acid Formula: C32H52N8O10 MolecularWeight: 708.80288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C(CCCCN)N)O

Isomeric SMILES

CC(C(C(=O)NC(CC1=CC=CC=C1)C(=O)O)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CC(=O)O)NC(=O)C(CCCCN)N)O

InChI

InChI=1S/C32H52N8O10/c1-18(27(44)40-26(19(2)41)31(48)39-24(32(49)50)16-20-10-4-3-5-11-20)36-29(46)22(13-7-9-15-34)37-30(47)23(17-25(42)43)38-28(45)21(35)12-6-8-14-33/h3-5,10-11,18-19,21-24,26,41H,6-9,12-17,33-35H2,1-2H3,(H,36,46)(H,37,47)(H,38,45)(H,39,48)(H,40,44)(H,42,43)(H,49,50)