3-[[4-[[4-[4-[[4-[(4-acetamido-1-methyl-imidazol-2-yl)carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]butanoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[4-[[4-[4-[[4-[(4-acetamido-1-methyl-imidazol-2-yl)carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]butanoylamino]-1-methyl-pyrrol-2-yl]carbonylamino]-1-methyl-pyrrol-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[4-[[4-[4-[[4-[(4-acetamido-1-methyl-imidazole-2-carbonyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]butanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]propanoic acid CAS Name: 3-[[[4-[[[4-[[4-[[[4-[[(4-acetamido-1-methyl-2-imidazolyl)-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-oxobutyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]-1-methyl-2-pyrrolyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[4-[[4-[4-[[4-[(4-acetamido-1-methylimidazole-2-carbonyl)amino]-1-methylpyrrole-2-carbonyl]amino]butanoylamino]-1-methylpyrrole-2-carbonyl]amino]-1-methylpyrrole-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[4-[[4-[4-[[4-[(4-acetamido-1-methyl-imidazole-2-carbonyl)amino]-1-methyl-pyrrole-2-carbonyl]amino]butanoylamino]-1-methyl-pyrrole-2-carbonyl]amino]-1-methyl-pyrrole-2-carbonyl]amino]propionic acid Formula: C32H39N11O8 MolecularWeight: 705.72096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CN(C(=N1)C(=O)NC2=CN(C(=C2)C(=O)NCCCC(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=O)O)C)C)C)C

Isomeric SMILES

CC(=O)NC1=CN(C(=N1)C(=O)NC2=CN(C(=C2)C(=O)NCCCC(=O)NC3=CN(C(=C3)C(=O)NC4=CN(C(=C4)C(=O)NCCC(=O)O)C)C)C)C

InChI

InChI=1S/C32H39N11O8/c1-18(44)35-25-17-43(5)28(39-25)32(51)38-21-13-22(41(3)16-21)29(48)33-9-6-7-26(45)36-19-11-24(42(4)14-19)31(50)37-20-12-23(40(2)15-20)30(49)34-10-8-27(46)47/h11-17H,6-10H2,1-5H3,(H,33,48)(H,34,49)(H,35,44)(H,36,45)(H,37,50)(H,38,51)(H,46,47)