3-[(2-acetamido-3-oxidanyl-propyl)amino]-4-[[1-(2-aminocarbonylpyrrolidin-1-yl)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[(2-acetamido-3-oxidanyl-propyl)amino]-4-[[1-(2-aminocarbonylpyrrolidin-1-yl)-6-azanyl-1-oxidanylidene-hexan-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[(2-acetamido-3-hydroxy-propyl)amino]-4-[[5-amino-1-(2-carbamoylpyrrolidine-1-carbonyl)pentyl]amino]-4-oxo-butanoic acid CAS Name: 3-[(2-acetamido-3-hydroxypropyl)amino]-4-[[6-amino-1-(2-carbamoyl-1-pyrrolidinyl)-1-oxohexan-2-yl]amino]-4-oxobutanoic acid IUPAC Name: 3-[(2-acetamido-3-hydroxypropyl)amino]-4-[[6-amino-1-(2-carbamoylpyrrolidin-1-yl)-1-oxohexan-2-yl]amino]-4-oxobutanoic acid Traditional Name: 3-[(2-acetamido-3-hydroxy-propyl)amino]-4-[[5-amino-1-(2-carbamoylpyrrolidine-1-carbonyl)pentyl]amino]-4-keto-butyric acid Formula: C20H36N6O7 MolecularWeight: 472.53584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H36N6O7/c1-12(28)24-13(11-27)10-23-15(9-17(29)30)19(32)25-14(5-2-3-7-21)20(33)26-8-4-6-16(26)18(22)31/h13-16,23,27H,2-11,21H2,1H3,(H2,22,31)(H,24,28)(H,25,32)(H,29,30)