6-azanyl-2-[[1-[6-azanyl-2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]hexanoyl]pyrrolidin-2-yl]carbonylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[1-[6-azanyl-2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]hexanoyl]pyrrolidin-2-yl]carbonylamino]hexanoic acid Openeye Name: 6-amino-2-[[1-[6-amino-2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]hexanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid CAS Name: 6-amino-2-[[[1-[6-amino-2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-1-oxohexyl]-2-pyrrolidinyl]-oxomethyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[1-[6-amino-2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]hexanoyl]pyrrolidine-2-carbonyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[1-[6-amino-2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]hexanoyl]prolyl]amino]hexanoic acid Formula: C22H40N6O7 MolecularWeight: 500.589

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCCN)NC(=O)C(CCC(=O)O)N)C(=O)NC(CCCCN)C(=O)O

Isomeric SMILES

C1CC(N(C1)C(=O)C(CCCCN)NC(=O)C(CCC(=O)O)N)C(=O)NC(CCCCN)C(=O)O

InChI

InChI=1S/C22H40N6O7/c23-11-3-1-6-15(26-19(31)14(25)9-10-18(29)30)21(33)28-13-5-8-17(28)20(32)27-16(22(34)35)7-2-4-12-24/h14-17H,1-13,23-25H2,(H,26,31)(H,27,32)(H,29,30)(H,34,35)