6-azanyl-2-[[2-[2,6-bis(azanyl)hexanoylamino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]hexanoic acid

Systemtic Name: 6-azanyl-2-[[2-[2,6-bis(azanyl)hexanoylamino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]hexanoic acid Openeye Name: 6-amino-2-[[2-(2,6-diaminohexanoylamino)-4-hydroxy-4-oxo-butanoyl]amino]hexanoic acid CAS Name: 6-amino-2-[[2-[(2,6-diamino-1-oxohexyl)amino]-4-hydroxy-1,4-dioxobutyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[[2-(2,6-diaminohexanoylamino)-4-hydroxy-4-oxobutanoyl]amino]hexanoic acid Traditional Name: 6-amino-2-[[2-(2,6-diaminohexanoylamino)-4-hydroxy-4-keto-butanoyl]amino]hexanoic acid Formula: C16H31N5O6 MolecularWeight: 389.44724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)NC(CC(=O)O)C(=O)NC(CCCCN)C(=O)O)N

Isomeric SMILES

C(CCN)CC(C(=O)NC(CC(=O)O)C(=O)NC(CCCCN)C(=O)O)N

InChI

InChI=1S/C16H31N5O6/c17-7-3-1-5-10(19)14(24)21-12(9-13(22)23)15(25)20-11(16(26)27)6-2-4-8-18/h10-12H,1-9,17-19H2,(H,20,25)(H,21,24)(H,22,23)(H,26,27)