6-azanyl-2-[2-[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]ethanoylamino]propanoylamino]hexanoic acid

Systemtic Name: 6-azanyl-2-[2-[2-[(2-azanyl-5-oxidanyl-5-oxidanylidene-pentanoyl)amino]ethanoylamino]propanoylamino]hexanoic acid Openeye Name: 6-amino-2-[2-[[2-[(2-amino-5-hydroxy-5-oxo-pentanoyl)amino]acetyl]amino]propanoylamino]hexanoic acid CAS Name: 6-amino-2-[[2-[[2-[(2-amino-5-hydroxy-1,5-dioxopentyl)amino]-1-oxoethyl]amino]-1-oxopropyl]amino]hexanoic acid IUPAC Name: 6-amino-2-[2-[[2-[(2-amino-5-hydroxy-5-oxopentanoyl)amino]acetyl]amino]propanoylamino]hexanoic acid Traditional Name: 6-amino-2-[2-[[2-[(2-amino-5-hydroxy-5-keto-pentanoyl)amino]acetyl]amino]propanoylamino]hexanoic acid Formula: C16H29N5O7 MolecularWeight: 403.43076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCCCN)C(=O)O)NC(=O)CNC(=O)C(CCC(=O)O)N

Isomeric SMILES

CC(C(=O)NC(CCCCN)C(=O)O)NC(=O)CNC(=O)C(CCC(=O)O)N

InChI

InChI=1S/C16H29N5O7/c1-9(14(25)21-11(16(27)28)4-2-3-7-17)20-12(22)8-19-15(26)10(18)5-6-13(23)24/h9-11H,2-8,17-18H2,1H3,(H,19,26)(H,20,22)(H,21,25)(H,23,24)(H,27,28)