(2S)-6-azanyl-2-[[4-azanyl-2-(2-azanylhexanoylamino)butanoyl]amino]hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-[[4-azanyl-2-(2-azanylhexanoylamino)butanoyl]amino]hexanoic acid Openeye Name: (2S)-6-amino-2-[[4-amino-2-(2-aminohexanoylamino)butanoyl]amino]hexanoic acid CAS Name: (2S)-6-amino-2-[[4-amino-2-[(2-amino-1-oxohexyl)amino]-1-oxobutyl]amino]hexanoic acid IUPAC Name: (2S)-6-amino-2-[[4-amino-2-(2-aminohexanoylamino)butanoyl]amino]hexanoic acid Traditional Name: (2S)-6-amino-2-[[4-amino-2-(2-aminohexanoylamino)butanoyl]amino]hexanoic acid Formula: C16H33N5O4 MolecularWeight: 359.46432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC(C(=O)NC(CCN)C(=O)N[C@@H](CCCCN)C(=O)O)N

InChI

InChI=1S/C16H33N5O4/c1-2-3-6-11(19)14(22)20-12(8-10-18)15(23)21-13(16(24)25)7-4-5-9-17/h11-13H,2-10,17-19H2,1H3,(H,20,22)(H,21,23)(H,24,25)/t11?,12?,13-/m0/s1