5-azanyl-2-[2-[2,6-bis(azanyl)hexanoylamino]ethanoylamino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[2-[2,6-bis(azanyl)hexanoylamino]ethanoylamino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[[2-(2,6-diaminohexanoylamino)acetyl]amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[[2-[(2,6-diamino-1-oxohexyl)amino]-1-oxoethyl]amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[[2-(2,6-diaminohexanoylamino)acetyl]amino]-5-oxopentanoic acid Traditional Name: 5-amino-2-[[2-(2,6-diaminohexanoylamino)acetyl]amino]-5-keto-valeric acid Formula: C13H25N5O5 MolecularWeight: 331.3681

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Descriptors Computed from Structure

Canonical SMILES:

C(CCN)CC(C(=O)NCC(=O)NC(CCC(=O)N)C(=O)O)N

Isomeric SMILES

C(CCN)CC(C(=O)NCC(=O)NC(CCC(=O)N)C(=O)O)N

InChI

InChI=1S/C13H25N5O5/c14-6-2-1-3-8(15)12(21)17-7-11(20)18-9(13(22)23)4-5-10(16)19/h8-9H,1-7,14-15H2,(H2,16,19)(H,17,21)(H,18,20)(H,22,23)