4-[2-(2-azanylpropanoylamino)propanoylamino]-5-(carboxymethylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[2-(2-azanylpropanoylamino)propanoylamino]-5-(carboxymethylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 4-[2-(2-aminopropanoylamino)propanoylamino]-5-(carboxymethylamino)-5-oxo-pentanoic acid CAS Name: 4-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-5-(carboxymethylamino)-5-oxopentanoic acid IUPAC Name: 4-[2-(2-aminopropanoylamino)propanoylamino]-5-(carboxymethylamino)-5-oxopentanoic acid Traditional Name: 4-[2-(alanylamino)propanoylamino]-5-(carboxymethylamino)-5-keto-valeric acid Formula: C13H22N4O7 MolecularWeight: 346.33638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N4O7/c1-6(14)11(22)16-7(2)12(23)17-8(3-4-9(18)19)13(24)15-5-10(20)21/h6-8H,3-5,14H2,1-2H3,(H,15,24)(H,16,22)(H,17,23)(H,18,19)(H,20,21)