2-[[2-[2-(2-azanylpropanoylamino)propanoylamino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoic acid

Systemtic Name: 2-[[2-[2-(2-azanylpropanoylamino)propanoylamino]-4-oxidanyl-4-oxidanylidene-butanoyl]amino]-3-methyl-pentanoic acid Openeye Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]-4-hydroxy-4-oxo-butanoyl]amino]-3-methyl-pentanoic acid CAS Name: 2-[[2-[[2-[(2-amino-1-oxopropyl)amino]-1-oxopropyl]amino]-4-hydroxy-1,4-dioxobutyl]amino]-3-methylpentanoic acid IUPAC Name: 2-[[2-[2-(2-aminopropanoylamino)propanoylamino]-4-hydroxy-4-oxobutanoyl]amino]-3-methylpentanoic acid Traditional Name: 2-[[2-[2-(alanylamino)propanoylamino]-4-hydroxy-4-keto-butanoyl]amino]-3-methyl-valeric acid Formula: C16H28N4O7 MolecularWeight: 388.41612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N4O7/c1-5-7(2)12(16(26)27)20-15(25)10(6-11(21)22)19-14(24)9(4)18-13(23)8(3)17/h7-10,12H,5-6,17H2,1-4H3,(H,18,23)(H,19,24)(H,20,25)(H,21,22)(H,26,27)