Molecule ID: 4474580

IUPAC Name: 2-[(4-amino-1-carboxybutyl)amino]pentanedioic acid

Description: The molecule is a glutamic acid derivative in which one of the amino hydrogens of glutamic acid has been replaced by a 4-amino-1-carboxybutyl group. It has a role as a plant metabolite. It is a glutamic acid derivative, an ornithine derivative, a tricarboxylic acid and a non-proteinogenic alpha-amino acid.

SMILES: NCCCC(NC(CCC(=O)O)C(=O)O)C(=O)O

SELFIES: [N][C][C][C][C][Branch1][P][N][C][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C10H18N2O6/c11-5-1-2-6(9(15)16)12-7(10(17)18)3-4-8(13)14/h6-7,12H,1-5,11H2,(H,13,14)(H,15,16)(H,17,18)

Molecular Properties:
- Polar Surface Area: 150.0 Ų
- LogP: -5.9