Molecule ID: 78437958

IUPAC Name: 2-azaniumyl-5-(1-carboxylatopropylamino)-5-oxopentanoate

Description: The molecule is a peptide anion that is the conjugate base of gamma-Glu-Abu, obtained by removal of protons from the two carboxy groups as well as protonation of the amino group; major species at pH 7.3. It is a conjugate base of a gamma-Glu-Abu.

SMILES: CCC(N=C([O-])CCC(N)C(=O)O)C(=O)O

SELFIES: [C][C][C][Branch1][P][N][=C][Branch1][C][O-1][C][C][C][Branch1][C][N][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C9H16N2O5/c1-2-6(9(15)16)11-7(12)4-3-5(10)8(13)14/h5-6H,2-4,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)/p-1

Molecular Properties:
- Polar Surface Area: 137.0 Ų
- LogP: -1.9