Molecule ID: 7020885

IUPAC Name: (2S)-2-[(2-azaniumylacetyl)amino]pentanedioate

Description: The molecule is a peptide anion that is the conjugate base of Gly-Glu, obtained by deprotonation of the terminal and side-chain carboxy groups and protonation of the terminal amino group. It is a conjugate base of a Gly-Glu.

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

SELFIES: [N][C][C][Branch1][C][O-1][=N][C@@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C7H12N2O5/c8-3-5(10)9-4(7(13)14)1-2-6(11)12/h4H,1-3,8H2,(H,9,10)(H,11,12)(H,13,14)/p-1/t4-/m0/s1

Molecular Properties:
- Polar Surface Area: 137.0 Ų
- LogP: -2.9