Molecule ID: 20841830

IUPAC Name: (2S)-2-amino-5-(4-aminobutylamino)-5-oxopentanoic acid

Description: The molecule is a gamma-glutamylputrescine, a L-glutamine derivative and a non-proteinogenic L-alpha-amino acid. It has a role as an Escherichia coli metabolite. It is a conjugate base of a gamma-L-glutamylputrescinium(1+).

SMILES: NCCCCN=C(O)CC[C@H](N)C(=O)O

SELFIES: [N][C][C][C][C][N][=C][Branch1][C][O][C][C][C@H1][Branch1][C][N][C][=Branch1][C][=O][O]

InChI: InChI=1S/C9H19N3O3/c10-5-1-2-6-12-8(13)4-3-7(11)9(14)15/h7H,1-6,10-11H2,(H,12,13)(H,14,15)/t7-/m0/s1

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: -4.0