Molecule ID: 7016106

IUPAC Name: (2S)-6-amino-2-[[(2S)-2-aminopropanoyl]amino]hexanoic acid

Description: The molecule is a dipeptide obtained by formal condensation of the carboxy group of L-alanine with the alpha-amino group of L-lysine. It has a role as a marine metabolite.

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

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

InChI: InChI=1S/C9H19N3O3/c1-6(11)8(13)12-7(9(14)15)4-2-3-5-10/h6-7H,2-5,10-11H2,1H3,(H,12,13)(H,14,15)/t6-,7-/m0/s1

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: -3.5