Molecule ID: 102067377

IUPAC Name: (2R)-2-[[(2S)-2,6-diaminohexanoyl]amino]pentanedioic acid

Description: The molecule is a dipeptide obtained by formal condensation of the carboxy group of L-lysine with the amino group of D-glutamic acid. It is a constituent of bacterial peptidoglycan type A4alpha. It derives from a L-lysine and a D-glutamic acid.

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

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

InChI: InChI=1S/C11H21N3O5/c12-6-2-1-3-7(13)10(17)14-8(11(18)19)4-5-9(15)16/h7-8H,1-6,12-13H2,(H,14,17)(H,15,16)(H,18,19)/t7-,8+/m0/s1

Molecular Properties:
- Polar Surface Area: 156.0 Ų
- LogP: -6.3