Molecule ID: 138911107

IUPAC Name: (4S)-4-amino-5-[[(2S)-4-carboxy-1-[[(1S)-1-carboxy-4-(diaminomethylideneamino)butyl]amino]-1-oxobutan-2-yl]amino]-5-oxopentanoic acid

Description: The molecule is a tripeptide composed of two L-glutamic acid and one L-arginine residues joined in sequence. It derives from a L-glutamic acid and a L-arginine.

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

SELFIES: [N][=C][Branch1][C][N][N][C][C][C][C@H1][Branch2][Ring1][S][N][=C][Branch1][C][O][C@H1][Branch1][Branch2][C][C][C][=Branch1][C][=O][O][N][=C][Branch1][C][O][C@@H1][Branch1][C][N][C][C][C][=Branch1][C][=O][O][C][=Branch1][C][=O][O]

InChI: InChI=1S/C16H28N6O8/c17-8(3-5-11(23)24)13(27)21-9(4-6-12(25)26)14(28)22-10(15(29)30)2-1-7-20-16(18)19/h8-10H,1-7,17H2,(H,21,27)(H,22,28)(H,23,24)(H,25,26)(H,29,30)(H4,18,19,20)/t8-,9-,10-/m0/s1

Molecular Properties:
- Polar Surface Area: 261.0 Ų
- LogP: -5.7