Molecule ID: 7010529

IUPAC Name: (2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-4-methylsulfanylbutanoic acid

Description: The molecule is a dipeptide formed from L-leucine and L-methionine residues. It has a role as a metabolite. It derives from a L-leucine and a L-methionine.

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

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

InChI: InChI=1S/C11H22N2O3S/c1-7(2)6-8(12)10(14)13-9(11(15)16)4-5-17-3/h7-9H,4-6,12H2,1-3H3,(H,13,14)(H,15,16)/t8-,9-/m0/s1

Molecular Properties:
- Polar Surface Area: 118.0 Ų
- LogP: -1.9