Molecule ID: 135471152

IUPAC Name: (2S)-2-amino-2-[(4R)-2-amino-1,4,5,6-tetrahydropyrimidin-4-yl]acetic acid

Description: The molecule is an L-alpha-amino acid obtained by enzyme-mediated intramolecular cyclisation of L-arginine. It has a role as a metabolite. It is a member of guanidines, a member of pyrimidines, a L-arginine derivative and a non-proteinogenic L-alpha-amino acid. It is a conjugate base of a (2S,3R)-capreomycidine(1+).

SMILES: N=C1NCC[C@H]([C@H](N)C(=O)O)N1

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

InChI: InChI=1S/C6H12N4O2/c7-4(5(11)12)3-1-2-9-6(8)10-3/h3-4H,1-2,7H2,(H,11,12)(H3,8,9,10)/t3-,4+/m1/s1

Molecular Properties:
- Polar Surface Area: 114.0 Ų
- LogP: -4.5