Molecule ID: 5460257

IUPAC Name: (2S)-2-(carbamoylamino)butanedioate

Description: The molecule is an N-carbamoyl-L-alpha-amino acid anion obtained by deprotonation of the carboxy groups of N-carbamoyl-L-aspartic acid. It has a role as a human metabolite and a Saccharomyces cerevisiae metabolite. It is a conjugate base of a N-carbamoyl-L-aspartic acid.

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

SELFIES: [N][=C][Branch1][C][O][N][C@@H1][Branch1][#Branch1][C][C][=Branch1][C][=O][O-1][C][=Branch1][C][=O][O-1]

InChI: InChI=1S/C5H8N2O5/c6-5(12)7-2(4(10)11)1-3(8)9/h2H,1H2,(H,8,9)(H,10,11)(H3,6,7,12)/p-2/t2-/m0/s1

Molecular Properties:
- Polar Surface Area: 135.0 Ų
- LogP: -0.4