Molecule ID: 439232

IUPAC Name: (2S)-2-acetamido-5-aminopentanoic acid

Description: The molecule is an N(2)-acyl-L-ornithine where the acyl group is specified to be acetyl. It has a role as a human metabolite, an Escherichia coli metabolite, a Saccharomyces cerevisiae metabolite and a mouse metabolite. It is an acetyl-L-ornithine and a N2-acyl-L-ornithine. It is a tautomer of a N(2)-acetyl-L-ornithine zwitterion.

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

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

InChI: InChI=1S/C7H14N2O3/c1-5(10)9-6(7(11)12)3-2-4-8/h6H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t6-/m0/s1

Molecular Properties:
- Polar Surface Area: 92.4 Ų
- LogP: -4.8