Molecule ID: 25201220

IUPAC Name: (2S)-2-azaniumyl-5-(ethylamino)-5-oxopentanoate

Description: The molecule is an amino acid zwitterion of N(5)-ethyl-L-glutamine arising from transfer of a proton from the carboxy to the amino group; major species at pH 7.3. It has a role as a plant metabolite. It is a tautomer of a N(5)-ethyl-L-glutamine.

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

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

InChI: InChI=1S/C7H14N2O3/c1-2-9-6(10)4-3-5(8)7(11)12/h5H,2-4,8H2,1H3,(H,9,10)(H,11,12)/t5-/m0/s1

Molecular Properties:
- Polar Surface Area: 96.9 Ų
- LogP: -2.7