Molecule ID: 4107891

IUPAC Name: 2-(furan-2-carbonylamino)acetate

Description: The molecule is a monocarboxylic acid anion that is the conjugate base of N-(2-furoyl)glycine, obtained by deprotonation of the carboxy group; major species at pH 7.3. It has a role as a human metabolite. It is a N-acylglycinate and a monocarboxylic acid anion. It is a conjugate base of a N-(2-furoyl)glycine.

SMILES: O=C([O-])CNC(=O)c1ccco1

SELFIES: [O][=C][Branch1][C][O-1][C][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1]

InChI: InChI=1S/C7H7NO4/c9-6(10)4-8-7(11)5-2-1-3-12-5/h1-3H,4H2,(H,8,11)(H,9,10)/p-1

Molecular Properties:
- Polar Surface Area: 82.4 Ų
- LogP: 0.6