Molecule ID: 135563679

IUPAC Name: (2S)-2-hydroxy-2-(tetradecanoylamino)acetate

Description: The molecule is an N-acyl-(2S)-hydroxyglycinate resulting from the deprotonation of the carboxy group of N-tetradecanoyl-(2S)-hydroxyglycine. The major species at pH 7.3. It is a conjugate base of a N-tetradecanoyl-(2S)-hydroxyglycine.

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

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

InChI: InChI=1S/C16H31NO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(18)17-15(19)16(20)21/h15,19H,2-13H2,1H3,(H,17,18)(H,20,21)/p-1/t15-/m0/s1

Molecular Properties:
- Polar Surface Area: 89.5 Ų
- LogP: 5.5