BioLiP

PDB

BioLiP

PDB CCD ID:

7OZ

Number of entries in BioLiP:

Chemical formula:

C4 H8 F N O2

InChI:

InChI=1S/C4H8FNO2/c5-2-1-3(6)4(7)8/h3H,1-2,6H2,(H,7,8)/t3-/m0/s1

InChIKey:

LJYFXGDRJCHELF-VKHMYHEASA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C(CF)[C@@H](C(=O)O)N
CACTVS 3.385	N[C@@H](CCF)C(O)=O
OpenEye OEToolkits 2.0.7	C(CF)C(C(=O)O)N
CACTVS 3.385	N[CH](CCF)C(O)=O

Name:

(S)-2-amino-4-fluorobutanoic acid;
(2S)-2-azanyl-4-fluoranyl-butanoic acid;
(2S)-2-amino-4-fluoro-butanoic Acid

ZINC:

ZINC000038948561

Reference:

Chengxin Zhang, Xi Zhang, Lydia Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023).

Jianyi Yang, Ambrish Roy, and Yang Zhang. BioLiP: a semi-manually curated database for biologically relevant ligand-protein interactions, Nucleic Acids Research, 41: D1096-D1103 (2013) (download the PDF file).