BioLiP

PDB

BioLiP

PDB CCD ID:

FY2

Number of entries in BioLiP:

Chemical formula:

C9 H9 F2 N O3

InChI:

InChI=1S/C9H9F2NO3/c10-7-4(3-5(12)9(14)15)1-2-6(13)8(7)11/h1-2,5,13H,3,12H2,(H,14,15)/t5-/m0/s1

InChIKey:

XWNMQLVJIYFCFZ-YFKPBYRVSA-N

SMILES:

Software	SMILES
CACTVS 3.385	N[C@@H](Cc1ccc(O)c(F)c1F)C(O)=O
OpenEye OEToolkits 1.9.2	c1cc(c(c(c1C[C@@H](C(=O)O)N)F)F)O
OpenEye OEToolkits 1.9.2	c1cc(c(c(c1CC(C(=O)O)N)F)F)O
CACTVS 3.385	N[CH](Cc1ccc(O)c(F)c1F)C(O)=O
ACDLabs 12.01	NC(Cc1c(c(F)c(O)cc1)F)C(=O)O

Name:

2,3-difluoro-L-tyrosine

ZINC:

ZINC000066325533

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).