BioLiP

PDB

BioLiP

PDB CCD ID:

YWK

Number of entries in BioLiP:

Chemical formula:

C3 H F5 O2

InChI:

InChI=1S/C3HF5O2/c4-2(5,1(9)10)3(6,7)8/h(H,9,10)

InChIKey:

LRMSQVBRUNSOJL-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	C(=O)(C(C(F)(F)F)(F)F)O
ACDLabs 12.01	FC(F)(F)C(F)(F)C(=O)O
CACTVS 3.385	OC(=O)C(F)(F)C(F)(F)F

Name:

pentafluoropropanoic acid

ZINC:

ZINC000004262401

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).