BioLiP

PDB

BioLiP

PDB CCD ID:

A1H49

Number of entries in BioLiP:

Chemical formula:

C10 H7 N O3 S

InChI:

InChI=1S/C10H7NO3S/c12-8-4-2-1-3-6(8)9-11-7(5-15-9)10(13)14/h1-5,12H,(H,13,14)

InChIKey:

UCVBEULMPJTLLH-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1ccc(c(c1)c2nc(cs2)C(=O)O)O
CACTVS 3.385	OC(=O)c1csc(n1)c2ccccc2O

Name:

2-(2-hydroxyphenyl)-1,3-thiazole-4-carboxylic acid

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).