BioLiP

PDB

BioLiP

PDB CCD ID:

NY5

Number of entries in BioLiP:

Chemical formula:

C11 H12 O2

InChI:

InChI=1S/C11H12O2/c12-11(13)10-6-5-8-3-1-2-4-9(8)7-10/h5-7H,1-4H2,(H,12,13)

InChIKey:

RSWXAGBBPCRION-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	c1cc2c(cc1C(=O)O)CCCC2
CACTVS 3.385	OC(=O)c1ccc2CCCCc2c1

Name:

5,6,7,8-tetrahydronaphthalene-2-carboxylic acid

ZINC:

ZINC000004219010

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).