BioLiP

PDB

BioLiP

PDB CCD ID:

6AB

Number of entries in BioLiP:

Chemical formula:

C7 H7 N O2

InChI:

InChI=1/C7H7NO2/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H,9,10)/f/h9H

InChIKey:

RWZYAGGXGHYGMB-BGGKNDAXCO

SMILES:

Software	SMILES
CACTVS 3.341	Nc1ccccc1C(O)=O
ACDLabs 10.04	O=C(O)c1ccccc1N
OpenEye OEToolkits 1.5.0	c1ccc(c(c1)C(=O)O)N

Name:

6-AMINOBENZOIC 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).