BioLiP

PDB

BioLiP

PDB CCD ID:

2OG

Number of entries in BioLiP:

Chemical formula:

C5 H6 O5

InChI:

InChI=1/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)/f/h7,9H

InChIKey:

KPGXRSRHYNQIFN-AUDIXQRPCH

SMILES:

Software	SMILES
ACDLabs 10.04	O=C(O)C(=O)CCC(=O)O
OpenEye OEToolkits 1.5.0	C(CC(=O)O)C(=O)C(=O)O
CACTVS 3.341	OC(=O)CCC(=O)C(O)=O

Name:

2-OXO-GLUTARIC 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).