BioLiP

PDB

BioLiP

PDB CCD ID:

Number of entries in BioLiP:

Chemical formula:

C2 H4 O2

InChI:

InChI=1/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/f/h3H

InChIKey:

QTBSBXVTEAMEQO-TULZNQERCK

SMILES:

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

Name:

CARBOXYMETHYL GROUP

ChEMBL:

CHEMBL539

DrugBank:

DB03166

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).