BioLiP

PDB

BioLiP

PDB CCD ID:

8LD

Number of entries in BioLiP:

Chemical formula:

C4 H2 O3

InChI:

InChI=1S/C4H2O3/c5-1-3-7-4-2-6/h5-6H

InChIKey:

QFHUYNIAGZXZMU-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.6	C(#COC#CO)O
ACDLabs 12.01 CACTVS 3.385	OC#COC#CO

Name:

2,2'-oxydi(ethyn-1-ol)

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).