BioLiP

PDB

BioLiP

PDB CCD ID:

BPS

Number of entries in BioLiP:

Chemical formula:

C12 H10 O2 S

InChI:

InChI=1S/C12H10O2S/c13-15(14)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H,(H,13,14)

InChIKey:

LZCLZDCSBDVAOV-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 1.5.0	c1ccc(cc1)c2ccccc2S(=O)O
ACDLabs 10.04	O=S(O)c2ccccc2c1ccccc1
CACTVS 3.341	O[S@@](=O)c1ccccc1c2ccccc2
OpenEye OEToolkits 1.5.0	c1ccc(cc1)c2ccccc2[S@](=O)O
CACTVS 3.341	O[S](=O)c1ccccc1c2ccccc2

Name:

1,1'-BIPHENYL-2-SULFINIC ACID;
BIPHENYL-2-SULFINIC ACID

DrugBank:

DB07483

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).