BioLiP

PDB

BioLiP

PDB CCD ID:

RUC

Number of entries in BioLiP:

Chemical formula:

C6 H6 Ru

InChI:

InChI=1S/C6H6.Ru/c1-2-4-6-5-3-1;/h1-6H;

InChIKey:

BFWXATGPNNYZKL-UHFFFAOYSA-N

SMILES:

Software	SMILES
OpenEye OEToolkits 2.0.7	[CH]12=[CH]3[Ru]1456[CH]2=[CH]4[CH]5=[CH]63
CACTVS 3.385	[Ru].C1=CC=CC=C1

Name:

(eta6-benzene)ruthenium

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).