BioLiP

PDB

BioLiP

PDB CCD ID:

RU3

Number of entries in BioLiP:

Chemical formula:

C2 H18 N8 O5 Ru2

InChI:

InChI=1S/2CH2O2.8H2N.O.2Ru/c2*2-1-3;;;;;;;;;;;/h2*1H,(H,2,3);8*1H2;;;/q;;8*-1;;2*+5/p-2

InChIKey:

NJIATLYSFWLYKK-UHFFFAOYSA-L

SMILES:

Software	SMILES
ACDLabs 12.01	N[Ru](O[Ru](N)(N)(N)(N)OC=O)(N)(N)(N)OC=O
OpenEye OEToolkits 2.0.7	C(=O)O[Ru](N)(N)(N)(N)O[Ru](N)(N)(N)(N)OC=O
CACTVS 3.385	N[Ru](N)(N)(N)(OC=O)O[Ru](N)(N)(N)(N)OC=O

Name:

ruthenium(6+) formate azanide tetraamino(formato-kappaO)oxidoruthenate(1-) (1/1/4/1)

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).