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- ChemComp-RU3: ruthenium(6+) formate azanide tetraamino(formato-kappaO)oxidoruth... -

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Basic information

EntryDatabase: PDB chemical components / ID: RU3
NameName: ruthenium(6+) formate azanide tetraamino(formato-kappaO)oxidoruthenate(1-) (1/1/4/1)

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Chemical information

Composition
Formula: C2H18N8O5Ru2 / Number of atoms: 35 / Formula weight: 436.355 / Formal charge: 0
Others

6v3c

Type: non-polymer / PDB classification: HETAIN / Three letter code: RU3 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6V3C
History
Create componentNov 26, 2019
Initial releaseFeb 26, 2020
External linksUniChem / ChemSpider / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

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

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SMILES CANONICAL

CACTVS 3.385N[Ru](N)(N)(N)(OC=O)O[Ru](N)(N)(N)(N)OC=O
OpenEye OEToolkits 2.0.7C(=O)O[Ru](N)(N)(N)(N)O[Ru](N)(N)(N)(N)OC=O

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InChI

InChI 1.03InChI=1S/2CH2O2.8H2N.O.2Ru/c2*2-1-3;;;;;;;;;;;/h2*1H,(H,2,3);8*1H2;;;/q;;8*-1;;2*+5/p-2

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InChIKey

InChI 1.03NJIATLYSFWLYKK-UHFFFAOYSA-L

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PDB entries

Showing all 1 items

PDB-6v3c:
K2P2.1(TREK-1)I110D:Ru360 bound channel structure

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