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BioLiP

PDB CCD ID: RU0
Number of entries in BioLiP: 2
Chemical formula: C8 H12 Cl2 O8 Ru2
InChI: InChI=1S/4C2H4O2.2ClH.2Ru/c4*1-2(3)4;;;;/h4*1H3,(H,3,4);2*1H;;/q;;;;;;2*+3/p-6
InChIKey: VJFVKLYKWCORIY-UHFFFAOYSA-H
SMILES:
SoftwareSMILES
CACTVS 3.370CC1=O|[Ru]|234(Cl)|O=C(C)O[Ru]|2(Cl)(|O=C(C)O3)(|O=C(C)O4)O1
ACDLabs 12.01Cl[Ru]2314oc(o[Ru]4(Cl)(oc(o1)C)(oc(o2)C)oc(o3)C)C
OpenEye OEToolkits 1.7.6CC1=O[Ru]234(=[Ru](O1)(O=C(O2)C)(O=C(O3)C)(OC(=O4)C)Cl)Cl
Name:Tetrakis(acetato)chloridodiruthenium(II,III)
Reference:
  • Chengxin Zhang, Xi Zhang, Peter L Freddolino, and Yang Zhang. BioLiP2: an updated structure database for biologically relevent ligand-protein interactions, Nucleic Acids Research, gkad630 (2023)(download the PDF file).
  • 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).

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