IWL

W11-O35 cluster

Created:	2022-04-14
Last modified:	2022-08-22

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1 entries where IWL is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	46
Chiral Atom Count	0
Bond Count	64
Aromatic Bond Count	0

2D diagram of IWL

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Chemical Component Summary
Name	W11-O35 cluster
Formula	O₃₅ W₁₁
Molecular Weight	2,582.219
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[W]O[W]1O[W]23(O1)O[W]4O[W]56O[W]78O[W]9(O7)O[W]%10%11O[W]%12(O[W]%13(O5)[O]24[W](O%10)([O]9%11%12)[O]68%13)O3
SMILES	OpenEye OEToolkits	2.0.7	[O][W]1(O[W]2(O1[W]345(O2[W]678(O391[W]2(O4)(O6[W]34(O2[W]9269O73[W]3(O4)(O2[W]2(O3)(O63[W]1(O5)(O8)(O[W]3(O2)(O9)([O])[O])[O])([O])[O])([O])[O])([O])[O])([O])[O])[O])[O])([O])([O])[O])[O]
Canonical SMILES	CACTVS	3.385	O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[W]O[W]1O[W]23(O1)O[W]4O[W]56O[W]78O[W]9(O7)O[W]%10%11O[W]%12(O[W]%13(O5)[O]24[W](O%10)([O]9%11%12)[O]68%13)O3
Canonical SMILES	OpenEye OEToolkits	2.0.7	[O][W]1(O[W]2(O1[W]345(O2[W]678(O391[W]2(O4)(O6[W]34(O2[W]9269O73[W]3(O4)(O2[W]2(O3)(O63[W]1(O5)(O8)(O[W]3(O2)(O9)([O])[O])[O])([O])[O])([O])[O])([O])[O])([O])[O])[O])[O])([O])([O])[O])[O]
InChI	InChI	1.06	InChI=1S/18H2O.17O.11W/h181H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;3+1;6*+2;+3/p-18
InChIKey	InChI	1.06	CUINPWXZLQHQKU-UHFFFAOYSA-A

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.