| PDB CCD ID: | PW9 |
| Number of entries in BioLiP: | 3 |
| Chemical formula: | O34 P W9 |
| InChI: | InChI=1S/O4P.30O.9W/c1-5(2,3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q+4;;;;;;;;;;;;;;;;15*-1;;;;;;;;; |
| InChIKey: | FITSDOGSJOFYAU-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | [O-][W]123([O-])O[W]45([O-])([O-])O[W]67([O-])([O-])O[W]89([O-])([O-])O[W]%10%11([O-])([O-])O[W]%12([O-])([O-])(O1)O[W]%13%14([O-])(O2)O[W]%15([O-])(O4)(O6)O[W]([O-])(O%10)(O8)(O%13)[O++]%14%15[P-]([O+]35)([O+]%11%12)[O+]79 | | OpenEye OEToolkits 2.0.7 | [O-][W]123(O[W]45([O+]1[P-]67[O+]8[W]9(O2)(O[W]81(O[W]28([O+]6[W](O2)(O4)(O[W]24(O5)([O+2]75[W](O3)(O9)(O2)(O[W]5(O1)(O8)(O4)[O-])[O-])[O-])([O-])[O-])([O-])[O-])([O-])[O-])([O-])[O-])([O-])[O-])[O-] |
|
| Name: | Trilacunary Keggin |
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