Info
| ID | 53 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"O": 4, "S": 2} |
| Abbreviation | 1b |
| SMILES | Cc1occc(=O)c1[O-].Cc1occc(=O)c1[O-].O=S1CCCC1.O=S1CCCC1 |
TUCAN
C20H26O8RuS2/(1-29)(2-43)(3-31)(4-43)(5-31)(6-32)(7-44)(8-35)(9-44)(10-32)(11-45)(12-33)(13-33)(14-45)(15-34)(16-46)(17-27)(18-27)(19-30)(20-36)(21-27)(22-34)(23-46)(24-28)(25-28)(26-28)(27-39)(28-40)(29-35)(29-37)(30-36)(30-42)(31-32)(31-43)(32-44)(33-34)(33-45)(34-46)(35-53)(36-54)(37-38)(37-47)(38-39)(38-48)(39-53)(40-41)(40-54)(41-42)(41-50)(42-49)(43-55)(44-55)(45-56)(46-56)(51-55)(52-56)(53-57)(54-57)(55-57)(56-57)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-435S | 3.7e+02 | — | 10.1021/ic030119j | 2003 |
Source-assisted 2D generator
Builds the drawing from source ligand graphs and explicit donor metadata, then uses Metal2D only for layout. Publication output uses black bonds without arrows or colour highlighting; validated octahedral enantiomers are encoded directly with solid and hashed wedge bonds.
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