Info
| ID | 57 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"S": 1, "O": 2, "N": 2} |
| Abbreviation | 3 |
| SMILES | CCS(=O)CCS(=O)CC.Cc1ncc([N+](=O)[O-])n1CCO.Cc1ncc([N+](=O)[O-])n1CCO.[Cl-].[Cl-] |
TUCAN
C18H32N6O8RuS2/(1-40)(2-46)(3-40)(4-33)(5-33)(6-33)(7-36)(8-45)(9-34)(10-39)(11-37)(12-35)(13-38)(14-46)(15-47)(16-48)(17-48)(18-36)(19-47)(20-45)(21-34)(22-39)(23-35)(24-35)(25-34)(26-36)(27-49)(28-50)(29-50)(30-49)(31-57)(32-64)(33-47)(34-43)(35-42)(36-50)(37-41)(37-55)(38-44)(38-56)(39-45)(39-52)(40-46)(40-51)(41-51)(41-54)(42-51)(42-55)(43-52)(43-56)(44-52)(44-53)(45-64)(46-57)(47-65)(48-49)(48-65)(49-66)(50-66)(53-59)(53-61)(54-58)(54-60)(55-67)(56-67)(62-65)(63-66)(64-67)(65-67)(66-67)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-435S | 8.6e+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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