Info
| ID | 2378 |
| Metal | Ru |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"O": 4, "N": 4} |
| Abbreviation | 1b |
| SMILES | CCc1occc(=O)c1[O-].CCc1occc(=O)c1[O-].Cc1ncc([N+](=O)[O-])n1CCO.Cc1ncc([N+](=O)[O-])n1CCO |
TUCAN
C26H32N6O12Ru/(1-37)(2-41)(3-51)(4-33)(5-38)(6-39)(7-49)(8-51)(9-33)(10-52)(11-50)(12-39)(13-34)(14-33)(15-43)(16-42)(17-43)(18-52)(19-34)(20-34)(21-35)(22-35)(23-40)(24-36)(25-36)(26-36)(27-44)(28-44)(29-35)(30-40)(31-73)(32-74)(33-46)(34-39)(35-40)(36-47)(37-49)(37-56)(38-50)(38-58)(39-54)(40-55)(41-45)(41-63)(42-48)(42-64)(43-51)(43-59)(44-52)(44-60)(45-59)(45-61)(46-59)(46-63)(47-60)(47-64)(48-60)(48-62)(49-75)(50-76)(51-73)(52-74)(53-54)(53-56)(53-66)(54-75)(55-57)(55-76)(56-65)(57-58)(57-68)(58-67)(61-69)(61-70)(62-71)(62-72)(63-77)(64-77)(73-77)(74-77)(75-77)(76-77)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-435S | 70 | — | 10.1016/j.jinorgbio.2006.07.00... | 2006 |
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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