Info
| ID | 1838 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 2} |
| Abbreviation | 4e |
| SMILES | CC(=O)OC[C@H]1O[C@@H]([n+]2[c-]c(-c3ccccc3)n(C)n2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.Cc1ccc(C(C)C)cc1.[Cl-].[Cl-] |
TUCAN
C33H41N3O9Ru/(1-62)(2-43)(3-42)(4-49)(5-42)(6-51)(7-47)(8-46)(9-66)(10-62)(11-62)(12-46)(13-43)(14-47)(15-50)(16-52)(17-43)(18-53)(19-42)(20-44)(21-54)(22-44)(23-44)(24-55)(25-61)(26-48)(27-48)(28-69)(29-65)(30-65)(31-48)(32-70)(33-46)(34-45)(35-67)(36-68)(37-47)(38-56)(39-57)(40-45)(41-45)(42-61)(43-58)(44-61)(45-71)(46-74)(47-72)(48-73)(49-50)(49-58)(50-59)(51-52)(51-58)(52-59)(53-54)(53-60)(54-55)(55-56)(56-57)(57-60)(59-61)(60-64)(62-75)(63-64)(63-76)(64-75)(65-69)(65-86)(66-67)(66-70)(66-82)(67-68)(67-85)(68-69)(68-83)(69-84)(70-76)(70-84)(71-81)(71-82)(72-78)(72-83)(73-80)(73-86)(74-79)(74-85)(75-77)(76-77)(77-87)(86-87)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | 41 | — | 10.1039/c3dt52584h | 2014 |
| A2780cisR | — | — | 10.1039/c3dt52584h | 2014 |
| HEK293 | — | — | 10.1039/c3dt52584h | 2014 |
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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