Info
| ID | 6003 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 8} |
| Abbreviation | Ir5ʹ |
| SMILES | CCCCOc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1.[c-]1ccccc1-n1cccn1.[c-]1ccccc1-n1cccn1 |
TUCAN
C41H34IrN8O/(1-56)(2-63)(3-54)(4-41)(5-40)(6-42)(7-61)(8-47)(9-48)(10-49)(11-43)(12-57)(13-57)(14-35)(15-56)(16-74)(17-55)(18-44)(19-65)(20-52)(21-46)(22-64)(23-38)(24-35)(25-74)(26-50)(27-45)(28-66)(29-53)(30-51)(31-39)(32-62)(33-35)(34-77)(35-57)(36-41)(36-67)(37-53)(37-68)(38-61)(38-63)(39-62)(39-64)(40-47)(40-67)(41-48)(42-43)(42-58)(43-65)(44-45)(44-66)(45-59)(46-51)(46-68)(47-48)(49-54)(49-75)(50-55)(50-75)(51-52)(52-53)(54-60)(55-60)(56-57)(56-74)(58-69)(58-71)(59-70)(59-72)(60-73)(61-78)(62-79)(63-82)(64-83)(65-76)(66-81)(67-78)(68-79)(69-70)(69-77)(70-80)(71-72)(71-76)(72-81)(73-77)(73-80)(74-84)(75-84)(78-82)(79-83)(80-85)(81-85)(82-85)(83-85)(84-85)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 13 | — | 10.1016/j.bioorg.2025.108148 | 2025 |
| A549 | 48 | — | 10.1016/j.bioorg.2025.108148 | 2025 |
| BEAS-2B | 53 | — | 10.1016/j.bioorg.2025.108148 | 2025 |
🧬 Cell Death Types (1)
Apoptosis
high
«Mechanistic studies confirmed that these complexes selectively target mitochondria ... leading to ... activation of intrinsic apoptosis pathways.»
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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