Info
| ID | 5908 |
| Metal | Ir |
| Oxidation state | 3 |
| Charge | 0 |
| Donor atoms | {"N": 5, "O": 1} |
| Abbreviation | Ir3 |
| SMILES | Fc1c[c-]c(-c2ccccn2)c(F)c1.Fc1c[c-]c(-c2ccccn2)c(F)c1.[O-]N=C(c1ccccn1)c1ccccn1 |
TUCAN
C33H20F4IrN5O/(1-32)(2-29)(3-27)(4-34)(5-44)(6-25)(7-41)(8-36)(9-23)(10-28)(11-43)(12-26)(13-31)(14-38)(15-35)(16-42)(17-24)(18-30)(19-33)(20-37)(21-28)(21-39)(22-35)(22-40)(23-32)(23-46)(24-30)(24-42)(25-31)(25-41)(26-32)(26-44)(27-50)(27-51)(28-50)(29-31)(29-47)(30-34)(33-52)(33-53)(34-49)(35-52)(36-37)(36-48)(37-38)(38-43)(39-47)(39-51)(40-48)(40-53)(41-55)(42-56)(43-57)(44-54)(45-46)(45-49)(45-58)(46-54)(47-55)(48-57)(49-56)(50-61)(51-60)(52-63)(53-62)(55-64)(56-64)(57-64)(58-59)(58-64)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 21 | — | 10.1039/d5ra03076e | 2025 |
| HT-29 | 27 | — | 10.1039/d5ra03076e | 2025 |
| LN229 | 31 | — | 10.1039/d5ra03076e | 2025 |
🧬 Cell Death Types (1)
Apoptosis
high
«Immunocytochemistry analysis revealed that the iridium complexes induced the upregulation and nuclear localization of the tumor suppressor protein p53, as well as the activation of cleaved caspase, a ...»
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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