Info
| ID | 6334 |
| Metal | Re |
| Oxidation state | 1 |
| Charge | 1 |
| Donor atoms | {"N": 3, "O": 3} |
| Abbreviation | Re-1 |
| SMILES | OCc1ccncc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C21H15N3O4Re/(1-27)(2-18)(3-29)(4-19)(5-28)(6-30)(7-36)(8-20)(9-17)(10-16)(11-21)(12-22)(13-23)(14-36)(15-43)(16-21)(16-24)(17-18)(17-24)(18-27)(19-26)(19-28)(20-22)(20-29)(21-25)(22-25)(23-26)(23-30)(24-31)(25-32)(26-36)(27-37)(28-39)(29-38)(30-39)(31-32)(31-37)(32-38)(33-40)(34-41)(35-42)(36-43)(37-44)(38-44)(39-44)(43-44)
Measurements (5)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | 64 | — | 10.1016/j.jinorgbio.2021.11153... | 2021 |
| A549 | 80 | — | 10.1016/j.jinorgbio.2021.11153... | 2021 |
| HepG2 | 92 | — | 10.1016/j.jinorgbio.2021.11153... | 2021 |
| A549cisR | — | — | 10.1016/j.jinorgbio.2021.11153... | 2021 |
| LO2 | — | — | 10.1016/j.jinorgbio.2021.11153... | 2021 |
🧬 Cell Death Types (2)
Apoptosis
high
«Mechanism studies show that Re-ART-1 and Re-ART-2 ... can induce both apoptosis and ferroptosis in HeLa cells through mitochondrial damage, caspase cascade»
Ferroptosis
high
«Mechanism studies show that Re-ART-1 and Re-ART-2 ... can induce both apoptosis and ferroptosis in HeLa cells through ... glutathione (GSH) depletion, glutathione peroxidase 4 (GPX4) inactivation and ...»
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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