Info
| ID | 139 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | RdU |
| SMILES | O=c1[nH]c(=O)n([C@H]2C[C@H](O)C(CO)O2)cc1-c1cn(-c2ccc(/C=C/c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2)nn1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1 |
TUCAN
C52H41N13O5Ru/(1-43)(2-69)(3-42)(4-60)(5-44)(6-70)(7-74)(8-49)(9-45)(10-75)(11-53)(12-51)(13-56)(14-76)(15-73)(16-92)(17-59)(18-47)(19-48)(20-57)(21-55)(22-64)(23-50)(24-63)(25-89)(26-64)(27-71)(28-72)(29-88)(30-54)(31-46)(32-52)(33-88)(34-62)(35-90)(36-61)(37-58)(38-95)(39-96)(40-110)(41-109)(42-43)(42-44)(43-77)(44-69)(45-49)(45-70)(46-50)(46-74)(47-49)(47-78)(48-50)(48-79)(51-55)(51-66)(52-54)(52-65)(53-56)(53-65)(54-87)(55-71)(56-85)(57-63)(57-84)(58-61)(58-85)(59-60)(59-68)(60-73)(61-65)(62-63)(62-75)(64-89)(64-92)(66-80)(66-81)(67-72)(67-83)(67-91)(68-82)(68-86)(69-103)(70-104)(71-94)(72-97)(73-101)(74-105)(75-106)(76-83)(76-99)(77-78)(77-103)(78-104)(79-84)(79-105)(80-82)(80-94)(81-86)(81-96)(82-101)(83-98)(84-106)(85-99)(86-102)(87-96)(87-102)(88-90)(88-110)(89-90)(89-109)(90-111)(91-95)(91-108)(92-97)(92-111)(93-95)(93-97)(93-107)(98-100)(99-100)(101-112)(102-112)(103-112)(104-112)(105-112)(106-112)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MDA-MB-231 | 36 | 1.1 | 10.1021/jacsau.3c00808 | 2024 |
| MCF-7 | 54 | 8.2 | 10.1021/jacsau.3c00808 | 2024 |
| MCF-10A | 73 | 37 | 10.1021/jacsau.3c00808 | 2024 |
🧬 Cell Death Types (1)
Ferroptosis
high
«It was further revealed that RdU induces ferroptosis of MDA-MB-231 cells under light irradiation (650 nm, 300 mW/cm^2).»
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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