Info
| ID | 1157 |
| Metal | Ru |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 4, "O": 1} |
| Abbreviation | 8 |
| SMILES | N=C(N)NCCO.N=C(N)NCCO.[O-]c1ccccc1/C=N/C1CCCCC1/N=C/c1ccccc1[O-] |
TUCAN
C26H38N8O4Ru/(1-47)(2-40)(3-48)(4-48)(5-57)(6-41)(7-61)(8-55)(9-47)(10-42)(11-50)(12-50)(13-53)(14-39)(15-61)(16-55)(17-43)(18-49)(19-54)(20-45)(21-44)(22-58)(23-49)(24-46)(25-62)(26-56)(27-62)(28-56)(29-67)(30-65)(31-65)(32-70)(33-69)(34-68)(35-66)(36-66)(37-75)(38-76)(39-41)(39-42)(40-42)(40-51)(41-63)(43-45)(43-46)(44-45)(44-64)(46-52)(47-48)(47-57)(48-50)(49-50)(49-58)(51-53)(51-63)(52-54)(52-64)(53-71)(54-72)(55-61)(55-67)(56-62)(56-68)(57-58)(57-71)(58-72)(59-66)(59-68)(59-70)(60-65)(60-67)(60-69)(61-75)(62-76)(63-73)(64-74)(69-77)(70-77)(71-77)(72-77)(76-77)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HeLa | — | — | 10.1039/c7sc02205k | 2017 |
| A549 | — | — | 10.1039/c7sc02205k | 2017 |
| MCF-7 | — | — | 10.1039/c7sc02205k | 2017 |
| HepG2 | — | — | 10.1039/c7sc02205k | 2017 |
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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