Info
| ID | 1160 |
| Metal | Ru |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"N": 4, "O": 1} |
| Abbreviation | 12 |
| SMILES | CC(=N)NCCN.CC(=N)NCCN.[O-]c1ccccc1/C=N/C1CCCCC1/N=C/c1ccccc1[O-] |
TUCAN
C28H42N8O2Ru/(1-54)(2-59)(3-54)(4-45)(5-46)(6-53)(7-62)(8-62)(9-43)(10-43)(11-56)(12-65)(13-56)(14-47)(15-48)(16-53)(17-43)(18-49)(19-55)(20-50)(21-66)(22-60)(23-51)(24-55)(25-52)(26-64)(27-44)(28-44)(29-61)(30-61)(31-63)(32-63)(33-44)(34-64)(35-73)(36-75)(37-71)(38-71)(39-74)(40-72)(41-72)(42-76)(43-67)(44-68)(45-47)(45-57)(46-47)(46-48)(48-69)(49-52)(49-70)(50-51)(50-52)(51-58)(53-54)(53-55)(54-65)(55-56)(56-66)(57-59)(57-69)(58-60)(58-70)(59-77)(60-78)(61-62)(61-71)(62-73)(63-64)(63-72)(64-74)(65-66)(65-77)(66-78)(67-73)(67-75)(68-74)(68-76)(69-79)(70-80)(75-81)(76-81)(77-81)(78-81)
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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