Info
| ID | 6346 |
| Metal | Re |
| Oxidation state | 1 |
| Charge | 0 |
| Donor atoms | {"N": 3, "O": 4} |
| Abbreviation | Re4 |
| SMILES | Cc1ccc2nc(-c3ccc(N(C)CCOCCCCSCCNCC(=O)[O-])cc3)sc2c1.[C-]#[O+].[C-]#[O+].[C-]#[O+] |
TUCAN
C28H32N3O6ReS2/(1-45)(2-33)(3-37)(4-42)(5-38)(6-48)(7-33)(8-36)(9-54)(10-47)(11-48)(12-54)(13-58)(14-58)(15-45)(16-45)(17-57)(18-46)(19-55)(20-47)(21-55)(22-57)(23-35)(24-33)(25-46)(26-40)(27-41)(28-41)(29-34)(30-42)(31-39)(32-61)(33-43)(34-43)(34-59)(35-36)(35-43)(36-50)(37-38)(37-44)(38-49)(39-40)(39-44)(40-49)(41-42)(41-58)(42-54)(44-60)(45-62)(46-57)(46-61)(47-56)(47-61)(48-55)(48-62)(49-62)(50-59)(50-63)(51-64)(52-65)(53-66)(54-69)(55-69)(56-67)(56-68)(57-71)(58-71)(59-70)(60-63)(60-70)(63-72)(69-72)(70-72)(71-72)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MCF-7 | 16 | — | 10.1039/c5ob00124b | 2015 |
| PC-3 | 32 | — | 10.1039/c5ob00124b | 2015 |
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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