Info
| ID | 6396 |
| Metal | Os |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 1, "O": 1} |
| Abbreviation | 6 |
| SMILES | COC1=Cc2ccnc3c([O-])c4cc(OC)c(OC)cc4c(c23)C1=O.Cc1ccc(C(C)C)cc1.[Cl-] |
TUCAN
C29H28NO5Os/(1-30)(2-33)(3-29)(4-35)(5-50)(6-29)(7-34)(8-29)(9-50)(10-31)(11-32)(12-30)(13-47)(14-31)(15-30)(16-50)(17-36)(18-31)(19-52)(20-52)(21-52)(22-39)(23-51)(24-51)(25-48)(26-38)(27-51)(28-37)(29-47)(30-40)(31-47)(32-33)(32-41)(33-40)(34-36)(34-40)(35-44)(35-53)(36-41)(37-46)(37-54)(38-45)(38-48)(39-45)(39-56)(41-47)(42-43)(42-45)(42-49)(43-44)(43-55)(44-46)(46-57)(48-58)(49-57)(49-58)(50-62)(51-61)(52-63)(53-54)(53-62)(54-61)(55-56)(55-59)(56-63)(57-60)(58-64)(63-64)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| T24 | 2 | — | 10.1002/anie.202208570 | 2022 |
| HeLa | 2 | — | 10.1002/anie.202208570 | 2022 |
| HT-29 | 12 | — | 10.1002/anie.202208570 | 2022 |
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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