Info
| ID | 4722 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 0 |
| Donor atoms | {"N": 1, "P": 1, "O": 2} |
| Abbreviation | Ru3 |
| SMILES | CC(=O)OC[C@H]1O[C@@H](OCCNC(=O)c2ccc(P(c3ccccc3)c3ccccc3)cc2)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.Cc1ccc(C(C)C)cc1.O=C([O-])C(=O)[O-] |
TUCAN
C47H52NO15PRu/(1-82)(2-60)(3-58)(4-85)(5-56)(6-61)(7-77)(8-56)(9-68)(10-57)(11-53)(12-53)(13-87)(14-66)(15-64)(16-69)(17-72)(18-53)(19-70)(20-63)(21-71)(22-65)(23-57)(24-73)(25-82)(26-54)(27-58)(28-62)(29-83)(30-54)(31-58)(32-83)(33-54)(34-59)(35-59)(36-84)(37-59)(38-84)(39-57)(40-67)(41-75)(42-86)(43-56)(44-96)(45-88)(46-74)(47-76)(48-55)(49-55)(50-55)(51-81)(52-100)(53-78)(54-81)(55-81)(56-93)(57-94)(58-92)(59-95)(60-61)(60-80)(61-78)(62-77)(62-78)(63-68)(63-97)(64-70)(64-79)(65-69)(65-97)(66-68)(66-69)(67-75)(67-98)(70-99)(71-72)(71-99)(72-79)(73-75)(73-76)(74-76)(74-98)(77-80)(79-89)(80-81)(82-83)(82-100)(83-113)(84-88)(84-115)(85-86)(85-88)(85-110)(86-87)(86-112)(87-96)(87-111)(88-114)(89-100)(89-108)(90-91)(90-101)(90-102)(91-103)(91-104)(92-107)(92-110)(93-105)(93-112)(94-106)(94-111)(95-109)(95-115)(96-113)(96-114)(97-116)(98-116)(99-116)(113-117)(114-117)(115-117)(116-117)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| A2780 | — | — | 10.1016/j.bioorg.2022.105901 | 2022 |
| A2780cisR | — | — | 10.1016/j.bioorg.2022.105901 | 2022 |
| MCF-7 | — | — | 10.1016/j.bioorg.2022.105901 | 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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The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.