Info
| ID | 2545 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"O": 1, "P": 4} |
| Abbreviation | 2 |
| SMILES | CC(C)Cc1ccc([C@H](C)C(=O)[O-])cc1.c1ccc(P(CP(c2ccccc2)c2ccccc2)c2ccccc2)cc1.c1ccc(P(CP(c2ccccc2)c2ccccc2)c2ccccc2)cc1 |
TUCAN
C63H61O2P4Ru/(1-123)(2-123)(3-65)(4-66)(5-67)(6-72)(7-124)(8-124)(9-73)(10-70)(11-69)(12-77)(13-71)(14-75)(15-78)(16-81)(17-76)(18-83)(19-85)(20-87)(21-79)(22-82)(23-80)(24-62)(25-84)(26-86)(27-64)(28-64)(29-113)(30-74)(31-92)(32-62)(33-64)(34-68)(35-90)(36-91)(37-93)(38-95)(39-96)(40-94)(41-88)(42-98)(43-100)(44-97)(45-101)(46-102)(47-104)(48-103)(49-107)(50-108)(51-99)(52-106)(53-105)(54-89)(55-62)(56-63)(57-112)(58-63)(59-109)(60-63)(61-109)(62-112)(63-112)(64-113)(65-67)(65-115)(66-67)(66-69)(68-74)(68-110)(69-72)(70-71)(70-75)(71-73)(72-115)(73-116)(74-111)(75-78)(76-77)(76-81)(77-79)(78-116)(79-83)(80-82)(80-85)(81-117)(82-84)(83-117)(84-87)(85-118)(86-90)(86-94)(87-118)(88-98)(88-100)(89-92)(89-110)(90-91)(91-119)(92-111)(93-94)(93-119)(95-98)(95-120)(96-100)(96-120)(97-101)(97-121)(99-101)(99-103)(102-103)(102-121)(104-107)(104-122)(105-108)(105-122)(106-107)(106-108)(109-110)(109-112)(111-113)(113-114)(114-125)(114-126)(115-127)(116-127)(117-128)(118-128)(119-129)(120-129)(121-130)(122-130)(123-127)(123-128)(124-129)(124-130)(127-131)(128-131)(129-131)(130-131)
Measurements (4)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HepG2 | 5 | — | 10.5935/0103-5053.20150161 | 2015 |
| GM07492A | 6 | — | 10.5935/0103-5053.20150161 | 2015 |
| MO59J | 6.5 | — | 10.5935/0103-5053.20150161 | 2015 |
| MCF-7 | 9 | — | 10.5935/0103-5053.20150161 | 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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