Info
| ID | 976 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 6, "S": 1} |
| Abbreviation | Ru2 |
| SMILES | C[C@@H]1CC[C@]2(C(=O)N3CCN(C(=S)[S-])CC3)CC[C@]3(C)C(=CCC4[C@@]5(C)CC[C@H](O)C(C)(C)C5CC[C@]43C)C2[C@H]1C.c1cnc2c(c1)ccc1cccnc12.c1cnc2c(c1)ccc1cccnc12 |
TUCAN
C59H71N6O2RuS2/(1-99)(2-107)(3-85)(4-86)(5-116)(6-80)(7-74)(8-117)(9-98)(10-93)(11-108)(12-82)(13-98)(14-74)(15-79)(16-87)(17-76)(18-74)(19-81)(20-128)(21-99)(22-120)(23-97)(24-92)(25-91)(26-75)(27-78)(28-110)(29-100)(30-100)(31-75)(32-75)(33-121)(34-97)(35-72)(36-72)(37-121)(38-72)(39-120)(40-122)(41-78)(42-78)(43-122)(44-92)(45-106)(46-123)(47-123)(48-73)(49-88)(50-94)(51-76)(52-76)(53-94)(54-73)(55-118)(56-89)(57-95)(58-95)(59-73)(60-83)(61-119)(62-109)(63-77)(64-77)(65-77)(66-93)(67-90)(68-84)(69-96)(70-96)(71-138)(72-106)(73-111)(74-107)(75-112)(76-115)(77-115)(78-114)(79-80)(79-101)(80-116)(81-82)(81-102)(82-117)(83-89)(83-118)(84-90)(84-119)(85-86)(85-101)(86-102)(87-88)(87-104)(88-105)(89-104)(90-105)(91-100)(91-103)(92-97)(92-106)(93-94)(93-111)(94-109)(95-96)(95-112)(96-113)(97-113)(98-99)(98-128)(99-114)(100-110)(101-124)(102-125)(103-108)(103-112)(104-126)(105-127)(106-107)(107-108)(108-113)(109-114)(109-115)(110-111)(110-114)(111-112)(113-129)(115-128)(116-133)(117-134)(118-135)(119-136)(120-121)(120-131)(121-132)(122-123)(122-132)(123-131)(124-125)(124-133)(125-134)(126-127)(126-135)(127-136)(128-138)(129-132)(129-137)(130-131)(130-139)(130-140)(133-141)(134-141)(135-141)(136-141)(138-141)
Measurements (6)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| MGC-803 | 0.73 | — | 10.1093/mtomcs/mfac072 | 2022 |
| T24 | 0.99 | — | 10.1093/mtomcs/mfac072 | 2022 |
| MDA-MB-231 | 1.9 | — | 10.1093/mtomcs/mfac072 | 2022 |
| HepG2 | 2.1 | — | 10.1093/mtomcs/mfac072 | 2022 |
| CNE-2 | 2.4 | — | 10.1093/mtomcs/mfac072 | 2022 |
| MCF-7 | 3.2 | — | 10.1093/mtomcs/mfac072 | 2022 |
🧬 Cell Death Types (1)
Necroptosis
high
«Mitochondrial swelling resulted in vacuolization, which induced vacuolation-associated cell death and necroptosis with the formation of necrosomes (RIP1-RIP3) and the uptake of propidium iodide.»
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.
Loading source metadata…
The generated SVG will appear here. The legacy ligand image above stays visible for side-by-side review.