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Complex #4461 — Ru(2) [1]

2D Structure

Structure
⬇ MOL V3000

Info

ID4461
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 2, "N": 2, "P": 2}
Abbreviation1
SMILESCc1ccc([O-])c(/N=N/c2[c-]c3c(cc2)OCO3)c1.[C-]#[O+].c1ccc(P(c2ccccc2)c2ccccc2)cc1.c1ccc(P(c2ccccc2)c2ccccc2)cc1

TUCAN

C51H40N2O4P2Ru/(1-46)(2-44)(3-52)(4-45)(5-48)(6-43)(7-47)(8-49)(9-58)(10-50)(11-55)(12-41)(13-77)(14-74)(15-51)(16-76)(17-53)(18-54)(19-56)(20-57)(21-60)(22-61)(23-59)(24-66)(25-73)(26-67)(27-62)(28-41)(29-41)(30-63)(31-65)(32-68)(33-69)(34-70)(35-75)(36-71)(37-72)(38-64)(39-85)(40-85)(41-78)(42-80)(42-84)(43-44)(43-46)(44-86)(45-47)(45-86)(46-47)(48-50)(48-87)(49-53)(49-87)(50-52)(51-76)(51-78)(52-53)(54-55)(54-58)(55-88)(56-58)(56-61)(57-60)(57-62)(59-60)(59-63)(61-88)(62-89)(63-89)(64-78)(64-79)(65-66)(65-90)(66-73)(67-68)(67-73)(68-90)(69-70)(69-91)(70-75)(71-72)(71-75)(72-91)(74-77)(74-80)(76-83)(77-82)(79-83)(79-93)(80-92)(81-95)(82-84)(82-97)(83-94)(84-96)(85-96)(85-97)(86-98)(87-98)(88-98)(89-99)(90-99)(91-99)(92-93)(92-100)(93-100)(96-100)(97-100)(98-100)(99-100)

Measurements (3)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa4.2— 10.1021/acs.inorgchem.0c02563 2020
HT-294.3— 10.1021/acs.inorgchem.0c02563 2020
NIH-3T36.6— 10.1021/acs.inorgchem.0c02563 2020

🧬 Cell Death Types (1)

Apoptosis high
«All three complexes induce cell death by apoptosis, as indicated by nuclear damage (fluorescence microscopy after staining with Hoechst dye).»

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.

experimental validation surface
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