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Complex #6030 — Ir(3) [Ir-ART]

2D Structure

Structure
⬇ MOL V3000

Info

ID6030
MetalIr
Oxidation state3
Charge1
Donor atoms{"N": 2}
AbbreviationIr-ART
SMILESCC1CCC2C(C)C(OC(=O)CCC(=O)OCc3ccncc3)OC3CC4CCC1C32OO4.Cc1c(C)c(C)[c-](C)c1C.[c-]1ccccc1-c1ccccn1

TUCAN

C46H56IrN2O7/(1-75)(2-57)(3-57)(4-57)(5-75)(6-66)(7-71)(8-58)(9-58)(10-72)(11-67)(12-58)(13-69)(14-59)(15-59)(16-59)(17-92)(18-65)(19-61)(20-60)(21-102)(22-77)(23-93)(24-61)(25-88)(26-89)(27-78)(28-96)(29-96)(30-76)(31-77)(32-70)(33-78)(34-79)(35-94)(36-79)(37-90)(38-60)(39-60)(40-61)(41-98)(42-62)(43-62)(44-97)(45-62)(46-80)(47-63)(48-80)(49-63)(50-73)(51-74)(52-74)(53-91)(54-63)(55-68)(56-76)(57-81)(58-82)(59-85)(60-90)(61-88)(62-86)(63-87)(64-68)(64-83)(65-66)(65-92)(66-69)(67-71)(67-83)(68-72)(69-95)(70-84)(70-93)(71-72)(73-84)(73-94)(74-75)(74-91)(75-98)(76-77)(76-100)(77-101)(78-79)(78-89)(79-90)(80-97)(80-98)(81-82)(81-85)(82-86)(83-95)(84-96)(85-87)(86-87)(88-89)(88-102)(89-99)(90-91)(91-99)(92-103)(93-104)(94-104)(95-103)(96-107)(97-99)(97-109)(98-111)(99-110)(100-105)(100-107)(101-106)(101-108)(102-108)(102-109)(103-112)(104-112)(110-111)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HCT-1166.4— 10.1039/d4cb00114a 2025
MCF-717— 10.1039/d4cb00114a 2025
A54921— 10.1039/d4cb00114a 2025
HeLa25— 10.1039/d4cb00114a 2025

🧬 Cell Death Types (2)

Autophagy high
«Taken together, Ir-ART mediated autophagic cell death in HCT-116 colon cancer cells.»
Immunogenic Cell Death high
«These results suggested that Ir-ART can be expected to initiate antitumor immune responses by eliciting ICD.»

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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