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Complex #164 — Ru(2) [Ru6]

2D Structure

Structure
⬇ MOL V3000

Info

ID164
MetalRu
Oxidation state2
Charge1
Donor atoms{"N": 2}
AbbreviationRu6
SMILESCc1c(C)c(C)c(Cn2[c-][n+](C3=NC4C=CC=CC4S3)cc2)c(C)c1C.Cc1ccc(C(C)C)cc1.[Cl-]

TUCAN

C32H39N3RuS/(1-53)(2-70)(3-65)(4-45)(5-64)(6-40)(7-40)(8-40)(9-41)(10-50)(11-41)(12-42)(13-43)(14-41)(15-48)(16-51)(17-49)(18-66)(19-52)(20-67)(21-67)(22-68)(23-43)(24-43)(25-55)(26-42)(27-42)(28-54)(29-44)(30-45)(31-45)(32-47)(33-47)(34-44)(35-46)(36-44)(37-47)(38-46)(39-46)(40-64)(41-64)(42-56)(43-57)(44-61)(45-60)(46-62)(47-63)(48-50)(48-60)(49-51)(49-60)(50-59)(51-59)(52-53)(52-70)(53-54)(54-55)(55-68)(56-57)(56-58)(57-62)(58-63)(58-67)(59-64)(61-62)(61-63)(65-66)(65-73)(66-72)(67-73)(68-70)(68-74)(69-72)(69-73)(70-75)(71-72)(71-74)(71-75)(74-76)(75-76)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
A27802 10.1016/j.ejmech.2020.112605 2020
HT-293.2 10.1016/j.ejmech.2020.112605 2020
LoVo12 10.1016/j.ejmech.2020.112605 2020
HCT-11613 10.1016/j.ejmech.2020.112605 2020
A54920 10.1016/j.ejmech.2020.112605 2020
HeLa23 10.1016/j.ejmech.2020.112605 2020

🧬 Cell Death Types (1)

Apoptosis high
«Ru4 and Ru6 complexes induced apoptosis in a caspase-dependent manner, primarily through intracellular reactive oxygen species (ROS) overproduction and cell cycle arrest at G1 phase.»

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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