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Complex #2693 — Ru(2) [5a]

2D Structure

Structure
⬇ MOL V3000

Info

ID2693
MetalRu
Oxidation state2
Charge0
Donor atoms{"O": 4}
Abbreviation5a
SMILESO=C(O[c-]1c(-c2ccccc2)c2c3ccccc3c3ccccc3c2c1-c1ccccc1)c1ccccc1.[C-]#[O+].[C-]#[O+].[Cl-]

TUCAN

C38ClO4Ru/(1-2)(1-22)(2-21)(3-9)(3-25)(4-5)(4-8)(5-16)(6-9)(6-10)(7-10)(7-25)(8-27)(11-20)(11-30)(12-14)(12-31)(13-14)(13-15)(15-19)(16-24)(17-18)(17-32)(18-20)(19-31)(21-23)(22-33)(23-33)(24-27)(24-29)(25-26)(26-29)(26-37)(27-30)(28-31)(28-34)(28-37)(29-34)(30-32)(32-34)(33-38)(35-39)(36-41)(37-42)(38-40)(38-42)

Measurements (6)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HeLa14— 10.1021/om400234p 2014
HeLa18— 10.1021/om400234p 2014
A278019— 10.1021/om400234p 2014
MCF-723— 10.1021/om400234p 2014
Caco-282— 10.1021/om400234p 2014
A431—— 10.1021/om400234p 2014

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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