home← all complexes D-MPNN

Complex #916 — Ru(2) [5b]

2D Structure

Structure
⬇ MOL V3000

Info

ID916
MetalRu
Oxidation state2
Charge0
Donor atoms{"N": 2}
Abbreviation5b
SMILESCC(=O)OC[C@H]1O[C@@H](CCC/N=C/C=N/CCC[C@@H]2O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]2OC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O.Cc1c(C)c(C)[c-](C)c1C.[Cl-]

TUCAN

C46H67N2O18Ru/(1-82)(2-76)(3-68)(4-74)(5-74)(6-68)(7-99)(8-79)(9-79)(10-102)(11-73)(12-73)(13-73)(14-94)(15-79)(16-74)(17-68)(18-75)(19-75)(20-69)(21-76)(22-92)(23-78)(24-69)(25-81)(26-69)(27-78)(28-70)(29-96)(30-70)(31-75)(32-70)(33-76)(34-82)(35-98)(36-71)(37-81)(38-71)(39-100)(40-71)(41-94)(42-72)(43-78)(44-72)(45-97)(46-72)(47-80)(48-95)(49-80)(50-80)(51-95)(52-84)(53-83)(54-104)(55-105)(56-83)(57-84)(58-92)(59-103)(60-77)(61-93)(62-77)(63-90)(64-101)(65-91)(66-77)(67-93)(68-85)(69-86)(70-87)(71-88)(72-89)(73-106)(74-107)(75-112)(76-108)(77-109)(78-110)(79-111)(80-113)(81-82)(81-97)(82-92)(83-84)(83-93)(84-105)(85-86)(85-87)(86-88)(87-89)(88-89)(90-91)(90-114)(91-115)(92-114)(93-115)(94-96)(94-129)(95-104)(95-132)(96-100)(96-124)(97-99)(97-124)(98-99)(98-100)(98-127)(99-125)(100-126)(101-103)(101-104)(101-128)(102-103)(102-105)(102-130)(103-131)(104-133)(105-133)(106-118)(106-127)(107-117)(107-125)(108-116)(108-126)(109-122)(109-128)(110-120)(110-131)(111-121)(111-129)(112-119)(112-130)(113-123)(113-132)(114-134)(115-134)

Measurements (4)

Cell lineIC₅₀ dark (µM)IC₅₀ light (µM)DOIYear
HEK29322 10.1002/aoc.5896 2020
A278029 10.1002/aoc.5896 2020
SK-OV-343 10.1002/aoc.5896 2020
MDA-MB-231 10.1002/aoc.5896 2020