Info
| ID | 4229 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 1 |
| Donor atoms | {"N": 3, "P": 2} |
| Abbreviation | 11Ru |
| SMILES | CCCCCCCC(=O)OCC1OC(n2cc(C)c(=O)n(Cc3ccc(C#N)cc3)c2=O)CC1OC(=O)CCCCCCC.c1cc[cH-]c1.c1ccc(P(CCP(c2ccccc2)c2ccccc2)c2ccccc2)cc1 |
TUCAN
C65H76N3O7P2Ru/(1-120)(2-136)(3-80)(4-84)(5-81)(6-90)(7-82)(8-91)(9-112)(10-86)(11-87)(12-92)(13-99)(14-101)(15-83)(16-104)(17-105)(18-136)(19-85)(20-88)(21-137)(22-94)(23-120)(24-110)(25-77)(26-119)(27-109)(28-117)(29-118)(30-129)(31-128)(32-127)(33-127)(34-98)(35-108)(36-79)(37-79)(38-79)(39-128)(40-114)(41-97)(42-126)(43-132)(44-114)(45-117)(46-118)(47-119)(48-109)(49-110)(50-77)(51-77)(52-116)(53-116)(54-111)(55-112)(56-111)(57-113)(58-89)(59-95)(60-93)(61-137)(62-100)(63-103)(64-115)(65-78)(66-96)(67-78)(68-115)(69-78)(70-106)(71-102)(72-113)(73-130)(74-121)(75-121)(76-107)(77-110)(78-113)(79-123)(80-84)(80-138)(81-84)(81-86)(82-86)(82-138)(83-87)(83-139)(85-92)(85-139)(87-90)(88-94)(88-140)(89-95)(89-140)(90-92)(91-94)(91-95)(93-96)(93-141)(96-103)(97-98)(97-124)(98-122)(99-101)(99-104)(100-102)(100-141)(101-105)(102-103)(104-106)(105-106)(107-108)(107-124)(108-122)(109-110)(109-119)(111-112)(111-116)(112-120)(113-115)(114-117)(114-134)(115-116)(117-118)(118-119)(120-135)(121-130)(121-132)(122-125)(123-126)(123-131)(124-127)(125-142)(126-144)(127-143)(128-129)(128-150)(129-130)(129-149)(130-151)(131-143)(131-147)(132-144)(132-149)(133-143)(133-144)(133-146)(134-145)(134-150)(135-148)(135-151)(136-137)(136-152)(137-153)(138-152)(139-152)(140-153)(141-153)(149-154)(150-154)(151-154)(152-154)(153-154)
Measurements (1)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HCT-116 | 6 | — | 10.1039/c8nj04515a | 2019 |
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.
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