Info
| ID | 1103 |
| Metal | Ru |
| Oxidation state | 2 |
| Charge | 2 |
| Donor atoms | {"N": 6} |
| Abbreviation | [Ru(L1)2]2+ |
| SMILES | c1ccc(-c2cccc(-c3nc(-c4cccc(-c5cccc(-c6cccc(-c7csc(-c8cccc(-c9ccccn9)n8)n7)c6)c5)c4)cs3)n2)nc1.c1ccc(-c2cccc(-c3nc(-c4cccc(-c5cccc(-c6cccc(-c7csc(-c8cccc(-c9ccccn9)n8)n7)c6)c5)c4)cs3)n2)nc1 |
TUCAN
C88H56N12RuS4/(1-98)(2-69)(3-62)(4-90)(5-66)(6-101)(7-103)(8-72)(9-70)(10-71)(11-81)(12-100)(13-118)(14-57)(15-137)(16-83)(17-94)(18-59)(19-97)(20-65)(21-87)(22-68)(23-82)(24-117)(25-61)(26-86)(27-102)(28-76)(29-79)(30-140)(31-89)(32-119)(33-92)(34-78)(35-74)(36-96)(37-95)(38-104)(39-120)(40-73)(41-138)(42-93)(43-63)(44-58)(45-75)(46-85)(47-80)(48-91)(49-60)(50-84)(51-67)(52-88)(53-139)(54-64)(55-99)(56-77)(57-82)(57-110)(58-82)(58-112)(59-85)(59-92)(60-86)(60-111)(61-84)(61-87)(62-83)(62-105)(63-105)(63-106)(64-86)(64-113)(65-91)(65-119)(66-93)(66-131)(67-93)(67-130)(68-91)(68-132)(69-94)(69-104)(70-95)(70-136)(71-96)(71-133)(72-96)(72-120)(73-100)(73-109)(74-107)(74-108)(75-97)(75-116)(76-95)(76-135)(77-99)(77-102)(78-100)(78-114)(79-98)(79-101)(80-97)(80-115)(81-115)(81-116)(83-89)(84-121)(85-117)(87-122)(88-110)(88-112)(89-106)(90-111)(90-113)(92-125)(94-129)(98-107)(99-118)(101-108)(102-126)(103-109)(103-114)(104-127)(105-113)(106-112)(107-115)(108-114)(109-134)(110-124)(111-123)(116-128)(117-146)(118-152)(119-153)(120-154)(121-132)(121-148)(122-143)(122-148)(123-139)(123-145)(124-137)(124-155)(125-131)(125-146)(126-135)(126-152)(127-133)(127-151)(128-140)(128-150)(129-144)(129-151)(130-141)(130-149)(131-149)(132-153)(133-154)(134-138)(134-156)(135-147)(136-142)(136-147)(137-158)(138-160)(139-157)(140-159)(141-155)(141-158)(142-156)(142-160)(143-145)(143-157)(144-150)(144-159)(153-161)(154-161)(155-161)(156-161)(159-161)(160-161)
Measurements (2)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| HCT-116 p53+/+ | 9.9 | — | 10.1002/anie.201805510 | 2018 |
| HCT-116 p53-/- | 12 | — | 10.1002/anie.201805510 | 2018 |
🧬 Cell Death Types (1)
Apoptosis
high
«Helicate 1a was found to induce cell death by apoptosis in both HCT116 p53+/+ and p53-/- cancer cells.»
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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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