Info
| ID | 6919 |
| Metal | Rh |
| Oxidation state | 3 |
| Charge | 1 |
| Donor atoms | {"O": 1, "N": 1} |
| Abbreviation | 3 |
| SMILES | COc1ccc(/C=C/C(=O)/C=C([O-])/C=C/c2ccc(OC)c(OC)c2)cc1OC.Cc1c(C)c(C)[c-](C)c1C.c1ccncc1 |
TUCAN
C38H43NO6Rh/(1-44)(2-49)(3-44)(4-73)(5-44)(6-50)(7-45)(8-73)(9-45)(10-73)(11-51)(12-45)(13-70)(14-46)(15-71)(16-46)(17-75)(18-75)(19-53)(20-59)(21-60)(22-74)(23-58)(24-61)(25-62)(26-54)(27-56)(28-57)(29-55)(30-46)(31-47)(32-72)(33-47)(34-72)(35-47)(36-72)(37-48)(38-75)(39-52)(40-48)(41-48)(42-74)(43-74)(44-63)(45-64)(46-65)(47-67)(48-68)(49-50)(49-70)(50-51)(51-71)(52-66)(52-77)(53-54)(53-76)(54-69)(55-69)(55-81)(56-57)(56-69)(57-78)(58-78)(58-80)(59-60)(59-66)(60-79)(61-62)(61-80)(62-66)(63-64)(63-65)(64-67)(65-68)(67-68)(70-82)(71-82)(72-86)(73-87)(74-88)(75-85)(76-81)(76-85)(77-79)(77-87)(78-83)(79-88)(80-84)(81-86)(82-89)(88-89)
Measurements (3)
| Cell line | IC₅₀ dark (µM) | IC₅₀ light (µM) | DOI | Year |
| SK-OV-3 | 34 | 4.3 | 10.1016/j.pdpdt.2020.102049 | 2020 |
| HeLa | 70 | 15 | 10.1016/j.pdpdt.2020.102049 | 2020 |
| HepG2 | 93 | 7.5 | 10.1016/j.pdpdt.2020.102049 | 2020 |
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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