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2369030-41-9

2369030-41-9 Structure

2369030-41-9 Structure
IdentificationBack Directory
[Name]

(3E,5E)-3,5-Bis[[3-(trifluoromethyl)phenyl]methylene]-4-piperidinone
[CAS]

2369030-41-9
[Synonyms]

ROS-generating agent 1
3,5-Bis((E)-3-(trifluoromethyl)benzylidene)piperidin-4-one
(3E,5E)-3,5-Bis[[3-(trifluoromethyl)phenyl]methylene]-4-piperidinone
[Molecular Formula]

C21H15F6NO
[MOL File]

2369030-41-9.mol
[Molecular Weight]

411.34
Chemical PropertiesBack Directory
[Boiling point ]

506.3±50.0 °C(Predicted)
[density ]

1.363±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
[form ]

Solid
[pka]

5.42±0.20(Predicted)
[color ]

Light yellow to yellow
Hazard InformationBack Directory
[Uses]

ROS-generating agent 1 (Compound 2c) covalently modifies the Sec-498 residue of TrxR to generate ROS. ROS-generating agent 1 reduces intracellular TrxR protein level. ROS-generating agent 1 results in ROS-dependent apoptosis and ferroptosis of NCI-H460 cells. ROS-generating agent 1 has anti-cancer activities[1].
[References]

[1] Liu X, et al. Tumor killing by a dietary curcumin mono-carbonyl analog that works as a selective ROS generator via TrxR inhibition. Eur J Med Chem. 2023 Mar 15;250:115191. DOI:10.1016/j.ejmech.2023.115191
Spectrum DetailBack Directory
[Spectrum Detail]

(3E,5E)-3,5-Bis[[3-(trifluoromethyl)phenyl]methylene]-4-piperidinone(2369030-41-9)1HNMR
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