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372495-52-8

372495-52-8 Structure

372495-52-8 Structure
IdentificationBack Directory
[Name]

4-(8-(piperazin-1-yl)-1,2,3,4-tetrahydro-[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-5-yl)morpholine
[CAS]

372495-52-8
[Synonyms]

UNC10201652
4-(8-(piperazin-1-yl)-1,2,3,4-tetrahydro-[1,2,3]triazino[4',5':4,5]thieno[2,3-c]isoquinolin-5-yl)morpholine
[1,2,3]Triazino[4',5':4,5]thieno[2,3-c]isoquinoline, 1,2,3,4-tetrahydro-5-(4-morpholinyl)-8-(1-piperazinyl)-
[Molecular Formula]

C20H25N7OS
[MOL File]

372495-52-8.mol
[Molecular Weight]

411.524
Chemical PropertiesBack Directory
[Boiling point ]

723.7±70.0 °C(Predicted)
[density ]

1.378±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO: 2mg/mL, clear
[form ]

Solid
[pka]

8.01±0.10(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Uses]

UNC10201652 is a potent Loop 1 (L1)-specific gut bacterial β-glucuronidase (GUSs) inhibitor with an IC50 value of 0.117 μM for E. coli GUS. UNC10201652 can block SN-38 glucuronide.html" class="link-product" target="_blank">SN-38 glucuronide (HY-126373) processing only in individuals whose fecal gut microbiota is highly abundant in L1 GUS enzymes[1][2].
[References]

[1] Jariwala PB, et al. Discovering the Microbial Enzymes Driving Drug Toxicity with Activity-Based Protein Profiling. ACS Chem Biol. 2020 Jan 17;15(1):217-225. DOI:10.1021/acschembio.9b00788
[2] Pellock SJ, et al. Gut Microbial β-Glucuronidase Inhibition via Catalytic Cycle Interception. ACS Cent Sci. 2018 Jul 25;4(7):868-879. DOI:10.1021/acscentsci.8b00239
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