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345222-92-6

345222-92-6 Structure

345222-92-6 Structure
IdentificationBack Directory
[Name]

3-[(Aminosulfonyl)oxy]-7,8,9,10,11,12,13,14-octahydro-6H-benzo[b]cyclodeca[d]pyran-6-one
[CAS]

345222-92-6
[Synonyms]

3-[(Aminosulfonyl)oxy]-7,8,9,10,11,12,13,14-octahydro-6H-benzo[b]cyclodeca[d]pyran-6-one
[Molecular Formula]

C17H21NO5S
[MOL File]

345222-92-6.mol
[Molecular Weight]

351.42
Chemical PropertiesBack Directory
[Melting point ]

183-185 °C(Solvent: Tetrahydrofuran ; Hexane)
[Boiling point ]

567.4±60.0 °C(Predicted)
[density ]

1.36±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
[pka]

8.27±0.70(Predicted)
Hazard InformationBack Directory
[Uses]

Steroid sulfatase-IN-8 (7) is a STS inhibitor with PM IC50 value of 1 nM, JEG-3 IC50 of 0.025 nM, respecively[1].
[References]

[1] L W Lawrence Woo, et al. Structure-activity relationship for the first-in-class clinical steroid sulfatase inhibitor Irosustat (STX64, BN83495). ChemMedChem. 2011 Nov 4;6(11):2019-34. DOI:10.1002/cmdc.201100288
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