Brief Information of the Compound and Protein
Compound Name
(3R,5S,8R,9R,10S,13S,14S)-3-[[2,5-dimethyl-4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methyl]-3-hydroxy-13-methyl-1,2,4,5,6,7,8,9,10,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
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PubChem ID
CID: 155533452
Canonical SMILES
CC1CN(C(C)CN1C[C@@]1(O)CC[C@H]2[C@@H](CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@H]23)C1)S(=O)(=O)c1ccccc1C(F)(F)F
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Compound Formula C32H45F3N2O4S
Compound Structure
Protein Name
17-beta-hydroxysteroid dehydrogenase type 3
Protein Classification
Enzyme
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Oxidoreductase
Uniprot ID
P37058
Gene Name
HSD17B3
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000141 LNCaP Homo sapiens (Human)  1
1
IC50 = 220 nM
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