Brief Information of the Compound and Protein
Compound Name
[(3R,10R,13S)-3-Hydroxy-10,13-dimethyl-1,2,3,4,7,8,9,10,11,12,13,14,15,16-tetradecahydro-cyclopenta[a]phenanthren-(17E)-ylidene]-acetaldehyde oxime
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PubChem ID
CID: 71458002
Canonical SMILES
C[C@]12CC[C@@H](O)CC1=CC[C@@H]1[C@@H]2CC[C@]2(C)/C(=C\C=N\O)CC[C@@H]12
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Compound Formula C21H31NO2
Compound Structure
Protein Name
Steroid 17-alpha-hydroxylase/17,20 lyase
Protein Classification
Enzyme
>
Cytochrome P450
>
Cytochrome P450 family 17
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Cytochrome P450 family 17A
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Cytochrome P450 17A1
Uniprot ID
P05093
Gene Name
CYP17A1
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 = 320 nM
   TI
   LI
   LO
   TS