Brief Information of the Compound and Protein
Compound Name
(5aR,5bS,7aS,10aS,10bR)-5a,7a-dimethyl-8-(pyridin-3-yl)-3,4,5,5a,5b,6,7,7a,10,10a,10b,11-dodecahydro-2H-spiro[cyclopenta[5,6]naphtho[1,2-d]azepine-12,1'-cyclopropan]-2-one
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PubChem ID
CID: 68087487
Canonical SMILES
C[C@]12CCNC(=O)C=C1C1(CC1)C[C@@H]1[C@@H]2CC[C@]2(C)C(c3cccnc3)=CC[C@@H]12
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Compound Formula C26H32N2O
Compound Structure
Protein Name
Steroid 17-alpha-hydroxylase/17,20 lyase
Protein Classification
Enzyme
>
Cytochrome P450
>
Cytochrome P450 family 17
>
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
CL000263 NCI-H295R Homo sapiens (Human)  1
1
IC50 <= 15 nM
   TI
   LI
   LO
   TS