Brief Information of the Compound and Protein
Compound Name
(1R,3S,Z)-5-((E)-2-((1R,3aS,7aR)-1-((S)-1-(2-(6,6-dimethylcyclohex-1-enyl)allyloxy)propan-2-yl)-7a-methyl-octahydroinden-4-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol
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PubChem ID
CID: 44436706
Canonical SMILES
C[C@H](COCC(=C)C1=CCCCC1(C)C)[C@H]1CC[C@H]2\C(CCC[C@]12C)=C\C=C1\C[C@@H](O)C[C@H](O)C1=C
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Compound Formula C33H50O3
Compound Structure
Protein Name
Vitamin D3 receptor
Protein Classification
Transcription factor
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Nuclear receptor
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Nuclear hormone receptor subfamily 1
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Nuclear hormone receptor subfamily 1 group I
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Nuclear hormone receptor subfamily 1 group I member 1
Uniprot ID
P11473
Gene Name
VDR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000109 COS-1 Chlorocebus aethiops (Green monkey)  1
1
IC50 = 300 nM
   TI
   LI
   LO
   TS
CL000994 ROS 17/2.8 Rattus norvegicus (Rat)  1
1
ED50 = 52 nM
   TI
   LI
   LO
   TS