Brief Information of the Compound and Protein
Compound Name
 Compound Info 
[(1R)-1-[(3S,8S,9R,10R,12R,13R,14R,17S)-8,14,17-trihydroxy-10,13-dimethyl-3-[(E)-3-(4-nitrophenyl)prop-2-enoyl]oxy-12-[(E)-3-phenylprop-2-enoyl]oxy-1,2,3,4,7,9,11,12,15,16-decahydrocyclopenta[a]phenanthren-17-yl]ethyl] pyridine-3-carboxylate
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 PubChem ID
CID: 137646359
Canonical SMILES
C[C@@H](OC(=O)c1cccnc1)[C@]1(O)CC[C@@]2(O)[C@]1(C)[C@@H](C[C@@H]1[C@@]3(C)CC[C@@H](CC3=CC[C@@]21O)OC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)OC(=O)\C=C\c1ccccc1
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Compound Formula C45H48N2O11
Compound Structure
Protein Name
 Protein Info 
Toll-like receptor 4
Protein Classification
Membrane receptor
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Toll-like and Il-1 receptors
Uniprot ID
O00206
Gene Name
TLR4
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000192 AD-293
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 14000 nM
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