Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(1R,4aS,10aR)-N-[(2S)-1-(4-methoxyanilino)-1-oxo-3-phenylpropan-2-yl]-6-[[(2S)-1-(4-methoxyanilino)-1-oxo-3-phenylpropan-2-yl]sulfamoyl]-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthrene-1-carboxamide
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 PubChem ID
CID: 145966162
Canonical SMILES
COc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@]2(C)CCC[C@@]3(C)[C@H]2CCc2cc(C(C)C)c(cc32)S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccc(OC)cc2)cc1
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Compound Formula C52H60N4O7S
Compound Structure
Protein Name
 Protein Info 
Matrix metalloproteinase-9
Protein Classification
Enzyme
>
Protease
>
Metallo protease
>
Metallo protease MAM clan
>
Metallo protease M10A subfamily
Uniprot ID
P14780
Gene Name
MMP9
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  1
1
IC50 = 54600 nM
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