Brief Information of the Compound and Protein
Compound Name
[(1R,3R,6R,8R,9R,10R,15R,17R,18R)-8,17-bis(6-aminopurin-9-yl)-9,18-difluoro-12-hydroxy-3,12-dioxo-2,4,7,11,13,16-hexaoxa-3lambda5,12lambda5-diphosphatricyclo[13.3.0.06,10]octadecan-3-yl]oxymethyl 2-ethylbutanoate
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PubChem ID
CID: 166633645
Canonical SMILES
CCC(CC)C(=O)OCO[P@]1(=O)OC[C@H]2O[C@H]([C@H](F)[C@@H]2OP(O)(=O)OC[C@H]2O[C@H]([C@H](F)[C@@H]2O1)n1cnc2c(N)ncnc12)n1cnc2c(N)ncnc12
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Compound Formula C27H34F2N10O12P2
Compound Structure
Protein Name
Stimulator of interferon genes protein
Protein Classification
Unclassified protein
Uniprot ID
Q86WV6
Gene Name
STING1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T Homo sapiens (Human)  2
1
EC50 = 450 nM
   TI
   LI
   LO
   TS
2
EC50 = 1360 nM
   TI
   LI
   LO
   TS
CL000494 THP1-Dual Homo sapiens (Human)  2
1
EC50 = 150 nM
   TI
   LI
   LO
   TS
2
EC50 = 970 nM
   TI
   LI
   LO
   TS