Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(6aR,9R)-N-[(1S,2S,4R,7S)-2-hydroxy-7-(2-methylpropyl)-5,8-dioxo-4-propan-2-yl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide
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 PubChem ID
CID: 134551
SID: 15232779
Canonical SMILES
CC(C)C[C@@H]1N2C(=O)[C@](NC(=O)[C@H]3CN(C)[C@@H]4Cc5c[nH]c6cccc(C4=C3)c56)(O[C@@]2(O)[C@@H]2CCCN2C1=O)C(C)C
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Compound Formula C32H41N5O5
Compound Structure
Protein Name
 Protein Info 
Cytochrome P450 3A4
Protein Classification
Enzyme
>
Cytochrome P450
>
Cytochrome P450 family 3
>
Cytochrome P450 family 3A
>
Cytochrome P450 3A4
Uniprot ID
P08684
Gene Name
CYP3A4
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4
 Cell Line Info 
Trichoplusia ni (Cabbage looper)  1
1
IC50 = 600 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Potency = 1000 nM