Brief Information of the Compound and Protein
Compound Name
(2S,5S,6S,10R,11S)-5-Benzyl-10-heptyl-6-hydroxy-2-isopropyl-4,11-dimethyl-1,9-dioxa-4-aza-cyclododecane-3,8,12-trione
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PubChem ID
CID: 71717292
Canonical SMILES
CCCCCCC[C@H]1OC(=O)CC(O)[C@H](Cc2ccccc2)N(C)C(=O)[C@H](C(C)C)OC(=O)[C@H]1C
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Compound Formula C28H43NO6
Compound Structure
Protein Name
ATP-dependent translocase ABCB1
Protein Classification
Transporter
>
Primary active transporter
>
ATP-binding cassette
>
ABCB subfamily
Uniprot ID
P08183
Gene Name
ABCB1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL001059 P388/VMDRC.04 Mus musculus (Mouse)  2
1
IC50 = 5800 nM
   TI
   LI
   LO
   TS
2
IC50 = 31300 nM
   TI
   LI
   LO
   TS