Bioactivity Information

Brief Information of the Compound and Protein

Compound Name

Compound Info

(4R,4aS,7aR,12bS)-3-allyl-4a,9-dihydroxy-2,4,5,6,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one;hydrochloride

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PubChem ID

CID: 5284596

SID: 16463984

Canonical SMILES	Oc1ccc2C[C@H]3N(CC=C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O Show/Hide
Compound Formula	C19H21NO4

Compound Structure

Protein Name

Protein Info

Kappa-type opioid receptor

Protein Classification

Membrane receptor

Family A G protein-coupled receptor

Peptide receptor (family A GPCR)

Short peptide receptor (family A GPCR)

Opioid receptor

Uniprot ID

P41145

Gene Name

OPRK1

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)	9
1	EC50 = 10 nM	TI LI LO TS
2	IC50 = 320 nM	TI LI LO TS
3	Ki = 0.25 nM	TI LI LO TS
4	Ki = 1.1 nM	TI LI LO TS
5	Ki = 1.2 nM	TI LI LO TS
6	Ki = 3 nM	TI LI LO TS
7	Ki = 4.467 nM	TI LI LO TS
8	Ki = 9.2 nM	TI LI LO TS
9	Ki = 10.7 nM	TI LI LO TS
CL000006	HEK293 Cell Line Info	Homo sapiens (Human)	4
1	Ki = 1.2 nM	TI LI LO TS
2	Ki = 14.7 nM	TI LI LO TS
3	Ki = 15 nM	TI LI LO TS
4	Ki = 362 nM	TI LI LO TS

Biochemical Assays