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SMILES: [H][C@@]12[C@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)C(=C)[C@@H](CC\C(C)=C\CO)[C@@]1(C)CCC[C@]2(C)C(O)=O

InChI Key: InChIKey=GIZWHSIXXJICSK-NFSQIVDPSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50046954   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Peroxisome proliferator-activated receptor gamma


(Mus musculus)		BDBM50046954
PNG
(CHEMBL3314492)
Show SMILES [H][C@@]12[C@H](OC(=O)c3ccccc3)[C@@H](OC(C)=O)C(=C)[C@@H](CC\C(C)=C\CO)[C@@]1(C)CCC[C@]2(C)C(O)=O |r|
Show InChI InChI=1S/C29H38O7/c1-18(14-17-30)12-13-22-19(2)23(35-20(3)31)24(36-26(32)21-10-7-6-8-11-21)25-28(22,4)15-9-16-29(25,5)27(33)34/h6-8,10-11,14,22-25,30H,2,9,12-13,15-17H2,1,3-5H3,(H,33,34)/b18-14+/t22-,23+,24-,25-,28-,29+/m1/s1
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Article
PubMed
n/an/an/an/a 900n/an/an/an/a



Institute of Chinese Materia Medica

Curated by ChEMBL


Assay Description
Agonist activity at mouse PPARgamma expressed in HEK293 cells co-expressing with Gal4 reporter vector after 24 hrs by dual-luciferase reporter assay

J Nat Prod 77: 1594-600 (2014)


Article DOI: 10.1021/np500150f
BindingDB Entry DOI: 10.7270/Q2D2208C
More data for this
Ligand-Target Pair