GW-870086 is a novel and potent glucocorticoid receptor agonist that has anti-inflammatory properties, and thus can be potentially usef for the treatment of asthma and atopic dermatitis.. It acts as a glucocorticoid receptor agonist with a pIC50 of 10.1 in A549 cells expressing NF-κB.

Physicochemical Properties

Molecular Formula	C31H39F2NO6
Molecular Weight	559.641276597977
Exact Mass	559.275
Elemental Analysis	C, 66.53; H, 7.02; F, 6.79; N, 2.50; O, 17.15
CAS #	827319-43-7
PubChem CID	11376392
Appearance	White to off-white solid powder
LogP	4.582
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	6
Heavy Atom Count	40
Complexity	1280
Defined Atom Stereocenter Count	9
SMILES	O([C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(C=C[C@]4(C)[C@]3([C@H](C[C@]12C)O)F)=O)C(=O)OCC#N)C(C1C(C)(C)C1(C)C)=O
InChi Key	WUBKGTSFJSEIEM-NSHBDUGJSA-N
InChi Code	InChI=1S/C31H39F2NO6/c1-16-12-18-19-14-21(32)20-13-17(35)8-9-28(20,6)30(19,33)22(36)15-29(18,7)31(16,25(38)39-11-10-34)40-24(37)23-26(2,3)27(23,4)5/h8-9,13,16,18-19,21-23,36H,11-12,14-15H2,1-7H3/t16-,18+,19+,21+,22+,28+,29+,30+,31+/m1/s1
Chemical Name	Androsta-1,4-diene-17-carboxylic acid, 6,9-difluoro-11-hydroxy-16-methyl-3-oxo-17-(((2,2,3,3-tetramethylcyclopropyl)carbonyl)oxy)-, cyanomethyl ester, (6alpha,11beta,16alpha,17alpha)-
Synonyms	GW-870086; GW-870086X; 870086; GW870086; GW870086X; GW 870086; GW 870086X
HS Tariff Code	2934.99.9001
Storage	Powder-20°C 3 years 4°C 2 years In solvent -80°C 6 months -20°C 1 month
Shipping Condition	Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)

Biological Activity

ln Vitro	The glucocorticoid receptor agonist GW-870086 has a pIC50 of 10.1 and suppresses the NFkB reporter gene; however, it has no effect on the MMTV reporter gene in A549 cells, nor on the progesterone or estrogen receptors. little or nonexistent action at androgen or mineralocorticoid receptors. GW-870086 (1 pM-1 μM) suppresses IL-1-induced L-6 release in MG63 osteosarcoma cells and dose-dependently TNF-α in A549 epithelial cancer cells (pIC50s, 9.6, 10.2)[1]. GW-870086 (GW870086X; 10-100 nM) dramatically boosts the release of fibronectin. GW-870086, however, does not enhance cellular myofibrillar protein or affect MMP2 secretion [2].
References	[1]. Discovery of GW870086: a potent anti-inflammatory steroid with a unique pharmacological profile. Br J Pharmacol. 2013 Jul;169(6):1389-403. [2]. Unique response profile of trabecular meshwork cells to the novel selective glucocorticoid receptor agonist, GW870086X. Invest Ophthalmol Vis Sci. 2013 Mar 1;54(3):2100-7.
Additional Infomation	GW870086X has been investigated for the treatment of ASTHMA.

Solubility Data

Solubility (In Vitro)

DMSO : ~100 mg/mL (~178.69 mM)

Solubility (In Vivo)

Solubility in Formulation 1: ≥ 2.5 mg/mL (4.47 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween80 + 45% Saline (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 400 μL PEG300 and mix evenly; then add 50 μL Tween-80 to the above solution and mix evenly; then add 450 μL normal saline to adjust the volume to 1 mL. Preparation of saline: Dissolve 0.9 g of sodium chloride in 100 mL ddH₂ O to obtain a clear solution. Solubility in Formulation 2: ≥ 2.5 mg/mL (4.47 mM) (saturation unknown) in 10% DMSO + 90% Corn Oil (add these co-solvents sequentially from left to right, and one by one), clear solution. For example, if 1 mL of working solution is to be prepared, you can add 100 μL of 25.0 mg/mL clear DMSO stock solution to 900 μL of corn oil and mix evenly.  (Please use freshly prepared in vivo formulations for optimal results.)

Preparing Stock Solutions		1 mg	5 mg	10 mg
	1 mM	1.7869 mL	8.9343 mL	17.8686 mL
	5 mM	0.3574 mL	1.7869 mL	3.5737 mL
	10 mM	0.1787 mL	0.8934 mL	1.7869 mL

*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles.