BiologicalActivity
PotentandselectiveGPERagonist(Ki=11nM,EC50=2nM);displaysnoactivityatERαandERβatconcentrationsupto10μM.IncreasescytosolicCa2+andinhibitsmigrationofSKBr3cellsandMCF-7cellsinresponsetochemoattractants(IC50valuesare0.7and1.6nMrespectively)invitro.BlocksMCF-1cellcycleprogressionattheG1phase.DisplaystherapeuticeffectsinthemouseEAEmodelofmultiplesclerosis.
TechnicalData
| M.Wt | 412.28 |
| Formula | C21H18BrNO3 |
| Storage | Storeat-20°C |
| Purity | ≥98%(HPLC) |
| CASNumber | 881639-98-1 |
| PubChemID | 5322399 |
| InChIKey | VHSVKVWHYFBIFJ-HKZYLEAXSA-N |
| Smiles | CC(C5=CC([C@@]4([H])[C@@]([H])3CC=C4)=C(C=C5)N[C@H]3[C@]1=CC(OCO2)=C2C=C1Br)=O |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 41.23 | 100 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight412.28.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 2.43mL | 12.13mL | 24.26mL |
| 5mM | 0.49mL | 2.43mL | 4.85mL |
| 10mM | 0.24mL | 1.21mL | 2.43mL |
| 50mM | 0.05mL | 0.24mL | 0.49mL |
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