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IRG1-IN-1

Cat No.:V64189 Purity: ≥98%
IRG1-IN-1 is an itaconic acid analogue.
IRG1-IN-1
IRG1-IN-1 Chemical Structure CAS No.: 2407652-42-8
Product category: Others 12
This product is for research use only, not for human use. We do not sell to patients.
Size Price Stock Qty
5mg
10mg
50mg
Other Sizes
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Product Description
IRG1-IN-1 is an itaconic acid analogue. IRG1-IN-1 inhibits the activity of immune response gene 1 (IRG1). IRG1-IN-1 may be utilized in research on cancer, inflammation, and autoimmune diseases.
Biological Activity I Assay Protocols (From Reference)
ln Vitro
Compound 6 (IRG1-IN-1; 0.5 mM; 2 mM) inhibits the release of TNFα and itaconic acid from human monocyte-derived macrophages (hMDMs) activated by lipopolysaccharide (LPS) [1]. C-IRG1-9 rat glioma cell growth is inhibited by IRG1-IN-1 (0.5 mM; 1 mM)[1]. TCR-activated hCD8+ T cell proliferation is enhanced by IRG1-IN-1 (10 nM)[1]. In CR-activated hCD8+ T cells, IRG1-IN-1(10μM) exhibits a reduction in the trimethylation of histone 3 at lysine 4 (H3K4me3)[1].
ln Vivo
In C57BL/6 mice, IRG1-IN-1 (compound 6) (ip; 0.2 mg/kg; 27 days) exhibits antitumor effect[1].
Cell Assay
Western Blot Analysis[1]
Cell Types: TCR-activated hCD8+ T cells
Tested Concentrations: 10 μM
Incubation Duration: 24-72 h
Experimental Results: diminished protein levels of histone 3 (H3).

Cell Proliferation Assay[1]
Cell Types: C-IRG1-9 rat glioma cells and TCR-activated hCD8+ T cells
Tested Concentrations: 0.5 mM; 1 mM; 10 nM
Incubation Duration: 48- 96 h
Experimental Results: Inhibited the proliferation of C-IRG1-9 rat glioma cells and increased proliferation of TCR-activated hCD8+ T cells.
Animal Protocol
Animal/Disease Models: C57BL/6 mice[1]
Doses: 0.2 mg/kg
Route of Administration: IP; 27 days
Experimental Results: Increased survival of C57BL/6 mice bearing mouse CT26 colorectal tumors. diminished intratumoral frequency of M-MDSCs in tumors.
References
[1]. Adonia Papathanassiu, et al. Compositions and methods of using itaconic acid derivatives. Patent. US20210261495A1.
These protocols are for reference only. InvivoChem does not independently validate these methods.
Physicochemical Properties
Molecular Formula
C18H15FO4
Molecular Weight
314.31
CAS #
2407652-42-8
Appearance
Typically exists as solids (or liquids in special cases) at room temperature
SMILES
C(O)(=O)C(=CC1=CC=C(F)C=C1)C(CC1=CC=CC=C1)C(O)=O
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

Note: Please store this product in a sealed and protected environment (e.g. under nitrogen), avoid exposure to moisture and light.
Shipping Condition
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
Solubility Data
Solubility (In Vitro)
DMSO: 100 mg/mL (318.16 mM)
Solubility (In Vivo)
Solubility in Formulation 1: ≥ 2.5 mg/mL (7.95 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 (7.95 mM) (saturation unknown) in 10% DMSO + 90% (20% SBE-β-CD in 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 900 μL of 20% SBE-β-CD physiological saline solution and mix evenly.
Preparation of 20% SBE-β-CD in Saline (4°C,1 week): Dissolve 2 g SBE-β-CD in 10 mL saline to obtain a clear solution.

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Solubility in Formulation 3: ≥ 2.5 mg/mL (7.95 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 3.1816 mL 15.9079 mL 31.8157 mL
5 mM 0.6363 mL 3.1816 mL 6.3631 mL
10 mM 0.3182 mL 1.5908 mL 3.1816 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.

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What is the mass of compound required to make a 10 mM stock solution in 5 ml of DMSO given that the molecular weight of the compound is 350.26 g/mol?
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  • The answer of 17.513 mg appears in the Mass box. In a similar way, you may calculate the volume and concentration.

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What volume of a given 10 mM stock solution is required to make 25 ml of a 25 μM solution?
Using the equation C1V1 = C2V2, where C1=10 mM, C2=25 μM, V2=25 ml and V1 is the unknown:
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  • The answer of 62.5 μL (0.1 ml) appears in the Volume (Start) box
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Note: Chemical formula is case sensitive: C12H18N3O4  c12h18n3o4
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Definitions of molecular mass, molecular weight, molar mass and molar weight:
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In vivo Formulation Calculator (Clear solution)
Step 1: Enter information below (Recommended: An additional animal to make allowance for loss during the experiment)
Step 2: Enter in vivo formulation (This is only a calculator, not the exact formulation for a specific product. Please contact us first if there is no in vivo formulation in the solubility section.)
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Calculation results

Working concentration mg/mL;

Method for preparing DMSO stock solution mg drug pre-dissolved in μL DMSO (stock solution concentration mg/mL). Please contact us first if the concentration exceeds the DMSO solubility of the batch of drug.

Method for preparing in vivo formulation:Take μL DMSO stock solution, next add μL PEG300, mix and clarify, next addμL Tween 80, mix and clarify, next add μL ddH2O,mix and clarify.

(1) Please be sure that the solution is clear before the addition of next solvent. Dissolution methods like vortex, ultrasound or warming and heat may be used to aid dissolving.
             (2) Be sure to add the solvent(s) in order.

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