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trans-Aconitic acid

Name: trans-Aconitic acid
Brand: TargetMol
SKU: T4861
Price: 30 USD
Availability: InStock
Rating: 5 (10 reviews)

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Catalog No. T4861Cas No. 4023-65-8

Trans-Aconitic acid is normally present in normal human urine, and it has been suggested that is present in larger amounts with Reye's syndrome and organic aciduria. trans-Aconitic acid is a substrate of enzyme trans-aconitate 2-methyltransferase (EC 2.1.1.144). Trans-aconitate in the urine is a biomarker for the consumption of soy products.trans-Aconitic acid is an antimicrobial agent that blocks the transformation of Leishmania donovani amastigotes to prostigotes.

trans-Aconitic acid

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Purity: 98.7%

Catalog No. T4861Cas No. 4023-65-8

Pack Size	Price	USA Warehouse	Global Warehouse
50 mg	$30	In Stock	In Stock
100 mg	$40	In Stock	In Stock
500 mg	$73	In Stock	In Stock
1 g	$106	In Stock	In Stock
2 g	$156	-	In Stock
1 mL x 10 mM (in DMSO)	$39	In Stock	In Stock

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In Stock Estimated shipping dateUSA Warehouse[1-2 days] Global Warehouse[5-7 days]

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Batch Information

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Purity:98.7%

Appearance:Solid

Color:White

Resource Download

COA HNMR LCMS

Product Introduction

trans-Aconitic acid AI Summary

trans-Aconitic acid demonstrates a wide range of bioactivities, including enzyme inhibition, hormone receptor modulation, and antiviral properties. Specifically, it inhibits rat ATP-Citrate Lyase by targeting the carbon-carbon bond cleavage activity in citrate substrate, evidencing a Ki value greater than 1000000.0 nM. It acts as an inhibitor of Human Jumonji Domain Containing 2E (JMJD2E) with a potency of 39.8107 µM, and as an agonist of the Thyroid Stimulating Hormone Receptor with a potency of 5.0119 µM, increasing intracellular cAMP concentrations in Parental HEK 293 cells. Additionally, it inhibits Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia with a potency of 12.5594 µM, and blocks Ebola Virus entry in Screen 2, both in the green (AC50 of 631.0 nM) and blue channels (AC50 of 10.0 µM). Moreover, trans-Aconitic acid inhibits sodium fluorescein uptake in OATP1B1-transfected CHO cells by 102.5% and in OATP1B3-transfected CHO cells by 88.62% at an equimolar substrate-inhibitor concentration of 10 µM. It also inhibits Sporosarcina pasteurii CCM 2056 urease, reducing ammonia production from urea with a Ki value of 6130.0 nM and 33.8% enzyme activity inhibition. Furthermore, it covalently inhibits the wild type N-terminal polyhis-tagged TEV protease cleavage site fused Mycobacterium tuberculosis ICL1 expressed in E. coli BL21 (DE3), with an IC50 value of 5020000.0 nM when using DL-isocitrate as a substrate..

Note: Summary generated by AI. Data source: ChEMBL

Bioactivity

Description

Targets&IC50

ATP citrate synthase:>1 mM(Ki,rat)

Chemical Properties

Molecular Weight	174.11
Formula	C₆H₆O₆
Cas No.	4023-65-8
Smiles	OC(=O)C\C(=C/C(O)=O)C(O)=O
Relative Density.	1.66g/cm3

Storage & Solubility Information

Storage

Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.

Solubility Information

DMSO: 55 mg/mL (315.89 mM), Sonication is recommended.

Solution Preparation Table

DMSO

	1mg	5mg	10mg	50mg
1 mM	5.7435 mL	28.7175 mL	57.4350 mL	287.1748 mL
5 mM	1.1487 mL	5.7435 mL	11.4870 mL	57.4350 mL
10 mM	0.5743 mL	2.8717 mL	5.7435 mL	28.7175 mL
20 mM	0.2872 mL	1.4359 mL	2.8717 mL	14.3587 mL
50 mM	0.1149 mL	0.5743 mL	1.1487 mL	5.7435 mL
100 mM	0.0574 mL	0.2872 mL	0.5743 mL	2.8717 mL

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In Vivo Formulation Calculator (Clear solution)

Please enter your animal experiment information in the following box and click Calculate to obtain the stock solution preparation method and in vivo formula preparation method:

For example, if the intended dosage is 10 mg/kg for animals weighing 20 g , with a dosing volume of 100 μL per animal, TargetMol | Animal experiments

and a total of 10 animals are to be administered, using a formulation of TargetMol | reagent

10% DMSO+ 40% PEG300+ 5% Tween 80+ 45% Saline/PBS/ddH₂O , the resulting working solution concentration would be 2 mg/mL.

Stock Solution Preparation:

Dissolve 2 mg of the compound in 100 μL DMSO TargetMol | reagent to obtain a stock solution at a concentration of 20 mg/mL . If the required concentration exceeds the compound's known solubility, please contact us for technical support before proceeding.

Preparation of the In Vivo Formulation:

1) Add 100 μL of the DMSO TargetMol | reagent stock solution to 400 μL PEG300 and mix thoroughly until the solution becomes clear.

2) Add 50 μL Tween 80 and mix well until fully clarified.

3) Add 450 μL Saline,PBS or ddH₂O TargetMol | reagent and mix thoroughly until a homogeneous solution is obtained.

This example is provided solely to demonstrate the use of the In Vivo Formulation Calculator and does not constitute a recommended formulation for any specific compound. Please select an appropriate dissolution and formulation strategy based on your experimental model and route of administration.

All co-solvents required for this protocol, includingDMSO, PEG300/PEG400, Tween 80, SBE-β-CD, and Corn oil, are available for purchase on the TargetMol website.

Dose Conversion

You can also refer to dose conversion for different animals. More Dose Conversion

Tech Support

Please see Inhibitor Handling Instructions for more frequently ask questions. Topics include: how to prepare stock solutions, how to store products, and cautions on cell-based assays & animal experiments, etc