| Size | Price | Stock | Qty |
|---|---|---|---|
| 100mg |
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| 500mg |
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| 1g | |||
| Other Sizes |
| Targets |
GPAT-IN-1 targets glycerol-3-phosphate acyltransferase (GPAT). GPAT is the first and rate-limiting enzyme in the synthesis of glycerolipids and triglycerides. It catalyzes the acylation of glycerol-3-phosphate to form lysophosphatidic acid, a key step in lipid biosynthesis. Inhibition of GPAT reduces triglyceride synthesis and may modulate lipid metabolism.
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|---|---|
| ln Vitro |
GPAT-IN-1 (Compound 13b) suppresses GPAT with an IC50 value of 8.9 μM[1].
In vitro, GPAT-IN-1 (Compound 13b) inhibits GPAT with an IC50 of 8.9 μM. This demonstrates its potency as a GPAT inhibitor in biochemical assays. The compound can be used for research on obesity and diabetes, where modulation of lipid metabolism is a therapeutic target. |
| ln Vivo |
Specific in vivo activity data for GPAT-IN-1 are not extensively reported. As a GPAT inhibitor, it would be expected to modulate lipid metabolism in vivo. It may be utilized in obesity research to study the effects of reduced triglyceride synthesis on body weight and metabolic parameters.
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| Enzyme Assay |
GPAT enzymatic activity is measured using biochemical assays with recombinant GPAT protein. The enzyme is incubated with glycerol-3-phosphate and acyl-CoA substrates in the presence of GPAT-IN-1 at varying concentrations. Product formation (lysophosphatidic acid) is measured, and IC50 values are calculated from dose-response curves.
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| Cell Assay |
The cellular activity of GPAT-IN-1 is evaluated in cell lines. Cells are treated with the compound, and lipid synthesis or triglyceride levels are measured to assess GPAT inhibition. Radiolabeled fatty acid incorporation into triglycerides is commonly used to measure de novo lipogenesis.
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| Animal Protocol |
In vivo efficacy of GPAT-IN-1 would typically be evaluated in animal models of obesity or diabetes. Animals would be administered the compound, and metabolic parameters such as body weight, lipid levels, and glucose homeostasis would be assessed. Hepatic triglyceride content would be measured as a pharmacodynamic endpoint.
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| ADME/Pharmacokinetics |
GPAT-IN-1 has a molecular formula of C21H26ClNO4S and a molecular weight of 423.95 g/mol. The compound is stored under recommended conditions. It is soluble in DMSO.
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| Toxicity/Toxicokinetics |
Comprehensive toxicological data for GPAT-IN-1 are limited. The compound is intended for research use only. Standard laboratory safety precautions should be followed when handling this compound.
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| References | |
| Additional Infomation |
GPAT-IN-1 is a glycerol-3-phosphate acyltransferase (GPAT) inhibitor with an IC50 of 8.9 μM. It can be used for research on obesity and diabetes. The compound is a valuable tool for studying lipid metabolism and the role of GPAT in metabolic disorders.
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| Molecular Formula |
C21H26CLNO4S
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|---|---|
| Molecular Weight |
423.953444004059
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| Exact Mass |
423.13
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| Elemental Analysis |
C, 59.50; H, 6.18; Cl, 8.36; N, 3.30; O, 15.10; S, 7.56
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| CAS # |
1204347-51-2
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| PubChem CID |
44608763
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| Appearance |
White to off-white solid powder
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| LogP |
6.6
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| Hydrogen Bond Donor Count |
2
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| Hydrogen Bond Acceptor Count |
5
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| Rotatable Bond Count |
11
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| Heavy Atom Count |
28
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| Complexity |
577
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| Defined Atom Stereocenter Count |
0
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| SMILES |
CCCCCCCCS(=O)(=O)NC1=C(C=C(C=C1)C2=CC(=CC=C2)Cl)C(=O)O
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| InChi Key |
AHHSQDHCFGYPOW-UHFFFAOYSA-N
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| InChi Code |
InChI=1S/C21H26ClNO4S/c1-2-3-4-5-6-7-13-28(26,27)23-20-12-11-17(15-19(20)21(24)25)16-9-8-10-18(22)14-16/h8-12,14-15,23H,2-7,13H2,1H3,(H,24,25)
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| Chemical Name |
3'-chloro-4-(octylsulfonamido)-[1,1'-biphenyl]-3-carboxylic acid
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| Synonyms |
GPAT-IN-1; GPAT-IN 1; GPAT IN 1; GPAT
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| HS Tariff Code |
2934.99.9001
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| 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)
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| Solubility (In Vitro) |
DMSO: ~100 mg/mL (~235.9 mM; with ultrasonication)
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|---|---|
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (5.90 mM) (saturation unknown) in 10% DMSO + 40% PEG300 + 5% Tween-80 + 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 DMSO stock solution (25.0 mg/mL) to 400 μL of PEG300 and mix well; then add 50 μL of Tween-80 and mix well; finally add 450 μL of physiological saline and 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 (5.90 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 DMSO stock solution (25.0 mg/mL) to 900 μL of corn oil and mix well. (Please use freshly prepared in vivo formulations for optimal results.) |
| Preparing Stock Solutions | 1 mg | 5 mg | 10 mg | |
| 1 mM | 2.3588 mL | 11.7938 mL | 23.5877 mL | |
| 5 mM | 0.4718 mL | 2.3588 mL | 4.7175 mL | |
| 10 mM | 0.2359 mL | 1.1794 mL | 2.3588 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.
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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