| Size | Price | |
|---|---|---|
| 250mg | ||
| Other Sizes |
| Targets |
Methyl 3-hydroxy-4,5-dimethoxybenzoate targets bacterial cells and oxidative stress pathways. It shows significant antibacterial effects against various bacterial strains. It also exhibits antioxidant activity in the presence of H2O2. Its mechanism of action likely involves disruption of bacterial cell walls and scavenging of free radicals.
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|---|---|
| ln Vitro |
In vitro, methyl 3-hydroxy-4,5-dimethoxybenzoate exhibits significant antibacterial effects and antioxidant activity. Its minimum inhibitory concentration (MIC) is 5 mg/ml against Staphylococcus aureus and Rhizopus, and 10 mg/ml against E. coli. It shows antioxidant activity in the presence of H2O2. Its activity is concentration-dependent, with effective concentrations in the mg/mL range. Its antibacterial and antioxidant activities make it a valuable tool for studying natural product pharmacology.
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| ln Vivo |
In vivo, methyl 3-hydroxy-4,5-dimethoxybenzoate has not been extensively studied as a therapeutic agent. Its antibacterial and antioxidant activities may have therapeutic potential. However, detailed in vivo efficacy data and pharmacokinetic profiles are limited in publicly available sources.
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| Enzyme Assay |
The in vitro antibacterial activity assay for methyl 3-hydroxy-4,5-dimethoxybenzoate typically uses broth microdilution or agar diffusion methods against bacterial strains. The compound is dissolved in suitable solvent and diluted in culture medium at varying concentrations (typically 1 to 10 mg/mL). The minimum inhibitory concentration (MIC) is determined. For antioxidant assays, the compound is tested for its ability to scavenge free radicals or protect cells from H2O2-induced oxidative stress.
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| Cell Assay |
For in vitro cellular assays, bacterial cultures or mammalian cells are treated with methyl 3-hydroxy-4,5-dimethoxybenzoate at concentrations ranging from 1 to 10 mg/mL for 24-72 hours. Bacterial growth inhibition is assessed by measuring optical density. Cell viability is assessed using MTT or CellTiter-Glo assays. All experiments include appropriate controls and are performed in triplicate.
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| Animal Protocol |
For in vivo studies, methyl 3-hydroxy-4,5-dimethoxybenzoate may be administered to rodents via oral gavage or intraperitoneal injection. However, specific in vivo protocols are not well-documented.
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| ADME/Pharmacokinetics |
The pharmacokinetic properties of methyl 3-hydroxy-4,5-dimethoxybenzoate have not been extensively characterized. The compound has a molecular weight of 212.2. Following oral administration, it is expected to have moderate absorption.
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| Toxicity/Toxicokinetics |
Preclinical toxicology studies of methyl 3-hydroxy-4,5-dimethoxybenzoate are limited. In acute toxicity studies, the compound is tolerated at moderate doses.
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| References | |
| Additional Infomation |
Methyl 3-hydroxy-4,5-dimethoxybenzoate is a gallic acid analogue extracted from pine flower and bayberry. It has a molecular formula of C10H12O5 and a molecular weight of 212.2. It exhibits significant antibacterial and antioxidant activities. It is not approved for human use and is intended for research purposes only.
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| Molecular Formula |
C10H12O5
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|---|---|
| Molecular Weight |
212.19928
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| Exact Mass |
212.068
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| CAS # |
83011-43-2
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| PubChem CID |
2733956
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| Appearance |
White to off-white solid powder
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| Density |
1.2±0.1 g/cm3
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| Boiling Point |
366.6±37.0 °C at 760 mmHg
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| Melting Point |
80-84 °C
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| Flash Point |
144.8±20.0 °C
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| Vapour Pressure |
0.0±0.9 mmHg at 25°C
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| Index of Refraction |
1.525
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| Source |
Originated from plants: Euphorbiaceae Macaranga sinensis (Baill.) Muell. Arg.
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| LogP |
1.66
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| Hydrogen Bond Donor Count |
1
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| Hydrogen Bond Acceptor Count |
5
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| Rotatable Bond Count |
4
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| Heavy Atom Count |
15
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| Complexity |
218
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| Defined Atom Stereocenter Count |
0
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| SMILES |
COC1=C(C(O)=CC(C(OC)=O)=C1)OC
|
| InChi Key |
LCIFXEQPXQVBGL-UHFFFAOYSA-N
|
| InChi Code |
InChI=1S/C10H12O5/c1-13-8-5-6(10(12)15-3)4-7(11)9(8)14-2/h4-5,11H,1-3H3
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| Chemical Name |
methyl 3-hydroxy-4,5-dimethoxybenzoate
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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 Note: This product requires protection from light (avoid light exposure) during transportation and storage. |
| 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 (~471.3 mM; with ultrasonication)
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|---|---|
| Solubility (In Vivo) |
Solubility in Formulation 1: ≥ 2.5 mg/mL (11.78 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 (11.78 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 DMSO stock solution (25.0 mg/mL) to 900 μL of 20% SBE-β-CD saline and mix well. 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. Solubility in Formulation 3: ≥ 2.5 mg/mL (11.78 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 | 4.7125 mL | 23.5627 mL | 47.1254 mL | |
| 5 mM | 0.9425 mL | 4.7125 mL | 9.4251 mL | |
| 10 mM | 0.4713 mL | 2.3563 mL | 4.7125 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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