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Product Name | 6-Hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone |
Cas Number | 87642-87-3 |
Formula | C12H12O5 |
Molar Mass | 236.22 g/mol |
Property 1 | Melting point: 175-177 °C |
Property 2 | Boiling point: Not available |
Property 3 | Density: Not available |
Property 4 | Solubility: Soluble in common organic solvents |
Property 5 | Appearance: Off-white to light yellow powder |
Property 6 | Refractive index: Not available |
Property 7 | Flash point: Not available |
Property 8 | Stability: Stable under normal conditions |
Property 9 | Storage condition: Store in a cool, dry place |
Property 10 | Purity: Typically > 95% |
What is the chemical structure of 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone?
6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta -lactone has a specific chemical structure based on its name.
The compound contains a benzofuran core.The compound contains benzofuran as its core. The benzofuran ring system consists of a benzene ring fused to a furan ring.The benzofuran system is made up of a benzene and a furan ring. In this particular case, at the 6 - position of the benzofuran ring, there is a hydroxyl group (-OH).In this case, the hydroxyl group is located at the 6 – position of the benzofuran rings. At the 7 - position, there is a methoxy group (-OCH3).At the 7 – position, there is a methyl group (-OCH3).
Attached to the benzofuran ring at the 5 - position is an acrylic acid moiety which has undergone cyclization to form a delta -lactone.The benzofuran ring is attached at the 5 'position by an acrylic acid moiety that has undergone cyclization in order to form a delta -lactone. An acrylic acid group typically has the structure CH=CH - COOH.The acrylic acid group has a typical structure of CH=CH – COOH. In the formation of the delta -lactone, the carboxylic acid group (-COOH) and a hydroxyl group from the appropriate position on the side - chain react to form a cyclic ester.The carboxylic acid (-COOH), and the hydroxyl group at the appropriate position in the side-chain react to form the cyclic esters. The 'delta' in delta -lactone indicates that the lactone ring is a five - membered ring formed by the reaction between the carboxyl group and a hydroxyl group that is four carbon atoms away in the chain (counting from the carbonyl carbon of the carboxylic acid).The 'delta" in delta-lactone indicates that a five-membered lactone ring has been formed by the reaction of a carboxyl group with a hydroxyl that is four carbons away from the carboxylic group.
The overall chemical structure can be envisioned as follows: The benzofuran ring provides a rigid and planar aromatic framework.The overall chemistry can be described as follows: the benzofuran ring forms a rigid, planar aromatic structure. The hydroxyl and methoxy groups on the benzofuran ring contribute to its electronic properties and reactivity.The hydroxyl groups and methoxy group on the benzofuran rings contribute to its electronic properties. The delta -lactone ring attached to the benzofuran at the 5 - position adds another level of complexity and functionality.The delta-lactone ring, attached to benzofuran in the 5 -position, adds a new level of functionality and complexity. The lactone ring can participate in various chemical reactions such as hydrolysis to reform the carboxylic acid and alcohol groups under appropriate conditions.The lactone ring is capable of participating in a variety of chemical reactions, such as hydrolysis, to reform the carboxylic acids and alcohol groups when conditions are right. The combination of the aromatic benzofuran ring and the lactone ring gives this compound unique physical and chemical characteristics, which may be relevant in areas such as organic synthesis, drug discovery, or natural product chemistry where such structures can exhibit interesting biological activities due to their ability to interact with biological targets through processes like hydrogen bonding (enabled by the hydroxyl group) and hydrophobic interactions (due to the aromatic and cyclic structures).The combination of the aromatic benzfuran ring with the lactone ring provides this compound with unique physical and chemical properties. This may be relevant to areas such as organic syntheses, drug discovery or natural product chemistry, where such compounds can exhibit interesting biological activity due to their ability interact with biological targets via processes like hydrogen bonds (enabled through the hydroxyl groups) and hydrophobic interaction (due to aromatic and cyclic structure).
What are the main applications of 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone?
6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta -lactone, also known as scopoletin, has several important applications.
In the field of medicine, scopoletin exhibits various pharmacological properties.Scopoletin has a variety of pharmacological properties. It has antioxidant effects.It has antioxidant properties. By scavenging free radicals, it can protect cells from oxidative damage, which is associated with many diseases such as neurodegenerative disorders, cardiovascular diseases, and cancer.It can protect cells against oxidative damage by scavenging the free radicals. This is associated with many diseases including neurodegenerative disorders and cardiovascular diseases. For example, in neurodegenerative diseases like Alzheimer's, excessive free radicals can damage neurons.In neurodegenerative disorders like Alzheimer's excessive free radicals may damage neurons. Scopoletin's antioxidant ability may potentially slow down the progression of such diseases.Scopoletin may be able to slow down the progression in such diseases because of its antioxidant properties.
It also shows anti - inflammatory properties.It also has anti-inflammatory properties. Inflammatory responses play a role in numerous pathological conditions, including arthritis and inflammatory bowel diseases.Inflammatory responses are involved in many pathological conditions including arthritis and inflammatory intestinal diseases. Scopoletin can inhibit the production of inflammatory mediators, thus reducing inflammation in the body.Scopoletin inhibits the production of inflammatory mediators and reduces inflammation in the body. Some research indicates that it may be useful in developing new anti - inflammatory drugs.Some research suggests that it could be useful in the development of new anti-inflammatory drugs.
In addition, scopoletin has been studied for its potential anticancer activity.Scopoletin was also studied for its anticancer properties. It can induce apoptosis (programmed cell death) in cancer cells, and may also inhibit the growth and metastasis of tumors.It can induce apoptosis in cancer cells and may also inhibit tumor growth and metastasis. For instance, in some in - vitro studies on certain cancer cell lines, scopoletin has shown promising results in suppressing cancer cell proliferation.In some in-vitro studies, scopoletin showed promising results in suppressing the proliferation of cancer cells.
In the agricultural area, scopoletin is involved in plant - plant interactions.Scopoletin is involved in plant-plant interactions. It can act as an allelochemical.It can act as a allelochemical. Allelochemicals are substances secreted by plants that can affect the growth, development, and survival of neighboring plants.Allelochemicals, substances secreted from plants, can affect the growth, survival, and development of neighboring plants. Scopoletin may inhibit the germination and growth of competing plant species, giving the producing plant a competitive advantage in the ecosystem.Scopoletin can inhibit the growth and germination of competing plant species. This gives the producing plant an advantage in the ecosystem. This property could potentially be exploited in agricultural weed control strategies.This property could be exploited to control weeds in agriculture. By understanding how scopoletin affects weed growth, new, more environmentally friendly herbicides could be developed.Understanding how scopoletin impacts weed growth could lead to the development of new, environmentally friendly herbicides.
Moreover, scopoletin has applications in the food industry.Scopoletin is also used in the food industry. Due to its antioxidant properties, it can be used as a natural food preservative.It can be used to preserve food naturally due to its antioxidant properties. It can prevent the oxidation of fats and oils in food products, thereby extending their shelf - life.It can prevent oxidation of oils and fats in food products extending their shelf life. Additionally, it may also contribute to the flavor and aroma of some foods, enhancing the overall sensory experience of consumers.It may also enhance the taste and aroma of certain foods, improving the overall sensory experience for consumers. Some plants that contain scopoletin are used in traditional food and beverage production, and the compound may play a role in the unique characteristics of these products.Scopoletin is found in some plants used in traditional food and drink production. The compound may contribute to the unique characteristics of the products.
What are the potential benefits of 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone?
6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta -lactone, often found in certain natural products, may have several potential benefits.
One area where it may show promise is in the realm of antioxidant activity.Antioxidant activity is one area where it could be promising. Compounds with antioxidant properties can help neutralize free radicals in the body.Compounds that have antioxidant properties can neutralize free radicals within the body. Free radicals are unstable molecules that can cause oxidative stress, which is linked to various health issues like aging, cancer, and cardiovascular diseases.Free radicals can cause oxidative damage, which is associated with various health problems, such as cancer and cardiovascular disease. By scavenging these free radicals, 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta -lactone could potentially protect cells from damage, maintaining their normal function and reducing the risk of these diseases.
It may also have anti - inflammatory effects.It may also have an anti-inflammatory effect. Chronic inflammation is at the root of many common health problems, including arthritis, inflammatory bowel diseases, and some neurodegenerative disorders.Chronic inflammation is the cause of many common diseases, such as arthritis, inflammatory bowel disease, and neurodegenerative disorders. If this lactone can modulate the body's inflammatory response, it could offer relief to patients suffering from such conditions.This lactone could provide relief for patients with such conditions if it can modulate the body’s inflammatory response. It might work by inhibiting the production of inflammatory mediators, such as cytokines and prostaglandins, which are responsible for triggering and maintaining the inflammatory process.It could work by inhibiting inflammatory mediators such as cytokines or prostaglandins that are responsible for initiating and maintaining inflammation.
In addition, there is a possibility that this compound could have antibacterial or antifungal properties.This compound may also have antibacterial and antifungal properties. With the increasing problem of antibiotic - resistant bacteria, finding new natural substances with antimicrobial activity is crucial.Finding new natural substances that have antimicrobial properties is important, especially with the growing problem of antibiotic-resistant bacteria. If 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta -lactone can effectively inhibit the growth of harmful bacteria or fungi, it could potentially be developed into new drugs or used as an additive in products like cosmetics or food packaging to prevent microbial contamination.
Furthermore, some research has suggested that related benzofuran - based compounds may have potential in the area of cancer prevention or treatment.Some research has also suggested that benzofuran-based compounds could have potential for cancer prevention or treatment. While more studies are needed to confirm this for 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta -lactone specifically, it could potentially interfere with cancer cell growth, induce apoptosis (programmed cell death) in cancer cells, or prevent the formation of new blood vessels that tumors need to grow and spread.
However, it's important to note that most of these potential benefits are currently based on preliminary research, often in vitro (in test tubes) or in animal models.It's important to remember that the majority of these potential benefits are based on research in vitro, or in animal models. Extensive clinical trials in humans are required to fully understand its safety, efficacy, and the appropriate dosages for realizing these potential benefits.To fully understand the safety, efficacy and dosages, extensive clinical trials are needed in humans.
What are the safety concerns associated with 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone?
6 - hydroxy - 7 - methoxy - 5 - benzofuranacrylic acid delta - lactone is a chemical compound.A chemical compound is 6 - hydroxy 7 – methoxy 5 – benzofuranacrylic delta - lactone. When considering its safety concerns, several aspects need to be taken into account.When evaluating its safety, it is important to consider several factors.
First, in terms of toxicity, limited information may be available in some cases.In some cases, there may be limited information available about toxicity. If it is ingested, it could potentially disrupt normal physiological functions.Ingestion of the substance could disrupt normal physiological functions. For example, it might interfere with metabolic pathways in the body.It could, for example, interfere with metabolic pathways within the body. Since the compound has a specific chemical structure, it could interact with enzymes or receptors in the digestive system or other organs.The compound's chemical structure could cause it to interact with enzymes and receptors in the digestive tract or other organs. If absorbed through the skin, it may cause skin irritation.It may cause irritation if absorbed through the surface of the skin. The chemical nature of the lactone ring and the attached functional groups could lead to an inflammatory response in the skin, manifested as redness, itching, or swelling.The lactone ring, and the functional groups attached to it, could cause an inflammatory reaction in the skin. This can manifest as redness, swelling, or itching.
Inhalation is another safety issue.Inhalation poses another safety concern. If present in the air as fine particles or vapors, it may be inhaled into the respiratory system.Inhalation is possible if the substance is present in the air in the form of fine particles or vapors. Once in the lungs, it could irritate the delicate lining of the airways.Once in the lungs it can irritate the delicate linings of the airways. This can result in coughing, shortness of breath, or more severe respiratory problems over time, especially with repeated exposure.This can lead to coughing, shortness in breath, or even more serious respiratory problems with repeated exposure. The potential for long - term respiratory effects, such as fibrosis or reduced lung function, is also a concern, although more research would be needed to fully understand these risks.Long-term respiratory effects such as fibrosis and reduced lung function are also a concern. However, more research is needed to fully understand the risks.
From an environmental perspective, if this compound is released into the environment, it may have an impact on ecosystems.If this compound is released in the environment, then it could have an impact on ecosystems. Aquatic organisms could be affected if it enters water bodies.If it enters water, aquatic organisms may be affected. It might disrupt the normal growth, reproduction, or behavior of fish, invertebrates, and other aquatic life.It could disrupt the normal growth or behavior of fishes, invertebrates and other aquatic animals. In soil, it could interact with soil microorganisms, potentially altering soil processes such as nutrient cycling.In soil, the compound could interact with soil bacteria, altering soil processes like nutrient cycling. The fate of the compound in the environment, including its biodegradability, is important.It is important to consider the fate of the compound, including its biodegradability. If it is not easily broken down, it could accumulate in the environment, leading to long - term exposure risks for various organisms.If it is not easily degraded, it can accumulate in the environment and pose long-term exposure risks to various organisms.
Furthermore, when handling this compound in a laboratory or industrial setting, there is a risk of accidental spills or leaks.In addition, handling this compound in an industrial or laboratory setting can lead to accidental spills and leaks. If not properly contained, it can contaminate work surfaces, equipment, and potentially the surrounding area.It can contaminate surfaces, equipment and the surrounding area if not contained properly. Adequate safety measures, such as proper personal protective equipment (PPE) including gloves, goggles, and lab coats, should be used to minimize the risk of exposure to workers.To minimize the risk to workers, it is important to use adequate safety measures such as personal protective equipment (PPE), including gloves, goggles and lab coats. Additionally, proper ventilation systems are essential to prevent the build - up of vapors in the air.Proper ventilation systems are also essential to prevent the accumulation of vapors.
Overall, while specific data on the safety of 6 - hydroxy - 7 - methoxy - 5 - benzofuranacrylic acid delta - lactone may vary, these general safety concerns related to toxicity, environmental impact, and handling should be considered to ensure the well - being of humans and the environment.While specific data on the safety 6 hydroxy 7 methoxy 5 benzofuranacrylic acids delta - lactone can vary, these general concerns about toxicity, environmental impact, handling, and safety should be taken into consideration to ensure the well-being of humans and the planet.
What are the recommended dosages of 6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta-lactone?
6-hydroxy-7-methoxy-5-benzofuranacrylic acid delta - lactone, also known as scopoletin, is a coumarin derivative found in various plants. However, specific recommended dosages are not well - established in a universal sense for several reasons.However, the recommended dosages for coumarin are not well-established in a general sense.
Firstly, most of the research on scopoletin has been in vitro (in test - tube) or in animal models.In vitro (in test tubes) or animal models have been the main research methods used to study scopoletin. In in vitro studies, different concentrations are used to observe effects on cell lines.In in vitro experiments, different concentrations of scopoletin are used to observe the effects on cell lines. For example, in studies looking at its anti - inflammatory effects on certain immune cells, concentrations in the micromolar range (e.g., 10 - 100 mM) might be used to assess how it modulates cytokine production.In studies looking at its anti-inflammatory effects on certain immune cell lines, concentrations within the micromolar range (10 - 100 mM), for example, might be used to assess its modulation of cytokine release.
In animal studies, dosages can vary widely depending on the species and the nature of the experiment.The dosage can vary greatly depending on the species, the type of experiment and the dosage. In rodents, dosages for investigating antioxidant properties might range from 10 to 100 mg/kg body weight per day.For rodents, the dosages to investigate antioxidant properties could range from 10 mg/kg bodyweight per day. This is administered either through oral gavage, injection, or inclusion in the diet.This can be administered by oral gavage, injection or inclusion in the food.
When it comes to human use, there is a lack of large - scale, well - controlled clinical trials to firmly establish safe and effective dosages.In the case of human use, large-scale, well-controlled clinical trials are not available to establish safe and effective doses. As a result, there is no official medical recommendation for a specific dosage of scopoletin for any particular condition.There is no official medical recommendation on a dosage of scopoletin to treat any condition.
If considering scopoletin as a supplement, extreme caution is advised.When considering scopoletin for use as a dietary supplement, it is important to exercise extreme caution. Without proper clinical data, self - prescribing can lead to potential risks.Self-prescription can be dangerous without proper clinical data. Some possible side effects could include interactions with other medications.Interactions with other medications could be one of the possible side effects. Since coumarins can affect blood - clotting factors, there is a risk of increased bleeding if taken with anticoagulant or anti - platelet drugs.Coumarins can cause blood clotting to slow down, so if you take anticoagulant or anti-platelet drugs with coumarins, the risk of bleeding increases. There may also be unforeseen effects on the liver or other organs.Other organs or the liver may also experience unanticipated effects.
In conclusion, until more comprehensive human clinical trials are conducted, it is not possible to provide a definite recommended dosage of 6 - hydroxy - 7 - methoxy - 5 - benzofuranacrylic acid delta - lactone.It is not possible, until more comprehensive clinical trials have been conducted on humans, to recommend a specific dosage of 6 – hydroxy – 7 – methoxy – 5 benzofuranacrylic - acid delta — lactone. If interested in its potential health benefits, it is crucial to consult a healthcare professional who can take into account an individual's overall health status, current medications, and other factors before making any decisions.It is important to consult a health professional before making any decisions if you are interested in the potential health benefits.