Exact Mass: 176.0320868

Exact Mass Matches: 176.0320868

Found 500 metabolites which its exact mass value is equals to given mass value 176.0320868, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

L-2-Amino-3-(oxalylamino)propanoic acid

N-Oxalyl-L-alpha-beta-diaminopropionic acid (BOAA,ODAP)

C5H8N2O5 (176.0433198)


L-2-Amino-3-(oxalylamino)propanoic acid is found in grass pea. L-2-Amino-3-(oxalylamino)propanoic acid is isolated from Panax notoginseng (sanchi Isolated from Panax notoginseng (sanchi). L-2-Amino-3-(oxalylamino)propanoic acid is found in tea and grass pea. L-2-Amino-3-(oxalylamino)propanoic acid is an alpha-amino acid. N(3)-oxalyl-L-2,3-diaminopropionic acid is an N(beta)-acyl-L-2,3-diaminopropionic acid in which the acyl group is oxalyl. It is functionally related to a propionic acid. It is a conjugate acid of a N(3)-(carboxylatoformyl)-L-2,3-diaminopropionate(1-). Dencichin is a natural product found in Lathyrus latifolius and Lathyrus sativus with data available. See also: Panax notoginseng root (part of). Dencichin is a non-protein amino acid originally extracted from Panax notoginseng, and can inhibit HIF-prolyl hydroxylase-2 (PHD-2) activity.

   

4-Methylumbelliferone

7-Hydroxy-4-methylcoumarin|4-Methylumbelliferone

C10H8O3 (176.0473418)


Beta-methylumbelliferone appears as colorless crystals. Insoluble in water. (NTP, 1992) 4-methylumbelliferone is a hydroxycoumarin that is umbelliferone substituted by a methyl group at position 4. It has a role as an antineoplastic agent and a hyaluronic acid synthesis inhibitor. It is functionally related to an umbelliferone. Hymecromone is a natural product found in Ferula fukanensis, Dalbergia volubilis, and other organisms with data available. 4-methylumbelliferone is a metabolite found in or produced by Saccharomyces cerevisiae. A coumarin derivative possessing properties as a spasmolytic, choleretic and light-protective agent. It is also used in ANALYTICAL CHEMISTRY TECHNIQUES for the determination of NITRIC ACID. 4-methylumbelliferone is a substrate for: Liver carboxylesterase 1, Cocaine esterase, and S-formylglutathione hydrolase. A - Alimentary tract and metabolism > A05 - Bile and liver therapy > A05A - Bile therapy A hydroxycoumarin that is umbelliferone substituted by a methyl group at position 4. COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Acquisition and generation of the data is financially supported in part by CREST/JST. 4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects. 4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects.

   

Herniarin

7-Methoxycoumarin, suitable for fluorescence, >=98.0\\% (TLC)

C10H8O3 (176.0473418)


Herniarin, also known as 7-methoxycoumarin or ayapanin, belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one). Herniarin is a sweet, balsamic, and tonka tasting compound. Herniarin has been detected, but not quantified, in several different foods, such as barley, tarragons, roman camomiles, fruits, and wild celeries. This could make herniarin a potential biomarker for the consumption of these foods. Herniarin is a member of the class of coumarins that is coumarin substituted by a methoxy group at position 7. It has a role as a fluorochrome. 7-Methoxycoumarin is a natural product found in Haplopappus multifolius, Herniaria hirsuta, and other organisms with data available. See also: Chamomile (part of); Glycyrrhiza Glabra (part of). Present in Prunus mahaleb (mahaleb cherry). Herniarin is found in many foods, some of which are caraway, wild celery, barley, and fruits. A member of the class of coumarins that is coumarin substituted by a methoxy group at position 7. Herniarin is a natural coumarin occurs in some flowering plants, with antitumor effect. Herniarin is a natural coumarin occurs in some flowering plants, with antitumor effect.

   

Ascorbic acid

L-Threoascorbic acid,Antiscorbutic factor,Vitamin C;(R)-5-((S)-1,2-Dihydroxyethyl)-3,4-dihydroxyfuran-2(5H)-one

C6H8O6 (176.0320868)


L-ascorbic acid is a white to very pale yellow crystalline powder with a pleasant sharp acidic taste. Almost odorless. (NTP, 1992) L-ascorbic acid is the L-enantiomer of ascorbic acid and conjugate acid of L-ascorbate. It has a role as a coenzyme, a flour treatment agent, a food antioxidant, a plant metabolite, a cofactor, a skin lightening agent and a geroprotector. It is an ascorbic acid and a vitamin C. It is a conjugate acid of a L-ascorbate. It is an enantiomer of a D-ascorbic acid. A six carbon compound related to glucose. It is found naturally in citrus fruits and many vegetables. Ascorbic acid is an essential nutrient in human diets, and necessary to maintain connective tissue and bone. Its biologically active form, vitamin C, functions as a reducing agent and coenzyme in several metabolic pathways. Vitamin C is considered an antioxidant. Ascorbic acid is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Ascorbic acid is a Vitamin C. Ascorbic Acid is a natural product found in Populus tremula, Rosa platyacantha, and other organisms with data available. Ascorbic Acid is a natural water-soluble vitamin (Vitamin C). Ascorbic acid is a potent reducing and antioxidant agent that functions in fighting bacterial infections, in detoxifying reactions, and in the formation of collagen in fibrous tissue, teeth, bones, connective tissue, skin, and capillaries. Found in citrus and other fruits, and in vegetables, vitamin C cannot be produced or stored by humans and must be obtained in the diet. (NCI04) A six carbon compound related to glucose. It is found naturally in citrus fruits and many vegetables. Ascorbic acid is an essential nutrient in human diets, and necessary to maintain connective tissue and bone. Its biologically active form, vitamin C, functions as a reducing agent and coenzyme in several metabolic pathways. Vitamin C is considered an antioxidant. See also: Sodium Ascorbate (active moiety of); D-ascorbic acid (related); Magnesium Ascorbyl Phosphate (active moiety of) ... View More ... G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AD - Organic acids A - Alimentary tract and metabolism > A11 - Vitamins > A11G - Ascorbic acid (vitamin c), incl. combinations > A11GA - Ascorbic acid (vitamin c), plain B - Blood and blood forming organs > B03 - Antianemic preparations > B03A - Iron preparations > B03AA - Iron bivalent, oral preparations COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D020011 - Protective Agents > D000975 - Antioxidants C26170 - Protective Agent > C275 - Antioxidant D018977 - Micronutrients > D014815 - Vitamins S - Sensory organs > S01 - Ophthalmologicals Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4]. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4].

   

Pemoline

2-amino-5-phenyl-4,5-dihydro-1,3-oxazol-4-one

C9H8N2O2 (176.0585748)


N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics > N06BA - Centrally acting sympathomimetics D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant

   

D-Glucurono-6,3-lactone

(2R,3R,3aR,6R,6aR)-2,3,6-trihydroxy-3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-5-one

C6H8O6 (176.0320868)


D-Glucurono-6,3-lactone belongs to the class of organic compounds known as isosorbides. These are organic polycyclic compounds containing an isosorbide(1,4-Dianhydrosorbitol) moiety, which consists of two -oxolan-3-ol rings. D-Glucurono-6,3-lactone is a very mild and mentholic tasting compound. Glucuronolactone is a naturally occurring substance that is an important structural component of nearly all connective tissues. It is frequently used in energy drinks to increase energy levels and improve alertness, and can also be used to reduce "brain fog" caused by various medical conditions. Glucuronolactone is also found in many plant gums. Glucuronolactone is a white solid odorless compound, soluble in hot and cold water. Its melting point ranges from 176 to 178 °C. The compound can exist in a monocyclic aldehyde form or in a bicyclic hemiacetal (lactol) form. Glucuronolactone is a popular ingredient in energy drinks because it has been shown to be effective at increasing energy levels and improving alertness. Glucuronolactone supplementation also significantly reduces "brain fog" cause by various medical conditions. Although levels of glucuronolactone in energy drinks can far exceed those found in the rest of the diet, glucuronolactone is extremely safe and well tolerated. The European Food Safety Authority (EFSA) has concluded that exposure to glucuronolactone from regular consumption of energy drinks is not a safety concern.[2] The no-observed-adverse-effect level of glucuronolactone is 1000 mg/kg/day. Additionally, according to The Merck Index, glucuronolactone is used as a detoxicant. The liver uses glucose to create glucuronolactone, which inhibits the enzyme B-glucuronidase (metabolizes glucuronides), which should cause blood-glucuronide levels to rise. Glucuronides combines with toxic substances, such as morphine and depot medroxyprogesterone acetate, by converting them to water-soluble glucuronide-conjugates which are excreted in the urine. Higher blood-glucuronides help remove toxins from the body, leading to the claim that energy drinks are detoxifying. Free glucuronic acid (or its self-ester glucuronolactone) has less effect on detoxification than glucose, because the body synthesizes UDP-glucuronic acid from glucose. Therefore, sufficient carbohydrate intake provides enough UDP-glucuronic acid for detoxication, and foods rich in glucose are usually abundant in developed nations. Glucuronolactone is also metabolized to glucaric acid, xylitol, and L-xylulose, and humans may also be able to use glucuronolactone as a precursor for ascorbic acid synthesis. D-glucurono-6,3-lactone participates in ascorbate and aldarate metabolism. D-glucurono-6,3-lactone is produced by the reaction between D-glucaric acid and the enzyme, aldehyde dehydrogenase (NAD+) [EC: 1.2.1.3]. [HMDB] D-Glucuronic acid lactone is an endogenous metabolite.

   

Allantoic acid

Bis[(aminocarbonyl)amino]acetic acid

C4H8N4O4 (176.0545528)


Allantoic acid is the end product of Allantoicase [EC:3.5.3.4], an enzyme involved in uric acid degradation (Purine metabolism). Although it is commonly accepted that allantoicase is lost in mammals, it has been identified in mice and humans. (PMID 11852104). A crystalline, transparent, colorless substance found in the allantoic liquid of the fetal calf. It was formerly called allantoic acid and amniotic acid. Isolated from coffee beans and leaves KEIO_ID A139 Allantoic acid is a degradative product of uric acid and associated with purine metabolism[1][2][3].

   

Ureidosuccinic acid

Ureidosuccinic acid, cobalt (+2), (1:1) salt,(L)-isomer

C5H8N2O5 (176.0433198)


N-carbamoyl-l-aspartate, also known as N-carbamoylaspartic acid or L-ureidosuccinic acid, belongs to aspartic acid and derivatives class of compounds. Those are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. N-carbamoyl-l-aspartate is soluble (in water) and a weakly acidic compound (based on its pKa). N-carbamoyl-l-aspartate can be found in a number of food items such as mustard spinach, black huckleberry, towel gourd, and chinese cabbage, which makes N-carbamoyl-l-aspartate a potential biomarker for the consumption of these food products. N-carbamoyl-l-aspartate can be found primarily in prostate Tissue and saliva, as well as in human prostate tissue. In humans, N-carbamoyl-l-aspartate is involved in a couple of metabolic pathways, which include aspartate metabolism and pyrimidine metabolism. N-carbamoyl-l-aspartate is also involved in several metabolic disorders, some of which include beta ureidopropionase deficiency, dihydropyrimidinase deficiency, canavan disease, and UMP synthase deficiency (orotic aciduria). Moreover, N-carbamoyl-l-aspartate is found to be associated with prostate cancer. Ureidosuccinic acid, also known as L-ureidosuccinate or carbamyl-L-aspartate, belongs to the class of organic compounds known as aspartic acids and derivatives. Aspartic acids and derivatives are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Ureidosuccinic acid is also classified as a carbamate derivative. It is a solid that is soluble in water. Ureidosuccinic acid exists in all living species, ranging from bacteria to plants to humans. Ureidosuccinic acid can be biosynthesized from carbamoyl phosphate and L-aspartic acid through the action of the enzyme known as aspartate carbamoyltransferase (ACTase) and serves as an intermediate in pyrimidine biosynthesis. In humans, a drop in the level of urinary ureidosuccinic acid is associated with bladder cancer (PMID: 25562196). It is also involved in the metabolic disorder called Canavan disease. Acquisition and generation of the data is financially supported in part by CREST/JST. D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids KEIO_ID C025 N-?Carbamoyl-?DL-?aspartic acid (Ureidosuccinic acid) is a precursor of nucleic acid pyrimidines[1].

   

1,3,8-Naphthalenertriol

1,3,8-Trihydroxynaphthalene

C10H8O3 (176.0473418)


   

2-Hydroxy-3-oxoadipate

2-hydroxy-3-oxoadipic acid

C6H8O6 (176.0320868)


   

2-Ketogulonolactone

5-(1,2-dihydroxyethyl)-4-hydroxyoxolane-2,3-dione

C6H8O6 (176.0320868)


   

Glucuronolactone

D(+)-Glucurono-3,6-lactone

C6H8O6 (176.0320868)


D-Glucuronic acid lactone is an endogenous metabolite.

   

4-Hydroxyaminoquinoline N-oxide

4-Quinolinamine, N-hydroxy-, 1-oxide

C9H8N2O2 (176.0585748)


D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens

   

5-Dehydro-4-deoxy-D-glucuronate

4,5-dihydroxy-2,6-dioxohexanoic acid

C6H8O6 (176.0320868)


   

SCHEMBL1332210

3-deoxy-D-glycero-hexo-2,5-diulosonic acid

C6H8O6 (176.0320868)


   

Parapyruvate

4-Hydroxy-4-methyl-2-oxoglutaric acid

C6H8O6 (176.0320868)


   

2-Dehydro-D-glucono-1,5-lactone

4,5-dihydroxy-6-(hydroxymethyl)oxane-2,3-dione

C6H8O6 (176.0320868)


   

2-oxo-6-methylthiohexanoic acid

6-(Methylthio)-2-oxo-hexanoic acid

C7H12O3S (176.0507122)


   

1,2,3-Propanetricarboxylic acid

Tricarballylic acid, trisodium salt

C6H8O6 (176.0320868)


1,2,3-Propanetricarboxylic acid is found in corn. 1,2,3-Propanetricarboxylic acid is isolated from plants e.g. sugarbeet sap, sap of Acer saccharinum (maple syrup). Propane-1,2,3-tricarboxylic acid, also known as tricarballylic acid, carballylic acid, and beta-carboxyglutaric acid, is a tricarboxylic acid that has three carboxylic acid functional groups. The compound is an inhibitor of the enzyme aconitase and interferes with the Krebs cycle. 1,2,3-Propanetricarboxylic acid can be produced by Bacteroides, Butyrivibrio, Megasphaera, Wolinella and fungi Nectriaceae (PMID:22815244; PMID:16346691). It is also associated with Fumonisins. Fumonisins are fungal toxins produced by Fusarium verticilloides. Detection of this compound indicates presence of fumonisins in gastrointestinal tract. Corn intake or corn contaminated with fumonisins can lead to increased levels of tricarballylic acid (PMID:22815244). Isolated from plants e.g. sugarbeet sap, sap of Acer saccharinum (maple syrup) Tricarballylic acid, a conjugate acid of a?tricarballylate, is a competitive inhibitor of the enzyme aconitate hydratase (aconitase; EC 4.2.1.3) with a Ki value of 0.52 mM[1]. Tricarballylic acid, a conjugate acid of a?tricarballylate, is a competitive inhibitor of the enzyme aconitate hydratase (aconitase; EC 4.2.1.3) with a Ki value of 0.52 mM[1]. Tricarballylic acid, a conjugate acid of a?tricarballylate, is a competitive inhibitor of the enzyme aconitate hydratase (aconitase; EC 4.2.1.3) with a Ki value of 0.52 mM[1].

   

4-hydroxy-2,2-bipyrrole-5-carbaldehyde

4-hydroxy-2,2-bipyrrole-5-carbaldehyde

C9H8N2O2 (176.0585748)


   

3-Dehydro-scyllo-inosose

3-Dehydro-scyllo-inosose; 2,4-Didehydroinositol

C6H8O6 (176.0320868)


A beta-diketone obtained by formal oxidation of the 2 and 4 hydroxy groups of scyllo-inositol to the corresponding ketones.

   

Erythorbic acid

Erythorbic acid

C6H8O6 (176.0320868)


D020011 - Protective Agents > D000975 - Antioxidants C26170 - Protective Agent > C275 - Antioxidant

   

(4S,5S)-4,5-Dihydroxy-2,6-dioxohexanoate

(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid

C6H8O6 (176.0320868)


   

D-Galacturonolactone

(R)-2-((2S,3S,4S)-3,4-Dihydroxy-5-oxotetrahydrofuran-2-yl)-2-hydroxyacetaldehyde

C6H8O6 (176.0320868)


   

Glycosmicine

1,2,3,4-Tetrahydro-1-methyl-2,4-dioxoquinazoline

C9H8N2O2 (176.0585748)


   

1-Methyl-3-nitro-1H-indole

1-Methyl-3-nitro-1H-indole

C9H8N2O2 (176.0585748)


   

10-Hydroxy-2,8-decadiene-4,6-diynoic acid

(2E,8Z)-10-hydroxydeca-2,8-dien-4,6-diynoic acid

C10H8O3 (176.0473418)


(E,E)-10-Hydroxy-2,8-decadiene-4,6-diynoic acid is found in mushrooms. (E,E)-10-Hydroxy-2,8-decadiene-4,6-diynoic acid is a constituent of Fistulina hepatica

   

7-Hydroxy-6-methyl-2H-1-benzopyran-2-one

7-Hydroxy-6-methyl-2H-1-benzopyran-2-one

C10H8O3 (176.0473418)


7-Hydroxy-6-methyl-2H-1-benzopyran-2-one is found in herbs and spices. 7-Hydroxy-6-methyl-2H-1-benzopyran-2-one is a constituent of Trachyspermum roxburghianum (Bishops weed). Constituent of Trachyspermum roxburghianum (Bishops weed). 6-Methylumbelliferone is found in herbs and spices.

   

3-(3,4-Methylenedioxyphenyl)propenal

(2Z)-3-(2H-1,3-benzodioxol-5-yl)prop-2-enal

C10H8O3 (176.0473418)


3-(3,4-Methylenedioxyphenyl)propenal is found in herbs and spices. 3-(3,4-Methylenedioxyphenyl)propenal is isolated from Sassafras albidum (sassafras). Isolated from Sassafras albidum (sassafras). 3-(3,4-Methylenedioxyphenyl)propenal is found in tea and herbs and spices.

   

L-3-Amino-2-(oxalylamino)propanoic acid

oxalyldiaminopropionic acid, (L-Ala)-isomer

C5H8N2O5 (176.0433198)


L-3-Amino-2-(oxalylamino)propanoic acid is found in pulses. L-3-Amino-2-(oxalylamino)propanoic acid is present in seeds of Lathyrus sativus (chickling pea). Present in seeds of Lathyrus sativus (chickling pea). L-3-Amino-2-(oxalylamino)propanoic acid is found in pulses.

   

1,4,5-Naphthalenetriol

1,4,5-Trihydroxynaphthalene

C10H8O3 (176.0473418)


1,4,5-Naphthalenetriol is found in nuts. 1,4,5-Naphthalenetriol occurs in green shells of unripe walnuts (Juglans sp.). Occurs in green shells of unripe walnuts (Juglans species). 1,4,5-Naphthalenetriol is found in nuts.

   

Methylthio 2-(propanoyloxy)propanoate

1-(Methylsulphanyl)-1-oxopropan-2-yl propanoic acid

C7H12O3S (176.0507122)


Methylthio 2-(propanoyloxy)propanoate is a flavouring ingredient. Flavouring ingredient

   

(2R)-2-[(3R,4S)-3,4-Dihydroxy-5-oxooxolan-2-yl]-2-hydroxyacetaldehyde

(2R)-2-[(3R,4S)-3,4-Dihydroxy-5-oxooxolan-2-yl]-2-hydroxyacetaldehyde

C6H8O6 (176.0320868)


   

2-(1H-Indazol-3-yl)acetic acid

2-(2H-indazol-3-yl)acetic acid

C9H8N2O2 (176.0585748)


   

4-Quinolinamine, N-hydroxy-, 1-oxide

4-(hydroxyimino)-1,4-dihydroquinolin-1-ol

C9H8N2O2 (176.0585748)


   

5-(1,2-Dihydroxyethyl)-4-hydroxyoxolane-2,3-dione

5-(1,2-dihydroxyethyl)-4-hydroxyoxolane-2,3-dione

C6H8O6 (176.0320868)


   

5-Phenylhydantoin

5-phenyl-5H-imidazole-2,4-diol

C9H8N2O2 (176.0585748)


   

3,4-Dihydroxy-5-[(S)-1,2-dihydroxyethyl]furan-2(5H)-one

5-(1,2-dihydroxyethyl)-3,4-dihydroxy-2,5-dihydrofuran-2-one

C6H8O6 (176.0320868)


The L-form Occurs widely in animals and plants. Good sources are citrus fruits and hip berries. Isolated from ox adrenal cortex, lemons and paprika. [CCD]. Ascorbic acid is found in nanking cherry. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4]. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4].

   

(R)-2-((S)-1,2-Dihydroxyethyl)-4,5-dihydroxyfuran-3(2H)-one

(R)-2-((S)-1,2-Dihydroxyethyl)-4,5-dihydroxyfuran-3(2H)-one

C6H8O6 (176.0320868)


   

Diglyceride

3,6-bis(hydroxymethyl)-1,4-dioxane-2,5-dione

C6H8O6 (176.0320868)


   

Erythrocentaurin

3,4-Dihydro-1-oxo-1H-2-benzopyran-5-carboxaldehyde

C10H8O3 (176.0473418)


   

(3S,4R,5S)-3,4-Dihydroxy-5-(2-hydroxyacetyl)oxolan-2-one

(3S,4R,5S)-3,4-Dihydroxy-5-(2-hydroxyacetyl)oxolan-2-one

C6H8O6 (176.0320868)


   

2-Hydroxy-5-oxohexanedioic acid

2-Hydroxy-5-oxohexanedioic acid

C6H8O6 (176.0320868)


   

(5R)-5-(1,2-Dihydroxyethyl)-3-hydroxyoxolane-2,4-dione

(5R)-5-(1,2-Dihydroxyethyl)-3-hydroxyoxolane-2,4-dione

C6H8O6 (176.0320868)


   

8-Methoxycoumarin

8-methoxy-2H-chromen-2-one

C10H8O3 (176.0473418)


8-methoxycoumarin, also known as 8-methoxy chromen-2-one, belongs to coumarins and derivatives class of compounds. Those are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one). 8-methoxycoumarin is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 8-methoxycoumarin can be found in common wheat, which makes 8-methoxycoumarin a potential biomarker for the consumption of this food product. 8-methoxycoumarin is found in Herniaria glabra, Ayapana triplinervis and in species of the genus Prunus (P. mahaleb, P. pensylvanica, and P. maximowiczii) .

   

5-Hydroxy-2-methylchromone

5-Hydroxy-2-methylchromone

C10H8O3 (176.0473418)


   
   
   

Ascorbic acid

(5R)-5-[(1S)-1,2-dihydroxyethyl]-3,4-dihydroxy-2,5-dihydrofuran-2-one

C6H8O6 (176.0320868)


Ascorbic acid is found naturally in citrus fruits and many vegetables and is an essential nutrient in human diets. It is necessary to maintain connective tissue and bone. The biologically active form of ascorbic acid is vitamin C. Vitamin C is a water soluble vitamin. Primates (including humans) and a few other species in all divisions of the animal kingdom, notably the guinea pig, have lost the ability to synthesize ascorbic acid and must obtain it in their food. Vitamin C functions as a reducing agent and coenzyme in several metabolic pathways. Vitamin C is considered an antioxidant (PubChem). Ascorbic acid is an electron donor for enzymes involved in collagen hydroxylation, biosynthesis of carnitine and norepinephrine, tyrosine metabolism, and amidation of peptide hormones. Ascrobic acid (vitamin C) deficiency causes scurvy. The amount of vitamin C necessary to prevent scurvy may not be adequate to maintain optimal health. The ability of vitamin C to donate electrons also makes it a potent water-soluble antioxidant that readily scavenges free radicals such as molecular oxygen, superoxide, hydroxyl radical, and hypochlorous acid. In this setting, several mechanisms could account for a link between vitamin C and heart disease. One is the relation between LDL oxidation and vitamins C and E. Vitamin C in vitro can recycle vitamin E, which can donate electrons to prevent LDL oxidation in vitro. As the lipid-phase vitamin E is oxidized, it can be regenerated by aqueous vitamin C. Other possibilities are that vitamin C could decrease cholesterol by mechanisms not well characterized, or could improve vasodilatation and vascular reactivity, perhaps by decreasing the interactions of nitric oxide with oxidants (PMID: 10799361). Moreover, ascorbic acid is found to be associated with hyperoxalemia, which is an inborn error of metabolism. Ascorbic acid is also a microbial metabolite produced by Ketogulonicigenium (PMID: 15785002). Occurs widely in animals and plants. Good sources are citrus fruits and hip berries. Isolated from ox adrenal cortex, lemons and paprika. Production industrially on a large scale from glucose. Vitamin (antiscorbutic), antioxidant, nutrient, preservative consistency enhancer. It is used to reduce discoloration, mainly browning caused by polyphenol oxidase, in fruit and vegetable products. It is used to enhance colour formn. and to reduced the formn. of nitrosamines in meat products. It is used synergistically with Sulfur dioxide HVF10-P in wine and beer as a perservative. Assists formn. of the gluten network in bread making, thus enhancing bread volume. L-Ascorbic acid is found in many foods, some of which are cabbage, hyssop, ginseng, and pancake. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4]. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4].

   

6-Methylthio-2-oxohexanoic acid

6-Methylthio-2-oxohexanoic acid

C7H12O3S (176.0507122)


   

Ascorbic Acid

5-(1,2-dihydroxyethyl)-3,4-dihydroxy-2,5-dihydrofuran-2-one

C6H8O6 (176.0320868)


L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4]. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4].

   
   

6-Hydroxy-4-methylcoumarin

6-Hydroxy-4-methylcoumarin, 6-Hydroxy-4-methyl-2-benzopyrone

C10H8O3 (176.0473418)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.663 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.664 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.659

   

3-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

3-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

C6H6F2N2O2 (176.03973200000001)


   

2-Hydroxy-2-methyl-4-oxopentanedioic acid

2-Hydroxy-2-methyl-4-oxopentanedioic acid

C6H8O6 (176.0320868)


   

6-hydroxy-7-methyl-2H-chromen-2-one

6-hydroxy-7-methyl-2H-chromen-2-one

C10H8O3 (176.0473418)


   

7-hydroxy-3-methyl-2H-chromen-2-one

7-hydroxy-3-methyl-2H-chromen-2-one

C10H8O3 (176.0473418)


   

thiolane-2,5-dicarboxylic acid

thiolane-2,5-dicarboxylic acid

C6H8O4S (176.0143288)


   

Naphthalenetriol

Naphthalenetriol

C10H8O3 (176.0473418)


   
   

8-methoxycoumarin

8-methoxycoumarin

C10H8O3 (176.0473418)


   

5-hydroxy-2-methyl-4H-chromen-4-one

5-hydroxy-2-methyl-4H-chromen-4-one

C10H8O3 (176.0473418)


   

4-hydroxy-5-methylcoumarin

4-hydroxy-5-methylcoumarin

C10H8O3 (176.0473418)


   

Naphthalene-1,2,4-triol

Naphthalene-1,2,4-triol

C10H8O3 (176.0473418)


   

8-Hydroxy-2-methyl-4H-1-benzopyran-4-one

8-Hydroxy-2-methyl-4H-1-benzopyran-4-one

C10H8O3 (176.0473418)


   

NU1025

8-Hydroxy-2-methylquinazolin-4(3H)-one

C9H8N2O2 (176.0585748)


   
   
   

D-Mannurono-6,3-lactone

D-Mannurono-6,3-lactone

C6H8O6 (176.0320868)


   

3-methoxychromen-2-one

3-methoxychromen-2-one

C10H8O3 (176.0473418)


   

1,3,8-naphthalenetriol

1,3,8-naphthalenetriol

C10H8O3 (176.0473418)


   

4-acetylisobenzofuran-1(3H)-one

4-acetylisobenzofuran-1(3H)-one

C10H8O3 (176.0473418)


   

5-hydroxy-4-methyl-2H-1-benzopyran-2-one

5-hydroxy-4-methyl-2H-1-benzopyran-2-one

C10H8O3 (176.0473418)


   

Desacylbaldrinal

Desacylbaldrinal

C10H8O3 (176.0473418)


   

5-METHOXYCOUMARIN

5-METHOXYCOUMARIN

C10H8O3 (176.0473418)


   

5-hydroxy-4-phenylfuran-2(5H)-one

5-hydroxy-4-phenylfuran-2(5H)-one

C10H8O3 (176.0473418)


   

Erythrocentaurin

5-Formyl-3,4-dihydroisocoumarin; 1-Oxo-3,4-dihydroisochromene-5-carbaldehyde

C10H8O3 (176.0473418)


Erythrocentaurin is a natural product found in Swertia decora, Gentiana pedicellata, and other organisms with data available.

   

5-hydroxy-2,3-dihydronaphthalene-1,4-dione

5-hydroxy-2,3-dihydronaphthalene-1,4-dione

C10H8O3 (176.0473418)


   

6-methoxycoumarin

6-methoxycoumarin

C10H8O3 (176.0473418)


   

Dimethyl dihydroxyfumarate

Dimethyl dihydroxyfumarate

C6H8O6 (176.0320868)


   

4-Hydroxy-3-methyl-2H-chromen-2-one

4-Hydroxy-3-methyl-2H-chromen-2-one

C10H8O3 (176.0473418)


   

5-methyl-4-phenyl-1,2,3-thiadiazole

5-methyl-4-phenyl-1,2,3-thiadiazole

C9H8N2S (176.0408168)


   

7-Methoxy-4H-chromen-4-one

7-Methoxy-4H-chromen-4-one

C10H8O3 (176.0473418)


   

4-deoxy-L-threo-hex-4-enopyranuronate

4-deoxy-L-threo-hex-4-enopyranuronate

C6H8O6 (176.0320868)


   

Hymecromone

7-HYDROXY-4-METHYLCOUMARIN

C10H8O3 (176.0473418)


CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3335; ORIGINAL_PRECURSOR_SCAN_NO 3333 A - Alimentary tract and metabolism > A05 - Bile and liver therapy > A05A - Bile therapy COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3322; ORIGINAL_PRECURSOR_SCAN_NO 3320 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3312; ORIGINAL_PRECURSOR_SCAN_NO 3309 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3317; ORIGINAL_PRECURSOR_SCAN_NO 3316 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3331; ORIGINAL_PRECURSOR_SCAN_NO 3329 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3329; ORIGINAL_PRECURSOR_SCAN_NO 3326 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7326; ORIGINAL_PRECURSOR_SCAN_NO 7323 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7324; ORIGINAL_PRECURSOR_SCAN_NO 7320 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7332; ORIGINAL_PRECURSOR_SCAN_NO 7328 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7358; ORIGINAL_PRECURSOR_SCAN_NO 7356 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7358; ORIGINAL_PRECURSOR_SCAN_NO 7355 CONFIDENCE standard compound; INTERNAL_ID 967; DATASET 20200303_ENTACT_RP_MIX502; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7342; ORIGINAL_PRECURSOR_SCAN_NO 7340 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3396; ORIGINAL_PRECURSOR_SCAN_NO 3391 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3389; ORIGINAL_PRECURSOR_SCAN_NO 3387 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3360; ORIGINAL_PRECURSOR_SCAN_NO 3358 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3383; ORIGINAL_PRECURSOR_SCAN_NO 3380 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3365; ORIGINAL_PRECURSOR_SCAN_NO 3363 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3363; ORIGINAL_PRECURSOR_SCAN_NO 3361 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7291; ORIGINAL_PRECURSOR_SCAN_NO 7286 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7335; ORIGINAL_PRECURSOR_SCAN_NO 7331 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7307; ORIGINAL_PRECURSOR_SCAN_NO 7303 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7337; ORIGINAL_PRECURSOR_SCAN_NO 7335 CONFIDENCE standard compound; INTERNAL_ID 207; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7336; ORIGINAL_PRECURSOR_SCAN_NO 7332 CONFIDENCE standard compound; INTERNAL_ID 4193 4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects. 4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects.

   

ascorbate

L-Ascorbic acid

C6H8O6 (176.0320868)


L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4]. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4].

   

4-Methylumbelliferone

7-HYDROXY-4-METHYLCOUMARIN

C10H8O3 (176.0473418)


4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects. 4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects.

   

Carbamoyl-DL-aspartic acid

N-​Carbamoyl-​DL-​aspartic acid

C5H8N2O5 (176.0433198)


N-?Carbamoyl-?DL-?aspartic acid (Ureidosuccinic acid) is a precursor of nucleic acid pyrimidines[1].

   

7-methoxychromen-2-one

NCGC00095528-05!7-methoxychromen-2-one

C10H8O3 (176.0473418)


   

7-hydroxy-4-methylchromen-2-one

NCGC00016345-11!7-hydroxy-4-methylchromen-2-one

C10H8O3 (176.0473418)


   

L-Ascorbic acid

L-Ascorbic acid

C6H8O6 (176.0320868)


The L-enantiomer of ascorbic acid and conjugate acid of L-ascorbate.

   

Ureidosuccinic acid

Ureidosuccinic acid

C5H8N2O5 (176.0433198)


   

Allantoic acid

Allantoic acid

C4H8N4O4 (176.0545528)


A member of the class of ureas that consists of acetic acid in which the two methyl hydrogens are replaced by carbamoylamino groups respectively. Allantoic acid is a degradative product of uric acid and associated with purine metabolism[1][2][3].

   

pemoline

pemoline

C9H8N2O2 (176.0585748)


N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics > N06BA - Centrally acting sympathomimetics D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant

   

herniarin

7-Methoxycoumarin

C10H8O3 (176.0473418)


Herniarin is a natural coumarin occurs in some flowering plants, with antitumor effect. Herniarin is a natural coumarin occurs in some flowering plants, with antitumor effect.

   

2-(hydroxymethyl)-4(3H)-quinazolinone

2-(hydroxymethyl)-4(3H)-quinazolinone

C9H8N2O2 (176.0585748)


   

Fluxapyroxad (BAS 700 F)-TP CSAA798670

3-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

C6H6F2N2O2 (176.03973200000001)


CONFIDENCE standard compound; UCHEM_ID 4184 UCHEM_ID 4184; CONFIDENCE standard compound

   
   

D-Glucuronolactone

D(+)-Glucurono-3,6-lactone

C6H8O6 (176.0320868)


D-Glucuronic acid lactone is an endogenous metabolite.

   

Tricarballylic acid; LC-tDDA; CE10

Tricarballylic acid; LC-tDDA; CE10

C6H8O6 (176.0320868)


   

Tricarballylic acid; LC-tDDA; CE20

Tricarballylic acid; LC-tDDA; CE20

C6H8O6 (176.0320868)


   

Tricarballylic acid; LC-tDDA; CE30

Tricarballylic acid; LC-tDDA; CE30

C6H8O6 (176.0320868)


   

Tricarballylic acid; LC-tDDA; CE40

Tricarballylic acid; LC-tDDA; CE40

C6H8O6 (176.0320868)


   

Ureidosuccinic acid; LC-tDDA; CE10

Ureidosuccinic acid; LC-tDDA; CE10

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; LC-tDDA; CE20

Ureidosuccinic acid; LC-tDDA; CE20

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; LC-tDDA; CE30

Ureidosuccinic acid; LC-tDDA; CE30

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; LC-tDDA; CE40

Ureidosuccinic acid; LC-tDDA; CE40

C5H8N2O5 (176.0433198)


   

Allantoic acid; LC-tDDA; CE10

Allantoic acid; LC-tDDA; CE10

C4H8N4O4 (176.0545528)


   

Allantoic acid; LC-tDDA; CE20

Allantoic acid; LC-tDDA; CE20

C4H8N4O4 (176.0545528)


   

Allantoic acid; LC-tDDA; CE30

Allantoic acid; LC-tDDA; CE30

C4H8N4O4 (176.0545528)


   

Allantoic acid; LC-tDDA; CE40

Allantoic acid; LC-tDDA; CE40

C4H8N4O4 (176.0545528)


   

Ureidosuccinic acid; AIF; CE0; CorrDec

Ureidosuccinic acid; AIF; CE0; CorrDec

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; AIF; CE10; CorrDec

Ureidosuccinic acid; AIF; CE10; CorrDec

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; AIF; CE30; CorrDec

Ureidosuccinic acid; AIF; CE30; CorrDec

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; AIF; CE0; MS2Dec

Ureidosuccinic acid; AIF; CE0; MS2Dec

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; AIF; CE10; MS2Dec

Ureidosuccinic acid; AIF; CE10; MS2Dec

C5H8N2O5 (176.0433198)


   

Ureidosuccinic acid; AIF; CE30; MS2Dec

Ureidosuccinic acid; AIF; CE30; MS2Dec

C5H8N2O5 (176.0433198)


   

Allantoic acid; AIF; CE0; CorrDec

Allantoic acid; AIF; CE0; CorrDec

C4H8N4O4 (176.0545528)


   

Allantoic acid; AIF; CE10; CorrDec

Allantoic acid; AIF; CE10; CorrDec

C4H8N4O4 (176.0545528)


   

Allantoic acid; AIF; CE30; CorrDec

Allantoic acid; AIF; CE30; CorrDec

C4H8N4O4 (176.0545528)


   

Allantoic acid [M+Na]+; AIF; CE0; CorrDec

Allantoic acid [M+Na]+; AIF; CE0; CorrDec

C4H8N4O4 (176.0545528)


   

Allantoic acid [M+Na]+; AIF; CE10; CorrDec

Allantoic acid [M+Na]+; AIF; CE10; CorrDec

C4H8N4O4 (176.0545528)


   

Allantoic acid [M+Na]+; AIF; CE30; CorrDec

Allantoic acid [M+Na]+; AIF; CE30; CorrDec

C4H8N4O4 (176.0545528)


   

Allantoic acid; AIF; CE0; MS2Dec

Allantoic acid; AIF; CE0; MS2Dec

C4H8N4O4 (176.0545528)


   

Allantoic acid; AIF; CE10; MS2Dec

Allantoic acid; AIF; CE10; MS2Dec

C4H8N4O4 (176.0545528)


   

Allantoic acid; AIF; CE30; MS2Dec

Allantoic acid; AIF; CE30; MS2Dec

C4H8N4O4 (176.0545528)


   

Allantoic acid [M+Na]+; AIF; CE0; MS2Dec

Allantoic acid [M+Na]+; AIF; CE0; MS2Dec

C4H8N4O4 (176.0545528)


   

Allantoic acid [M+Na]+; AIF; CE10; MS2Dec

Allantoic acid [M+Na]+; AIF; CE10; MS2Dec

C4H8N4O4 (176.0545528)


   

Allantoic acid [M+Na]+; AIF; CE30; MS2Dec

Allantoic acid [M+Na]+; AIF; CE30; MS2Dec

C4H8N4O4 (176.0545528)


   

Tricarballylic acid

Tricarballylic acid

C6H8O6 (176.0320868)


Tricarballylic acid, a conjugate acid of a?tricarballylate, is a competitive inhibitor of the enzyme aconitate hydratase (aconitase; EC 4.2.1.3) with a Ki value of 0.52 mM[1]. Tricarballylic acid, a conjugate acid of a?tricarballylate, is a competitive inhibitor of the enzyme aconitate hydratase (aconitase; EC 4.2.1.3) with a Ki value of 0.52 mM[1]. Tricarballylic acid, a conjugate acid of a?tricarballylate, is a competitive inhibitor of the enzyme aconitate hydratase (aconitase; EC 4.2.1.3) with a Ki value of 0.52 mM[1].

   

2-Propenal, 3-(1,3-benzodioxol-5-yl)-

2-Propenal, 3-(1,3-benzodioxol-5-yl)-

C10H8O3 (176.0473418)


   

N-Carbamoyl-DL-aspartic acid

N-​Carbamoyl-​DL-​aspartic acid

C5H8N2O5 (176.0433198)


N-?Carbamoyl-?DL-?aspartic acid (Ureidosuccinic acid) is a precursor of nucleic acid pyrimidines[1].

   

3,4,5-Trifluorobenzoic acid

3,4,5-Trifluorobenzoic acid

C7H3F3O2 (176.0085134)


   

7-METHOXYCHROMONE

7-METHOXYCHROMONE

C10H8O3 (176.0473418)


   

4-phenyl-5-methyl-1,2,3-Thiadiazole

4-phenyl-5-methyl-1,2,3-Thiadiazole

C9H8N2S (176.0408168)


   

10-hydroxy-8E-Decene-2,4,6-triynoic acid

10-hydroxy-8E-Decene-2,4,6-triynoic acid

C10H8O3 (176.0473418)


   

10-Hydroxymatricaric acid

(2E,8Z)-10-hydroxydeca-2,8-dien-4,6-diynoic acid

C10H8O3 (176.0473418)


   

a-Hydrojuglone

1,4,5-Trihydroxynaphthalene

C10H8O3 (176.0473418)


   

6-Methylumbelliferone

7-Hydroxy-6-methyl-2H-1-benzopyran-2-one

C10H8O3 (176.0473418)


   

Piperonylacrolein

(2Z)-3-(2H-1,3-benzodioxol-5-yl)prop-2-enal

C10H8O3 (176.0473418)


   

oxalyldiaminopropionic acid

3-amino-2-(carboxyformamido)propanoic acid

C5H8N2O5 (176.0433198)


   

FEMA 3790

1-(methylsulfanyl)-1-oxopropan-2-yl propanoate

C7H12O3S (176.0507122)


   

FA 10:6;O

10-hydroxy-2Z,8Z-Decadiene-4,6-diynoic acid

C10H8O3 (176.0473418)


   

FA 6:2;O4

(4S)-4,6-dihydroxy-2,5-dioxohexanoic acid;3-deoxy-D-glycero-hexo-2,5-diulosonic acid

C6H8O6 (176.0320868)


   

6-Methyl-2,4(1H,3H)-quinazolinedione

6-Methyl-2,4(1H,3H)-quinazolinedione

C9H8N2O2 (176.0585748)


   

2-Methyl-1-benzofuran-4-carboxylic acid

2-Methyl-1-benzofuran-4-carboxylic acid

C10H8O3 (176.0473418)


   

4-(3-HYDROXY-PROP-1-YNYL)-BENZOIC ACID

4-(3-HYDROXY-PROP-1-YNYL)-BENZOIC ACID

C10H8O3 (176.0473418)


   
   

7-Methoxy-1,8-naphthyridin-2(1H)-one

7-Methoxy-1,8-naphthyridin-2(1H)-one

C9H8N2O2 (176.0585748)


   

7-Methoxy-6-azaindole-3-carbaldehyde

7-Methoxy-6-azaindole-3-carbaldehyde

C9H8N2O2 (176.0585748)


   

6-Methoxy-5-azaindole-3-carbaldehyde

6-Methoxy-5-azaindole-3-carbaldehyde

C9H8N2O2 (176.0585748)


   

7-Methoxy-4-azaindole-3-carbaldehyde

7-Methoxy-4-azaindole-3-carbaldehyde

C9H8N2O2 (176.0585748)


   
   

2-Trifluoromethylphenylhydrazine

2-Trifluoromethylphenylhydrazine

C7H7F3N2 (176.0561298)


   

7-methoxy-1H-1,5-naphthyridin-4-one

7-methoxy-1H-1,5-naphthyridin-4-one

C9H8N2O2 (176.0585748)


   

1H-imidazo[4,5-f][2,1,3]benzothiadiazole

1H-imidazo[4,5-f][2,1,3]benzothiadiazole

C7H4N4S (176.0156664)


   
   

Ethyl 2-cyanonicotinate

Ethyl 2-cyanonicotinate

C9H8N2O2 (176.0585748)


   

Sodium 2-amino-4-nitrophenolate

Sodium 2-amino-4-nitrophenolate

C6H5N2NaO3 (176.019786)


   

2-Methyl-5-nitro-1H-indole

1H-Indole,2-methyl-5-nitro-

C9H8N2O2 (176.0585748)


   

ibotenic acid monohydrate

ibotenic acid monohydrate

C5H8N2O5 (176.0433198)


   

Cyclohexane,1-bromo-3-methyl-

Cyclohexane,1-bromo-3-methyl-

C7H13Br (176.0200558)


   

3-ACETYLIMIDAZO[1,2-A]PYRIDIN-2(3H)-ONE

3-ACETYLIMIDAZO[1,2-A]PYRIDIN-2(3H)-ONE

C9H8N2O2 (176.0585748)


   
   

1H-indole-4-carbothioamide

1H-indole-4-carbothioamide

C9H8N2S (176.0408168)


   

1H-Indole-5-carbothioamide

1H-Indole-5-carbothioamide

C9H8N2S (176.0408168)


   

1H-Indole-6-carbothioamide

1H-Indole-6-carbothioamide

C9H8N2S (176.0408168)


   

Methyl imidazo[1,2-a]pyridine-8-carboxylate

Methyl imidazo[1,2-a]pyridine-8-carboxylate

C9H8N2O2 (176.0585748)


   
   

5-methylpyrazolo[1,5-a]pyridine-3-carboxylic acid

5-methylpyrazolo[1,5-a]pyridine-3-carboxylic acid

C9H8N2O2 (176.0585748)


   

5-Methyl-imidazo[1,2-a]pyridine-2-carboxylic acid

5-Methyl-imidazo[1,2-a]pyridine-2-carboxylic acid

C9H8N2O2 (176.0585748)


   

1-Methyl-1H-benzo[d]imidazole-6-carboxylic acid

1-Methyl-1H-benzo[d]imidazole-6-carboxylic acid

C9H8N2O2 (176.0585748)


   

5-chloro-3-cyanoindole

5-chloro-3-cyanoindole

C9H5ClN2 (176.014124)


   

6-Chloro-1H-indole-3-carbonitrile

6-Chloro-1H-indole-3-carbonitrile

C9H5ClN2 (176.014124)


   

6-methylimidazo[1,2-a]pyridine-2-carboxylicacid

6-methylimidazo[1,2-a]pyridine-2-carboxylicacid

C9H8N2O2 (176.0585748)


   

2-Methyl-6-(trifluoromethyl)-3-pyridinamine

2-Methyl-6-(trifluoromethyl)-3-pyridinamine

C7H7F3N2 (176.0561298)


   

Cyano temozolomide

Cyano temozolomide

C6H4N6O (176.0446574)


   

(2,4,5-Trifluorophenyl)boronic acid

(2,4,5-Trifluorophenyl)boronic acid

C6H4BF3O2 (176.025643)


   

3-PHENYLISOTHIAZOL-5-AMINE

3-PHENYLISOTHIAZOL-5-AMINE

C9H8N2S (176.0408168)


   

2,3-Dimethyl-4-nitrobenzonitrile

2,3-Dimethyl-4-nitrobenzonitrile

C9H8N2O2 (176.0585748)


   

1H-Pyrrolo[3,2-c]pyridine-2-carboxylic acid, Methyl ester

1H-Pyrrolo[3,2-c]pyridine-2-carboxylic acid, Methyl ester

C9H8N2O2 (176.0585748)


   

methyl 4-amino-3-cyanobenzoate

methyl 4-amino-3-cyanobenzoate

C9H8N2O2 (176.0585748)


   

methyl 2-amino-5-cyanobenzoate

methyl 2-amino-5-cyanobenzoate

C9H8N2O2 (176.0585748)


   

2-Methyl-1H-benzimidazole-5-carboxylic acid

2-Methyl-1H-benzimidazole-5-carboxylic acid

C9H8N2O2 (176.0585748)


   

3-(TRIFLUOROMETHYL)PHENYLHYDRAZINE

3-(TRIFLUOROMETHYL)PHENYLHYDRAZINE

C7H7F3N2 (176.0561298)


   

Pyrrolo[1,2-a]thieno[3,2-e]pyrazine, 4,5-dihydro- (9CI)

Pyrrolo[1,2-a]thieno[3,2-e]pyrazine, 4,5-dihydro- (9CI)

C9H8N2S (176.0408168)


   

5-acetyl-1,3-dihydrobenzimidazol-2-one

5-acetyl-1,3-dihydrobenzimidazol-2-one

C9H8N2O2 (176.0585748)


   

4-(5-methyl-1,2,4-oxadiazol-3-ylidene)cyclohexa-2,5-dien-1-one

4-(5-methyl-1,2,4-oxadiazol-3-ylidene)cyclohexa-2,5-dien-1-one

C9H8N2O2 (176.0585748)


   

4-(Trifluormethyl)benzol-1,2-diamin

4-(Trifluormethyl)benzol-1,2-diamin

C7H7F3N2 (176.0561298)


   

2,5-Diaminobenzo-Trifluoride

2,5-Diaminobenzo-Trifluoride

C7H7F3N2 (176.0561298)


   

3,4,5-Trifluorophenylboronic acid

3,4,5-Trifluorophenylboronic acid

C6H4BF3O2 (176.025643)


   

3-Oxoindane-1-carboxylic acid

3-Oxoindane-1-carboxylic acid

C10H8O3 (176.0473418)


   

5-(2-FURYL)-1-METHYL-1H-PYRAZOLE-3-CARBALDEHYDE

5-(2-FURYL)-1-METHYL-1H-PYRAZOLE-3-CARBALDEHYDE

C9H8N2O2 (176.0585748)


   

1-Methyl-3-indazolecarboxylic acid

1-Methyl-3-indazolecarboxylic acid

C9H8N2O2 (176.0585748)


   

3-Methylbenzofuran-2-carboxylic acid

3-Methylbenzofuran-2-carboxylic acid

C10H8O3 (176.0473418)


   

(2-Fluoro-4-methyl-phenyl)-hydrazine hydrochloride

(2-Fluoro-4-methyl-phenyl)-hydrazine hydrochloride

C7H10ClFN2 (176.05165019999998)


   

2-Acetyl-7-hydroxybenzofuran

2-Acetyl-7-hydroxybenzofuran

C10H8O3 (176.0473418)


   

2,2,2-trifluoro-1-pyridin-2-yl-ethylamine

2,2,2-trifluoro-1-pyridin-2-yl-ethylamine

C7H7F3N2 (176.0561298)


   

3-Oxo-2,3-dihydro-1H-indene-5-carboxylic acid

3-Oxo-2,3-dihydro-1H-indene-5-carboxylic acid

C10H8O3 (176.0473418)


   

2,2,2-Trifluoro-1-(pyridin-3-yl)ethanamine

2,2,2-Trifluoro-1-(pyridin-3-yl)ethanamine

C7H7F3N2 (176.0561298)


   

Phthalic anhydride, 3,6-dimethyl-

Phthalic anhydride, 3,6-dimethyl-

C10H8O3 (176.0473418)


   

5-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

5-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

C9H8N2O2 (176.0585748)


   

(1R)-2,2,2-Trifluoro-1-phenylethanol

(1R)-2,2,2-Trifluoro-1-phenylethanol

C8H7F3O (176.0448968)


   
   

2-(2,4,5-Trifluorophenyl)ethanol

2-(2,4,5-Trifluorophenyl)ethanol

C8H7F3O (176.0448968)


   

2-Amino-5-cyano-3-methylbenzoic acid

2-Amino-5-cyano-3-methylbenzoic acid

C9H8N2O2 (176.0585748)


   

1-Oxo-4-indanecarboxylic acid

1-Oxo-4-indanecarboxylic acid

C10H8O3 (176.0473418)


   

1H-Pyrazole-4-carbonyl chloride, 5-fluoro-1,3-dimethyl- (9CI)

1H-Pyrazole-4-carbonyl chloride, 5-fluoro-1,3-dimethyl- (9CI)

C6H6ClFN2O (176.0152668)


   

benzofuran-5-yl-acetic acid

benzofuran-5-yl-acetic acid

C10H8O3 (176.0473418)


   

4-(Methylsulfonyl)cyclohexanone

4-(Methylsulfonyl)cyclohexanone

C7H12O3S (176.0507122)


   

Imidazo[1,2-a]pyridine-6-carboxylic acid

Imidazo[1,2-a]pyridine-6-carboxylic acid

C9H8N2O2 (176.0585748)


   

4-Trifluoromethylanisole

4-Trifluoromethylanisole

C8H7F3O (176.0448968)


   

(1H-benzoimidazol-2-yl)acetic acid

(1H-benzoimidazol-2-yl)acetic acid

C9H8N2O2 (176.0585748)


   

[3-(Trifluoromethyl)phenyl]methanol

[3-(Trifluoromethyl)phenyl]methanol

C8H7F3O (176.0448968)


   

7-hydroxy-2-methyl-chromen-4-one

7-hydroxy-2-methyl-chromen-4-one

C10H8O3 (176.0473418)


   

3-Methyl-6-nitro-1H-indole

3-Methyl-6-nitro-1H-indole

C9H8N2O2 (176.0585748)


   

2-Methyl-2H-indazole-3-carboxylic acid

2-Methyl-2H-indazole-3-carboxylic acid

C9H8N2O2 (176.0585748)


   

1H-2-Benzopyran-1,3,4-trione

1H-2-Benzopyran-1,3,4-trione

C9H4O4 (176.0109584)


   

1-phenyl-2,2,2-trifluoroethanol

1-phenyl-2,2,2-trifluoroethanol

C8H7F3O (176.0448968)


   

(1S)-2,2,2-Trifluoro-1-phenylethanol

(1S)-2,2,2-Trifluoro-1-phenylethanol

C8H7F3O (176.0448968)


   

7-METHOXYBENZOFURAN-2-CARBALDEHYDE

7-METHOXYBENZOFURAN-2-CARBALDEHYDE

C10H8O3 (176.0473418)


   

4-Chloro-1H-indole-3-carbonitrile

4-Chloro-1H-indole-3-carbonitrile

C9H5ClN2 (176.014124)


   

6-Nitro-2-methylindole

6-Nitro-2-methylindole

C9H8N2O2 (176.0585748)


   

6-HYDROXY-3-METHYLQUINAZOLIN-4(3H)-ONE

6-HYDROXY-3-METHYLQUINAZOLIN-4(3H)-ONE

C9H8N2O2 (176.0585748)


   

(2-(Trifluoromethyl)pyridin-3-yl)methanamine

(2-(Trifluoromethyl)pyridin-3-yl)methanamine

C7H7F3N2 (176.0561298)


   

3-Methyl-1H-indazole-6-carboxylic acid

3-Methyl-1H-indazole-6-carboxylic acid

C9H8N2O2 (176.0585748)


   

1H-pyrrolo[2,3-b]pyridin-3-yl acetate

1H-pyrrolo[2,3-b]pyridin-3-yl acetate

C9H8N2O2 (176.0585748)


   

methyl 5-(cyanomethyl)pyridine-3-carboxylate

methyl 5-(cyanomethyl)pyridine-3-carboxylate

C9H8N2O2 (176.0585748)


   

Methyl 1-benzofuran-6-carboxylate

Methyl 1-benzofuran-6-carboxylate

C10H8O3 (176.0473418)


   

2-Ethyl-4-nitrobenzonitrile

2-Ethyl-4-nitrobenzonitrile

C9H8N2O2 (176.0585748)


   
   

2(1H)-Quinoxalinethione,3-methyl-(9CI)

2(1H)-Quinoxalinethione,3-methyl-(9CI)

C9H8N2S (176.0408168)


   

2,3,4-Trifluorophenylboronic acid

2,3,4-Trifluorophenylboronic acid

C6H4BF3O2 (176.025643)


   

6-Aminoindole-3-carboxylic acid

6-Aminoindole-3-carboxylic acid

C9H8N2O2 (176.0585748)


   

7-methylimidazo[1,2-a]pyridine-3-carboxylic acid

7-methylimidazo[1,2-a]pyridine-3-carboxylic acid

C9H8N2O2 (176.0585748)


   

2,4,6-Trifluorophenylboronic acid

2,4,6-Trifluorophenylboronic acid

C6H4BF3O2 (176.025643)


   

8-Methylimidazo[1,2-a]pyridine-2-carboxylic acid

8-Methylimidazo[1,2-a]pyridine-2-carboxylic acid

C9H8N2O2 (176.0585748)


   

5-Methoxy-1H-indazole-3-carbaldehyde

5-Methoxy-1H-indazole-3-carbaldehyde

C9H8N2O2 (176.0585748)


   

1H-Imidazole-4-sulfonamide,5-amino-1-methyl-

1H-Imidazole-4-sulfonamide,5-amino-1-methyl-

C4H8N4O2S (176.0367948)


   

Naphthalene,1-chloro-4-methyl-

Naphthalene,1-chloro-4-methyl-

C11H9Cl (176.03927439999998)


   

3,4-Dihydro-1H-1,4-benzodiazepine-2,5-dione

3,4-Dihydro-1H-1,4-benzodiazepine-2,5-dione

C9H8N2O2 (176.0585748)


   

4-Hydroxy-1H-indole-7-carboxamide

4-Hydroxy-1H-indole-7-carboxamide

C9H8N2O2 (176.0585748)


   

(S)-2,3-DIAMINOPROPANOIC ACID DIHYDROCHLORIDE

(S)-2,3-DIAMINOPROPANOIC ACID DIHYDROCHLORIDE

C3H10Cl2N2O2 (176.01193)


   

3-formyl-4-nitrobenzonitrile

3-formyl-4-nitrobenzonitrile

C8H4N2O3 (176.0221914)


   

2,2,2-TRIFLUORO-1-(PYRAZIN-2-YL)ETHANONE

2,2,2-TRIFLUORO-1-(PYRAZIN-2-YL)ETHANONE

C6H3F3N2O (176.01974639999997)


   

Methyl imidazo[1,2-a]pyridine-5-carboxylate

Methyl imidazo[1,2-a]pyridine-5-carboxylate

C9H8N2O2 (176.0585748)


   

3-(Trifluoromethoxy)toluene

3-(Trifluoromethoxy)toluene

C8H7F3O (176.0448968)


   

1-Indanone-5-carboxylic acid

1-Indanone-5-carboxylic acid

C10H8O3 (176.0473418)


   

7-METHYLQUINAZOLINE-2,4(1H,3H)-DIONE

7-METHYLQUINAZOLINE-2,4(1H,3H)-DIONE

C9H8N2O2 (176.0585748)


   

2-(2-methyl-5-nitrophenyl)acetonitrile

2-(2-methyl-5-nitrophenyl)acetonitrile

C9H8N2O2 (176.0585748)


   

(3-TRIMETHYLSILYL-2-PROPYNYL)TRIPHENYLPHOSPHONIUMBROMIDE

(3-TRIMETHYLSILYL-2-PROPYNYL)TRIPHENYLPHOSPHONIUMBROMIDE

C9H8N2O2 (176.0585748)


   

5-methoxy-1H-pyrrolo[3,2-b]pyridine-2-carbaldehyde

5-methoxy-1H-pyrrolo[3,2-b]pyridine-2-carbaldehyde

C9H8N2O2 (176.0585748)


   

5-Fluoro-2-methylphenylhydrazine hydrochloride

5-Fluoro-2-methylphenylhydrazine hydrochloride

C7H10ClFN2 (176.05165019999998)


   

4-Phenyl-1,3-thiazol-2-amine

4-Phenyl-1,3-thiazol-2-amine

C9H8N2S (176.0408168)


   

2-(1H-benzimidazol-4-yl)acetic acid

2-(1H-benzimidazol-4-yl)acetic acid

C9H8N2O2 (176.0585748)


   

4-amino-1H-indole-2-carboxylic acid

4-amino-1H-indole-2-carboxylic acid

C9H8N2O2 (176.0585748)


   

Methyl 1H-pyrrolo[2,3-c]pyridine-7-carboxylate

Methyl 1H-pyrrolo[2,3-c]pyridine-7-carboxylate

C9H8N2O2 (176.0585748)


   

4-methoxycoumarin

4-methoxycoumarin

C10H8O3 (176.0473418)


   

4-(Thiazol-2-yl)aniline

4-(Thiazol-2-yl)aniline

C9H8N2S (176.0408168)


   

4-Amino-n-methylphthalimide

4-Amino-n-methylphthalimide

C9H8N2O2 (176.0585748)


   

4-oxo-4-phenylbut-2-enoic acid

4-oxo-4-phenylbut-2-enoic acid

C10H8O3 (176.0473418)


   

(Bromomethyl)cyclohexane

(Bromomethyl)cyclohexane

C7H13Br (176.0200558)


   

2-Amino-5,6-dihydro-4H-cyclopentathiazole hydrochloride

2-Amino-5,6-dihydro-4H-cyclopentathiazole hydrochloride

C6H9ClN2S (176.0174944)


   

1-Chloromethyl naphthalene

1-(Chloromethyl)naphthalene

C11H9Cl (176.03927439999998)


   

5,6-Methylenedioxy-1-indanone

5,6-Methylenedioxy-1-indanone

C10H8O3 (176.0473418)


   

1-Cyclopentene-1-carbonyl chloride, 2-(methylthio)- (9CI)

1-Cyclopentene-1-carbonyl chloride, 2-(methylthio)- (9CI)

C7H9ClOS (176.0062614)


   

1-BROMO-4-METHYL-3-HEXENE

1-BROMO-4-METHYL-3-HEXENE

C7H13Br (176.0200558)


   

5-Methyl-1H-indazole-3-carboxylic acid

5-Methyl-1H-indazole-3-carboxylic acid

C9H8N2O2 (176.0585748)


   

4H-Pyrido[1,2-a]pyrimidin-4-one,2-hydroxy-9-methyl-

4H-Pyrido[1,2-a]pyrimidin-4-one,2-hydroxy-9-methyl-

C9H8N2O2 (176.0585748)


   

1-Methyl-1H-benzimidazole-5-carboxylic acid

1-Methyl-1H-benzimidazole-5-carboxylic acid

C9H8N2O2 (176.0585748)


   

2-Methylpyrazolo[1,5-a]pyridine-3-carboxylic acid

2-Methylpyrazolo[1,5-a]pyridine-3-carboxylic acid

C9H8N2O2 (176.0585748)


   

(2-(Trifluoromethyl)pyridin-4-yl)methanamine

(2-(Trifluoromethyl)pyridin-4-yl)methanamine

C7H7F3N2 (176.0561298)


   

2-(3H-benzimidazol-5-yl)acetic acid

2-(3H-benzimidazol-5-yl)acetic acid

C9H8N2O2 (176.0585748)


   

2-(5-AMINOISOXAZOL-3-YL)PHENOL

2-(5-AMINOISOXAZOL-3-YL)PHENOL

C9H8N2O2 (176.0585748)


   

7-Methoxyquinoxalin-2(1H)-one

7-Methoxyquinoxalin-2(1H)-one

C9H8N2O2 (176.0585748)


   

7-Methyl-1H-indazole-5-carboxylic acid

7-Methyl-1H-indazole-5-carboxylic acid

C9H8N2O2 (176.0585748)


   

5-CHLORO-6-(1-FLUOROETHYL)-4(1H)-PYRIMIDINONE

5-CHLORO-6-(1-FLUOROETHYL)-4(1H)-PYRIMIDINONE

C6H6ClFN2O (176.0152668)


   

Methyl H-pyrrolo[1,2-b]pyridazine-6-carboxylate

Methyl H-pyrrolo[1,2-b]pyridazine-6-carboxylate

C9H8N2O2 (176.0585748)


   

4-chloro-5-fluoro-2-methoxy-6-methylpyrimidine

4-chloro-5-fluoro-2-methoxy-6-methylpyrimidine

C6H6ClFN2O (176.0152668)


   

ALUMINUM SESQUICHLOROHYDREX PG

ALUMINUM SESQUICHLOROHYDREX PG

C3H14AlClO4 (176.0395984)


   

5-(3-Pyridinyl)-2-thiophenamine

5-(3-Pyridinyl)-2-thiophenamine

C9H8N2S (176.0408168)


   

4-(5-AMINO-ISOXAZOL-3-YL)-PHENOL

4-(5-AMINO-ISOXAZOL-3-YL)-PHENOL

C9H8N2O2 (176.0585748)


   

3-OXOISOINDOLINE-4-CARBOXAMIDE

3-OXOISOINDOLINE-4-CARBOXAMIDE

C9H8N2O2 (176.0585748)


   

6-hydroxychromene-3-carboxaldehyde

6-hydroxychromene-3-carboxaldehyde

C10H8O3 (176.0473418)


   

1H,3H-Thiazolo[3,4-a]benzimidazole(9CI)

1H,3H-Thiazolo[3,4-a]benzimidazole(9CI)

C9H8N2S (176.0408168)


   

O-acetylmalic acid

O-acetylmalic acid

C6H8O6 (176.0320868)


   

2-(3-METHYL-1,2,4-OXADIAZOL-5-YL)PHENOL

2-(3-METHYL-1,2,4-OXADIAZOL-5-YL)PHENOL

C9H8N2O2 (176.0585748)


   

4,5,6,7-Tetrahydrothiazolo[5,4-c]pyridine hydrochloride

4,5,6,7-Tetrahydrothiazolo[5,4-c]pyridine hydrochloride

C6H9ClN2S (176.0174944)


   

2-Trifluoromethoxy toluene

2-Trifluoromethoxy toluene

C8H7F3O (176.0448968)


   

2,3,5-Trifluorobenzoic acid

2,3,5-Trifluorobenzoic acid

C7H3F3O2 (176.0085134)


   

(2E)-3-(2-Formylphenyl)acrylic acid

(2E)-3-(2-Formylphenyl)acrylic acid

C10H8O3 (176.0473418)


   
   

Sodium gentisate

Sodium gentisate

C7H5NaO4 (176.008553)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent

   

2-Chloro-5-fluoro-4-methoxy-6-methylpyrimidine

2-Chloro-5-fluoro-4-methoxy-6-methylpyrimidine

C6H6ClFN2O (176.0152668)


   

3-METHOXYCARBONYL-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE

3-METHOXYCARBONYL-2,5-DIHYDROTHIOPHENE-1,1-DIOXIDE

C6H8O4S (176.0143288)


   

3-methylbenzo[b]thiophene-2-carboxaldehyde

3-methylbenzo[b]thiophene-2-carboxaldehyde

C10H8OS (176.02958379999998)


   

5-(4-methylphenyl)-1,2,4-thiadiazole

5-(4-methylphenyl)-1,2,4-thiadiazole

C9H8N2S (176.0408168)


   

5-Methyl-1-benzofuran-2-carboxylic acid

5-Methyl-1-benzofuran-2-carboxylic acid

C10H8O3 (176.0473418)


   

3-Butenoic acid,2-oxo-4-phenyl-

3-Butenoic acid,2-oxo-4-phenyl-

C10H8O3 (176.0473418)


   

7-Bromo-1-heptene

7-Bromo-1-heptene

C7H13Br (176.0200558)


   

4-HYDROXY-7-METHYLCOUMARIN

4-HYDROXY-7-METHYLCOUMARIN

C10H8O3 (176.0473418)


   

2-(Benzofuran-3-yl)acetic acid

2-(Benzofuran-3-yl)acetic acid

C10H8O3 (176.0473418)


   

2,3,6-trifluorophenylboronic acid

2,3,6-trifluorophenylboronic acid

C6H4BF3O2 (176.025643)


   

Naphthalene,1-chloro-2-methyl-

Naphthalene,1-chloro-2-methyl-

C11H9Cl (176.03927439999998)


   

2-Propynoic acid,3-(4-methoxyphenyl)-

2-Propynoic acid,3-(4-methoxyphenyl)-

C10H8O3 (176.0473418)


   

5-(chloromethyl)-4-isopropyl-1,2,3-thiadiazole

5-(chloromethyl)-4-isopropyl-1,2,3-thiadiazole

C6H9ClN2S (176.0174944)


   

5-METHOXYBENZOFURAN-2-CARBALDEHYDE

5-METHOXYBENZOFURAN-2-CARBALDEHYDE

C10H8O3 (176.0473418)


   

(S)-1-(2-Thienyl)-2-chloroethanol

(S)-1-(2-Thienyl)-2-chloroethanol

C7H9ClOS (176.0062614)


   

METHYL-(R)-PYRROLIDIN-3-YL-AMINE

METHYL-(R)-PYRROLIDIN-3-YL-AMINE

C6H9ClN2S (176.0174944)


   

(2-Bromoethyl)cyclopentane

(2-Bromoethyl)cyclopentane

C7H13Br (176.0200558)


   

(6-(trifluoromethyl)pyridin-2-yl)methanamine

(6-(trifluoromethyl)pyridin-2-yl)methanamine

C7H7F3N2 (176.0561298)


   

3-Cyano-7-chloroindole

3-Cyano-7-chloroindole

C9H5ClN2 (176.014124)


   

1-methyl-4-imidazoleacetic acid hydrochloride

1-methyl-4-imidazoleacetic acid hydrochloride

C6H9ClN2O2 (176.03525240000002)


   

3-methyl-5-(trifluoromethyl)pyridin-2-amine

3-methyl-5-(trifluoromethyl)pyridin-2-amine

C7H7F3N2 (176.0561298)


   

3-(Trifluoromethyl)pyrazine-2-carbaldehyde

3-(Trifluoromethyl)pyrazine-2-carbaldehyde

C6H3F3N2O (176.01974639999997)


   

4-FLUORO-3-METHYLBENZENE-1,2-DIAMINE HYDROCHLORIDE

4-FLUORO-3-METHYLBENZENE-1,2-DIAMINE HYDROCHLORIDE

C7H10ClFN2 (176.05165019999998)


   

2-amino-1-(5-amino-1H-imidazol-4-yl)ethanone dihydrochloride

2-amino-1-(5-amino-1H-imidazol-4-yl)ethanone dihydrochloride

C5H9ClN4O (176.0464854)


   
   
   

4-(Trifluoromethyl)benzyl alcohol

(4-(Trifluoromethyl)phenyl)methanol

C8H7F3O (176.0448968)


   

Gaboxadol hydrochloride

Gaboxadol hydrochloride

C6H9ClN2O2 (176.03525240000002)


Gaboxadol hydrochloride (Lu 02-030 hydrochloride) is a potent agonist of the GABAA receptor and an antagonist of GABAC receptors (IC50=25 μM). Gaboxadol hydrochloride displays a partial agonist efficacy on subunit α1β2γ2 with an ED50 value of 143 μM, a full agonist efficacy at α5 subunit (ED50=28-129 μM) and a superagonist efficacy at α4β3δ (ED50=6 μM). Gaboxadol hydrochloride is a non-opioid agent[1][2].

   

1H-Indole-3-carbothioamide

1H-Indole-3-carbothioamide

C9H8N2S (176.0408168)


   

2-(trifluoromethyl)anisole

2-(trifluoromethyl)anisole

C8H7F3O (176.0448968)


   

5-methyl-1-benzothiophene-2-carbaldehyde

5-methyl-1-benzothiophene-2-carbaldehyde

C10H8OS (176.02958379999998)


   

sodium,butyl sulfate

sodium,butyl sulfate

C4H9NaO4S (176.0119234)


   

2H-1-Benzopyran-2-one,4-hydroxy-3-methyl-

2H-1-Benzopyran-2-one,4-hydroxy-3-methyl-

C10H8O3 (176.0473418)


   

(3-fluoro-2-methylphenyl)hydrazine,hydrochloride

(3-fluoro-2-methylphenyl)hydrazine,hydrochloride

C7H10ClFN2 (176.05165019999998)


   

4-(Trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile

4-(Trifluoromethyl)-1,4,5,6-tetrahydropyridine-3-carbonitrile

C7H7F3N2 (176.0561298)


   

6-(Trifluoromethyl)pyridazine-3-carbaldehyde

6-(Trifluoromethyl)pyridazine-3-carbaldehyde

C6H3F3N2O (176.01974639999997)


   

4-(Trifluoromethyl)-1,3-benzenediamine

4-(Trifluoromethyl)-1,3-benzenediamine

C7H7F3N2 (176.0561298)


   

2-chloro-N-(prop-2-enylcarbamoyl)acetamide

2-chloro-N-(prop-2-enylcarbamoyl)acetamide

C6H9ClN2O2 (176.03525240000002)


   

3-(bromomethyl)-1,1-dimethylcyclobutane

3-(bromomethyl)-1,1-dimethylcyclobutane

C7H13Br (176.0200558)


   

4-CHLORO-5-FLUORO-2-METHOXYMETHYL-PYRIMIDINE

4-CHLORO-5-FLUORO-2-METHOXYMETHYL-PYRIMIDINE

C6H6ClFN2O (176.0152668)


   

(4-Fluorobenzyl)hydrazine hydrochloride (1:1)

(4-Fluorobenzyl)hydrazine hydrochloride (1:1)

C7H10ClFN2 (176.05165019999998)


   
   
   

2h-chromene-3-carboxylic acid

2h-chromene-3-carboxylic acid

C10H8O3 (176.0473418)


   

2,3,6-TRIFLUOROBENZOIC ACID

2,3,6-TRIFLUOROBENZOIC ACID

C7H3F3O2 (176.0085134)


   

3-Acetoxybenzofuran

3-Acetoxybenzofuran

C10H8O3 (176.0473418)


   

2,4,6-Trifluorobenzoic acid

2,4,6-Trifluorobenzoic acid

C7H3F3O2 (176.0085134)


   

CHEMBRDG-BB 4010333

CHEMBRDG-BB 4010333

C9H8N2S (176.0408168)


   

2-Benzofurancarboxylicacid, methyl ester

2-Benzofurancarboxylicacid, methyl ester

C10H8O3 (176.0473418)


   

3-(1,3-thiazol-4-yl)aniline

3-(1,3-thiazol-4-yl)aniline

C9H8N2S (176.0408168)


   

6-THIEN-2-YLPYRID-3-YLAMINE

6-THIEN-2-YLPYRID-3-YLAMINE

C9H8N2S (176.0408168)


   

(3-Fluoro-4-methylphenyl)hydrazine hydrochloride

(3-Fluoro-4-methylphenyl)hydrazine hydrochloride

C7H10ClFN2 (176.05165019999998)


   

1H,4H-Thiazolo[3,4-a]benzimidazole(9CI)

1H,4H-Thiazolo[3,4-a]benzimidazole(9CI)

C9H8N2S (176.0408168)


   

(2E)-3-(4-Formylphenyl)acrylic acid

(2E)-3-(4-Formylphenyl)acrylic acid

C10H8O3 (176.0473418)


   

1H-Iodole-2-carbothioamide

1H-Iodole-2-carbothioamide

C9H8N2S (176.0408168)


   

(R)-(+)-2-METHOXYA-METHYLBENZYLAMINE

(R)-(+)-2-METHOXYA-METHYLBENZYLAMINE

C7H12O3S (176.0507122)


   

Cyclohexane,1-bromo-4-methyl-

Cyclohexane,1-bromo-4-methyl-

C7H13Br (176.0200558)


   

3-(Trifluoromethyl)anisole

3-(Trifluoromethyl)anisole

C8H7F3O (176.0448968)


   

3-methoxymethylenebenzofuran-2(3H)-one

3-methoxymethylenebenzofuran-2(3H)-one

C10H8O3 (176.0473418)


   
   

Methyl 1-benzofuran-5-carboxylate

Methyl 1-benzofuran-5-carboxylate

C10H8O3 (176.0473418)


   

Potassium cyclopentyltrifluoroborate

Potassium cyclopentyltrifluoroborate

C5H9BF3K (176.03864399999998)


   

5-AMINO-3-(2-FURYL)ISOXAZOLE-4-CARBONITRILE

5-AMINO-3-(2-FURYL)ISOXAZOLE-4-CARBONITRILE

C7H7F3N2 (176.0561298)


   

3,5-Diaminobenzotrifluoride

3,5-Diaminobenzotrifluoride

C7H7F3N2 (176.0561298)


   

2-(trifluoromethyl)pyrimidine-5-carbaldehyde

2-(trifluoromethyl)pyrimidine-5-carbaldehyde

C6H3F3N2O (176.01974639999997)


   

5-Phenylthiazol-2-amine

5-Phenylthiazol-2-amine

C9H8N2S (176.0408168)


   

4-(ISOTHIAZOL-5-YL)ANILINE

4-(ISOTHIAZOL-5-YL)ANILINE

C9H8N2S (176.0408168)


   

3-Methyl-5-phenyl-1,2,4-thiadiazole

1,2,4-THIADIAZOLE, 3-METHYL-5-PHENYL-

C9H8N2S (176.0408168)


   

5-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

5-(DIFLUOROMETHYL)-1-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID

C6H6F2N2O2 (176.03973200000001)


   

(1,1,2,2-TETRAFLUOROETHYL)TRIFLUOROOXIRANE

(1,1,2,2-TETRAFLUOROETHYL)TRIFLUOROOXIRANE

C6H8O4S (176.0143288)


   

3-(ISOTHIAZOL-5-YL)ANILINE

3-(ISOTHIAZOL-5-YL)ANILINE

C9H8N2S (176.0408168)


   

Diethyl Phosphate Sodium Salt

Diethyl Phosphate Sodium Salt

C4H10NaO4P (176.021439)


   

di(1H-pyrrol-2-yl)methanethione

di(1H-pyrrol-2-yl)methanethione

C9H8N2S (176.0408168)


   

2,2,5-Trifluoro-1,3-benzodioxole

2,2,5-Trifluoro-1,3-benzodioxole

C7H3F3O2 (176.0085134)


   

2-METHYL-BENZOFURAN-5-CARBOXYLIC ACID

2-METHYL-BENZOFURAN-5-CARBOXYLIC ACID

C10H8O3 (176.0473418)


   

4-HYDROXY-3-PHENYL-2(5H)-FURANONE

4-HYDROXY-3-PHENYL-2(5H)-FURANONE

C10H8O3 (176.0473418)


   

4(3H)-Quinazolinethione,2-methyl-

4(3H)-Quinazolinethione,2-methyl-

C9H8N2S (176.0408168)


   

4-Isoxazolesulfonamide,3,5-dimethyl-(9CI)

4-Isoxazolesulfonamide,3,5-dimethyl-(9CI)

C5H8N2O3S (176.0255618)


   

4-Phenylthiazol-5-amine

4-Phenylthiazol-5-amine

C9H8N2S (176.0408168)


   

2-METHYL-5,6-DIHYDRO-4H-PYRROLO[3,4-D]THIAZOLE HYDROCHLORIDE

2-METHYL-5,6-DIHYDRO-4H-PYRROLO[3,4-D]THIAZOLE HYDROCHLORIDE

C6H9ClN2S (176.0174944)


   

7-HYDROXY-5-OXO-4,5-DIHYDROPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE

7-HYDROXY-5-OXO-4,5-DIHYDROPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE

C7H4N4O2 (176.0334244)


   

3-(aminomethyl)-6-(trifluoromethyl)pyridine

3-(aminomethyl)-6-(trifluoromethyl)pyridine

C7H7F3N2 (176.0561298)


   

1-(1-Benzothien-3-yl)ethanone

1-(1-Benzothien-3-yl)ethanone

C10H8OS (176.02958379999998)


   

2,4,5-Trifluorobenzoic acid

2,4,5-Trifluorobenzoic acid

C7H3F3O2 (176.0085134)


   

N-(2-Aminoethyl)maleimide hydrochloride salt

N-(2-Aminoethyl)maleimide hydrochloride salt

C6H9ClN2O2 (176.03525240000002)


   

1-phenylimidazoline-2-thione

1-phenylimidazoline-2-thione

C9H8N2S (176.0408168)


   

4-azidophenyl isothiocyanate

4-azidophenyl isothiocyanate

C7H4N4S (176.0156664)


   

2-(BENZOFURAN-2-YL)ACETIC ACID

2-(BENZOFURAN-2-YL)ACETIC ACID

C10H8O3 (176.0473418)


   

4-Chloro-2-ethoxy-5-fluoropyrimidine

4-Chloro-2-ethoxy-5-fluoropyrimidine

C6H6ClFN2O (176.0152668)


   

1,1,2,2-tetrafluoro-1-(2-methoxyethoxy)ethane

1,1,2,2-tetrafluoro-1-(2-methoxyethoxy)ethane

C5H8F4O2 (176.0460396)


   

1H-Imidazole-5-sulfonamide,4-amino-1-methyl-

1H-Imidazole-5-sulfonamide,4-amino-1-methyl-

C4H8N4O2S (176.0367948)


   

3-Benzoylacrylic acid

3-Benzoylacrylic acid

C10H8O3 (176.0473418)


   

(4-(trifluoromethyl)pyridin-3-yl)methanamine

(4-(trifluoromethyl)pyridin-3-yl)methanamine

C7H7F3N2 (176.0561298)


   

4-Formyl-3-nitrobenzonitrile

4-Formyl-3-nitrobenzonitrile

C8H4N2O3 (176.0221914)


   

Bromocycloheptane

CYCLOHEPTYL BROMIDE

C7H13Br (176.0200558)


   

1H-Benzimidazole,2-(ethenylthio)-(9CI)

1H-Benzimidazole,2-(ethenylthio)-(9CI)

C9H8N2S (176.0408168)


   

4-Hydroxy-6-methylcoumarin

4-Hydroxy-6-methylcoumarin

C10H8O3 (176.0473418)


   

2-(Trifluoromethyl)benzyl alcohol

(2-(Trifluoromethyl)phenyl)methanol

C8H7F3O (176.0448968)


   

2,4,5,6-pyrimidinetetraamine hydrochloride

2,4,5,6-pyrimidinetetraamine hydrochloride

C4H9ClN6 (176.0577184)


   

4-(4-METHYLPHENYL)-1,2,3-THIADIAZOLE

4-(4-METHYLPHENYL)-1,2,3-THIADIAZOLE

C9H8N2S (176.0408168)


   

2,3,4-Trifluorobenzoic acid

2,3,4-Trifluorobenzoic acid

C7H3F3O2 (176.0085134)


   

(3-(trifluoromethyl)pyridin-2-yl)methanamine

(3-(trifluoromethyl)pyridin-2-yl)methanamine

C7H7F3N2 (176.0561298)


   

(5-(Trifluoromethyl)pyridin-3-yl)methanamine

(5-(Trifluoromethyl)pyridin-3-yl)methanamine

C7H7F3N2 (176.0561298)


   

(5-(trifluoromethyl)pyridin-2-yl)methanamine

(5-(trifluoromethyl)pyridin-2-yl)methanamine

C7H7F3N2 (176.0561298)


   

Cyclopropanecarboxylic acid, 2-(chlorocarbonyl)-, ethyl ester (9CI)

Cyclopropanecarboxylic acid, 2-(chlorocarbonyl)-, ethyl ester (9CI)

C7H9ClO3 (176.02401940000001)


   

2,2-difluoro-2-(2-fluoro-phenyl)-ethanol

2,2-difluoro-2-(2-fluoro-phenyl)-ethanol

C8H7F3O (176.0448968)


   

(2,4,6-Trifluorophenyl)boronic acid

(2,4,6-Trifluorophenyl)boronic acid

C6H4BF3O2 (176.025643)


   

3-formyl-2-nitrobenzonitrile

3-formyl-2-nitrobenzonitrile

C8H4N2O3 (176.0221914)


   

3-fluoro-N,N-dimethylpyridin-2-amine hydrochloride

3-fluoro-N,N-dimethylpyridin-2-amine hydrochloride

C7H10ClFN2 (176.05165019999998)


   

PROPANE TRICARBOXYLIC ACID

PROPANE TRICARBOXYLIC ACID

C6H8O6 (176.0320868)


   

2-methyl-4-(trifluoromethyl)phenol

2-methyl-4-(trifluoromethyl)phenol

C8H7F3O (176.0448968)


   

4-Methyl-6-(trifluoromethyl)-3-pyridinamine

4-Methyl-6-(trifluoromethyl)-3-pyridinamine

C7H7F3N2 (176.0561298)


   

(S)-3-Chloro-1-(thiophen-2-yl)propan-1-ol

(S)-3-Chloro-1-(thiophen-2-yl)propan-1-ol

C7H9ClOS (176.0062614)


   

1-METHOXY-2-(TRIFLUOROMETHYL)BENZENE

1-METHOXY-2-(TRIFLUOROMETHYL)BENZENE

C8H7F3O (176.0448968)


   

7-Methoxy-1,2,3,4-tetrahydronaphthalen-2-amine

7-Methoxy-1,2,3,4-tetrahydronaphthalen-2-amine

C10H8O3 (176.0473418)


   

N-(2,2,2-trifluoroethyl)pyridin-3-amine

N-(2,2,2-trifluoroethyl)pyridin-3-amine

C7H7F3N2 (176.0561298)


   

2H-Chromene-6-carboxylic acid

2H-Chromene-6-carboxylic acid

C10H8O3 (176.0473418)


   

1H-Indole-7-carbothioamide

1H-Indole-7-carbothioamide

C9H8N2S (176.0408168)


   

METHYL 2-(1H-IMIDAZOL-4-YL)ACETATE HYDROCHLORIDE

METHYL 2-(1H-IMIDAZOL-4-YL)ACETATE HYDROCHLORIDE

C6H9ClN2O2 (176.03525240000002)


   

3-(3-HYDROXY-PROP-1-YNYL)-BENZOIC ACID

3-(3-HYDROXY-PROP-1-YNYL)-BENZOIC ACID

C10H8O3 (176.0473418)


   

p-trifluoromethylphenylhydrazine

p-trifluoromethylphenylhydrazine

C7H7F3N2 (176.0561298)


   

7-Benzofurancarboxylicacid, 2-methyl-

7-Benzofurancarboxylicacid, 2-methyl-

C10H8O3 (176.0473418)


   

3-methyl-1-benzofuran-5-carboxylic acid

3-methyl-1-benzofuran-5-carboxylic acid

C10H8O3 (176.0473418)


   

2-(2-PROPYNYLOXY)BENZENECARBOXYLIC ACID

2-(2-PROPYNYLOXY)BENZENECARBOXYLIC ACID

C10H8O3 (176.0473418)


   

4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride

4,6-dimethyl-1H-pyrimidine-2-thione hydrochloride

C6H9ClN2S (176.0174944)


   

2-Phenyl-1,3-thiazol-4-amine

2-Phenyl-1,3-thiazol-4-amine

C9H8N2S (176.0408168)


   

Monophenyl succinic anhydride

Monophenyl succinic anhydride

C10H8O3 (176.0473418)


   

4-Phenylimidazole-2-thiol

4-Phenylimidazole-2-thiol

C9H8N2S (176.0408168)


   

methyl (Z)-3,4-dihydroxy-4-methoxy-2-oxo-but-3-enoate

methyl (Z)-3,4-dihydroxy-4-methoxy-2-oxo-but-3-enoate

C6H8O6 (176.0320868)


   

4-Trifluoromethoxy toluene

4-Trifluoromethoxy toluene

C8H7F3O (176.0448968)


   
   

benzenesulfonic acid,hydrate

benzenesulfonic acid,hydrate

C6H8O4S (176.0143288)


   

5-THIOPHEN-2-YL-3H-[1,2,3]TRIAZOLE-4-CARBONITRILE

5-THIOPHEN-2-YL-3H-[1,2,3]TRIAZOLE-4-CARBONITRILE

C7H4N4S (176.0156664)


   

3-chloro-1-(2-thienyl)-1-propanol

3-chloro-1-(2-thienyl)-1-propanol

C7H9ClOS (176.0062614)


   

6-Chloro-1H-indole-5-carbonitrile

6-Chloro-1H-indole-5-carbonitrile

C9H5ClN2 (176.014124)


   

2,2,2-TRIFLUORO-1-(PYRIDIN-4-YL)ETHANAMINE

2,2,2-TRIFLUORO-1-(PYRIDIN-4-YL)ETHANAMINE

C7H7F3N2 (176.0561298)


   

2,3-DIAMINOBENZOTRIFLUORIDE

2,3-DIAMINOBENZOTRIFLUORIDE

C7H7F3N2 (176.0561298)


   

(E)-5-(2-(thiophen-2-yl)vinyl)-1H-pyrazole

(E)-5-(2-(thiophen-2-yl)vinyl)-1H-pyrazole

C9H8N2S (176.0408168)


   

4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid

4-deoxy-alpha-L-threo-hex-4-enopyranuronic acid

C6H8O6 (176.0320868)


   

D-ascorbic acid

D-ascorbic acid

C6H8O6 (176.0320868)


   

(2R)-2-Hydroxy-2-methyl-4-oxopentanedioic acid

(2R)-2-Hydroxy-2-methyl-4-oxopentanedioic acid

C6H8O6 (176.0320868)


   

Methylthio 2-(propionyloxy) propionate

Methylthio 2-(propionyloxy) propionate

C7H12O3S (176.0507122)


   

L-isoascorbic acid

L-isoascorbic acid

C6H8O6 (176.0320868)


   

3-(hydroxymethyl)-1H-isochromen-1-one

3-(hydroxymethyl)-1H-isochromen-1-one

C10H8O3 (176.0473418)


   

Methyl 3-(acetylthio)-2-methylpropanoate

Methyl 3-(acetylthio)-2-methylpropanoate

C7H12O3S (176.0507122)


   

N-Carbamoyl-D-aspartic acid

N-Carbamoyl-D-aspartic acid

C5H8N2O5 (176.0433198)


D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids The D-enantiomer N-carbamoylaspartic acid.

   

1,1,1-Propanetricarboxylic acid

1,1,1-Propanetricarboxylic acid

C6H8O6 (176.0320868)


   
   

2-Methyl-4H-1-benzothiopyran-4-one

2-Methyl-4H-1-benzothiopyran-4-one

C10H8OS (176.02958379999998)


   

Methyl 5-methylthio-3-oxopentanoate

Methyl 5-methylthio-3-oxopentanoate

C7H12O3S (176.0507122)


   

4-Deoxy-Alpha-L-Erythro-Hex-4-Enopyranuronic Acid

4-Deoxy-Alpha-L-Erythro-Hex-4-Enopyranuronic Acid

C6H8O6 (176.0320868)


   

LM-94

5-18-01-00439 (Beilstein Handbook Reference)

C10H8O3 (176.0473418)


A - Alimentary tract and metabolism > A05 - Bile and liver therapy > A05A - Bile therapy COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS 4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects. 4-Methylumbelliferone is a hyaluronic acid biosynthesis inhibitor with antitumoral and antimetastatic effects.

   

vitamin C

2-o-(beta-d-glucopyranosyl)-ascorbic acid_qt

C6H8O6 (176.0320868)


G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AD - Organic acids A - Alimentary tract and metabolism > A11 - Vitamins > A11G - Ascorbic acid (vitamin c), incl. combinations > A11GA - Ascorbic acid (vitamin c), plain B - Blood and blood forming organs > B03 - Antianemic preparations > B03A - Iron preparations > B03AA - Iron bivalent, oral preparations COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D020011 - Protective Agents > D000975 - Antioxidants C26170 - Protective Agent > C275 - Antioxidant D018977 - Micronutrients > D014815 - Vitamins S - Sensory organs > S01 - Ophthalmologicals Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4]. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4].

   

Ayapanin

5-18-01-00387 (Beilstein Handbook Reference)

C10H8O3 (176.0473418)


Herniarin is a natural coumarin occurs in some flowering plants, with antitumor effect. Herniarin is a natural coumarin occurs in some flowering plants, with antitumor effect.

   

(Z)-9-hydroxybenzo[c]oxepin-3(1H)-one

(Z)-9-hydroxybenzo[c]oxepin-3(1H)-one

C10H8O3 (176.0473418)


A natural product found in Pestalotiopsis virgatula and Xylaria polymorpha.

   

2,3,4-trihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid

2,3,4-trihydroxy-3,4-dihydro-2H-pyran-6-carboxylic acid

C6H8O6 (176.0320868)


   

N-formyl-L-methioninate

N-formyl-L-methioninate

C6H10NO3S- (176.038137)


The conjugate base of N-formyl-L-methionine; major species at pH 7.3.

   

D-Glucurono-6,2-lactone

D-Glucurono-6,2-lactone

C6H8O6 (176.0320868)


   

3,3-Thiodipropanoate

3,3-Thiodipropanoate

C6H8O4S-2 (176.0143288)


   

L-xylo-hex-3-ulono-1,4-lactone

L-xylo-hex-3-ulono-1,4-lactone

C6H8O6 (176.0320868)


   

gamma-Hydroxy-gamma-methylglutamate

gamma-Hydroxy-gamma-methylglutamate

C6H10NO5- (176.05589500000002)


   
   

4-Deoxy-l-erythro-hex-4-enopyranuronic acid

4-Deoxy-l-erythro-hex-4-enopyranuronic acid

C6H8O6 (176.0320868)


   
   

(Z,4S,5R)-2-amino-4,5,6-trihydroxyhex-2-enoate

(Z,4S,5R)-2-amino-4,5,6-trihydroxyhex-2-enoate

C6H10NO5- (176.05589500000002)


   
   

3,4-Dihydroxy-5-[(S)-1,2-dihydroxyethyl]furan-2(5H)-one

3,4-Dihydroxy-5-[(S)-1,2-dihydroxyethyl]furan-2(5H)-one

C6H8O6 (176.0320868)


   

L-xylo-hex-3-ulonolactone

L-xylo-hex-3-ulonolactone

C6H8O6 (176.0320868)


   

6-(hydroxymethyl)-2H-chromen-2-one

6-(hydroxymethyl)-2H-chromen-2-one

C10H8O3 (176.0473418)


   

(5R)-5-[(1S)-1,2-dihydroxyethyl]-4-hydroxyoxolane-2,3-dione

(5R)-5-[(1S)-1,2-dihydroxyethyl]-4-hydroxyoxolane-2,3-dione

C6H8O6 (176.0320868)


   

(2S,4S)-4-hydroxy-4-methylglutamate

(2S,4S)-4-hydroxy-4-methylglutamate

C6H10NO5- (176.05589500000002)


   

4-deoxy-beta-L-threo-hex-4-enopyranuronic acid

4-deoxy-beta-L-threo-hex-4-enopyranuronic acid

C6H8O6 (176.0320868)


   

(2S,4R)-4-hydroxy-4-methylglutamate

(2S,4R)-4-hydroxy-4-methylglutamate

C6H10NO5- (176.05589500000002)


   

2-Ethylthiofumaric acid

2-Ethylthiofumaric acid

C6H8O4S (176.0143288)


   

3-Hydroxy-6-methylchromen-2-one

3-Hydroxy-6-methylchromen-2-one

C10H8O3 (176.0473418)


   

2,3-Didehydro-D-glucose

2,3-Didehydro-D-glucose

C6H8O6 (176.0320868)


   

3,4-didehydro-D-glucose

3,4-didehydro-D-glucose

C6H8O6 (176.0320868)


   

alpha-Mannofuranuronic acid gamma-lactone

alpha-Mannofuranuronic acid gamma-lactone

C6H8O6 (176.0320868)


A carbohydrate lactone obtained by intramolecular condensation of the 6-carboxy group with the 3-hydroxy group of alpha-mannofuranuronic acid.

   

S-methylmercapturate

S-methylmercapturate

C6H10NO3S- (176.038137)


   

(3R)-3-{[carboxy(hydroxy)methyl]amino}butanoate

(3R)-3-{[carboxy(hydroxy)methyl]amino}butanoate

C6H10NO5- (176.05589500000002)


   

3-Methoxy-2H-cyclohepta[b]furan-2-one

3-Methoxy-2H-cyclohepta[b]furan-2-one

C10H8O3 (176.0473418)


   

L-BOAA

N-Oxalyl-L-alpha-beta-diaminopropionic acid (BOAA,ODAP)

C5H8N2O5 (176.0433198)


N(3)-oxalyl-L-2,3-diaminopropionic acid is an N(beta)-acyl-L-2,3-diaminopropionic acid in which the acyl group is oxalyl. It is functionally related to a propionic acid. It is a conjugate acid of a N(3)-(carboxylatoformyl)-L-2,3-diaminopropionate(1-). Dencichin is a natural product found in Lathyrus latifolius and Lathyrus sativus with data available. See also: Panax notoginseng root (part of). Dencichin is a non-protein amino acid originally extracted from Panax notoginseng, and can inhibit HIF-prolyl hydroxylase-2 (PHD-2) activity.

   

Vitamin_C

L-Threoascorbic acid,Antiscorbutic factor,Vitamin C;(R)-5-((S)-1,2-Dihydroxyethyl)-3,4-dihydroxyfuran-2(5H)-one

C6H8O6 (176.0320868)


L-ascorbic acid is a white to very pale yellow crystalline powder with a pleasant sharp acidic taste. Almost odorless. (NTP, 1992) L-ascorbic acid is the L-enantiomer of ascorbic acid and conjugate acid of L-ascorbate. It has a role as a coenzyme, a flour treatment agent, a food antioxidant, a plant metabolite, a cofactor, a skin lightening agent and a geroprotector. It is an ascorbic acid and a vitamin C. It is a conjugate acid of a L-ascorbate. It is an enantiomer of a D-ascorbic acid. A six carbon compound related to glucose. It is found naturally in citrus fruits and many vegetables. Ascorbic acid is an essential nutrient in human diets, and necessary to maintain connective tissue and bone. Its biologically active form, vitamin C, functions as a reducing agent and coenzyme in several metabolic pathways. Vitamin C is considered an antioxidant. Ascorbic acid is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). Ascorbic acid is a Vitamin C. Ascorbic Acid is a natural product found in Populus tremula, Rosa platyacantha, and other organisms with data available. Ascorbic Acid is a natural water-soluble vitamin (Vitamin C). Ascorbic acid is a potent reducing and antioxidant agent that functions in fighting bacterial infections, in detoxifying reactions, and in the formation of collagen in fibrous tissue, teeth, bones, connective tissue, skin, and capillaries. Found in citrus and other fruits, and in vegetables, vitamin C cannot be produced or stored by humans and must be obtained in the diet. (NCI04) A six carbon compound related to glucose. It is found naturally in citrus fruits and many vegetables. Ascorbic acid is an essential nutrient in human diets, and necessary to maintain connective tissue and bone. Its biologically active form, vitamin C, functions as a reducing agent and coenzyme in several metabolic pathways. Vitamin C is considered an antioxidant. See also: Sodium Ascorbate (active moiety of); D-ascorbic acid (related); Magnesium Ascorbyl Phosphate (active moiety of) ... View More ... G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AD - Organic acids A - Alimentary tract and metabolism > A11 - Vitamins > A11G - Ascorbic acid (vitamin c), incl. combinations > A11GA - Ascorbic acid (vitamin c), plain B - Blood and blood forming organs > B03 - Antianemic preparations > B03A - Iron preparations > B03AA - Iron bivalent, oral preparations COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D020011 - Protective Agents > D000975 - Antioxidants C26170 - Protective Agent > C275 - Antioxidant D018977 - Micronutrients > D014815 - Vitamins S - Sensory organs > S01 - Ophthalmologicals Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4]. L-Ascorbic acid (L-Ascorbate), an electron donor, is an endogenous antioxidant agent. L-Ascorbic acid inhibits selectively Cav3.2 channels with an IC50 of 6.5 μM. L-Ascorbic acid is also a collagen deposition enhancer and an elastogenesis inhibitor[1][2][3]. L-Ascorbic acid exhibits anti-cancer effects through the generation of reactive oxygen species (ROS) and selective damage to cancer cells[4].

   

Glucurolactone

D(+)-Glucurono-3,6-lactone

C6H8O6 (176.0320868)


D-Glucuronic acid lactone is an endogenous metabolite.

   

N-Carbamoyl-L-aspartate

N-Carbamoyl-L-aspartate

C5H8N2O5 (176.0433198)


D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids

   

1,3,8-Trihydroxynaphthalene

1,3,8-Trihydroxynaphthalene

C10H8O3 (176.0473418)


   

L-xylo-Hex-2-ulono-1,4-lactone

L-xylo-Hex-2-ulono-1,4-lactone

C6H8O6 (176.0320868)


   

(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid

(4S,5S)-4,5-dihydroxy-2,6-dioxohexanoic acid

C6H8O6 (176.0320868)


   

2-hydroxy-3-oxoadipic acid

2-hydroxy-3-oxoadipic acid

C6H8O6 (176.0320868)


   

4-Hydroxy-4-methyl-2-oxoglutaric acid

4-Hydroxy-4-methyl-2-oxoglutaric acid

C6H8O6 (176.0320868)


   

3-deoxy-D-glycero-hexo-2,5-diulosonic acid

3-deoxy-D-glycero-hexo-2,5-diulosonic acid

C6H8O6 (176.0320868)


   

5-dehydro-4-deoxy-D-glucuronic acid

5-dehydro-4-deoxy-D-glucuronic acid

C6H8O6 (176.0320868)


   

5-(1,2-dihydroxyethyl)-4-hydroxyoxolane-2,3-dione

5-(1,2-dihydroxyethyl)-4-hydroxyoxolane-2,3-dione

C6H8O6 (176.0320868)


   

Naphthalene-1,4,5-triol

Naphthalene-1,4,5-triol

C10H8O3 (176.0473418)


   

7-Hydroxy-6-methyl-2H-1-benzopyran-2-one

7-Hydroxy-6-methyl-2H-1-benzopyran-2-one

C10H8O3 (176.0473418)


   

3-(3,4-Methylenedioxyphenyl)propenal

2-Propenal,3-(1,3-benzodioxol-5-yl)-

C10H8O3 (176.0473418)


   

10-Hydroxy-2,8-decadiene-4,6-diynoic acid

10-Hydroxy-2,8-decadiene-4,6-diynoic acid

C10H8O3 (176.0473418)


   

3-amino-N-(carboxycarbonyl)alanine

3-amino-N-(carboxycarbonyl)alanine

C5H8N2O5 (176.0433198)


   

N-Carbamoylaspartic acid

N-Carbamoylaspartic acid

C5H8N2O5 (176.0433198)


An N-carbamoylamino acid that is aspartic acid with one of its amino hydrogens replaced by a carbamoyl group.

   

8,9-Epoxy-2Z-decene-4,6-diynoic acid

8,9-Epoxy-2Z-decene-4,6-diynoic acid

C10H8O3 (176.0473418)


   

10-hydroxy-2E,8E-Decadiene-4,6-diynoic acid

10-hydroxy-2E,8E-Decadiene-4,6-diynoic acid

C10H8O3 (176.0473418)


   

10-hydroxy-2Z,8Z-Decadiene-4,6-diynoic acid

10-hydroxy-2Z,8Z-Decadiene-4,6-diynoic acid

C10H8O3 (176.0473418)


   

N-acetyl-S-methyl-L-cysteine(1-)

N-acetyl-S-methyl-L-cysteine(1-)

C6H10NO3S (176.038137)


An S-substituted N-acetyl-L-cysteinate that is the conjugate base of N-acetyl-S-methyl-L-cysteine resulting from the deprotonation of the carboxy group; major species at pH 7.3.

   

N-Carbamoyl-L-aspartic acid

N-Carbamoyl-L-aspartic acid

C5H8N2O5 (176.0433198)


The L-enantiomer N-carbamoylaspartic acid.

   

Naphthalene-1,3,8-triol

Naphthalene-1,3,8-triol

C10H8O3 (176.0473418)


   

Propanetricarboxylic acid

Propanetricarboxylic acid

C6H8O6 (176.0320868)