Exact Mass: 300.06338519999997
Exact Mass Matches: 300.06338519999997
Found 500 metabolites which its exact mass value is equals to given mass value 300.06338519999997,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Diosmetin
Diosmetin is a monomethoxyflavone that is the 4-methyl ether derivative of luteolin. It is a natural product isolated from citrus fruits which exhibits a range of pharmacological activities. It has a role as an antioxidant, an antineoplastic agent, a plant metabolite, a tropomyosin-related kinase B receptor agonist, an apoptosis inducer, an angiogenesis inhibitor, a cardioprotective agent, a bone density conservation agent, an anti-inflammatory agent and a vasodilator agent. It is a monomethoxyflavone, a trihydroxyflavone and a 3-hydroxyflavonoid. It is functionally related to a luteolin. It is a conjugate acid of a diosmetin-7-olate. Diosmetin is an O-methylated flavone and the aglycone part of the flavonoid glycosides diosmin that occurs naturally in citrus fruits. Pharmacologically, diosmetin is reported to exhibit anticancer, antimicrobial, antioxidant, oestrogenic and anti-inflamatory activities. It also acts as a weak TrkB receptor agonist. Diosmetin is a natural product found in Vicia tenuifolia, Salvia tomentosa, and other organisms with data available. See also: Agathosma betulina leaf (part of). A monomethoxyflavone that is the 4-methyl ether derivative of luteolin. It is a natural product isolated from citrus fruits which exhibits a range of pharmacological activities. Isolated from peel of lemon (Citrus limon) and others. Diosmetin is found in many foods, some of which are spearmint, citrus, rosemary, and common thyme. Diosmetin is found in citrus. Diosmetin is isolated from peel of lemon (Citrus limon) and other Diosmetin is a natural flavonoid which inhibits human CYP1A enzyme activity with an IC50 of 40 μM in HepG2 cell. Diosmetin is a natural flavonoid which inhibits human CYP1A enzyme activity with an IC50 of 40 μM in HepG2 cell.
Chrysoeriol
Chrysoeriol, also known as 3-O-methylluteolin, belongs to the class of organic compounds known as 3-O-methylated flavonoids. These are flavonoids with methoxy groups attached to the C3 atom of the flavonoid backbone. Thus, chrysoeriol is considered to be a flavonoid lipid molecule. Chrysoeriol is a very hydrophobic molecule, practically insoluble (in water), and relatively neutral. Chrysoeriol is a bitter-tasting compound. Outside of the human body, chrysoeriol has been detected, but not quantified in, several different foods, such as wild celeries, ryes, hard wheat, alfalfa, and triticales. This could make chrysoeriol a potential biomarker for the consumption of these foods. 4,5,7-trihydroxy-3-methoxyflavone is the 3-O-methyl derivative of luteolin. It has a role as an antineoplastic agent, an antioxidant and a metabolite. It is a trihydroxyflavone and a monomethoxyflavone. It is functionally related to a luteolin. It is a conjugate acid of a 4,5-dihydroxy-3-methoxyflavon-7-olate(1-). Chrysoeriol is a natural product found in Haplophyllum ramosissimum, Myoporum tenuifolium, and other organisms with data available. See also: Acai (part of); Acai fruit pulp (part of). Widespread flavone. Chrysoeriol is found in many foods, some of which are peanut, german camomile, tarragon, and alfalfa. The 3-O-methyl derivative of luteolin. Chrysoeriol, a natural flavonoid extracted from the tropical plant Coronopus didymus, exhibits potent antioxidant activity. Chrysoeriol shows significant inhibition of lipid peroxidation[1]. Chrysoeriol, a natural flavonoid extracted from the tropical plant Coronopus didymus, exhibits potent antioxidant activity. Chrysoeriol shows significant inhibition of lipid peroxidation[1].
Rhamnocitrin
Rhamnocitrin, also known as 3,4,5-trihydroxy-7-methoxyflavone or 7-methylkaempferol, is a member of the class of compounds known as flavonols. Flavonols are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position. Thus, rhamnocitrin is considered to be a flavonoid lipid molecule. Rhamnocitrin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Rhamnocitrin can be found in cloves and lemon balm, which makes rhamnocitrin a potential biomarker for the consumption of these food products. Rhamnocitrin is a monomethoxyflavone that is the 7-methyl ether derivative of kaempferol. It has a role as a plant metabolite. It is a trihydroxyflavone, a member of flavonols and a monomethoxyflavone. It is functionally related to a kaempferol. Rhamnocitrin is a natural product found in Ageratina altissima, Chromolaena odorata, and other organisms with data available. Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2]. Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2]. Rhamnocitrin is a flavonoid isolated from astragalus complanatus R. Br. (Sha-yuan-zi)[1]. Rhamnocitrin is a scavenger of DPPH with an IC50 of 28.38 mM. Rhamnocitrin has anti-oxidant, anti-inflammatory and an-tiatherosclerosis activity[2]. Rhamnocitrin is a flavonoid isolated from astragalus complanatus R. Br. (Sha-yuan-zi)[1]. Rhamnocitrin is a scavenger of DPPH with an IC50 of 28.38 mM. Rhamnocitrin has anti-oxidant, anti-inflammatory and an-tiatherosclerosis activity[2].
Temazepam
Temazepam is only found in individuals that have used or taken this drug. It is a benzodiazepine that acts as a gamma-aminobutyric acid modulator and anti-anxiety agent. [PubChem]Benzodiazepines bind nonspecifically to benzodiazepine receptors, which affects muscle relaxation, anticonvulsant activity, motor coordination, and memory. As benzodiazepine receptors are thought to be coupled to gamma-aminobutyric acid-A (GABAA) receptors, this enhances the effects of GABA by increasing GABA affinity for the GABA receptor. Binding of the inhibitory neurotransmitter GABA to the site opens the chloride channel, resulting in a hyperpolarized cell membrane that prevents further excitation of the cell. D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CD - Benzodiazepine derivatives D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
dinatin
Hispidulin is a natural flavone with a broad spectrum of biological activities. Hispidulin is a Pim-1 inhibitor with an IC50 of 2.71 μM. Hispidulin is a natural flavone with a broad spectrum of biological activities. Hispidulin is a Pim-1 inhibitor with an IC50 of 2.71 μM.
3-O-Methylkaempferol
3-o-methylkaempferol, also known as 5,7,4-trihydroxy-3-methoxyflavone or isokaempferide, is a member of the class of compounds known as 3-o-methylated flavonoids. 3-o-methylated flavonoids are flavonoids with methoxy groups attached to the C3 atom of the flavonoid backbone. Thus, 3-o-methylkaempferol is considered to be a flavonoid lipid molecule. 3-o-methylkaempferol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 3-o-methylkaempferol can be found in common bean and coriander, which makes 3-o-methylkaempferol a potential biomarker for the consumption of these food products.
Kaempferide
Kaempferide is a monomethoxyflavone that is the 4-O-methyl derivative of kaempferol. It has a role as an antihypertensive agent and a metabolite. It is a trihydroxyflavone, a monomethoxyflavone and a 7-hydroxyflavonol. It is functionally related to a kaempferol. It is a conjugate acid of a kaempferide(1-). Kaempferide is a natural product found in Ageratina altissima, Chromolaena odorata, and other organisms with data available. Isolated from roots of Alpinia officinarum (lesser galangal). Kaempferide is found in many foods, some of which are herbs and spices, cloves, sour cherry, and european plum. Kaempferide is found in cloves. Kaempferide is isolated from roots of Alpinia officinarum (lesser galangal). A monomethoxyflavone that is the 4-O-methyl derivative of kaempferol. Acquisition and generation of the data is financially supported in part by CREST/JST. Kaempferide is an O-methylated flavonol also found in kaempferol. Kaempferide has antiviral activity. Kaempferide is an orally active flavonol isolated from Hippophae rhamnoides L. Kaempferide has anticancer, anti-inflammatory, antioxidant, antidiabetic, antiobesity, antihypertensive, and neuroprotective activities. Kaempferide induces apoptosis. Kaempferide promotes osteogenesis through antioxidants and can be used in osteoporosis research[1][2][3][4][5][6]. Kaempferide is an O-methylated flavonol also found in kaempferol. Kaempferide has antiviral activity.
Tectorigenin
Tectorigenin is a methoxyisoflavone that is isoflavone substituted by a methoxy group at position 6 and hydroxy groups at positions 5, 7 and 4 respectively. It has a role as an anti-inflammatory agent and a plant metabolite. It is a member of 7-hydroxyisoflavones and a methoxyisoflavone. It is functionally related to an isoflavone. Tectorigenin is a natural product found in Iris milesii, Dalbergia sissoo, and other organisms with data available. Tectorigenin is an isoflavone from Pueraria thunbergiana, which induces differentiation and apoptosis in cancer cells. (NCI) Tectorigenin is an O-methylated isoflavone, a type of flavonoid. It can be isolated from leopard lily (Belamcanda chinensis) or Pueraria thunbergiana. A methoxyisoflavone that is isoflavone substituted by a methoxy group at position 6 and hydroxy groups at positions 5, 7 and 4 respectively. C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor A polyphenol metabolite detected in biological fluids [PhenolExplorer] C471 - Enzyme Inhibitor > C1017 - Glucuronidase Inhibitor Tectorigenin is a plant isoflavonoid originally isolated from the dried flower of Pueraria lobate Benth. Tectorigenin is a plant isoflavonoid originally isolated from the dried flower of Pueraria lobate Benth.
1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 4-phosphate
beta-D-3-Ribofuranosyluric acid
C10H12N4O7 (300.07059619999995)
beta-D-3-Ribofuranosyluric acid is found in animal foods. beta-D-3-Ribofuranosyluric acid is isolated from beef bloo Isolated from beef blood. beta-D-3-Ribofuranosyluric acid is found in animal foods.
Cinnavalininate
Cinnavalininate is an intermediate in the tryptophan metabolic pathway [Kegg: C05640]. It is generated from 3-hydroxyanthranilate via the enzyme catalase (EC:1.11.1.6). [HMDB] Cinnavalininate is an intermediate in the tryptophan metabolic pathway [Kegg: C05640]. It is generated from 3-hydroxyanthranilate via the enzyme catalase (EC:1.11.1.6). Cinnabarinic acid is a specific orthosteric agonist of mGlu4 by interacting with residues of the glutamate binding pocket of mGlu4, has no activity at other mGlu receptors. Cinnabarinic acid is an endogenous metabolite of the kynurenine pathway of tryptophan. Cinnabarinic acid induces cell apoptosis[1].
Tazobactam
Tazobactam is only found in individuals that have used or taken this drug.It is a antibacterial penicillin derivative which inhibits the action of bacterial beta-lactamases.Tazobactam broadens the spectrum of piperacillin by making it effective against organisms that express beta-lactamase and would normally degrade piperacillin. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01C - Beta-lactam antibacterials, penicillins > J01CG - Beta-lactamase inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D065093 - beta-Lactamase Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C2140 - Adjuvant > C183118 - Beta-lactamase Inhibitor D004791 - Enzyme Inhibitors Tazobactam (CL-298741) is a potent β-lactamases inhibitor and penicillin antibiotic. Tazobactam has antibacterial activity. Tazobactam can be used for pneumonia research[1][2].
Leptosidin
A hydroxyaurone that is aurone substituted by hydroxy groups at positions 6, 3 and 4 and a methoxy group at position 7.
Cajanin
Cajanin is a member of 7-methoxyisoflavones. It has a role as a metabolite. Cajanin is a natural product found in Crotalaria lachnophora, Dalbergia parviflora, and other organisms with data available. Isolated from Cajanus cajan (pigeon pea), Canavalia ensiformis (jack bean). Cajanin is found in pigeon pea, coffee and coffee products, and pulses. Cajanin is found in coffee and coffee products. Cajanin is isolated from Cajanus cajan (pigeon pea), Canavalia ensiformis (jack bean A natural product found in Crotalaria lachnophora.
Pratensein
Pratensein is a member of the class of 7-hydroxyisoflavones in which isoflavone is substituted by hydroxy groups at the 5, 7, and 3 positions, and by a methoxy group at the 4 position. It is a member of 7-hydroxyisoflavones and a member of 4-methoxyisoflavones. It is a conjugate acid of a pratensein(1-). Pratensein is a natural product found in Dalbergia sissoo, Cicer chorassanicum, and other organisms with data available. See also: Trifolium pratense flower (part of). A member of the class of 7-hydroxyisoflavones in which isoflavone is substituted by hydroxy groups at the 5, 7, and 3 positions, and by a methoxy group at the 4 position. Constituent of Cicer arietinum (chickpea). 3-Hydroxybiochanin A is found in peanut, chickpea, and pulses. Pratensein is found in chickpea. Pratensein is a constituent of Cicer arietinum (chickpea)
N1-Amidinostreptamine 6-phosphate
3-(4-Chlorobenzyl)-5-(2-methoxyphenyl)-1,2,4-oxadiazole
6alpha-Hydroxymaackiain
Isolated from leaves of Trifolium pratense (red clover) as a phytoalexin. 6alpha-Hydroxymaackiain is found in many foods, some of which are pulses, tea, common pea, and herbs and spices. 6alpha-Hydroxymaackiain is found in common pea. 6alpha-Hydroxymaackiain is isolated from leaves of Trifolium pratense (red clover) as a phytoalexin.
Questinol
Questinol is found in green vegetables. Questinol is isolated from roots of Polygonum cuspidatum (Japanese knotweed Isolated from roots of Polygonum cuspidatum (Japanese knotweed). Questinol is found in green vegetables.
(3R)-Sophorol
(3r)-sophorol is a member of the class of compounds known as isoflavanones. Isoflavanones are polycyclic compounds containing an isoflavan skeleton which bears a ketone at position C4. Thus, (3r)-sophorol is considered to be a flavonoid lipid molecule (3r)-sophorol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). (3r)-sophorol can be found in a number of food items such as japanese chestnut, radish, star fruit, and acerola, which makes (3r)-sophorol a potential biomarker for the consumption of these food products.
Sodium 3-ethyl-7-isopropyl-1-azulenesulfonate
C15H17O3S. Na (300.07960520000006)
Luteolin 7-methyl ether
Luteolin 7-methyl ether is a member of flavonoids and an ether. It is a conjugate acid of a luteolin-5-olate 7-methyl ether. 7-O-Methylluteolin is a natural product found in Verbascum lychnitis, Salvia hypoleuca, and other organisms with data available. Luteolin 7-methyl ether is found in common sage. Luteolin 7-methyl ether is isolated from Salvia officinalis (sage). Isolated from Salvia officinalis (sage). Luteolin 7-methyl ether is found in tea, herbs and spices, and common sage. Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2]. Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2].
Sulfaquinoxaline
Sulfaquinoxaline is an antimicrobial and a coccidiostat for veterinary use. It is a potential food contaminant in animal products arising from its veterinary use. Antimicrobial, coccidiostat for vet. use. Potential food contaminant in animal products arising from its veterinary use. D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides
Clobazam
Clobazam is only found in individuals that have used or taken this drug. It is a drug which is a benzodiazepine derivative. It has been marketed as an anxiolytic since 1975 and an anticonvulsant since 1984. [Wikipedia]Clobazam binds at a distinct binding site associated with a Cl- ionopore at the GABA-A receptor, increasing the duration of time for which the Cl- ionopore is open. The post-synaptic inhibitory effect of GABA in the thalamus is prolonged as a result. D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents N - Nervous system > N05 - Psycholeptics > N05B - Anxiolytics > N05BA - Benzodiazepine derivatives D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018755 - GABA Agonists C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants
Salicylic acid beta-D-glucoside
Constituent of various plant subspecies e.g. white mustard seed (Sinapis alba), bell pepper (Capsicum annuum) and leaves of thyme, rosemary, basil and sweet marjoram. Salicylic acid glucoside is found in many foods, some of which are herbs and spices, yellow bell pepper, orange bell pepper, and red bell pepper. Salicylic acid beta-D-glucoside is found in herbs and spices. Salicylic acid beta-D-glucoside is a constituent of various plant species e.g. white mustard seed (Sinapis alba), bell pepper (Capsicum annuum) and leaves of thyme, rosemary, basil and sweet marjoram. D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
(3,4,5,6-tetrahydroxyoxan-2-yl)methyl 4-hydroxybenzoate
Khrinone A
Khrinone A belongs to the class of organic compounds known as 3-hydroxy,4-methoxyisoflavonoids. These are isoflavonoids carrying a methoxy group attached to the C4 atom, as well as a hydroxyl group at the C3-position of the isoflavonoid backbone. BioTransformer predicts that khrinone A is a product of 2-hydroxyformononetin metabolism via a hydroxylation-of-benzene-para-to-edg reaction catalyzed by CYP1A2, CYP2C9, and CYP2D6 enzymes (PMID: 30612223).
5,7-dihydroxy-2-(3-hydroxyphenyl)-6-methoxy-4H-chromen-4-one
Santal
Santal is found in green vegetables. Santal is a constituent of Pterocarpus soyauxii. Constituent of Pterocarpus soyauxii. Santal is found in green vegetables.
Mumefural
Mumefural is isolated from fruit juice concentrate of Prunus mume (Japanese apricot Isolated from fruit juice concentrate of Prunus mume (Japanese apricot)
Dimethyl fukiic acid
Dimethyl fukiic acid is found in green vegetables. Dimethyl fukiic acid is isolated from Petasites japonicus (sweet coltsfoot
3,5-Dihydroxy-6,7-methylenedioxyflavanone
3,5-Dihydroxy-6,7-methylenedioxyflavanone is found in common beet. 3,5-Dihydroxy-6,7-methylenedioxyflavanone is a constituent of sugarbeet infected with Rhizoctonia solani. Constituent of sugarbeet infected with Rhizoctonia solani. 3,5-Dihydroxy-6,7-methylenedioxyflavanone is found in common beet.
3,3',7-Trihydroxy-4'-methoxyflavone
3,3,7-Trihydroxy-4-methoxyflavone is isolated from quebracho heartwoo
Barpisoflavone A
Barpisoflavone A is found in scarlet bean. Barpisoflavone A is a constituent of Phaseolus coccineus (scarlet runner bean) Constituent of Phaseolus coccineus (scarlet runner bean). Barpisoflavone A is found in scarlet bean.
Takakin
Isolated from aerial parts of Citrus reticulata (mandarin). 4-Methylisoscutellarein is found in citrus. Takakin is found in citrus. Takakin is isolated from aerial parts of Citrus reticulata (mandarin
Carboxytolbutamide
Carboxytolbutamide belongs to the family of Sulfanylbenzoic Acid Derivatives. These are benzoic acid derivatives which bear a sulfanyl group (R-SH) attached to the benzene ring.
4-Methylcatechol 1-glucuronide
4-Methylcatechol 2-glucuronide
Indole-2-carboxylic acid, 5-(bis(2-chloroethyl)amino)-
5,3',4'-Trihydroxy-7-methoxy-4-phenylcoumarin
Hematein
Hematein is a oxidation product of hematoxylin acted as a dye[1]. Hematein is an allosteric casein kinase II inhibitor with an IC50 of 0.74 μM. Hematein inhibits Akt/PKB Ser129 phosphorylation, the Wnt/TCF pathway and increases apoptosis in lung cancer cells[2].
N-(3-Methyl-2-pyridyl)-3-(4-chlorophenyl)succinimide
Itanoxone
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent
Tinctormine
C9H12N6O4S (300.06407120000006)
Tinctormine is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Tinctormine can be found in safflower, which makes tinctormine a potential biomarker for the consumption of this food product.
Oryzanin
Oryzenin, also known as thiamin or vitamin b1, is a member of the class of compounds known as thiamines. Thiamines are compounds containing a thiamine moiety, which is structurally characterized by a 3-[(4-Amino-2-methyl-pyrimidin-5-yl)methyl]-4-methyl-thiazol-5-yl backbone. Oryzenin is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Oryzenin can be found in rice, which makes oryzenin a potential biomarker for the consumption of this food product. A - Alimentary tract and metabolism > A11 - Vitamins > A11D - Vitamin b1, plain and in combination with vitamin b6 and b12 > A11DA - Vitamin b1, plain D018977 - Micronutrients > D014815 - Vitamins COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Thiamine monochloride (Vitamin B1) is an essential vitamin that plays an important role in cellular production of energy from ingested food and enhances normal neuronal actives. Thiamine monochloride (Vitamin B1) is an essential vitamin that plays an important role in cellular production of energy from ingested food and enhances normal neuronal actives.
4-Hydroxybenzoyl glucose
4-hydroxybenzoyl glucose, also known as 1-O-P-hydroxybenzoyl-β-D-glucose, is a member of the class of compounds known as hexoses. Hexoses are monosaccharides in which the sugar unit is a is a six-carbon containing moeity. 4-hydroxybenzoyl glucose is soluble (in water) and a very weakly acidic compound (based on its pKa). 4-hydroxybenzoyl glucose can be found in common thyme, which makes 4-hydroxybenzoyl glucose a potential biomarker for the consumption of this food product.
4-Hydroxybenzoic acid glucoside
4-hydroxybenzoic acid glucoside is a member of the class of compounds known as phenolic glycosides. Phenolic glycosides are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. 4-hydroxybenzoic acid glucoside is soluble (in water) and a weakly acidic compound (based on its pKa). 4-hydroxybenzoic acid glucoside can be found in a number of food items such as highbush blueberry, jostaberry, caraway, and carrot, which makes 4-hydroxybenzoic acid glucoside a potential biomarker for the consumption of these food products.
Isotectorigenin
Isolated from Dalbergia sissoo bark, Millettia auriculata seeds and metabolite of Aspergillus niger [CCD]. A polyphenol metabolite detected in biological fluids [PhenolExplorer] Isolated from Dalbergia sissoo bark, Millettia auriculata seeds and metabolite of Aspergillus niger [CCD]
Hispidulin
Hispidulin is a monomethoxyflavone that is scutellarein methylated at position 6. It has a role as an apoptosis inducer, an anti-inflammatory agent, an antioxidant, an anticonvulsant, an antineoplastic agent and a plant metabolite. It is a trihydroxyflavone and a monomethoxyflavone. It is functionally related to a scutellarein. Hispidulin (4,5,7-trihydroxy-6-methoxyflavone) is a potent benzodiazepine (BZD) receptor ligand with positive allosteric properties. Hispidulin is a natural product found in Eupatorium cannabinum, Eupatorium perfoliatum, and other organisms with data available. See also: Arnica montana Flower (part of). A monomethoxyflavone that is scutellarein methylated at position 6. 6-methylscutellarein, also known as 4,5,7-trihydroxy-6-methoxyflavone or dinatin, is a member of the class of compounds known as 6-o-methylated flavonoids. 6-o-methylated flavonoids are flavonoids with methoxy groups attached to the C6 atom of the flavonoid backbone. Thus, 6-methylscutellarein is considered to be a flavonoid lipid molecule. 6-methylscutellarein is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 6-methylscutellarein can be found in a number of food items such as italian oregano, common sage, sunflower, and common thyme, which makes 6-methylscutellarein a potential biomarker for the consumption of these food products. Hispidulin is a natural flavone with a broad spectrum of biological activities. Hispidulin is a Pim-1 inhibitor with an IC50 of 2.71 μM. Hispidulin is a natural flavone with a broad spectrum of biological activities. Hispidulin is a Pim-1 inhibitor with an IC50 of 2.71 μM.
Mopanone
5,2,6-Trihydroxy-7-methoxyflavone
6,7,4-Trihydroxy-3-methoxyflavone
5-methoxy-7-phenyl-3H-benzo[de]isochromen-1,6-dione
5,7,2-Trihydroxy-6-methoxyflavone
A trihydroxyflavone that is flavone substituted by hydroxy groups at positions 5, 7 and 2 and a methoxy group at position 6. It has been isolated from the roots of Rubia yunnanensis.
Pedicinin
Sorbifolin
Scutellarein 7-methyl ether is a monomethoxyflavone and a trihydroxyflavone. It is functionally related to a scutellarein. Sorbifolin is a natural product found in Galeopsis ladanum, Sorbaria sorbifolia var. stellipila, and other organisms with data available.
dinatin
Hispidulin is a natural flavone with a broad spectrum of biological activities. Hispidulin is a Pim-1 inhibitor with an IC50 of 2.71 μM. Hispidulin is a natural flavone with a broad spectrum of biological activities. Hispidulin is a Pim-1 inhibitor with an IC50 of 2.71 μM.
3,5-dihydroxy-6,7-methylenedioxyflavanone
Diosmetin
Diosmetin is a natural flavonoid which inhibits human CYP1A enzyme activity with an IC50 of 40 μM in HepG2 cell. Diosmetin is a natural flavonoid which inhibits human CYP1A enzyme activity with an IC50 of 40 μM in HepG2 cell.
Hydroxygenkwanin
Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2]. Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2].
Rhamnocitrin
Rhamnocitrin is a monomethoxyflavone that is the 7-methyl ether derivative of kaempferol. It has a role as a plant metabolite. It is a trihydroxyflavone, a member of flavonols and a monomethoxyflavone. It is functionally related to a kaempferol. Rhamnocitrin is a natural product found in Ageratina altissima, Chromolaena odorata, and other organisms with data available. A monomethoxyflavone that is the 7-methyl ether derivative of kaempferol. Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2]. Hydroxygenkwanin (7-O-Methylluteolin), a natural flavonoid compound, is one of the main components of Lilac Daphne. Hydroxygenkwanin has anti-oxidant ability, anti-glioma ability and anticancer effect[1][2]. Rhamnocitrin is a flavonoid isolated from astragalus complanatus R. Br. (Sha-yuan-zi)[1]. Rhamnocitrin is a scavenger of DPPH with an IC50 of 28.38 mM. Rhamnocitrin has anti-oxidant, anti-inflammatory and an-tiatherosclerosis activity[2]. Rhamnocitrin is a flavonoid isolated from astragalus complanatus R. Br. (Sha-yuan-zi)[1]. Rhamnocitrin is a scavenger of DPPH with an IC50 of 28.38 mM. Rhamnocitrin has anti-oxidant, anti-inflammatory and an-tiatherosclerosis activity[2].
Tectorigenin
Tectorigenin is a plant isoflavonoid originally isolated from the dried flower of Pueraria lobate Benth. Tectorigenin is a plant isoflavonoid originally isolated from the dried flower of Pueraria lobate Benth.
ACETYLSALICYLSALICYLIC ACID
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
3(2-Chlorophenyl)-7-ethoxycoumarin
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.294 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.292
(2Z)-4,6-dihydroxy-2-[(3-hydroxy-4-methoxyphenyl)methylidene]-1-benzofuran-3-one
Hematein
Hematein is an organic heterotetracyclic compound that is -6a,7-dihydrobenzo[b]indeno[1,2-d]pyran-9-one carrying four hydroxy substituents at positions 3, 4, 6a and 10. It has a role as a histological dye. It is an enol, an organic heterotetracyclic compound, a member of phenols, a member of quinomethanes and a tertiary alcohol. Hematein is a oxidation product of hematoxylin acted as a dye[1]. Hematein is an allosteric casein kinase II inhibitor with an IC50 of 0.74 μM. Hematein inhibits Akt/PKB Ser129 phosphorylation, the Wnt/TCF pathway and increases apoptosis in lung cancer cells[2].
1,3,5-Trihydroxy-4-methoxy-2-methylanthracene-9,10-dione
Erythroglaucin
A trihydroxyanthraquinone that is anthracene-9,10-dione substituted by hydroxy groups at positions 1, 4 and 5, a methoxy group at position 7 and a methyl group at position 2. It has been isolated from Chaetomium globosum and other fungal species.
1,5,7-Trihydroxy-8-methoxy-3-methyl-9,10-anthraquinone
5,7-dihydroxy-2-(4-methoxyphenoxy)-4H-chromen-4-one
3-beta-D-ribofuranosyl-7,9-dihydro-3H-purine-2,6,8-trione|Harnsaeure-(3)-ribosid
C10H12N4O7 (300.07059619999995)
1,3,5-trihydroxy-2-(methoxymethyl)anthracene-9,10-dione
1,3-dihydroxy-2-hydroxymethyl-6-methoxyanthraquinone
1-Me ether-1,5,8-Trihydroxy-2-(hydroxymethyl)anthraquinone
2,6,8-Trihydroxy-1-methoxy-3-methylanthracene-9,10-dione
4-(2,5-Dihydroxyphenyl)-5-hydroxy-7-methoxy-2-benzopyrone
5,7-dihydroxy-2-(2-hydroxy-5-methoxyphenyl)-4h-chromen-4-on
1,8-Dihydroxy-10-methoxy-3-methyldibenzo[b,e]oxepin-6,11-dione
3,10,11-trihydroxydibenz[b,e]oxonin-7,13(6h,8h)-dione
Pinselin
A member of the class of xanthones that is methyl 9H-xanthene-1-carboxylate substituted by hydroxy groups at positions 2 and 8, a methyl group at position 6 and an oxo group at position 9. It has been isolated from Aspergillus sydowii.
1,4,7-trihydroxy-2-methoxy-6-methylanthracene-9,10-dione
3-(3,4-dihydroxybenzyl)-6,7-dihydroxycoumarin|3-(3,4-dihydroxybenzyl)-6,7-dihydroxy-2H-1-benzopyran-2-one
1-Me ether-1,2,4,5-Tetrahydroxy-3-methylanthraquinone
(E)-3-(3,4-dihydroxybenzylidene)-5,7-dihydroxychroman-4-one|ovatifolionone
(3S,4S)-3,4-dihydroxyl-7,8,-methylenedioxylpterocarpan
2,8-dihydroxy-6-(hydroxymethyl)-1-methoxyanthracene-9,10-dione
6-p-hydroxybenzoyl-D-glucose|O6-(4-Hydroxy-benzoyl)-D-glucose|p-hydroxybenzoic acid glucose ester
1,8-Di-Me ether,2,3-methylene ether-1,2,3,8-Tetrahydroxyxanthone|1,8-dimethoxy-2,3-methylenedioxyxanthone
2,5-dihydroxy-4-methoxy-3,6-dioxochalcone|3.6-Dihydroxy-5-methoxy-2-cinnamoyl-benzochinon-(1.4)|3.6-Dihydroxy-5-methoxy-2-trans-cinnamoyl-benzochinon-(1.4)|3.6-dihydroxy-5-methoxy-2-trans-cinnamoyl-benzoquinone-(1.4)|Pedicinin
2-(2,3-Dihydro-5-methyl-6-oxopyran-2-yl)-5,8-dihydroxy-1,4-naphthoquinone
1,4-Dimethoxy-2,3-(methylenebisoxy)-9H-xanthene-9-one
SYDOWININ A
A member of the class of xanthones that is methyl 9-oxo-9H-xanthene-1-carboxylate substituted by a hydroxy group at position 8 and a hydroxymethyl group at position 6. It has been isolated from the sea fan derived fungus Aspergillus sydowii.
5-Me ether-1,3,5,8-Tetrahydroxy-2-methylanthraquinone
1-Hydroxy-3-(hydroxymethyl)-10-methoxy-6,11-dihydrodibenzo[b,e]oxepin-6,11-dione
1-(7,9-dihydroxy-1-methoxy-9h-4,8-dioxacyclopenta[def]phenanthren-5-yl)-ethanone
6-chloro-1-pentofuranosyl-1h-imidazo[4,5-c]pyridin-4-amine
3-O-METHYLOROBOL
3-O-methylorobol is a hydroxyisoflavone that is orobol in which the hydroxy group at position 3 has been replaced by a methoxy group. It has been isolated from Crotalaria lachnophora. It has a role as a plant metabolite. It is a methoxyisoflavone and a hydroxyisoflavone. It is functionally related to an orobol. 3-O-Methylorobol is a natural product found in Dalbergia sissoo, Crotalaria lachnophora, and other organisms with data available. A hydroxyisoflavone that is orobol in which the hydroxy group at position 3 has been replaced by a methoxy group. It has been isolated from Crotalaria lachnophora.
4-HYDROXYWOGONIN
4-Hydroxywogonin is a natural product found in Scutellaria amoena, Scutellaria amabilis, and other organisms with data available.
p-hydroxybenzoyl glucose
1-O-(4-hydroxybenzoyl)-beta-D-glucopyranose is an O-acyl carbohydrate that is beta-D-glucopyranose in which the anomeric hydroxy hydrogen has been replaced by a 4-hydroxybenzoyl group. It has a role as a plant metabolite. It is a beta-D-glucoside, an O-acyl carbohydrate, a benzoate ester and a monosaccharide derivative. 4-Hydroxybenzoyl glucose is a natural product found in Moricandia arvensis, Rhodiola chrysanthemifolia, and other organisms with data available. An O-acyl carbohydrate that is beta-D-glucopyranose in which the anomeric hydroxy hydrogen has been replaced by a 4-hydroxybenzoyl group.
JGWNHIDADWFGIJ-UHFFFAOYSA-
2,6,8-Trihydroxy-1-methoxy-3-methylanthracene-9,10-dione is a natural product found in Ventilago leiocarpa with data available.
temazepam
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CD - Benzodiazepine derivatives D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018757 - GABA Modulators C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent CONFIDENCE standard compound; INTERNAL_ID 1557 CONFIDENCE standard compound; INTERNAL_ID 8605
Clobazam
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents N - Nervous system > N05 - Psycholeptics > N05B - Anxiolytics > N05BA - Benzodiazepine derivatives D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018755 - GABA Agonists C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D002491 - Central Nervous System Agents > D000927 - Anticonvulsants CONFIDENCE standard compound; EAWAG_UCHEM_ID 3593 CONFIDENCE standard compound; INTERNAL_ID 1598
Methyl-3-[(2-nitrobenzoyl)amino]benzoate
[Raw Data] CB134_Methyl 3-[(2-nitrobenzoyl)amino]benzoate_neg_20eV_000029.txt [Raw Data] CB134_Methyl 3-[(2-nitrobenzoyl)amino]benzoate_neg_10eV_000029.txt [Raw Data] CB134_Methyl-3-[(2-nitrobenzoyl)amino]benzoate_pos_50eV_CB000047.txt [Raw Data] CB134_Methyl-3-[(2-nitrobenzoyl)amino]benzoate_pos_40eV_CB000047.txt [Raw Data] CB134_Methyl-3-[(2-nitrobenzoyl)amino]benzoate_pos_30eV_CB000047.txt [Raw Data] CB134_Methyl-3-[(2-nitrobenzoyl)amino]benzoate_pos_20eV_CB000047.txt [Raw Data] CB134_Methyl-3-[(2-nitrobenzoyl)amino]benzoate_pos_10eV_CB000047.txt
Chrysoeriol
Chrysoeriol, a natural flavonoid extracted from the tropical plant Coronopus didymus, exhibits potent antioxidant activity. Chrysoeriol shows significant inhibition of lipid peroxidation[1]. Chrysoeriol, a natural flavonoid extracted from the tropical plant Coronopus didymus, exhibits potent antioxidant activity. Chrysoeriol shows significant inhibition of lipid peroxidation[1].
Chryseriol
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.094 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.096 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.093 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.091 Chrysoeriol, a natural flavonoid extracted from the tropical plant Coronopus didymus, exhibits potent antioxidant activity. Chrysoeriol shows significant inhibition of lipid peroxidation[1]. Chrysoeriol, a natural flavonoid extracted from the tropical plant Coronopus didymus, exhibits potent antioxidant activity. Chrysoeriol shows significant inhibition of lipid peroxidation[1].
Kaempferide
relative retention time with respect to 9-anthracene Carboxylic Acid is 1.191 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.194 relative retention time with respect to 9-anthracene Carboxylic Acid is 1.190 Kaempferide is an O-methylated flavonol also found in kaempferol. Kaempferide has antiviral activity. Kaempferide is an orally active flavonol isolated from Hippophae rhamnoides L. Kaempferide has anticancer, anti-inflammatory, antioxidant, antidiabetic, antiobesity, antihypertensive, and neuroprotective activities. Kaempferide induces apoptosis. Kaempferide promotes osteogenesis through antioxidants and can be used in osteoporosis research[1][2][3][4][5][6]. Kaempferide is an O-methylated flavonol also found in kaempferol. Kaempferide has antiviral activity.
Methyl 3,8-dihydroxy-6-methyl-9-oxo-9H-xanthene-1-carboxylate_120100
3-(2,4-dihydroxyphenyl)-7-hydroxy-5-methoxychromen-4-one
1,8-dihydroxy-3-(hydroxymethyl)-6-methoxyanthracene-9,10-dione
3-(3-chloro-1,2-dihydroxypropyl)-8-hydroxy-6-methoxyisochromen-1-one
5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methoxychromen-4-one
methyl 8-hydroxy-6-(hydroxymethyl)-9-oxoxanthene-1-carboxylate
methyl 3,8-dihydroxy-6-methyl-9-oxoxanthene-1-carboxylate
1,3-dihydroxy-6-(hydroxymethyl)-8-methoxyanthracene-9,10-dione
5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxychromen-4-one
5,6,7-trihydroxy-2-(4-methoxyphenyl)chromen-4-one
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-methoxychromen-4-one
Kaempferid
Kaempferide is an O-methylated flavonol also found in kaempferol. Kaempferide has antiviral activity. Kaempferide is an orally active flavonol isolated from Hippophae rhamnoides L. Kaempferide has anticancer, anti-inflammatory, antioxidant, antidiabetic, antiobesity, antihypertensive, and neuroprotective activities. Kaempferide induces apoptosis. Kaempferide promotes osteogenesis through antioxidants and can be used in osteoporosis research[1][2][3][4][5][6]. Kaempferide is an O-methylated flavonol also found in kaempferol. Kaempferide has antiviral activity.
sulfaquinoxaline
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3548; ORIGINAL_PRECURSOR_SCAN_NO 3544 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3503; ORIGINAL_PRECURSOR_SCAN_NO 3499 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3555; ORIGINAL_PRECURSOR_SCAN_NO 3554 INTERNAL_ID 412; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3555; ORIGINAL_PRECURSOR_SCAN_NO 3554 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3538; ORIGINAL_PRECURSOR_SCAN_NO 3536 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3575; ORIGINAL_PRECURSOR_SCAN_NO 3573 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3512; ORIGINAL_PRECURSOR_SCAN_NO 3508 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7297; ORIGINAL_PRECURSOR_SCAN_NO 7295 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7320; ORIGINAL_PRECURSOR_SCAN_NO 7318 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7347; ORIGINAL_PRECURSOR_SCAN_NO 7344 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7347; ORIGINAL_PRECURSOR_SCAN_NO 7345 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7334; ORIGINAL_PRECURSOR_SCAN_NO 7332 CONFIDENCE standard compound; INTERNAL_ID 412; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7362; ORIGINAL_PRECURSOR_SCAN_NO 7359
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-methoxy-4H-chromen-4-one
Salicylic acid glucoside
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
Benzaldehyde,4-methyl-, 2-(2,4-dinitrophenyl)hydrazone
N-(3-Cyano-4,5,6,7-Tetrahydro-1-Benzothien-2-Yl)-2-Fluorobenzamide
(2R,4R)-1-BENZYL-4-AMINO-PYRROLIDINE-2,4-DICARBOXYLIC ACID HCL
N-[5-(5-methyl-1,2,4-oxadiazol-3-yl)-4-phenyl-1,3-thiazol-2-yl]acetamide
6-Chloro-9-(3-C-methyl-beta-D-ribofuranosyl)-9H-purine
Sulazepam
C16H13ClN2S (300.04879280000006)
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
2-phenyl-3-sulfanylidene-4,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one
ETHYL 6-((TERT-BUTOXYCARBONYL)AMINO)-4-CHLOROPICOLINATE
1,2,3,4-TETRAHYDRO-6-METHYL-4-(4-TRIFLUOROMETHYLPHENYL)-2-OXO-5-PYRIMIDINECARBOX
C13H11F3N2O3 (300.07217319999995)
3-(4-CHLOROPHENYL)-5-METHYLTHIO-1-PHENYL-1H-PYRAZOLE
C16H13ClN2S (300.04879280000006)
2-[2-[(4-CHLOROPHENYL)SULFONYL]ETHYL]CYCLOHEXAN-1-ONE
4-(2,5-Dioxotetrahydrofuran-3-yl)-Tetralin-1,2-Dicarboxylic Anhydride
2-[(4-METHYL-5-QUINOLIN-6-YL-4H-1,2,4-TRIAZOL-3-YL)THIO]ACETIC ACID
4-(METHYLTHIO)-2-(([2-(METHYLTHIO)-3-PYRIDYL]CARBONYL)AMINO)BUTANOIC ACID
PNU 282987
PNU-282987 is a potent α7 nicotinic acetylcholine receptor (nAChR) agonist with an EC50 of 154 nM. PNU-282987 is also a functional antagonist of the 5-HT3 receptor with an IC50 of 4541 nM. PNU-282987 can be used for the research of central and peripheral nervous systems[1].
1H-PYRROLO[2,3-B]PYRIDINE-2-CARBOXALDEHYDE, 1-[(4-METHYLPHENYL)SULFONYL]-
2-[(3-methyl-4-nitropyridin-2-yl)methylsulfanyl]-1H-benzimidazole
sodium gualenate
C15H17NaO3S (300.07960520000006)
C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent
ethyl 4-phenyl-5-(trifluoromethyl)thiophene-2-carboxylate
3-ALLYL-5-(3-ETHYL-4-METHYL-2-THIAZOLINYLIDENE)RHODANINE
Sulfamethazine sodium
C12H13N4NaO2S (300.06568780000003)
C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent
3-Amino-6-(4-methylpiperazin-1-yl)pyridine triHydrochloride
C10H19Cl3N4 (300.06752240000003)
3-((TERT-BUTOXYCARBONYL)AMINO)-3-(6-CHLOROPYRIDIN-3-YL)PROPANOIC ACID
1-Bromo-4-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]benzene
(5-BROMO-1,3-PHENYLENE)BIS(TRIMETHYLSILANE)
C12H21BrSi2 (300.03650860000005)
4-carbamoyl-2-[(4-methylphenyl)sulfonylamino]butanoic acid
Methyl-2-(5-brompyridin-3-yl)norleucinat
C12H17BrN2O2 (300.04733219999997)
4,6-BIS(2-HYDROXYETHOXY)-m-PHENYLENEDIAMINE HCl
C10H18Cl2N2O4 (300.06435680000004)
2,6-diamino-4-(4-hydroxy-3-methoxyphenyl)-4H-thiopyran-3,5-dicarbonitrile
tert-butyl 5-chloro-3-(chloromethyl)pyrrolo[2,3-b]pyridine-1-carboxylate
6-Chloro-9-(2-C-methyl-beta-D-ribofuranosyl)-9H-purine
(3-Bromo-4-methylphenoxy)(tert-butyl)dimethylsilane
1-[(4-NITROPHENYL)SULFONYL]PYRROLIDINE-2-CARBOXYLIC ACID
C11H12N2O6S (300.04160520000005)
Methyl-2-deoxy-2-(trifluoromethyl)-alpha-D-arabinofuranoside diacetate
1-(4-Bromo-2-fluorobenzyl)-4-ethylpiperazine
C13H18BrFN2 (300.06372999999996)
METHYL-2-DEOXY-2-(TRIFLUOROMETHYL)-A-D-RIBOFURANOSIDE-DIACETATE
(2S)-1-(3-nitrophenyl)sulfonylproline
C11H12N2O6S (300.04160520000005)
3-[2-carboxyethylsulfanyl(phenyl)methyl]sulfanylpropanoic acid
5-(4-CHLOROPHENYL)-3-METHYLTHIO-1-PHENYL-1H-PYRAZOLE
C16H13ClN2S (300.04879280000006)
(R,R)-1,2-BIS(METHANESULFONYLOXYMETHYL)CYCLOHEXANE
TERT-BUTYL (5-BROMOPYRIDIN-2-YL)(ETHYL)CARBAMATE
C12H17BrN2O2 (300.04733219999997)
1,2,3,4-TETRAHYDRO-6-METHYL-2-OXO-4-[2-(TRIFLUOROMETHYL)PHENYL]-5-PYRIMIDINECARB
C13H11F3N2O3 (300.07217319999995)
2-[3,5-bis(trifluoromethyl)phenyl]-2-methylpropanoic acid
ETHYL 2-[(6-CHLORO-5-FLUOROPYRIDIN-3-YL)CARBONYL]-3-(ETHYLAMINO)ACRYLATE
2-(4-FLUORO-PHENYL)-5-HYDROXY-BENZOFURAN-3-CARBOXYLIC ACID ETHYL ESTER
Ethyl 2-(1,3-benzoxazol-2-ylamino)-6-oxo-1,6-dihydro-5-pyrimidine carboxylate
2-(4-METHOXY-PHENYL)-5-THIOPHEN-2-YL-2H-PYRAZOLE-3-CARBOXYLIC ACID
Salicylic acid beta-D-glucoside
D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates
1-benzyl-5-(4-chlorophenyl)-1H-imidazole-2-thiol
C16H13ClN2S (300.04879280000006)
7-ethoxy-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
3-chloro-N-[5-(3-pyridinyl)-1,3,4-oxadiazol-2-yl]benzamide
N-[5-(2-chlorophenyl)-1H-1,2,4-triazol-3-yl]-4,6-dimethyl-2-pyrimidinamine
3-(3-Chloro-1,2-dihydroxypropyl)-8-hydroxy-6-methoxyisochromen-1-one
2,6-Diamino-(S)-9-[2-(phosphonomethoxy)propyl]purine
C9H13N6O4P-2 (300.07358680000004)
Vitamin B1
A - Alimentary tract and metabolism > A11 - Vitamins > A11D - Vitamin b1, plain and in combination with vitamin b6 and b12 > A11DA - Vitamin b1, plain D018977 - Micronutrients > D014815 - Vitamins COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Thiamine monochloride (Vitamin B1) is an essential vitamin that plays an important role in cellular production of energy from ingested food and enhances normal neuronal actives. Thiamine monochloride (Vitamin B1) is an essential vitamin that plays an important role in cellular production of energy from ingested food and enhances normal neuronal actives.
K 251T
C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C1017 - Glucuronidase Inhibitor Tectorigenin is a plant isoflavonoid originally isolated from the dried flower of Pueraria lobate Benth. Tectorigenin is a plant isoflavonoid originally isolated from the dried flower of Pueraria lobate Benth.
CHEBI:16741
3,5-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-7-one
2,2-Piperazine-1,4-diylbisethanesulfonate
C8H16N2O6S2-2 (300.04497560000004)
(2R,3S,5R,6S)-4-{[amino(iminio)methyl]amino}-2,3,5,6-tetrahydroxycyclohexyl phosphate
C7H15N3O8P- (300.05967400000003)
N-acetyl-D-galactosamine 6-O-sulfate
C8H14NO9S- (300.03892540000004)
(1S,2R,3S,4S,5R,6S)-4-azaniumyl-2-{[azaniumyl(imino)methyl]amino}-3,5,6-trihydroxycyclohexyl phosphate
1D-3-amino-1-guanidino-1,3-dideoxy-scyllo-inositol 6-phosphate
N-acetyl-D-glucosamine 6-sulfate(1-)
C8H14NO9S- (300.03892540000004)
N-acetyl-beta-D-galactosamine 4-O-sulfate
C8H14NO9S- (300.03892540000004)
alpha-N-acetyl-D-glucosamine 3-sulfate
C8H14NO9S- (300.03892540000004)
3,6,8-trihydroxy-1-methyl-9-oxo-10H-anthracene-2-carboxylic acid
2-acetamido-3-[(Z)-(5-carbamoyl-1H-imidazol-4-yl)diazenyl]sulfanylpropanoic acid
C9H12N6O4S (300.06407120000006)
N-acetyl-beta-D-galactosamine 6-sulfate(1-)
C8H14NO9S- (300.03892540000004)
N-[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]-3-pyridinecarboxamide
N-{[(3-methyl-4-nitrophenyl)carbonyl]oxy}pyridine-4-carboximidamide
5-methyl-4-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]-2-phenyl-4H-pyrazol-3-one
2-[(4-Fluorophenyl)methylthio]-5-(2-methylphenyl)-1,3,4-oxadiazole
2-[(2-Fluorophenyl)methylthio]-5-(4-methylphenyl)-1,3,4-oxadiazole
N-{[2-(2-nitrophenyl)acetyl]oxy}-3-pyridinecarboximidamide
7-[(4-Acetylphenoxy)methyl]-5-thiazolo[3,2-a]pyrimidinone
2-[[Acetamido(sulfanylidene)methyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester
5-[(6-Hydroxy-4-oxo-1-benzopyran-3-yl)methylidene]-1,3-diazinane-2,4,6-trione
1-(4-Methoxyphenyl)-2-(5-thiophen-2-yl-2-tetrazolyl)ethanone
N-[2-[(3-chloroanilino)-oxomethoxy]ethyl]carbamic acid propan-2-yl ester
2-chloro-5-[(2E)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]benzoic acid
7,9,10-trihydroxy-3-(2-oxopropyl)-1H-benzo[g]isochromen-1-one
N2-(5-Chloro-2-methoxyphenyl)quinazoline-2,4-diamine
7,8-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)chromen-4-one
[(E)-5-(4-methoxyphenyl)-2-methyl-3-oxopent-4-enyl] hydrogen sulate
Tazobactam
A member of the class of penicillanic acids that is sulbactam in which one of the exocyclic methyl hydrogens is replaced by a 1,2,3-triazol-1-yl group; used (in the form of its sodium salt) in combination with ceftolozane sulfate for treatment of complicated intra-abdominal infections and complicated urinary tract infections. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01C - Beta-lactam antibacterials, penicillins > J01CG - Beta-lactamase inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D065093 - beta-Lactamase Inhibitors D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C2140 - Adjuvant > C183118 - Beta-lactamase Inhibitor D004791 - Enzyme Inhibitors Tazobactam (CL-298741) is a potent β-lactamases inhibitor and penicillin antibiotic. Tazobactam has antibacterial activity. Tazobactam can be used for pneumonia research[1][2].
Cinnabarinic acid
Cinnabarinic acid is a specific orthosteric agonist of mGlu4 by interacting with residues of the glutamate binding pocket of mGlu4, has no activity at other mGlu receptors. Cinnabarinic acid is an endogenous metabolite of the kynurenine pathway of tryptophan. Cinnabarinic acid induces cell apoptosis[1].
4-(beta-D-glucosyloxy)benzoic acid
A beta-D-glucoside of 4-hydroxybenzoic acid.
Dehydroferreirin
A methoxyisoflavone in which the methoxy group is located at position 4 together with three additional hydroxy substituents at positions 2 5 and 7.
(3,4,5,6-tetrahydroxyoxan-2-yl)methyl 4-hydroxybenzoate
2-(beta-D-Glucopyranosyloxy)benzoic acid
A 2-(D-glucosyloxy)benzoic acid with beta configuration at the anomeric centre.
beta-D-glucosyl salicylate
A D-glucosyl salicylate in which the glucosyl moiety has beta-configuration at the anomeric centre. A transferrin binding compound used in research for cancer therapy.
methyl 3,8-dihydroxy-6-methyl-9-oxo-9H-xanthene-1-carboxylate
A member of the class of xanthones that is 9H-xanthene substituted by a methyl group at position 6, hydroxy groups at positions 3 and 8, an oxo group at position 9 and a methoxy carbonyl at position 1. It has been isolated from Microdiplodia species and Aspergillus sydowii.
D-glucosyl salicylate
A benzoate ester resulting from the formal condensation of the carboxy group of salicylic acid with the anomeric hydroxy group of D-glucose.
3-Methoxyapigenin
A trihydroxyflavone that is apigenin substituted by a methoxy group at position 3.