Exact Mass: 288.0141
Exact Mass Matches: 288.0141
Found 500 metabolites which its exact mass value is equals to given mass value 288.0141,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Eriodictyol
Eriodictyol, also known as 3,4,5,7-tetrahydroxyflavanone or 2,3-dihydroluteolin, belongs to the class of organic compounds known as flavanones. Flavanones are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a ketone at the carbon C3. Thus, eriodictyol is considered to be a flavonoid lipid molecule. Outside of the human body, eriodictyol has been detected, but not quantified in, several different foods, such as common oregano, common thymes, parsley, sweet basils, and tarragons. This could make eriodictyol a potential biomarker for the consumption of these foods. Eriodictyol is a compound isolated from Eriodictyon californicum and can be used in medicine as an expectorant. BioTransformer predicts that eriodictiol is a product of luteolin metabolism via a flavonoid-c-ring-reduction reaction catalyzed by an unspecified-gut microbiota enzyme (PMID: 30612223). Eriodictyol, also known as 5735-tetrahydroxyflavanone, is a member of the class of compounds known as flavanones. Flavanones are compounds containing a flavan-3-one moiety, with a structure characterized by a 2-phenyl-3,4-dihydro-2H-1-benzopyran bearing a ketone at the carbon C3. Eriodictyol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Eriodictyol can be found in a number of food items such as rowal, grape, cardamom, and lemon balm, which makes eriodictyol a potential biomarker for the consumption of these food products. Eriodictyol is a bitter-masking flavanone, a flavonoid extracted from yerba santa (Eriodictyon californicum), a plant native to North America. Eriodictyol is one of the four flavanones identified in this plant as having taste-modifying properties, the other three being homoeriodictyol, its sodium salt, and sterubin . Eriodictyol is a tetrahydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 7, 3 and 4 respectively. It is a tetrahydroxyflavanone and a member of 3-hydroxyflavanones. Eriodictyol is a natural product found in Eupatorium album, Eupatorium hyssopifolium, and other organisms with data available. A tetrahydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 7, 3 and 4 respectively. Acquisition and generation of the data is financially supported in part by CREST/JST. Eriodictyol is a flavonoid isolated from the Chinese herb, with antioxidant and anti-inflammatory activity. Eriodictyol induces Nrf2 signaling pathway. Eriodictyol is also a potent influenza RNA-dependent RNA polymerase inhibitor with an IC50 of 18 nM. Eriodictyol is a flavonoid isolated from the Chinese herb, with antioxidant and anti-inflammatory activity. Eriodictyol induces Nrf2 signaling pathway. Eriodictyol is also a potent influenza RNA-dependent RNA polymerase inhibitor with an IC50 of 18 nM.
Micromelin
Micromelin is a member of coumarins. Micromelin is a natural product found in Micromelum integerrimum, Micromelum falcatum, and other organisms with data available.
Okanin
Okanin is a member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 3, 4, 2, 3, and 4 respectively. It has a role as a plant metabolite. It is a member of chalcones and a benzenetriol. It is functionally related to a trans-chalcone. Okanin is a natural product found in Acacia implexa, Acacia concurrens, and other organisms with data available. A member of the class of chalcones that is trans-chalcone substituted by hydroxy groups at positions 3, 4, 2, 3, and 4 respectively. Okanin, effective constituent of the flower tea Coreopsis tinctoria, attenuates LPS-induced microglial activation through inhibition of the TLR4/NF-κB signaling pathways[1]. Okanin, effective constituent of the flower tea Coreopsis tinctoria, attenuates LPS-induced microglial activation through inhibition of the TLR4/NF-κB signaling pathways[1].
Fustin
Fustin is a natural product found in Acacia vestita, Acacia carneorum, and other organisms with data available. See also: Cotinus coggygria whole (part of); Toxicodendron succedaneum whole (part of). A dihydroflavonol that is the 2,3-dihydro derivative of fisetin. Fustinis ((±)-Fustin; 3,7,3',4'-Tetrahydroxyflavanone) is a potent amyloid β (Aβ) inhibitor. Fustinis ((±)-Fustin; 3,7,3',4'-Tetrahydroxyflavanone) increases the expression of acetylcholine (ACh) levels, choline acetyltransferase (ChAT) activity, and ChAT gene induced by Aβ (1-42). Fustinis ((±)-Fustin; 3,7,3',4'-Tetrahydroxyflavanone) decreases in acetyl cholinesterase (AChE) activity and AChE gene expression induced by Aβ (1-42). Fustinis ((±)-Fustin; 3,7,3',4'-Tetrahydroxyflavanone) increases muscarinic M1 receptor gene expression and muscarinic M1 receptor binding activity. Fustinis ((±)-Fustin; 3,7,3',4'-Tetrahydroxyflavanone) can be used for Alzheimer's disease research[1].
3-deoxy-D-arabino-heptulosonate-7-phosphate
2-dehydro-3-deoxy-d-arabino-heptonate 7-phosphate, also known as 2-dahp or 3-deoxy-arabino-heptulonic acid 7-phosphoric acid, is a member of the class of compounds known as monosaccharide phosphates. Monosaccharide phosphates are monosaccharides comprising a phosphated group linked to the carbohydrate unit. 2-dehydro-3-deoxy-d-arabino-heptonate 7-phosphate is soluble (in water) and a moderately acidic compound (based on its pKa). 2-dehydro-3-deoxy-d-arabino-heptonate 7-phosphate can be found in a number of food items such as prairie turnip, horned melon, bilberry, and biscuit, which makes 2-dehydro-3-deoxy-d-arabino-heptonate 7-phosphate a potential biomarker for the consumption of these food products. 2-dehydro-3-deoxy-d-arabino-heptonate 7-phosphate exists in E.coli (prokaryote) and yeast (eukaryote).
3,5-Dimethoxy-1,6-dihydroxyxanthone
A member of the class of xanthones that is 9H-xanthen-9-one substituted by methoxy groups at positions 3 and 5 and hydroxy groups at positions 1 and 6.
Swertiaperennin
2-O-methylswertianin is a member of the class of xanthones that is swertianin in which the hydroxy group at position 2 has been replaced by a methoxy group. It has a role as a plant metabolite. It is a member of xanthones, an aromatic ether and a polyphenol. It is functionally related to a swertianin. 1,8-Dihydroxy-2,6-dimethoxy-9H-xanthen-9-one is a natural product found in Gentiana orbicularis, Swertia japonica, and other organisms with data available. A member of the class of xanthones that is swertianin in which the hydroxy group at position 2 has been replaced by a methoxy group.
Dalbergioidin
Isolated from Dolichos biflorus (papadi), Lablab niger (hyacinth bean) and Phaseolus vulgaris (kidney bean). Dalbergioidin is found in many foods, some of which are hyacinth bean, yellow wax bean, adzuki bean, and fruits. Dalbergioidin is found in adzuki bean. Dalbergioidin is isolated from Dolichos biflorus (papadi), Lablab niger (hyacinth bean) and Phaseolus vulgaris (kidney bean
2-hydroxyisoflavanone naringenin
2-hydroxyisoflavanone naringenin, also known as 2,5,7,4-tetrahydroxyisoflavanol or 2-hydroxy-2,3-dihydrogenistein, is a member of the class of compounds known as isoflavanols. Isoflavanols are polycyclic compounds containing a hydroxylated isoflavan skeleton. 2-hydroxyisoflavanone naringenin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 2-hydroxyisoflavanone naringenin can be found in a number of food items such as wild carrot, chicory, cloves, and sweet cherry, which makes 2-hydroxyisoflavanone naringenin a potential biomarker for the consumption of these food products.
Furamizole
Terbufos
A carbohydrase and cellulase enzyme prepn. derived from Aspergillus niger is used in the prepn. of starch syrups and dextrose, alcoholic drinks, fruit juices, chocolate syrups, bakery products, liq. coffee, dairy products, cereals and spice and flavour extracts. It is used in fruit and vegetable processing; breaks down cellulosics for production of fermentable sugars. Cellulase is found in garden tomato (variety) and cocoa bean. C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor
Norartocarpanone
Norartocarpanone is a member of flavanones. Steppogenin is a natural product found in Euphorbia nicaeensis, Maclura tricuspidata, and other organisms with data available. Norartocarpanone is found in fruits. Norartocarpanone is isolated from Artocarpus incisus (breadfruit). Isolated from Artocarpus incisus (breadfruit). Norartocarpanone is found in fruits.
2,4',5,7-Tetrahydroxyflavanone
2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one is a tetrahydroxyflavanone carrying the hydroxy groups at positions 2, 4, 5 and 7. It has a role as a plant metabolite. It is a tetrahydroxyflavanone and a member of 2-hydroxyflavanones. 2,4,5,7-Tetrahydroxyflavanone is found in fruits. 2,4,5,7-Tetrahydroxyflavanone is a constituent of the bark of Prunus avium (wild cherry). Constituent of the bark of Prunus avium (wild cherry). 2-Hydroxynaringenin is found in fruits. A tetrahydroxyflavanone carrying the hydroxy groups at positions 2, 4, 5 and 7.
Orotidine
Orotidine is a nucleoside formed by attaching orotic acid to a ribose ring via a beta-N1-glycosidic bond. It is a water-soluble solid. Orotidine is found in bacteria, fungi, plants, and animals. In humans, orotidine occurs as its 5-phosphate (orotidylic acid), which is an intermediate in the biosynthesis of pyrimidine nucleosides (cytidine and uridine) that are found in nucleic acids (as the nucleotides containing the bases cytosine and uracil). Orotidine itself is not a component of nucleic acid. Orotidine monophosphate (OMP) is converted to uridine monophosphate by OMP decarboxylase, which is inhibited by mononucleotide precursors. Large amounts of orotidine are excreted in the urine of cancer patients treated with 6-azauridine, which is one such inhibitor, indicating that the subject has increased DNA synthesis due to cancer. Orotidine was first isolated from a mutant strain of the fungus Neurospora by A. Michael Michelson, William Drell, and Herschel K. Mitchell (PMID: 14853953). Isolated from Phaseolus vulgaris (kidney bean) Orotidine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=314-50-1 (retrieved 2024-07-16) (CAS RN: 314-50-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
N-Desalkyl flurazepam
N-Desalkyl flurazepam is a metabolite of flurazepam. Flurazepam (marketed under the brand names Dalmane and Dalmadorm) is a drug which is a benzodiazepine derivative. It possesses anxiolytic, anticonvulsant, sedative and skeletal muscle relaxant properties. It produces a metabolite with a very long half-life (40–250 hours), which may stay in the bloodstream for up to four days. http://www. non-benzodiazepines. org. uk/equivalents. html Flurazepam is therefore unsuitable as a sleeping medication for some individuals due to next day sedation. (Wikipedia)
3',4',5,7-Tetrahydroxyisoflavanone
3,4,5,7-Tetrahydroxyisoflavanone is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
7-hydroxy-3-(2,4,5-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
Porric acid B
Porric acid B is found in onion-family vegetables. Porric acid B is a constituent of the bulbs of Allium porrum (leeks)
5'-(3',4'-Dihydroxyphenyl)-gamma-valerolactone sulfate
5-(3,4-dihydroxyphenyl)-gamma-valerolactone sulfate is a cocoa metabolite from gut microflora. It is found in urine.
5-(3',4'-Dihydroxyphenyl)-γ-valerolactone 4'-sulfate
5-(3',5'-Dihydroxyphenyl)-γ-valerolactone sulfate
3-(3,4-Dihydroxyphenyl)-1-(2,3,4-trihydroxyphenyl)prop-2-en-1-one
Ciprofibrate
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98150 - Fibrate Antilipidemic Agent C - Cardiovascular system > C10 - Lipid modifying agents > C10A - Lipid modifying agents, plain > C10AB - Fibrates D009676 - Noxae > D002273 - Carcinogens > D020025 - Peroxisome Proliferators D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D009676 - Noxae > D000963 - Antimetabolites Ciprofibrate (Win35833) is a potent peroxisome proliferator and increases the phosphorylation level of the PPARalpha[1]. Ciprofibrate acts as an orally active hypolipidaemic agent and can be used for the research of primary hyperlipidaemias[2].
Dodecafluoropentane
V - Various > V08 - Contrast media > V08D - Ultrasound contrast media > V08DA - Ultrasound contrast media C274 - Antineoplastic Agent > C798 - Radiosensitizing Agent
Pyrido(3,4-d)pyridazine-1,4-dione, 8-amino-5-chloro-2,3-dihydro-7-phenyl-
Ritipenem
1-Trichloromethyl-1,2,3,4-tetrahydro-beta-carboline
6,12-Mehthano-6H,12H-dibenzo[b,f][1,5]dioxocin-2,3,9,13-tetrol
Isookanin
Isookanin is a natural product found in Acacia melanoxylon, Canarium album, and other organisms with data available. Isookanin can be used for the research of various illnesses including cancers, skin rashes, snake and insects bites, diabetes mellitus, diarrhoea. Isookanin acts as an anti-viral agent against HSV and varicella-zoster virus (VZV). Antioxidant activity[1][2].
Porric acid B
katuranin
Dihydrokaempferol is isolated from Bauhinia championii (Benth). Dihydrokaempferol induces apoptosis and inhibits Bcl-2 and Bcl-xL expression. Dihydrokaempferol is a good candidate for new antiarthritic agents[1]. Dihydrokaempferol is isolated from Bauhinia championii (Benth). Dihydrokaempferol induces apoptosis and inhibits Bcl-2 and Bcl-xL expression. Dihydrokaempferol is a good candidate for new antiarthritic agents[1].
Eriodictyol
Constituent of the leaves and branches of Phyllanthus emblica (emblic). Eriodictyol 7-(6-coumaroylglucoside) is found in fruits. Annotation level-1 Eriodictyol is a flavonoid isolated from the Chinese herb, with antioxidant and anti-inflammatory activity. Eriodictyol induces Nrf2 signaling pathway. Eriodictyol is also a potent influenza RNA-dependent RNA polymerase inhibitor with an IC50 of 18 nM. Eriodictyol is a flavonoid isolated from the Chinese herb, with antioxidant and anti-inflammatory activity. Eriodictyol induces Nrf2 signaling pathway. Eriodictyol is also a potent influenza RNA-dependent RNA polymerase inhibitor with an IC50 of 18 nM.
2-(diethoxyphosphorylsulfanylmethylsulfinyl)-2-methylpropane
3-(4-(trifluoromethoxy)phenyl)-1,2,4-oxadiazole-5-carbohydrazide
Ciprofibrate
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98150 - Fibrate Antilipidemic Agent C - Cardiovascular system > C10 - Lipid modifying agents > C10A - Lipid modifying agents, plain > C10AB - Fibrates D009676 - Noxae > D002273 - Carcinogens > D020025 - Peroxisome Proliferators D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D009676 - Noxae > D000963 - Antimetabolites CONFIDENCE standard compound; INTERNAL_ID 691; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4943; ORIGINAL_PRECURSOR_SCAN_NO 4941 CONFIDENCE standard compound; INTERNAL_ID 691; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4958; ORIGINAL_PRECURSOR_SCAN_NO 4954 CONFIDENCE standard compound; INTERNAL_ID 691; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4923; ORIGINAL_PRECURSOR_SCAN_NO 4921 CONFIDENCE standard compound; INTERNAL_ID 691; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4952; ORIGINAL_PRECURSOR_SCAN_NO 4949 ORIGINAL_ACQUISITION_NO 4951; CONFIDENCE standard compound; INTERNAL_ID 691; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 4949 CONFIDENCE standard compound; INTERNAL_ID 691; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4951; ORIGINAL_PRECURSOR_SCAN_NO 4949 CONFIDENCE standard compound; INTERNAL_ID 691; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4945; ORIGINAL_PRECURSOR_SCAN_NO 4943 Ciprofibrate (Win35833) is a potent peroxisome proliferator and increases the phosphorylation level of the PPARalpha[1]. Ciprofibrate acts as an orally active hypolipidaemic agent and can be used for the research of primary hyperlipidaemias[2].
4,10-Dihydroxy-6-methylfuro[3,4:6,7]naphtho[2,3-d]-1,3-dioxole-5,9-dione
2.4.5.8-Tetrahydroxy-7-methyl-1.2-dihydro-anthrachinon (oder Tautomeres)|7,8-Dihydro-Catenarin
afrostyraxthioside B|methylsulfonylmethyl 1-thio-beta-D-glucopyranoside
Monodictyphenone
A member of the class of benzophenones in which one phenyl group is substituted at positions 2 and 6 by hydroxy groups while the other is substituted at positions 2, 4, and 6 by hydroxy, methyl, and carboxy groups, respectively. First obtained from the fungal strain Monodictys putredinis, isolated from the inner tissue of a marine green alga, it was subsequently obtained from the fungus Aspergillus nidulans.
1,7-Dihydroxy-3,6,-dimethoxyxanthon|1,7-Dihydroxy-3,6-dimethoxyxanthon|3,5-dihydroxy-2,7-dimethoxy-xanthen-9-one
2-(2,6-dihydroxy-4-methylbenzoyl)-6-hydroxybenzoic acid
3,4-methylendioxy-2,4-dihydroxy-3-methoxybenzophenone
3,4-dihydro-3-(3,4-dihydroxyphenyl)-5,6-dihydroxy-1H-2-benzopyran-1-one|3-(3,4-dihydroxyphenyl)-3,4-dihydroisocoumarin
6,9-Dihydroxy-7-methoxy-3-methyl-1H-benz[g]isochromen-5,10-chinon|6,9-dihydroxy-7-methoxy-3-methyl-1H-benz[g]isochromene-5,10-quinone|anhydrofusarubin
7-hydroxy-4,8-dimethoxy-2,3-methylenedioxydibenzofuran
1,3,10-trihydroxy-8-(hydroxymethyl)dibenzo[b,e]oxepin-11(6H)-one|chaetone F
Cephalanone F
A member of the class of benzophenones that is benzophenone in which one phenyl group is substituted at positions 2 and 6 by hydroxy groups and at position 4 by a methyl group while the other is substituted at positions 2 and 6 by hydroxy and carboxy groups, respectively. It is a secondary metabolite isolated from the fungal species Graphiopsis chlorocephala, Paecilomyces variotii and Pseudopalawania siamensis.
4-methoxy-3,4-oxydibenzoic acid|6-Methoxy-3,4-oxy-di-benzoesaeure|6-methoxy-3,4-oxy-di-benzoic acid|6-Methoxy-3-(4-carboxy-phenoxy)-benzoesaeure
2,5,7-Trihydroxy-2-(4-hydroxy-phenyl)-chroman-3-on|2,5,7-trihydroxy-2-(4-hydroxy-phenyl)-chroman-3-one|Pseudobase des Pelargonidins
2-acetoxymethyl-5--bithienyl(2,5)|5-Acetoxymethyl-2--dithienyl-(5,2)|5-acetoxymethyl-5-(3-butene-1-ynyl)-2,2-bithiophene|5-(3-Buten-1-ynyl)-2,2-bithienyl-5-methylacetate|5-Acetoxymethyl-5-but-3-en-1-inyl-<2,2>-bithienyl|5-acetoxymethyl-5-but-3-en-1-ynyl-[2,2]bithiophenyl
alpha,2,3,4,4-Pentahydroxy-chalkon|alpha,2,3,4,4-Pentahydroxychalcone
2-(1-Hydroxyethyl)-7-methoxy-8-hydroxynaphtho[2,3-b]furan-4,9-dione
7,8-dihydroxy-3-(3-hydroxy-4-oxo-4H-pyran-2-yl)-2H-chromen-2-one
dihydrokaempferol
Annotation level-1 Dihydrokaempferol is isolated from Bauhinia championii (Benth). Dihydrokaempferol induces apoptosis and inhibits Bcl-2 and Bcl-xL expression. Dihydrokaempferol is a good candidate for new antiarthritic agents[1]. Dihydrokaempferol is isolated from Bauhinia championii (Benth). Dihydrokaempferol induces apoptosis and inhibits Bcl-2 and Bcl-xL expression. Dihydrokaempferol is a good candidate for new antiarthritic agents[1].
ACon1_000409
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one is a member of flavanones. (+/-)-Eriodictyol is a natural product found in Prunus campanulata, Lawsonia inermis, and other organisms with data available.
Protoapigenin
2-(1,4-Dihydroxycyclohexa-2,5-dien-1-yl)-5,7-dihydroxychromen-4-one is a natural product found in Macrothelypteris torresiana with data available.
Dalbergioidin
Isolated from Dolichos biflorus (papadi), Lablab niger (hyacinth bean) and Phaseolus vulgaris (kidney bean). Dalbergioidin is found in many foods, some of which are hyacinth bean, yellow wax bean, adzuki bean, and fruits. (+-)-dalbergioidin is a hydroxyisoflavanone. Dalbergioidin is a natural product found in Vigna subterranea, Vigna radiata, and other organisms with data available. Dalbergioidin is found in adzuki bean. Dalbergioidin is isolated from Dolichos biflorus (papadi), Lablab niger (hyacinth bean) and Phaseolus vulgaris (kidney bean
Eriodictyolchalcone
2,3,4,4,6-pentahydroxychalcone is a member of the class of chalcones that is chalcone substituted by hydroxy groups at positions 2, 3, 4, 4, and 6. It is functionally related to a chalcone. It is a conjugate acid of a 2,3,4,4,6-pentahydroxychalcone(1-). 2,3,4,4,6-Pentahydroxychalcone is a natural product found in Limonium with data available.
2,7-Naphthalenedisulfonic acid
CONFIDENCE standard compound; INTERNAL_ID 8677 CONFIDENCE standard compound; EAWAG_UCHEM_ID 654
Malotilate
C26170 - Protective Agent > C2081 - Hepatoprotective Agent Malotilate (NKK 105), an orally active hepatotropic agent and an anti-fibrotic substance, selectively inhibits the 5-lipoxygenase (5-LOX) (IC50=4.7 μM). Malotilate prevents the development of hepatocytic injury in alcohol-pyrazole hepatitis by decreasing hepatic acetaldehyde levels and preventing the retention of transferrin in the hepatocytes[1][2].
2,4,6-trihydroxy-2-[(4-hydroxyphenyl)methyl]-1-benzofuran-3-one
3-(5-formyl-2-hydroxyphenoxy)-4-methoxybenzoic acid
(2S,3S)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one
(2S)-2-(2,6-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one
7-methoxy-6-[(1R,4R,5S)-1-methyl-2-oxo-3,6-dioxabicyclo[3.1.0]hexan-4-yl]chromen-2-one
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydrochromen-4-one
Orotidine
A nucleoside formed by attaching orotic acid to a ribose ring via a beta-N(1)-glycosidic bond.
(2S,3S)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one
(2S,3S)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-2,3-dihydrochromen-4-one
(2S,3S)-3,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one_major
6,12-Methano-6H,12H-dibenzo[b,f][1,5]dioxocin-2,3,9,13-tetrol
5-(3,4-Dihydroxyphenyl)-gamma-valerolactone sulfate
3',4',5,7-Tetrahydroxyisoflavanone
(5-(but-3-en-1-yn-1-yl)-[2,2-bithiophen]-5-yl)methyl acetate
carthamidin
A tetrahydroxyflavanone that is (S)-naringenin substituted by an additional hydroxy group at position 6.
4(1H)-Quinazolinone,3-(4-chlorophenyl)-2,3-dihydro-2-thioxo-
4-(4-CHLORO-PHENYL)-5-PYRIDIN-4-YL-4H-[1,2,4]TRIAZOLE-3-THIOL
N-(3-Cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-thiopheneca rboxamide
5-chloro-3-[[ethoxy(methyl)phosphoryl]methyl]-1-benzothiophene
phenyl N-[4-(trifluoromethyl)-1,3-thiazol-2-yl]carbamate
3,5-Dichloro-4-hydroxyphenylboronic acid pinacol ester
3-((4-CHLOROPHENYL)SULFONYL)-4-ETHOXYBUT-3-EN-2-ONE
ETHYL 2-(5-((ETHOXYCARBONYL)AMINO)-1,2,4-THIADIAZOL-3-YL)-2-(HYDROXYIMINO)ACETATE
4-Chloro-6-acetoxy-7-methoxyquinazoline hydrochloride
2,6-diamino-4-(4-chlorophenyl)-4H-thiopyran-3,5-dicarbonitrile
1-Benzyl-2-(bromodifluoromethyl)-4,5-dihydro-1H-imidazole
methyl 2-cyano-2-[2-nitro-4-(trifluoromethyl)phenyl]acetate
5-Amino-3-methyl-1-(perfluorophenyl)-1H-pyrazole-4-carbonitrile
ETHYL 2-BROMO-4,5,6,7-TETRAHYDROBENZO[B]THIOPHENE-3-CARBOXYLATE
3-(4-METHOXY-BENZYL)-1H-THIENO[3,2-D]PYRIMIDINE-2,4-DIONE
2-METHYL-6-(4-(METHYLSULFONYL)PHENOXY)NICOTINONITRILE
(5-Bromo-3-nitropyridin-2-yl)acetic acid ethyl ester
4-CHLORO-7-FLUORO-2-(4-METHOXY-PHENYL)-QUINAZOLINE
potassium (3,5-dinitro-2-methylphenyl)trifluoroborate
4-(1,1,1,3,3,3-Hexafluoro-2-hydroxypropan-2-yl)benzoic acid
5,6-dimethyl-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one
2,4-dichloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenol
1H-PYRROLO[2,3-B]PYRIDINE, 4-METHOXY-1-(PHENYLSULFONYL)-
1H-Pyrrolo[2,3-b]pyridine, 5-methoxy-1-(phenylsulfonyl)-
2-(2,4-dichloro-5-nitrophenyl)-5-methyl-1H-1,2,4-triazol-3-one
3-CHLORO-4-([5-(TRIFLUOROMETHYL)-2-PYRIDINYL]OXY)ANILINE
5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-3H-1,3,4-oxadiazole-2-thione
2-CHLORO-6-(2-THIENYL)-4-(TRIFLUOROMETHYL)NICOTINONITRILE
Thiazolidine, 3-(methylsulfonyl)-2-(3-nitrophenyl)- (9CI)
Thiazolidine, 3-(methylsulfonyl)-2-(4-nitrophenyl)- (9CI)
4-CHLORO-2-(4-CARBOMETHOXYL-1-PIPERIDINYL)-5-THIAZOLECARBOXALDEHYDE
4(1H)-Quinazolinone,3-(3-chlorophenyl)-2,3-dihydro-2-thioxo-
2-mercapto-5-benzimidazolesulfonic acid sodium salt dihydrate
4-(bromomethyl)-1-methoxy-2-(3-methoxypropoxy)benzene
sodium,6,7-dimethylnaphthalene-1-sulfonate,formaldehyde
2-(5,6-dichloro-4-methylsulfanylpyridin-3-yl)-5-ethyl-1,3-oxazole
2,4-bis(Trifluoromethyl)-5-pyrimidinecarboxylic acid ethyl ester
Magnesium dihydrogen di-L-aspartate
A - Alimentary tract and metabolism > A12 - Mineral supplements > A12C - Other mineral supplements > A12CC - Magnesium D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids
1-(5-chloro-2-hydroxy-4-methylphenyl)-3-phenyl-1,3-propanedione
3-chloro-5-[(3-methoxyphenyl)methylsulfinyl]-1,2,4-thiadiazole
2-bromo-3,3,3-trifluoro-1-(4-methylpiperazin-1-yl)propan-1-one
2-(4-FLUORO-PHENYL)-5-THIOPHEN-2-YL-2H-PYRAZOLE-3-CARBOXYLIC ACID
1,3-dimethoxy-2-methylimidazol-1-ium,hexafluorophosphate
3-(2-CHLOROPHENYL)-6-FLUORO-2-METHYLQUINAZOLIN-4(3H)-ONE
2,6-diamino-4-(2-chlorophenyl)-4H-thiopyran-3,5-dicarbonitrile
1-(4-METHANESULFONYL-PHENYL)-2-PHENYL-ETHANE-1,2-DIONE
Ethyl 2-(3-cyano-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate
N1-(2-chloro-5-(trifluoromethyl)pyrimidin-4-yl)benzene-1,3-diamine
6-Chloropurine-9-beta-D-(2-deoxy-2-fluoro)arabino-riboside
5-Bromo-1-butyl-1H-benzo[d]imidazole hydrochloride
3-[6-(2-Chlorophenyl)-2-pyridinyl]-1,2,4-thiadiazol-5-amine
3-[6-(3-Chlorophenyl)-2-pyridinyl]-1,2,4-thiadiazol-5-amine
3-[6-(4-Chlorophenyl)-2-pyridinyl]-1,2,4-thiadiazol-5-amine
3-[(2-chlorophenyl)methyl]-7,8-dihydro-6H-chromene-2,5-dione
3-chloro-5-[(4-methylphenyl)methylsulfonyl]-1,2,4-thiadiazole
1,3-DIMETHYL-2,4-DIOXO-1,2,3,4-TETRAHYDRO-QUINAZOLINE-6-SULFONYL CHLORIDE
BENZENEBUTANOIC ACID, 2,4-DICHLORO-.ALPHA.,.GAMMA.-DIOXO-, ETHYL ESTER
3-(2-CHLORO-PHENYL)-2-MERCAPTO-3H-QUINAZOLIN-4-ONE
1-(4-Chloro-2-(3-methyl-1H-pyrazol-1-yl)phenyl)-2,2,2-trifluoroethanone
methyl (2Z,4Z)-5-chloro-2-(chloromethyl)-5-(4-fluorophenyl)penta-2,4-dienoate
2-tert-butyl-6-chlorobenzo[d]oxazole-7-sulfonaMide
Nickel,bis[[2,3-butanedione 2,3-di(oximato-kN)](1-)]-, (SP-4-1)-
Ethyl 2-{[(trifluoromethyl)sulfonyl]oxy}cyclopent-1-ene-1-carboxylate
1-(trichloromethyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Flupyradifurone
Flupyradifurone is a systemic nAChR agonist that interferes with signal transduction in the central nervous system of sucking pests. Flupyradifurone can be used as a butenolide insecticide[1].
2-Hydroxy-6-[2-(3,4-dihydroxyphenyl)-2-oxo-ethyl]benzoic acid
A monohydroxybenzoic acid that is benzoic acid substituted by a hydroxy group at position 2 and a 2-(3,4-dihydroxyphenyl)-2-oxoethyl group at position 6. It has been isolated from the roots of Scorzonera judaica.
7-(2-chloro-6-fluorophenyl)-5-methyl-6,7-dihydro-1H-1,4-diazepine-2,3-dicarbonitrile
Funalenone
An organic tricyclic compound that is 1H-phenalen-1-one which is substituted by hydroxy groups at positions 3,4,7, and 9, by a methoxy group at position 2, and by a methyl group at position 6. It is a collagenase inhibitor produced by Aspergillus niger. D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D061965 - Matrix Metalloproteinase Inhibitors
4-(4-Chlorophenyl)-1-(6-fluoro-2-pyridinyl)-3-pyrazolamine
2-[(5-Methyl-4-phenyl-1,3-thiazol-2-yl)methyl]-1,3-thiazol-4-ol
Methyl 5-{[(5-sulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]methyl}furan-2-carboxylate
4H-1-Benzopyran-4-one, 2-(2,6-dihydroxyphenyl)-2,3-dihydro-5,7-dihydroxy-, (2S)-
dodecafluoropentane
V - Various > V08 - Contrast media > V08D - Ultrasound contrast media > V08DA - Ultrasound contrast media C274 - Antineoplastic Agent > C798 - Radiosensitizing Agent
Gentiacaulein
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 2 and 8 and methoxy groups at positions 1 and 6.
Swerchirin
A member of the class of xanthones that is the 5-O-methyl derivative of bellidifolin. Isolated from Centaurium erythraea and Swertia chirayita, it exhibits hypoglycemic activity.
2-(2,6-Dihydroxy-4-methylbenzoyl)-3-hydroxybenzoic acid
3-(5-Formyl-2-hydroxyphenoxy)-4-methoxybenzoic acid
2-[Hydroperoxy(4-hydroxyphenyl)methyl]-6-hydroxy-1-benzofuran-3-one
[5-(5-But-3-en-1-ynylthiophen-2-yl)thiophen-2-yl]methyl acetate
D-Sedoheptulose 7-phosphate
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
(4S)-2-(4-hydroxyphenyl)-4H-1-benzopyran-3,4,5,7-tetrol
1-Carboxy-2-deoxy-alpha-D-glucopyranose 6-phosphoric acid
2-Carboxy-4-[2-(4-nitrophenyl)hydrazinyl]phenolate
5-(3,5-Dihydroxyphenyl)-gamma-valerolactone sulfate
(2S)-2-hydroxynaringenin
A 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one that has (S) configuration.
2-(4-Methyl-1-oxo-[1]benzothiolo[2,3-d]pyridazin-2-yl)propanoic acid
agnestin A
A member of the class of xanthones that is 1,2-dihydro-9H-xanthen-9-one substituted by a carboxy group at position 1R, hydroxy groups at positions 2R and 8, and a methyl group at position 3. It has been isolated from the fungus Paecilomyces variotti.
4-[Methyl-(4-thiophen-2-yl-2-thiazolyl)amino]phenol
N-[(phenacylamino)-sulfanylidenemethyl]-2-furancarboxamide
2-[[(4-Chlorophenyl)thio]methyl]-5-methylimidazo[1,2-a]pyridine
6-Chloro-2-[(phenylmethylthio)methyl]imidazo[1,2-a]pyridine
N-(2-furanylmethyl)-2-(2-oxo-1,3-benzothiazol-3-yl)acetamide
3-Methyl-6-thiophen-2-yl-4-isoxazolo[5,4-b]pyridinecarboxylic acid ethyl ester
(2R,3R)-rel-2-(3,4-Dihydroxyphenyl)-2,3-dihydro-3,7-dihydroxy-4H-1-benzopyran-4-one
(2S)-2-[2-(ethylsulfonylamino)ethylsulfonylamino]propanoic acid
agnestin B
A member of the class of xanthones that is agnestin A in which the double bond between positions 3 and 4 has been reduced and the carboxlic acid group at position 1 forms a single bond with the carbon atom at position 3 resulting in a cyclic ester. It has been isolated from the fungus Paecilomyces variotti.
Dimethylammonium 4-chloro-2,3-dihydro-2-oxo-1,3-benzothiazol-3-ylacetate
N-({5-[N-(aminocarbonyl)ethanehydrazonoyl]-3-thienyl}methyl)-2-chloroacetamide
(2R)-2-hydroxynaringenin
A 2,5,7-trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one that has (R) configuration.
[4-[(Z)-2-hydroxy-3-oxobut-1-enyl]-2-methoxyphenyl] hydrogen sulate
[4-(3-Acetyloxiran-2-yl)-2-methoxyphenyl] hydrogen sulate
(2xi)-3-deoxy-7-O-phospho-beta-D-threo-hept-6-ulopyranosonic acid
5,6,7-Trihydroxy-2-(3-hydroxyphenyl)-2,3-dihydrochromen-4-one
[4-[(E)-4-hydroxy-3-oxobut-1-enyl]-2-methoxyphenyl] hydrogen sulfate
[3-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hydroxypropyl] acetate
7-methoxy-6-[(1S,2R,5R)-5-methyl-4-oxo-3,6-dioxabicyclo[3.1.0]hexan-2-yl]chromen-2-one
3-deoxy-D-arabino-heptulosonate-7-phosphate
A ketoaldonic acid phosphate consisting of 2-dehydro-3-deoxy-D-arabino-heptonic acid having a phospho group at the 7-position.
2-Hydroxy-2,3-dihydrogenistein
A hydroxyisoflavanone that is 2,3-dihydrogenistein with a hydroxy substituent at position 2.
D-glycero-beta-D-manno-heptose 1-phosphate(2-)
D-glycero-D-manno-heptose 1-phosphate(2-) with beta-configuration at the anomeric carbon atom.
sedoheptulose 7-phosphate(2-)
An organophosphate oxoanion that is the dianion of sedoheptulose 7-phosphate arising from deprotonation of both OH groups from the phosphate.
D-glycero-alpha-D-manno-heptose 1-phosphate(2-)
D-glycero-D-manno-heptose 1-phosphate(2-) with alpha-configuration at the anomeric carbon atom.
D-glycero-D-manno-heptose 7-phosphate(2-)
The dianion obtained by removal of two protons from the phosphate group of D-glycero-D-manno-heptose 7-phosphate.
2-Hydroxy-5-[(5-oxooxolan-2-yl)methyl]phenyl hydrogen sulfate
5,7,3,5-Tetrahydroxyflavanone
A tetrahydroxyflavanone that is flavanone substituted by hydroxy groups at positions 5, 7, 3 and 5 respectively. It has been isolated from Cyperus teneriffae.
D-glycero-D-manno-heptose 1-phosphate(2-)
Dianion of D-glycero-D-manno-heptose 1-phosphate arising from deprotonation of both phosphate OH groups.
5-(3,4-dihydroxyphenyl)-gamma-valerolactone 3-O-sulfate
A butan-4-olide that is gamma-valerolactone in which one of the methyl hydrogens has been replaced by a 3-sulfooxy-4-hydroxyphenyl group.
D-glycero-alpha-D-manno-heptose 7-phosphate(2-)
The dianion obtained by removal of two protons from the phosphate group of D-glycero-alpha-D-manno-heptose 7-phosphate.
D-glycero-beta-D-manno-heptose 7-phosphate(2-)
The dianion obtained by removal of two protons from the phosphate group of D-glycero-beta-D-manno-heptose 7-phosphate.
5,7,8-Trihydroxy-2-(4-hydroxyphenyl)-2,3-dihydro-4H-chromen-4-one
CNDAC (hydrochloride)
CNDAC hydrochloride is a metabolite of the orally active agent Sapacitabine (HY-16445), and a nucleoside analog. CNDAC hydrochloride induces DNA damage and apoptosis[1][2].
1-(2,3,4,5,6-pentahydroxyphenyl)-3-phenylprop-2-en-1-one
(3s)-3-(2,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one
3,7-dihydroxy-1-(hydroxymethyl)-9-methoxybenzo[c]chromen-6-one
[5'-(but-3-en-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]methyl acetate
(3e)-4-(2,6-dichloro-3,5-dimethoxyphenyl)pent-3-en-2-one
5-hydroxy-1-[(1r)-1-hydroxyethyl]-7-methoxynaphtho[2,3-c]furan-4,9-dione
{2-methoxy-4-[(1e)-3-methoxy-3-oxoprop-1-en-1-yl]phenyl}oxidanesulfonic acid
5-(3-buten-1-ynyl)-2,2'-bithienyl-5'-methylacetate
{"Ingredient_id": "HBIN011008","Ingredient_name": "5-(3-buten-1-ynyl)-2,2'-bithienyl-5'-methylacetate","Alias": "NA","Ingredient_formula": "C15H12O2S2","Ingredient_Smile": "CC(=O)OCC1=CC=C(S1)C2=CC=C(S2)C#CC=C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "30691","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5-(3-buten-1-ynyl)-2,2'-bithienyl-5’-methyl-acetate
{"Ingredient_id": "HBIN011009","Ingredient_name": "5-(3-buten-1-ynyl)-2,2'-bithienyl-5\u2019-methyl-acetate","Alias": "NA","Ingredient_formula": "C15H12O2S2","Ingredient_Smile": "CC(=O)OCC1=CC=C(S1)C2=CC=C(S2)C#CC=C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14526","TCMID_id": "2784","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
