Exact Mass: 296.0272668

Exact Mass Matches: 296.0272668

Found 298 metabolites which its exact mass value is equals to given mass value 296.0272668, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Enilconazole

InChI=1/C14H14Cl2N2O/c1-2-7-19-14(9-18-6-5-17-10-18)12-4-3-11(15)8-13(12)16/h2-6,8,10,14H,1,7,9H2

C14H14Cl2N2O (296.0483134)


Imazalil is a slightly yellow to brown solidified oil. Non-corrosive. Used as a fungicide. 1-[2-(allyloxy)-2-(2,4-dichlorophenyl)ethyl]imidazole is a member of the class of imidazoles in which the hydrogen at position 1 is replaced by a 2-(allyloxy)-2-(2,4-dichlorophenyl)ethyl group. It is a member of imidazoles, an ether and a dichlorobenzene. Enilconazole is a natural product found in Ganoderma lucidum with data available. Enilconazole (synonyms imazalil, chloramizole) is a fungicide widely used in agriculture, particularly in the growing of citrus fruits. Trade names include Freshgard, Fungaflor, and Nuzone. Enilconazole is an Agricultural fungicide Enilconazole is a fungicide widely used in agriculture, particularly in the growing of citrus fruits. It is also called Imazalil, Chloramizole, Freshgard, Fungaflor, and Nuzone C254 - Anti-Infective Agent > C514 - Antifungal Agent D016573 - Agrochemicals D010575 - Pesticides CONFIDENCE standard compound; INTERNAL_ID 924; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7952; ORIGINAL_PRECURSOR_SCAN_NO 7950 CONFIDENCE standard compound; INTERNAL_ID 924; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8037; ORIGINAL_PRECURSOR_SCAN_NO 8036 CONFIDENCE standard compound; INTERNAL_ID 924; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7940; ORIGINAL_PRECURSOR_SCAN_NO 7936 CONFIDENCE standard compound; INTERNAL_ID 924; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7963; ORIGINAL_PRECURSOR_SCAN_NO 7962 CONFIDENCE standard compound; INTERNAL_ID 924; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7958; ORIGINAL_PRECURSOR_SCAN_NO 7957 CONFIDENCE standard compound; INTERNAL_ID 924; DATASET 20200303_ENTACT_RP_MIX501; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7890; ORIGINAL_PRECURSOR_SCAN_NO 7888 CONFIDENCE standard compound; INTERNAL_ID 8782 CONFIDENCE standard compound; INTERNAL_ID 2858 CONFIDENCE standard compound; INTERNAL_ID 4009 Imazalil (Enilconazole) is a fungicide, widely used in agriculture, particularly in the growing of citrus fruits, also used in veterinary medicine as a topical antimycotic.

   

disulfiram

Disulfiram (Antabuse)

C10H20N2S4 (296.050928)


P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides > P03AA - Sulfur containing products N - Nervous system > N07 - Other nervous system drugs > N07B - Drugs used in addictive disorders > N07BB - Drugs used in alcohol dependence C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2160 - Proteasome Inhibitor COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D004791 - Enzyme Inhibitors > D065086 - Acetaldehyde Dehydrogenase Inhibitors D002491 - Central Nervous System Agents > D000427 - Alcohol Deterrents C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor C1744 - Multidrug Resistance Modulator C471 - Enzyme Inhibitor Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Disulfiram (Tetraethylthiuram disulfide) is a specific inhibitor of?aldehyde-dehydrogenase (ALDH1), used for the treatment of chronic alcoholism by producing an acute sensitivity to alcohol. Disulfiram inhibits gasdermin D (GSDMD) pore formation in liposomes and inflammasome-mediated pyroptosis and IL-1β secretion in human and mouse cells. Disulfiram, a copper ion carrier,?with?Cu2+ increases intracellular ROS levels and induces cuproptosis[1][2][3][4][5][6].

   

Caffeoylmalic acid

2-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

C13H12O8 (296.0532152)


Isolated from leaves of French bean (Phaseolus vulgaris) and from Trifolium pratense (red clover). L-Malic acid caffeate is found in many foods, some of which are yellow wax bean, herbs and spices, tea, and pulses. Caffeoylmalic acid is found in common bean. Caffeoylmalic acid is isolated from leaves of French bean (Phaseolus vulgaris) and from Trifolium pratense (red clover

   

Aspulvinone E

(5Z)-4-Hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylene]-2(5H)-furanone

C17H12O5 (296.0684702)


A 4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one in which the double bond adopts a Z-configuration. It is a marine metabolite isolated from the fungus Aspergillus terreus and exhibits antiviral activity.

   

Medicagol

16-hydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(12),2,4(8),9,13(18),14,16-heptaen-20-one

C16H8O6 (296.0320868)


Medicagol is a member of coumestans. Medicagol is a natural product found in Cicer chorassanicum, Sophora moorcroftiana, and other organisms with data available. See also: Trifolium pratense flower (part of). Medicagol is found in alfalfa. Medicagol is found in alfalfa (Medicago sativa) having viral leaf spot infections. Also from Cicer arietinum (chick pea) and Trifolium pratense (red clover). Found in alfalfa (Medicago sativa) having viral leaf spot infectionsand is also from Cicer arietinum (chick pea) and Trifolium pratense (red clover).

   

Disulfiram

N,N-diethyl[(diethylcarbamothioyl)disulfanyl]carbothioamide

C10H20N2S4 (296.050928)


A carbamate derivative used as an alcohol deterrent. It is a relatively nontoxic substance when administered alone, but markedly alters the intermediary metabolism of alcohol. When alcohol is ingested after administration of disulfiram, blood acetaldehyde concentrations are increased, followed by flushing, systemic vasodilation, respiratory difficulties, nausea, hypotension, and other symptoms (acetaldehyde syndrome). It acts by inhibiting aldehyde dehydrogenase. [PubChem] P - Antiparasitic products, insecticides and repellents > P03 - Ectoparasiticides, incl. scabicides, insecticides and repellents > P03A - Ectoparasiticides, incl. scabicides > P03AA - Sulfur containing products N - Nervous system > N07 - Other nervous system drugs > N07B - Drugs used in addictive disorders > N07BB - Drugs used in alcohol dependence C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2160 - Proteasome Inhibitor COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D004791 - Enzyme Inhibitors > D065086 - Acetaldehyde Dehydrogenase Inhibitors D002491 - Central Nervous System Agents > D000427 - Alcohol Deterrents C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor C1744 - Multidrug Resistance Modulator C471 - Enzyme Inhibitor Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Disulfiram (Tetraethylthiuram disulfide) is a specific inhibitor of?aldehyde-dehydrogenase (ALDH1), used for the treatment of chronic alcoholism by producing an acute sensitivity to alcohol. Disulfiram inhibits gasdermin D (GSDMD) pore formation in liposomes and inflammasome-mediated pyroptosis and IL-1β secretion in human and mouse cells. Disulfiram, a copper ion carrier,?with?Cu2+ increases intracellular ROS levels and induces cuproptosis[1][2][3][4][5][6].

   

cis-Coutaric acid

2-hydroxy-3-{[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

C13H12O8 (296.0532152)


Constituent of grapes and wines. cis-Coutaric acid is found in alcoholic beverages, fruits, and common grape. cis-Coutaric acid is found in alcoholic beverages. cis-Coutaric acid is a constituent of grapes and wines

   

2-O-Feruloyltartronic acid

2-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propanedioic acid

C13H12O8 (296.0532152)


2-O-Feruloyltartronic acid is found in pulses. 2-O-Feruloyltartronic acid is a constituent of Vigna radiata (mung bean). Constituent of Vigna radiata (mung bean). 2-O-Feruloyltartronic acid is found in pulses.

   

N-Methoxyspirobrassinol methyl ether

1,2-Dimethoxy-5-(methylsulphanyl)-1,2-dihydro-3H-spiro[indole-3,2-[1,4]thiazole]

C13H16N2O2S2 (296.0653156)


N-Methoxyspirobrassinol methyl ether is found in brassicas. N-Methoxyspirobrassinol methyl ether is a stress metabolite from Japanese daikon radish inoculated with Pseudomonas cichorii. Stress metabolite from Japanese daikon radish inoculated with Pseudomonas cichorii. N-Methoxyspirobrassinol methyl ether is found in brassicas and radish.

   

Gyrocyanin

4-Hydroxy-2,5-bis(4-hydroxyphenyl)-4-cyclopentene-1,3-dione, 9ci

C17H12O5 (296.0684702)


Gyrocyanin is found in mushrooms. Gyrocyanin is a constituent of the mushroom Gyroporus cyanescens (cornflower bolete). Constituent of the mushroom Gyroporus cyanescens (cornflower bolete). Gyrocyanin is found in mushrooms.

   

1,4-Benzothiazine-O-quinonimine

(3S)-7-[(2R)-2-amino-2-carboxyethyl]-5-oxo-3,5-dihydro-2H-1,4-benzothiazine-3-carboxylic acid

C12H12N2O5S (296.0466902)


1,4-Benzothiazine-o-quinonimine is a reaction intermediate of oxidation of quinonimine. [HMDB] 1, 4-benzothiazine-o-quinonimine is a reaction intermediate of oxidation of quinonimine.

   

Trifluridine

1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-(trifluoromethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione

C10H11F3N2O5 (296.0620032)


Trifluridine is only found in individuals that have used or taken this drug. It is an antiviral derivative of thymidine used mainly in the treatment of primary keratoconjunctivitis and recurrent epithelial keratitis due to herpes simplex virus. (From Martindale, The Extra Pharmacopoeia, 30th ed, p557)The mechanism of action of trifluridine has not been fully determined, but appears to involve the inhibition of viral replication. Trifluridine does this by incorporating into viral DNA during replication, which leads to the formation of defective proteins and an increased mutation rate. This drug also reversibly inhibits thymidylate synthetase, an enzyme that is necessary for DNA synthesis. C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives > S01AD - Antivirals D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D009676 - Noxae > D000963 - Antimetabolites Trifluridine (Trifluorothymidine) is an irreversible and orally active thymidylate synthase inhibitor, and thereby suppressing DNA synthesis. Trifluridine is an antiviral molecule used for research of HSV, rhabdovirus and orthopoxvirus infection. Trifluridine induces cell apoptosis and autophagy. Trifluridine is also an anticancer agent used in studies of metastatic colorectal cancer, gastrointestinal tumors[1][2][3][4].

   

N-Acetyldjenkolic acid

2-amino-3-{[({2-carboxy-2-[(Z)-(1-hydroxyethylidene)amino]ethyl}sulfanyl)methyl]sulfanyl}propanoic acid

C9H16N2O5S2 (296.0500606)


N-Acetyldjenkolic acid is isolated from Acacia farnesiana (sweet acacia

   

(2s)-2-[6-(Sulfooxy)naphthalen-2-yl]propanoic acid

(2S)-2-[6-(Sulphooxy)naphthalen-2-yl]propanoic acid

C13H12O6S (296.0354572)


   

Fenclofenac

2-[2-(2,4-dichlorophenoxy)phenyl]acetic acid

C14H10Cl2O3 (296.00069700000006)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents

   

Flunixin

2-{[2-methyl-3-(trifluoromethyl)phenyl]amino}pyridine-3-carboxylic acid

C14H11F3N2O2 (296.07725819999996)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents D058633 - Antipyretics

   

Octogen

beta-1,3,5,7-tetranitro-1,3,5,7-Tetraazacyclooctane

C4H8N8O8 (296.0465088)


   

Anhydropisatin

16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(12),2,4(8),9,13(18),14,16-heptaene

C17H12O5 (296.0684702)


Anhydropisatin is a member of the class of compounds known as pterocarpans. Pterocarpans are benzo-pyrano-furano-benzene compounds, containing the 6H-[1]benzofuro[3,2-c]chromene skeleton. They are derivatives of isoflavonoids. Thus, anhydropisatin is considered to be a flavonoid lipid molecule. Anhydropisatin is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Anhydropisatin can be found in common pea, which makes anhydropisatin a potential biomarker for the consumption of this food product.

   

4-amino-2-methyl-5-diphosphomethylpyrimidine

{[(6-imino-2-methyl-1,6-dihydropyrimidin-5-yl)methyl phosphonato]oxy}phosphonate

C6H8N3O7P2 (295.9837498)


2-methyl-4-amino-5-hydroxymethylpyrimidine diphosphate, also known as hmp-pp or 4-amino-5-hydroxymethyl-2-methylpyrimidine-pp, is a member of the class of compounds known as organic pyrophosphates. Organic pyrophosphates are organic compounds containing the pyrophosphate oxoanion, with the structure OP([O-])(=O)OP(O)([O-])=O. 2-methyl-4-amino-5-hydroxymethylpyrimidine diphosphate is soluble (in water) and a moderately acidic compound (based on its pKa). 2-methyl-4-amino-5-hydroxymethylpyrimidine diphosphate can be found in a number of food items such as purple laver, japanese pumpkin, parsnip, and cloves, which makes 2-methyl-4-amino-5-hydroxymethylpyrimidine diphosphate a potential biomarker for the consumption of these food products. 2-methyl-4-amino-5-hydroxymethylpyrimidine diphosphate may be a unique E.coli metabolite.

   

5-Hydroxy-7-acetoxyflavone

5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl acetate

C17H12O5 (296.0684702)


   
   
   
   

4-Acetylchrysophanol

4-Acetylchrysophanol

C17H12O5 (296.0684702)


   

3-methoxy-4,5-methylenedioxyflavone

3-methoxy-4,5-methylenedioxyflavone

C17H12O5 (296.0684702)


   
   
   
   
   
   

2,5-Dihydroxyflavone 5-acetate

2,5-Dihydroxyflavone 5-acetate

C17H12O5 (296.0684702)


   
   

Caffeoylmalic acid

Caffeoylmalic acid

C13H12O8 (296.0532152)


   

Mono-trans-p-coumaroylmesotartaric acid

2-hydroxy-3-{[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

C13H12O8 (296.0532152)


   

Milleyanaflavone

2- (1,3-Benzodioxol-5-yl) -7-methoxy-4H-1-benzopyran-4-one

C17H12O5 (296.0684702)


   

Unonal

5,7-Dihydroxy-8-methyl-4-oxo-2-phenyl-4H-1-benzopyran-6-carboxaldehyde

C17H12O5 (296.0684702)


   

Isounonal

5,7-Dihydroxy-6-methyl-4-oxo-2-phenyl-4H-1-benzopyran-8-carboxaldehyde

C17H12O5 (296.0684702)


   

Pseudobaptigenin methyl ether

7-Methoxy-3,4-methylenedioxyisoflavone

C17H12O5 (296.0684702)


   

Coumestrol dimethyl ether

3,9-Dimethoxy-6-oxopterocarpene

C17H12O5 (296.0684702)


   

5-Methoxy-6,7-methylenedioxyflavone

5-Methoxy-6,7-methylenedioxyflavone

C17H12O5 (296.0684702)


   

5-Methoxy-7,8-methylenedioxyflavone

5-Methoxy-7,8-methylenedioxyflavone

C17H12O5 (296.0684702)


   

Maximaisoflavone H

4-Methoxy-7,8-methylenedioxyisoflavone

C17H12O5 (296.0684702)


   

Anhydropisatin

3-Methoxy-6H- [ 1,3 ] dioxolo [ 5,6 ] benzofuro [ 3,2-c ] [ 1 ] benzopyran

C17H12O5 (296.0684702)


   

Medicagol

7-Hydroxy-11,12-methylenedioxycoumestan

C16H8O6 (296.0320868)


   

8-chloro-2-phenyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine

8-chloro-2-phenyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine

C14H8ClF3N2 (296.03280739999997)


   

2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)acrylonitrile

2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)acrylonitrile

C16H9ClN2S (296.01749440000003)


   
   
   

1-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide

1-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide

C13H13ClN2O2S (296.03862280000004)


   

Flunixin Meglumine

Flunixin Meglumine

C14H11F3N2O2 (296.07725819999996)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents D058633 - Antipyretics CONFIDENCE standard compound; INTERNAL_ID 1148

   
   

5,7,4-trihydroxy-4-styrylcoumarin

5,7,4-trihydroxy-4-styrylcoumarin

C17H12O5 (296.0684702)


   
   
   
   
   

7-acetylchrysophanol

7-acetylchrysophanol

C17H12O5 (296.0684702)


   

2-ethoxycarbonyl-1-hydroxyanthraquinone

2-ethoxycarbonyl-1-hydroxyanthraquinone

C17H12O5 (296.0684702)


   
   

4,6-dichloro-3,7-dihydroxy-1,9-dimethyldibenzofuran

4,6-dichloro-3,7-dihydroxy-1,9-dimethyldibenzofuran

C14H10Cl2O3 (296.00069700000006)


   

2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-carbaldehyde

2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-carbaldehyde

C17H12O5 (296.0684702)


   
   

3-methylgalangin|5,7-dihydroxy-3-methoxyflavone

3-methylgalangin|5,7-dihydroxy-3-methoxyflavone

C17H12O5 (296.0684702)


   
   

(2S)-2-[(beta-D-Glucopyranosyl)oxy]butanedioic acid

(2S)-2-[(beta-D-Glucopyranosyl)oxy]butanedioic acid

C10H16O10 (296.0743436)


   

7-hydroxy-3-[6-hydroxyphenyl-2-oxo-ethyl]chromone|terminalianone

7-hydroxy-3-[6-hydroxyphenyl-2-oxo-ethyl]chromone|terminalianone

C17H12O5 (296.0684702)


   
   
   
   

furano(2,3:7,6)-4-hydroxyflavanone

furano(2,3:7,6)-4-hydroxyflavanone

C17H12O5 (296.0684702)


   
   
   

3,4,5-triacetoxybenzoic acid

3,4,5-triacetoxybenzoic acid

C13H12O8 (296.0532152)


   
   

2,8-Dichloro-1,9-dimethyldibenzofuran-3,7-diol

2,8-Dichloro-1,9-dimethyldibenzofuran-3,7-diol

C14H10Cl2O3 (296.00069700000006)


   

6-O-(1-L-maloyl)-alpha/beta-D-glucopyranose|veracylglucan A

6-O-(1-L-maloyl)-alpha/beta-D-glucopyranose|veracylglucan A

C10H16O10 (296.0743436)


   
   
   

6-Sulfoaminopenicillanic acid

6-Sulfoaminopenicillanic acid

C8H12N2O6S2 (296.0136772)


   

(1E,3E,5S,6S)-2-acetoxymethyl-1,5,6-trichloro-6-methyl-octa-1,3,7-triene

(1E,3E,5S,6S)-2-acetoxymethyl-1,5,6-trichloro-6-methyl-octa-1,3,7-triene

C12H15Cl3O2 (296.013758)


   
   

gamma-L-Glu-S-Me-L-cys sulphoxide

gamma-L-Glu-S-Me-L-cys sulphoxide

C9H16N2O7S (296.0678186)


   

1-O-malyl-beta-D-glucose

1-O-malyl-beta-D-glucose

C10H16O10 (296.0743436)


   

Flunixine

Flunixin Meglumine

C14H11F3N2O2 (296.07725819999996)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics CONFIDENCE standard compound; EAWAG_UCHEM_ID 3685 D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents D058633 - Antipyretics

   

(2-Oxo-2H-chromen-7-yloxy)-phenyl-acetic acid

NCGC00160319-01!(2-Oxo-2H-chromen-7-yloxy)-phenyl-acetic acid

C17H12O5 (296.0684702)


   

3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-chromen-2-one

"NCGC00160228-01!3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-chromen-2-one"

C17H12O5 (296.0684702)


   

Tetraethylthiuram disulfide

Tetraethylthiuram disulfide

C10H20N2S4 (296.050928)


   

MLS001076475-01!TETRAETHYLTHIURAM DISULFIDE97-77-8

MLS001076475-01!TETRAETHYLTHIURAM DISULFIDE97-77-8

C10H20N2S4 (296.050928)


   

Aspulvinone E - Yellow pigment - Found in Aspergillus

Aspulvinone E - Yellow pigment - Found in Aspergillus

C17H12O5 (296.0684702)


   

Imazalil

Pesticide4_Imazalil_C14H14Cl2N2O_Freshgard

C14H14Cl2N2O (296.0483134)


Imazalil (Enilconazole) is a fungicide, widely used in agriculture, particularly in the growing of citrus fruits, also used in veterinary medicine as a topical antimycotic.

   

Desmethylnaproxen-6-O-sulfate

Desmethylnaproxen-6-O-sulfate

C13H12O6S (296.0354572)


   

Trifluridine

Trifluorothymidine

C10H11F3N2O5 (296.0620032)


C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C272 - Antimetabolite S - Sensory organs > S01 - Ophthalmologicals > S01A - Antiinfectives > S01AD - Antivirals D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D009676 - Noxae > D000963 - Antimetabolites Trifluridine (Trifluorothymidine) is an irreversible and orally active thymidylate synthase inhibitor, and thereby suppressing DNA synthesis. Trifluridine is an antiviral molecule used for research of HSV, rhabdovirus and orthopoxvirus infection. Trifluridine induces cell apoptosis and autophagy. Trifluridine is also an anticancer agent used in studies of metastatic colorectal cancer, gastrointestinal tumors[1][2][3][4].

   

N-Acetyldjenkolic acid

2-amino-3-({[(2-carboxy-2-acetamidoethyl)sulfanyl]methyl}sulfanyl)propanoic acid

C9H16N2O5S2 (296.0500606)


   

2-O-Feruloyltartronic acid

2-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}propanedioic acid

C13H12O8 (296.0532152)


   

Gyrocyanin

4-Hydroxy-2,5-bis(4-hydroxyphenyl)-4-cyclopentene-1,3-dione, 9ci

C17H12O5 (296.0684702)


   

cis-Coutaric acid

2-hydroxy-3-{[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

C13H12O8 (296.0532152)


   

N-Methoxyspirobrassinol methyl ether

1,2-dimethoxy-5-(methylsulfanyl)-1,2-dihydro-3H-spiro[indole-3,2-[1,4]thiazole]

C13H16N2O2S2 (296.0653156)


   

tert-Butyl 4-bromo-1H-pyrrolo[2,3-c]pyridine-1-carboxylate

tert-Butyl 4-bromo-1H-pyrrolo[2,3-c]pyridine-1-carboxylate

C12H13BrN2O2 (296.0160338)


   
   

Octogen

Octogen

C4H8N8O8 (296.0465088)


D053834 - Explosive Agents

   

1-(4-(trifluoromethoxy)phenyl) piperazin-2-one hydrochloride

1-(4-(trifluoromethoxy)phenyl) piperazin-2-one hydrochloride

C11H12ClF3N2O2 (296.0539358)


   

2-(6-CHLORO-4-ETHYL-2-OXO-2H-CHROMEN-7-YLOXY)-PROPIONIC ACID

2-((6-Chloro-4-ethyl-2-oxo-2H-chromen-7-yl)oxy)propanoic acid

C14H13ClO5 (296.0451478)


   

4-Thiazolidinone,3-methyl-5-[2-(4-nitrophenyl)diazenyl]-2-thioxo-

4-Thiazolidinone,3-methyl-5-[2-(4-nitrophenyl)diazenyl]-2-thioxo-

C10H8N4O3S2 (296.0037818)


   

Ralitoline

Ralitoline

C13H13ClN2O2S (296.03862280000004)


C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent

   

4-methylbenzothiophene

4-methylbenzothiophene

C18H16S2 (296.0693376)


   

7-Hydroxy-4-oxo-2-phenyl-4H-chromen-5-yl acetate

7-Hydroxy-4-oxo-2-phenyl-4H-chromen-5-yl acetate

C17H12O5 (296.0684702)


   

2-(5-bromo-2-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(5-bromo-2-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C13H18BBrO2 (296.0583138)


   

Palladium(2+) chloride 1,2-ethanediamine (1:2:2)

Palladium(2+) chloride 1,2-ethanediamine (1:2:2)

C4H16Cl2N4Pd (295.9786706)


   
   

3,5-DICHLORO-5-METHOXY-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

3,5-DICHLORO-5-METHOXY-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

C14H10Cl2O3 (296.00069700000006)


   

2-(1-Adamantyl)ethyltrichlorosilane

2-(1-Adamantyl)ethyltrichlorosilane

C12H19Cl3Si (296.0321544)


   

Octamethylcyclotetrasiloxane

Octamethylcyclotetrasiloxane

C8H24O4Si4 (296.0751624)


D001697 - Biomedical and Dental Materials D007155 - Immunologic Factors

   

3-(Benzyloxy)-2,4-dichlorophenylboronic acid

3-(Benzyloxy)-2,4-dichlorophenylboronic acid

C13H11BCl2O3 (296.01782660000003)


   

3-CHLORO-4-(2-CHLOROBENZYLOXY)PHENYLBO&

3-CHLORO-4-(2-CHLOROBENZYLOXY)PHENYLBO&

C13H11BCl2O3 (296.01782660000003)


   

3-CHLORO-4-(3-CHLOROBENZYLOXY)PHENYLBO&

3-CHLORO-4-(3-CHLOROBENZYLOXY)PHENYLBO&

C13H11BCl2O3 (296.01782660000003)


   

Ethyl 7-bromo-4-oxo-1,4-dihydro-1,5-naphthyridine-3-carboxylate

Ethyl 7-bromo-4-oxo-1,4-dihydro-1,5-naphthyridine-3-carboxylate

C11H9BrN2O3 (295.97965039999997)


   

1-(4-CHLOROPHENYL)-2,2,3,3,3-PENTAFLUORO-PROPAN-1-ONE

1-(4-CHLOROPHENYL)-2,2,3,3,3-PENTAFLUORO-PROPAN-1-ONE

C14H10Cl2OS (295.98293900000004)


   

(6R,7R)-7-Amino-3-[(5-methyl-2H-tetrazol-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

(6R,7R)-7-Amino-3-[(5-methyl-2H-tetrazol-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

C10H12N6O3S (296.06915620000007)


   

ANTHRAQUINONE-2,3-DICARBOXYLIC ACID

ANTHRAQUINONE-2,3-DICARBOXYLIC ACID

C16H8O6 (296.0320868)


   

6-Bromo-1-hydroxypyrene

6-Bromo-1-hydroxypyrene

C16H9BrO (295.9836724)


   

5-Chloro-1-aza-5-stanna-bicyclo[3.3.3]undecane

5-Chloro-1-aza-5-stanna-bicyclo[3.3.3]undecane

C9H19ClNSn (296.02279339999995)


   

7-Chloro-2-(3-(trifluoromethyl)phenyl)pyrazolo[1,5-a]pyridine

7-Chloro-2-(3-(trifluoromethyl)phenyl)pyrazolo[1,5-a]pyridine

C14H8ClF3N2 (296.03280739999997)


   

1-Boc-3-bromo-1H-pyrrolo[3,2-b]pyridine

1-Boc-3-bromo-1H-pyrrolo[3,2-b]pyridine

C12H13BrN2O2 (296.0160338)


   

1-Boc-3-bromo-5-azaindole

1-Boc-3-bromo-5-azaindole

C12H13BrN2O2 (296.0160338)


   

Ethyl 3-(4-bromophenyl)-1,2,4-oxadiazole-5-carboxylate

Ethyl 3-(4-bromophenyl)-1,2,4-oxadiazole-5-carboxylate

C11H9BrN2O3 (295.97965039999997)


   
   

1-(4,5-DICHLORO-2-NITROPHENYL)PIPERIDINE

1-(4,5-DICHLORO-2-NITROPHENYL)PIPERIDINE

C15H14Cl2O2 (296.0370804)


   

4-[(3,4-DICHLOROBENZYL)OXY]BENZENECARBOXYLIC ACID

4-[(3,4-DICHLOROBENZYL)OXY]BENZENECARBOXYLIC ACID

C14H10Cl2O3 (296.00069700000006)


   

4-Chloro-2-(4-chloro-phenyl)-pyrimidine-5-carboxylic acid ethyl ester

4-Chloro-2-(4-chloro-phenyl)-pyrimidine-5-carboxylic acid ethyl ester

C13H10Cl2N2O2 (296.01193)


   

1-(4-Bromophenyl)-4-oxocyclohexanecarboxylic acid

1-(4-Bromophenyl)-4-oxocyclohexanecarboxylic acid

C13H13BrO3 (296.0048008)


   

Benzeneacetic acid,2-chloro-a-(2-chlorophenyl)-a-hydroxy-

Benzeneacetic acid,2-chloro-a-(2-chlorophenyl)-a-hydroxy-

C14H10Cl2O3 (296.00069700000006)


   

5-BROMO-3-METHYL-N-CYCLOHEXYLPYRIDINE-2-CARBOXAMIDE

5-BROMO-3-METHYL-N-CYCLOHEXYLPYRIDINE-2-CARBOXAMIDE

C13H17BrN2O (296.0524172)


   

8-(4-BROMOPHENYL)-1,4-DIOXASPIRO[4,5]DECANE

8-(4-BROMOPHENYL)-1,4-DIOXASPIRO[4,5]DECANE

C14H17BrO2 (296.0411842)


   

2,6-dichloro-N-(1-cyanocyclohexyl)benzamide

2,6-dichloro-N-(1-cyanocyclohexyl)benzamide

C14H14Cl2N2O (296.0483134)


   

TERT-BUTYL 5-BROMO-3-METHYLPYRIDIN-2-YLCARBAMATE

TERT-BUTYL 5-BROMO-3-METHYLPYRIDIN-2-YLCARBAMATE

C12H13BrN2O2 (296.0160338)


   

1-(Mesitylsulfonyl)-3-nitro-1H-1,2,4-triazole

1-(Mesitylsulfonyl)-3-nitro-1H-1,2,4-triazole

C11H12N4O4S (296.0579232)


   

TERT-BUTYL 5-BROMO-1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLATE

TERT-BUTYL 5-BROMO-1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLATE

C12H13BrN2O2 (296.0160338)


   

Thieno[3,2-f:4,5-f]bis[1]benzothiophene

Thieno[3,2-f:4,5-f]bis[1]benzothiophene

C16H8S3 (295.9788128)


   

5-(2-BROMO-5-FLUOROPHENYL)-1-(TERT-BUTYL)-1H-PYRAZOLE

5-(2-BROMO-5-FLUOROPHENYL)-1-(TERT-BUTYL)-1H-PYRAZOLE

C13H14BrFN2 (296.0324316)


   

1-(3-bromophenyl)-4-oxocyclohexane-1-carboxylic acid

1-(3-bromophenyl)-4-oxocyclohexane-1-carboxylic acid

C13H13BrO3 (296.0048008)


   

6-[(2-chloro-6-nitrophenyl)methylamino]-1H-pyrimidine-2,4-dione

6-[(2-chloro-6-nitrophenyl)methylamino]-1H-pyrimidine-2,4-dione

C11H9ClN4O4 (296.03123039999997)


   

2-(3-chlorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine

2-(3-chlorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine

C14H8ClF3N2 (296.03280739999997)


   

Benzoic acid,3,4,5-tris(acetyloxy)-

Benzoic acid,3,4,5-tris(acetyloxy)-

C13H12O8 (296.0532152)


   

2-(4-(Bromomethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(4-(Bromomethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C13H18BBrO2 (296.0583138)


   

4-Chloro-7-(2-chloroethoxy)-6-methoxy-3-quinolinecarbonitrile

4-Chloro-7-(2-chloroethoxy)-6-methoxy-3-quinolinecarbonitrile

C13H10Cl2N2O2 (296.01193)


   

6-Bromotryptophan methyl ester

6-Bromotryptophan methyl ester

C12H13BrN2O2 (296.0160338)


   

1-[4-(3-TRIFLUOROMETHOXY-PHENOXY)-PHENYL]-ETHANONE

1-[4-(3-TRIFLUOROMETHOXY-PHENOXY)-PHENYL]-ETHANONE

C15H11F3O3 (296.0660252)


   

1-[4-(4-TRIFLUOROMETHOXY-PHENOXY)-PHENYL]-ETHANONE

1-[4-(4-TRIFLUOROMETHOXY-PHENOXY)-PHENYL]-ETHANONE

C15H11F3O3 (296.0660252)


   

3-(4-ACETYL-PHENYL)-2-MERCAPTO-3H-QUINAZOLIN-4-ONE

3-(4-ACETYL-PHENYL)-2-MERCAPTO-3H-QUINAZOLIN-4-ONE

C16H12N2O2S (296.0619452)


   

1,5,9,13-tetrathiacyclohexadecane

1,5,9,13-tetrathiacyclohexadecane

C12H24S4 (296.0760784)


   

tert-Butyl 4-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

tert-Butyl 4-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

C12H13BrN2O2 (296.0160338)


   

5-(MORPHOLIN-4-YLSULFONYL)-1H-INDOLE-2,3-DIONE

5-(MORPHOLIN-4-YLSULFONYL)-1H-INDOLE-2,3-DIONE

C12H12N2O5S (296.0466902)


   

Benzo[b]thiophene-2-carboximidamide, 6-(benzoyloxy)-

Benzo[b]thiophene-2-carboximidamide, 6-(benzoyloxy)-

C16H12N2O2S (296.0619452)


   

1-(3-(TRIFLUOROMETHOXY)PHENYL) PIPERAZIN-2-ONE HYDROCHLORIDE

1-(3-(TRIFLUOROMETHOXY)PHENYL) PIPERAZIN-2-ONE HYDROCHLORIDE

C11H12ClF3N2O2 (296.0539358)


   

Diethyl hexafluoropentanedioate

Diethyl hexafluoropentanedioate

C9H10F6O4 (296.0483252)


   

1,1-[Carbonylbis(oxy)]bis(1H-benzotriazole)

1,1-[Carbonylbis(oxy)]bis(1H-benzotriazole)

C13H8N6O3 (296.06578579999996)


   

4-Amino-5-iodo-2-phenylpyridine

4-Amino-5-iodo-2-phenylpyridine

C11H9IN2 (295.98104639999997)


   

4-(4-chlorophenyl)sulfonylbenzoic acid

4-(4-chlorophenyl)sulfonylbenzoic acid

C13H9ClO4S (295.9910064)


   

ETHYL5-BROMO-1-(PYRIMIDIN-2-YL)-1H-PYRAZOLE-4-CARBOXYLATE

ETHYL5-BROMO-1-(PYRIMIDIN-2-YL)-1H-PYRAZOLE-4-CARBOXYLATE

C10H9BrN4O2 (295.9908834)


   

1-[7-AMINO-5-(2-BROMOPROPYL)-2,3-DIHYDRO-1H-INDOL-1-YL]ETHANONE

1-[7-AMINO-5-(2-BROMOPROPYL)-2,3-DIHYDRO-1H-INDOL-1-YL]ETHANONE

C13H17BrN2O (296.0524172)


   
   

Diisobutylthiuram disulfide

Diisobutylthiuram disulfide

C10H20N2S4 (296.050928)


   

tert-butyl 4-bromo-1H-indazole-5-carboxylate

tert-butyl 4-bromo-1H-indazole-5-carboxylate

C12H13BrN2O2 (296.0160338)


   

2,4-dinitrophenylhydrazine phosphoric acid

2,4-dinitrophenylhydrazine phosphoric acid

C6H9N4O8P (296.01580040000005)


   

tert-Butyl 6-bromo-1H-indazole-1-carboxylate

tert-Butyl 6-bromo-1H-indazole-1-carboxylate

C12H13BrN2O2 (296.0160338)


   

tert-Butyl 7-bromo-1H-indazole-1-carboxylate

tert-Butyl 7-bromo-1H-indazole-1-carboxylate

C12H13BrN2O2 (296.0160338)


   

n-(7-nitro-4-benzofurazanyl)-l-prolyl

n-(7-nitro-4-benzofurazanyl)-l-prolyl

C11H9ClN4O4 (296.03123039999997)


   

(1-(N,N-DIMETHYLSULFAMOYL)-3-(PYRIDIN-2-YL)-1H-PYRAZOL-4-YL)BORONIC ACID

(1-(N,N-DIMETHYLSULFAMOYL)-3-(PYRIDIN-2-YL)-1H-PYRAZOL-4-YL)BORONIC ACID

C10H13BN4O4S (296.07505280000004)


   
   

2-methoxyethylmercury chloride

2-methoxyethylmercury chloride

C3H7ClHgO (295.9891722)


   

Ethyl 6-bromo-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylate

Ethyl 6-bromo-2-oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylate

C11H9BrN2O3 (295.97965039999997)


   

Bis(benzo[d]thiazol-2-yl)methanone

Bis(benzo[d]thiazol-2-yl)methanone

C15H8N2OS2 (296.0078038)


   

BENZAMIDE, N-[7-(CHLOROMETHYL)-1-ISOQUINOLINYL]-

BENZAMIDE, N-[7-(CHLOROMETHYL)-1-ISOQUINOLINYL]-

C17H13ClN2O (296.0716358)


   

2-Bromo-10H-indolo[3,2-b]quinoline

2-Bromo-10H-indolo[3,2-b]quinoline

C15H9BrN2 (295.9949054)


   

methyl (Z)-3-(1-chloro-3,4-dihydronaphthalen-2-yl)-2-(chloromethyl)prop-2-enoate

methyl (Z)-3-(1-chloro-3,4-dihydronaphthalen-2-yl)-2-(chloromethyl)prop-2-enoate

C15H14Cl2O2 (296.0370804)


   

methyl (2Z,4Z,6E)-5-chloro-2-(chloromethyl)-7-phenylhepta-2,4,6-trienoate

methyl (2Z,4Z,6E)-5-chloro-2-(chloromethyl)-7-phenylhepta-2,4,6-trienoate

C15H14Cl2O2 (296.0370804)


   

1,3-DIPHENYL-2-THIOBARBITURIC ACID

1,3-DIPHENYL-2-THIOBARBITURIC ACID

C16H12N2O2S (296.0619452)


   

tert-Butyl 4-bromo-1H-indazole-1-carboxylate

tert-Butyl 4-bromo-1H-indazole-1-carboxylate

C12H13BrN2O2 (296.0160338)


   

Sodium Dimethyl 5-Sulfoisophthalate

Sodium Dimethyl 5-Sulfoisophthalate

C10H9NaO7S (295.9966684)


   

2-Bromobenzylboronic acid pinacol ester

2-Bromobenzylboronic acid pinacol ester

C13H18BBrO2 (296.0583138)


   

TETRAAMMINEPALLADIUM (II) HYDROGEN CARBONATE

TETRAAMMINEPALLADIUM (II) HYDROGEN CARBONATE

C2H14N4O6Pd (295.9948054)


   

3-AMINO-6-NITROBENZOTRIFLUORIDE

3-AMINO-6-NITROBENZOTRIFLUORIDE

C9H14BrClN2O2 (295.9927114)


   

Methyl 3-bromo-4-cyclohexylbenzoate

Methyl 3-bromo-4-cyclohexylbenzoate

C14H17BrO2 (296.0411842)


   

2-(4-bromophenyl)-1-(4-methylpiperazin-1-yl)ethanone

2-(4-bromophenyl)-1-(4-methylpiperazin-1-yl)ethanone

C13H17BrN2O (296.0524172)


   

phenyl N-(4-phenyl-1,3-thiazol-2-yl)carbamate

phenyl N-(4-phenyl-1,3-thiazol-2-yl)carbamate

C16H12N2O2S (296.0619452)


   

CIS-3-(8-AMINO-1-BROMOIMIDAZO[1,5-A]PYRAZIN-3-YL)-1-METHYLCYCLOBUTANOL

CIS-3-(8-AMINO-1-BROMOIMIDAZO[1,5-A]PYRAZIN-3-YL)-1-METHYLCYCLOBUTANOL

C11H13BrN4O (296.0272668)


   

2-[(3-METHYLBENZO[B]THIOPHEN-2-YL)CARBONYL]BENZOIC ACID

2-[(3-METHYLBENZO[B]THIOPHEN-2-YL)CARBONYL]BENZOIC ACID

C17H12O3S (296.0507122)


   

4-Bromobenzylboronic acid pinacol ester

4-Bromobenzylboronic acid pinacol ester

C13H18BBrO2 (296.0583138)


   

1,2,3,4,5,6,7,8-octafluoroacenaphthylene

1,2,3,4,5,6,7,8-octafluoroacenaphthylene

C12F8 (295.9872256)


   

2,2-dimethyl-6,6,7,7,8,8,8-heptafluoro-3,5-octanedione

2,2-dimethyl-6,6,7,7,8,8,8-heptafluoro-3,5-octanedione

C10H11F7O2 (296.06472299999996)


   

2,4,6-Cycloheptatrien-1-one,3-[3-(1,3-benzodioxol-5-yl)-1-oxo-2-propen-1-yl]-2-hydroxy-

2,4,6-Cycloheptatrien-1-one,3-[3-(1,3-benzodioxol-5-yl)-1-oxo-2-propen-1-yl]-2-hydroxy-

C17H12O5 (296.0684702)


   

(5-(BENZYLOXY)-2,4-DICHLOROPHENYL)BORONIC ACID

(5-(BENZYLOXY)-2,4-DICHLOROPHENYL)BORONIC ACID

C13H11BCl2O3 (296.01782660000003)


   

(3-((2,4-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

(3-((2,4-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

C13H11BCl2O3 (296.01782660000003)


   

(4-((2,4-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

(4-((2,4-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

C13H11BCl2O3 (296.01782660000003)


   

(3-((3,4-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

(3-((3,4-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

C13H11BCl2O3 (296.01782660000003)


   

2-(4-Bromobenzoyl)cyclopentanecarboxylic acid

2-(4-Bromobenzoyl)cyclopentanecarboxylic acid

C13H13BrO3 (296.0048008)


   

9H-Telluroxanthene

9H-Telluroxanthene

C13H10Te (295.984475)


   

7-Chloro-2-(4-(trifluoromethyl)phenyl)pyrazolo[1,5-a]pyridine

7-Chloro-2-(4-(trifluoromethyl)phenyl)pyrazolo[1,5-a]pyridine

C14H8ClF3N2 (296.03280739999997)


   

ethyl 4-chloro-6,7-dimethoxyquinazoline-2-carboxylate

ethyl 4-chloro-6,7-dimethoxyquinazoline-2-carboxylate

C13H13ClN2O4 (296.0563808)


   

4,4-(Bromomethylene)dibenzonitrile

4,4-(Bromomethylene)dibenzonitrile

C15H9BrN2 (295.9949054)


   

(3-Bromomethylphenyl)boronic acid pinacol ester

(3-Bromomethylphenyl)boronic acid pinacol ester

C13H18BBrO2 (296.0583138)


   

Bis(phenylsulfonyl)methane

Bis(phenylsulfonyl)methane

C13H12O4S2 (296.0176992)


   
   

n-(7-nitro-4-benzofurazanyl)-d-prolyl

n-(7-nitro-4-benzofurazanyl)-d-prolyl

C11H9ClN4O4 (296.03123039999997)


   

tert-Butyl 2-(5-bromopyridin-2-yl)-2-cyanoacetate

tert-Butyl 2-(5-bromopyridin-2-yl)-2-cyanoacetate

C12H13BrN2O2 (296.0160338)


   

CARBONIC ACID TERT-BUTYL 2,4,5-TRICHLOROPHENYL ESTER

CARBONIC ACID TERT-BUTYL 2,4,5-TRICHLOROPHENYL ESTER

C11H11Cl3O3 (295.9773746)


   

3-BROMO-1-ETHYL-1,4-DIHYDRO[1,3]DIOXOLO[4,5-G]CINNOLIN-4-ONE

3-BROMO-1-ETHYL-1,4-DIHYDRO[1,3]DIOXOLO[4,5-G]CINNOLIN-4-ONE

C11H9BrN2O3 (295.97965039999997)


   

tert-butyl 3-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

tert-butyl 3-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

C12H13BrN2O2 (296.0160338)


   

2,6-Diamino-4-pyrimidinyl p-Toluenesulfonate 3-Oxide

2,6-Diamino-4-pyrimidinyl p-Toluenesulfonate 3-Oxide

C11H12N4O4S (296.0579232)


   

2-Sulfo-1,4-benzenedicarboxylic acid 1,4-dimethyl ester sodium salt

2-Sulfo-1,4-benzenedicarboxylic acid 1,4-dimethyl ester sodium salt

C10H9NaO7S (295.9966684)


   

Benzo[b]naphtho[2,3-d]furan, 3-bromo-

Benzo[b]naphtho[2,3-d]furan, 3-bromo-

C16H9BrO (295.9836724)


   

2,3-dimethyl-6-(4-(trifluoromethyl)phenyl)imidazo[2,1-b]thiazole

2,3-dimethyl-6-(4-(trifluoromethyl)phenyl)imidazo[2,1-b]thiazole

C14H11F3N2S (296.0595002)


   
   

2-Deoxy-2,2-difluoro-D-erythro-pentofuranose triacetate

2-Deoxy-2,2-difluoro-D-erythro-pentofuranose triacetate

C11H14F2O7 (296.07075580000003)


   

Benzo[b]naphtho[1,2-d]furan, 9-bromo-

Benzo[b]naphtho[1,2-d]furan, 9-bromo-

C16H9BrO (295.9836724)


   

2,6-Bis-O-(carboxymethyl)-D-glucose

2,6-Bis-O-(carboxymethyl)-D-glucose

C10H16O10 (296.0743436)


   

6-bromonaphtho[2,3-b]benzofuran

6-bromonaphtho[2,3-b]benzofuran

C16H9BrO (295.9836724)


   

[(6-METHYL-BENZOTHIAZOL-2-YLCARBAMOYL)-METHYLSULFANYL]-ACETIC ACID

[(6-METHYL-BENZOTHIAZOL-2-YLCARBAMOYL)-METHYLSULFANYL]-ACETIC ACID

C12H12N2O3S2 (296.0289322)


   

[4-[(2,6-dichlorophenyl)methoxy]phenyl]boronic acid

[4-[(2,6-dichlorophenyl)methoxy]phenyl]boronic acid

C13H11BCl2O3 (296.01782660000003)


   

[2-[(2,6-dichlorophenyl)methoxy]phenyl]boronic acid

[2-[(2,6-dichlorophenyl)methoxy]phenyl]boronic acid

C13H11BCl2O3 (296.01782660000003)


   

[4-[(3,4-dichlorophenyl)methoxy]phenyl]boronic acid

[4-[(3,4-dichlorophenyl)methoxy]phenyl]boronic acid

C13H11BCl2O3 (296.01782660000003)


   

(2-((2,4-Dichlorobenzyl)oxy)phenyl)boronic acid

(2-((2,4-Dichlorobenzyl)oxy)phenyl)boronic acid

C13H11BCl2O3 (296.01782660000003)


   

(2-((3,4-Dichlorobenzyl)oxy)phenyl)boronic acid

(2-((3,4-Dichlorobenzyl)oxy)phenyl)boronic acid

C13H11BCl2O3 (296.01782660000003)


   
   

8-bromo-7-(but-2-ynyl)-3-methyl-1H-purine-2,6(3H,7H)-dione

8-bromo-7-(but-2-ynyl)-3-methyl-1H-purine-2,6(3H,7H)-dione

C10H9BrN4O2 (295.9908834)


   

6-BROMOSPIRO[BENZO[E][1,3]OXAZINE-2,4-PIPERIDIN]-4(3H)-ONE

6-BROMOSPIRO[BENZO[E][1,3]OXAZINE-2,4-PIPERIDIN]-4(3H)-ONE

C12H13BrN2O2 (296.0160338)


   

P-NITROBENZOYL-L-GLUTAMIC ACID

P-NITROBENZOYL-L-GLUTAMIC ACID

C12H12N2O7 (296.0644482)


   

9,10-difluoro-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline,dihydrochloride

9,10-difluoro-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline,dihydrochloride

C12H16Cl2F2N2 (296.065854)


   
   

2-broMobenzo[b]-naphtho[2,3-d]furan

2-broMobenzo[b]-naphtho[2,3-d]furan

C16H9BrO (295.9836724)


   

tetraethylcyclotetrasiloxane

tetraethylcyclotetrasiloxane

C8H24O4Si4 (296.0751624)


   

Z-3-Chloro-1-(2-chlorophenyl)-2-(4-fluorophenyl)-oxirane

Z-3-Chloro-1-(2-chlorophenyl)-2-(4-fluorophenyl)-oxirane

C15H11Cl2FO (296.0170948)


   

(2-Bromomethylphenyl)boronic acid pinacol ester

(2-Bromomethylphenyl)boronic acid pinacol ester

C13H18BBrO2 (296.0583138)


   

4-(Benzyloxy)-3,5-dichlorophenylboronic acid

4-(Benzyloxy)-3,5-dichlorophenylboronic acid

C13H11BCl2O3 (296.01782660000003)


   

(3-((2,6-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

(3-((2,6-DICHLOROBENZYL)OXY)PHENYL)BORONIC ACID

C13H11BCl2O3 (296.01782660000003)


   

1-(2-Bromophenyl)-4-oxocyclohexanecarboxylic acid

1-(2-Bromophenyl)-4-oxocyclohexanecarboxylic acid

C13H13BrO3 (296.0048008)


   

methyl 1-acetyl-6-bromo-1H-indazole-4-carboxylate

methyl 1-acetyl-6-bromo-1H-indazole-4-carboxylate

C11H9BrN2O3 (295.97965039999997)


   

Methyl 3-bromo-4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate

Methyl 3-bromo-4-(3-methyl-1,2,4-oxadiazol-5-yl)benzoate

C11H9BrN2O3 (295.97965039999997)


   
   

[5,7-Bis(trifluoromethyl)-1,8-naphthyridin-2-yl]hydrazine

[5,7-Bis(trifluoromethyl)-1,8-naphthyridin-2-yl]hydrazine

C10H6F6N4 (296.04966279999996)


   

1,3-Dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid phenyl ester

1,3-Dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid phenyl ester

C12H12N2O5S (296.0466902)


   

4-[(3-Mercapto-5-phenyl-[1,2,4]triazol-4-ylimino)-methyl]-phenol

4-[(3-Mercapto-5-phenyl-[1,2,4]triazol-4-ylimino)-methyl]-phenol

C15H12N4OS (296.07317820000003)


   
   
   

2-(2,4-dichlorophenoxy)-N-pyridin-3-ylacetamide

2-(2,4-dichlorophenoxy)-N-pyridin-3-ylacetamide

C13H10Cl2N2O2 (296.01193)


   

4-(4-Chlorophenyl)sulfinyl-6-(methoxymethyl)-2-methylpyrimidine

4-(4-Chlorophenyl)sulfinyl-6-(methoxymethyl)-2-methylpyrimidine

C13H13ClN2O2S (296.03862280000004)


   

2-[(5Z)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

2-[(5Z)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid

C12H12N2O3S2 (296.0289322)


   

Fenclofenac

Fenclofenac

C14H10Cl2O3 (296.00069700000006)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents

   
   

(R)-4-phosphonatopantothenate(3-)

(R)-4-phosphonatopantothenate(3-)

C9H15NO8P-3 (296.05352600000003)


COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

4-Amino-2-methyl-5-(diphosphooxymethyl)pyrimidine

4-Amino-2-methyl-5-(diphosphooxymethyl)pyrimidine

C6H8N3O7P2-3 (295.9837498)


   

trans-Coutaric acid

trans-Coutaric acid

C13H12O8 (296.0532152)


   
   

3-benzyl-3,6-disulfide-6-(hydroxymethyl)-DKP

3-benzyl-3,6-disulfide-6-(hydroxymethyl)-DKP

C12H12N2O3S2 (296.0289322)


   

3-(3-Carboxy-5-hydroxy-2H-1,4-benzothiazine-7-yl)alanine

3-(3-Carboxy-5-hydroxy-2H-1,4-benzothiazine-7-yl)alanine

C12H12N2O5S (296.0466902)


   

3-(3-Carboxy-5-hydroxy-2H-1,4-benzothiazine-8-yl)alanine

3-(3-Carboxy-5-hydroxy-2H-1,4-benzothiazine-8-yl)alanine

C12H12N2O5S (296.0466902)


   

(2S)-2-hydroxy-4-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid

(2S)-2-hydroxy-4-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid

C10H16O10 (296.0743436)


   

[(2R,3S,4R,5R)-5-(4-amino-1H-imidazol-3-ium-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

[(2R,3S,4R,5R)-5-(4-amino-1H-imidazol-3-ium-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

C8H15N3O7P+ (296.06475900000004)


   

2-(4-Chlorophenyl)-6-(methylthio)-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile

2-(4-Chlorophenyl)-6-(methylthio)-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile

C12H9ClN2OS2 (295.9844814)


   

N-(3-chloro-4-methoxyphenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine

N-(3-chloro-4-methoxyphenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine

C12H13ClN4O3 (296.0676138)


   

9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide

9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide

C16H12N2O2S (296.0619452)


   

Isoaspulvinone E

Isoaspulvinone E

C17H12O5 (296.0684702)


A 4-hydroxy-5-(4-hydroxybenzylidene)-3-(4-hydroxyphenyl)furan-2(5H)-one in which the double bond adopts an E-configuration. It is a marine metabolite isolated from the fungus Aspergillus terreus and exhibits antiviral activity.

   

N-(4-bromophenyl)-5-methyl-4-nitro-1H-pyrazol-3-amine

N-(4-bromophenyl)-5-methyl-4-nitro-1H-pyrazol-3-amine

C10H9BrN4O2 (295.9908834)


   

4-[[5-(1-Naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]-2-butyn-1-ol

4-[[5-(1-Naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]-2-butyn-1-ol

C16H12N2O2S (296.0619452)


   

2-[(4-Oxo-2-phenyl-1-benzopyran-3-yl)oxy]acetic acid

2-[(4-Oxo-2-phenyl-1-benzopyran-3-yl)oxy]acetic acid

C17H12O5 (296.0684702)


   

3-(2-Furanyl)-2-methylsulfonyl-5-thiophen-2-yl-3,4-dihydropyrazole

3-(2-Furanyl)-2-methylsulfonyl-5-thiophen-2-yl-3,4-dihydropyrazole

C12H12N2O3S2 (296.0289322)


   

(2R,3S)-cis-coutaric acid

(2R,3S)-cis-coutaric acid

C13H12O8 (296.0532152)


A cinnamate ester obtained by formal condensation of the carboxy group of cis-coumaric acid with one of the hydroxy groups of meso-tartaric acid.

   

2-tert-butyl-4-[(4-chlorophenyl)thio]-5-methyl-1H-pyrazol-3-one

2-tert-butyl-4-[(4-chlorophenyl)thio]-5-methyl-1H-pyrazol-3-one

C14H17ClN2OS (296.0750062)


   
   

3-phenyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,2,4-thiadiazole

3-phenyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,2,4-thiadiazole

C12H7F3N4S (296.03434980000003)


   

cis-4,5-Bis(trimethylsiloxy)-1,2-dithiane

cis-4,5-Bis(trimethylsiloxy)-1,2-dithiane

C10H24O2S2Si2 (296.0756204)


   

N-[(E)-(3-phenyl-4-pyrazolylidene)methyl]-2-thiophenecarbohydrazide

N-[(E)-(3-phenyl-4-pyrazolylidene)methyl]-2-thiophenecarbohydrazide

C15H12N4OS (296.07317820000003)


   

[(3aR,4S,9bS)-8-bromo-5-methyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aR,4S,9bS)-8-bromo-5-methyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

C13H17BrN2O (296.0524172)


   

[(3aS,4R,9bR)-8-bromo-5-methyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

[(3aS,4R,9bR)-8-bromo-5-methyl-1,2,3,3a,4,9b-hexahydropyrrolo[3,2-c]quinolin-4-yl]methanol

C13H17BrN2O (296.0524172)


   

Methyl 2-(6-hydroxy-5,7,8-trimethyl-2-oxo-1,4-benzoxathiin-3-yl)acetate

Methyl 2-(6-hydroxy-5,7,8-trimethyl-2-oxo-1,4-benzoxathiin-3-yl)acetate

C14H16O5S (296.07184060000003)


   

7-(2-amino-2-carboxyethyl)-5-hydroxy-2H-1,4-benzothiazine-3-carboxylic acid

7-(2-amino-2-carboxyethyl)-5-hydroxy-2H-1,4-benzothiazine-3-carboxylic acid

C12H12N2O5S (296.0466902)


A member of the class of benzothiazines that is 2H-1,4-benzothiazine-3-carboxylic acid bearing additional hydroxy and 2-amino-2-carboxyethyl substituents at positions 5 and 7 respectively.

   

[(2R,3S,4R)-5-(4-amino-1H-imidazol-3-ium-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

[(2R,3S,4R)-5-(4-amino-1H-imidazol-3-ium-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

C8H15N3O7P+ (296.06475900000004)


   

2-[(2-oxo-2H-chromen-7-yl)oxy]-2-phenylacetic acid

2-[(2-oxo-2H-chromen-7-yl)oxy]-2-phenylacetic acid

C17H12O5 (296.0684702)


   

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2H-chromen-2-one

3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2H-chromen-2-one

C17H12O5 (296.0684702)


   

1-(p-Chlorophenyl)-2,2-dichloro-2-trimethylsilylethanol

1-(p-Chlorophenyl)-2,2-dichloro-2-trimethylsilylethanol

C11H15Cl3OSi (295.995771)


   
   

(2s)-2-[6-(Sulfooxy)naphthalen-2-yl]propanoic acid

(2s)-2-[6-(Sulfooxy)naphthalen-2-yl]propanoic acid

C13H12O6S (296.0354572)


   

1,4-Benzothiazine-O-quinonimine

1,4-Benzothiazine-O-quinonimine

C12H12N2O5S (296.0466902)


   

4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3-)

4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3-)

C6H8N3O7P2 (295.9837498)


Trianion of 4-amino-2-methyl-5-diphosphooxymethylpyrimidine arising from deprotonation of the diphosphate OH groups; major species at pH 7.3.

   

(R)-4-phosphonatopantothenate(3-)

(R)-4-phosphonatopantothenate(3-)

C9H15NO8P (296.05352600000003)


An organophosphate oxoanion that is the trianion of (R)-5-phosphopantothenic acid arising from deprotonation of the carboxy and phosphate OH groups; major species at pH 7.3

   

desmethylnaproxen sulfate

desmethylnaproxen sulfate

C13H12O6S (296.0354572)


A member of the class of naphthalenes that is naproxen in which the methoxy group has been replaced by a sulfooxy group.

   

(2R,3S)-trans-coutaric acid

(2R,3S)-trans-coutaric acid

C13H12O8 (296.0532152)


A cinnamate ester obtained by formal condensation of the carboxy group of trans-coumaric acid with one of the hydroxy groups of meso-tartaric acid.

   

2-hydroxy-3-{[(2e)-3-(2-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

2-hydroxy-3-{[(2e)-3-(2-hydroxyphenyl)prop-2-enoyl]oxy}butanedioic acid

C13H12O8 (296.0532152)


   

(2s)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanedioic acid

(2s)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanedioic acid

C10H16O10 (296.0743436)


   

5,7-dihydroxy-3-methoxy-2-phenylnaphthalene-1,4-dione

5,7-dihydroxy-3-methoxy-2-phenylnaphthalene-1,4-dione

C17H12O5 (296.0684702)


   

3-hydroxy-4-oxo-4-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]butanoic acid

3-hydroxy-4-oxo-4-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]butanoic acid

C10H16O10 (296.0743436)


   

1-acetyl-4,5-dihydroxy-2-methylanthracene-9,10-dione

1-acetyl-4,5-dihydroxy-2-methylanthracene-9,10-dione

C17H12O5 (296.0684702)


   

2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanedioic acid

2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanedioic acid

C10H16O10 (296.0743436)


   

2-hydroxy-2-[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]propanedioic acid

2-hydroxy-2-[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]propanedioic acid

C13H12O8 (296.0532152)


   

2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one

C17H12O5 (296.0684702)