Exact Mass: 296.0595

Exact Mass Matches: 296.0595

Found 155 metabolites which its exact mass value is equals to given mass value 296.0595, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

disulfiram

Disulfiram (Antabuse)

C10H20N2S4 (296.0509)


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 (296.0532)


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 (296.0685)


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.

   

Disulfiram

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

C10H20N2S4 (296.0509)


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 (296.0532)


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 (296.0532)


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 (296.0653)


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 (296.0685)


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.

   

Trifluridine

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

C10H11F3N2O5 (296.062)


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 (296.0501)


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

   

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 (296.0685)


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.

   

5-Hydroxy-7-acetoxyflavone

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

C17H12O5 (296.0685)


   

Coneuplectin

Coneuplectin

C17H12O5 (296.0685)


   

4-Acetylchrysophanol

4-Acetylchrysophanol

C17H12O5 (296.0685)


   

3-methoxy-4,5-methylenedioxyflavone

3-methoxy-4,5-methylenedioxyflavone

C17H12O5 (296.0685)


   

Haloquinone

Haloquinone

C17H12O5 (296.0685)


   

Aristolic acid

Aristolic acid

C17H12O5 (296.0685)


   

Aristolide A

Aristolide A

C17H12O5 (296.0685)


   

2,5-Dihydroxyflavone 5-acetate

2,5-Dihydroxyflavone 5-acetate

C17H12O5 (296.0685)


   

Coutaric acid

Coutaric acid

C13H12O8 (296.0532)


   

Caffeoylmalic acid

Caffeoylmalic acid

C13H12O8 (296.0532)


   

Mono-trans-p-coumaroylmesotartaric acid

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

C13H12O8 (296.0532)


   

Milleyanaflavone

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

C17H12O5 (296.0685)


   

Unonal

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

C17H12O5 (296.0685)


   

Isounonal

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

C17H12O5 (296.0685)


   

Pseudobaptigenin methyl ether

7-Methoxy-3,4-methylenedioxyisoflavone

C17H12O5 (296.0685)


   

Coumestrol dimethyl ether

3,9-Dimethoxy-6-oxopterocarpene

C17H12O5 (296.0685)


   

5-Methoxy-6,7-methylenedioxyflavone

5-Methoxy-6,7-methylenedioxyflavone

C17H12O5 (296.0685)


   

5-Methoxy-7,8-methylenedioxyflavone

5-Methoxy-7,8-methylenedioxyflavone

C17H12O5 (296.0685)


   

Maximaisoflavone H

4-Methoxy-7,8-methylenedioxyisoflavone

C17H12O5 (296.0685)


   

Anhydropisatin

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

C17H12O5 (296.0685)


   
   

5,7,4-trihydroxy-4-styrylcoumarin

5,7,4-trihydroxy-4-styrylcoumarin

C17H12O5 (296.0685)


   

SCHEMBL13692852

SCHEMBL13692852

C17H12O5 (296.0685)


   

Flemichapparin B

Flemichapparin B

C17H12O5 (296.0685)


   

SCHEMBL5724935

SCHEMBL5724935

C17H12O5 (296.0685)


   

7-acetylchrysophanol

7-acetylchrysophanol

C17H12O5 (296.0685)


   

2-ethoxycarbonyl-1-hydroxyanthraquinone

2-ethoxycarbonyl-1-hydroxyanthraquinone

C17H12O5 (296.0685)


   

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 (296.0685)


   

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

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

C17H12O5 (296.0685)


   

Agrostophyllone

Agrostophyllone

C17H12O5 (296.0685)


   

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

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

C17H12O5 (296.0685)


   

SCHEMBL16432557

SCHEMBL16432557

C17H12O5 (296.0685)


   

Grandiquinone A

Grandiquinone A

C17H12O5 (296.0685)


   

DTXSID40725189

DTXSID40725189

C17H12O5 (296.0685)


   

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

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

C17H12O5 (296.0685)


   
   

DTXSID20420524

DTXSID20420524

C17H12O5 (296.0685)


   

3,4,5-triacetoxybenzoic acid

3,4,5-triacetoxybenzoic acid

C13H12O8 (296.0532)


   
   

SCHEMBL3723343

SCHEMBL3723343

C17H12O5 (296.0685)


   
   

Frutinone B

Frutinone B

C17H12O5 (296.0685)


   

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

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

C9H16N2O7S (296.0678)


   

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

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

C17H12O5 (296.0685)


   

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 (296.0685)


   

Tetraethylthiuram disulfide

Tetraethylthiuram disulfide

C10H20N2S4 (296.0509)


   

MLS001076475-01!TETRAETHYLTHIURAM DISULFIDE97-77-8

MLS001076475-01!TETRAETHYLTHIURAM DISULFIDE97-77-8

C10H20N2S4 (296.0509)


   

Aspulvinone E - Yellow pigment - Found in Aspergillus

Aspulvinone E - Yellow pigment - Found in Aspergillus

C17H12O5 (296.0685)


   

Trifluridine

Trifluorothymidine

C10H11F3N2O5 (296.062)


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 (296.0501)


   

2-O-Feruloyltartronic acid

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

C13H12O8 (296.0532)


   

Gyrocyanin

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

C17H12O5 (296.0685)


   

cis-Coutaric acid

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

C13H12O8 (296.0532)


   

N-Methoxyspirobrassinol methyl ether

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

C13H16N2O2S2 (296.0653)


   

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

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

C11H12ClF3N2O2 (296.0539)


   

4-methylbenzothiophene

4-methylbenzothiophene

C18H16S2 (296.0693)


   

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

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

C17H12O5 (296.0685)


   

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 (296.0583)


   

(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 (296.0692)


   

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

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

C13H17BrN2O (296.0524)


   

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

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

C11H12N4O4S (296.0579)


   

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

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

C13H12O8 (296.0532)


   

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 (296.0583)


   

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

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

C15H11F3O3 (296.066)


   

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

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

C15H11F3O3 (296.066)


   

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

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

C16H12N2O2S (296.0619)


   

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

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

C16H12N2O2S (296.0619)


   

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

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

C11H12ClF3N2O2 (296.0539)


   

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

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

C13H8N6O3 (296.0658)


   

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 (296.0524)


   

Diisobutylthiuram disulfide

Diisobutylthiuram disulfide

C10H20N2S4 (296.0509)


   

1,3-DIPHENYL-2-THIOBARBITURIC ACID

1,3-DIPHENYL-2-THIOBARBITURIC ACID

C16H12N2O2S (296.0619)


   

2-Bromobenzylboronic acid pinacol ester

2-Bromobenzylboronic acid pinacol ester

C13H18BBrO2 (296.0583)


   

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

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

C13H17BrN2O (296.0524)


   

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

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

C16H12N2O2S (296.0619)


   

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

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

C17H12O3S (296.0507)


   

4-Bromobenzylboronic acid pinacol ester

4-Bromobenzylboronic acid pinacol ester

C13H18BBrO2 (296.0583)


   

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 (296.0647)


   

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 (296.0685)


   

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

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

C13H13ClN2O4 (296.0564)


   

(3-Bromomethylphenyl)boronic acid pinacol ester

(3-Bromomethylphenyl)boronic acid pinacol ester

C13H18BBrO2 (296.0583)


   

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

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

C11H12N4O4S (296.0579)


   

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 (296.0595)


   

Bromo-PEG2-C2-Boc

Bromo-PEG2-C2-Boc

C11H21BrO4 (296.0623)


   

P-NITROBENZOYL-L-GLUTAMIC ACID

P-NITROBENZOYL-L-GLUTAMIC ACID

C12H12N2O7 (296.0644)


   

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 (296.0659)


   

(2-Bromomethylphenyl)boronic acid pinacol ester

(2-Bromomethylphenyl)boronic acid pinacol ester

C13H18BBrO2 (296.0583)


   

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

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

C10H6F6N4 (296.0497)


   

p-Coutaric acid

p-Coutaric acid

C13H12O8 (296.0532)


   

(R)-4-phosphonatopantothenate(3-)

(R)-4-phosphonatopantothenate(3-)

C9H15NO8P-3 (296.0535)


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

   

trans-Coutaric acid

trans-Coutaric acid

C13H12O8 (296.0532)


   

[(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+ (296.0648)


   

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 (296.0676)


   

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 (296.0619)


   

Isoaspulvinone E

Isoaspulvinone E

C17H12O5 (296.0685)


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.

   

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 (296.0619)


   

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 (296.0685)


   

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

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

C13H12O8 (296.0532)


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.

   

Pharmakon1600-01504183

Pharmakon1600-01504183

C10H11F3N2O5 (296.062)


   

[(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 (296.0524)


   

[(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 (296.0524)


   

[(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+ (296.0648)


   

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

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

C17H12O5 (296.0685)


   

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 (296.0685)


   

Phaselic acid

Phaselic acid

C13H12O8 (296.0532)


   

(R)-4-phosphonatopantothenate(3-)

(R)-4-phosphonatopantothenate(3-)

C9H15NO8P (296.0535)


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

   

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

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

C13H12O8 (296.0532)


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 (296.0532)


   

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

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

C17H12O5 (296.0685)


   

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

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

C17H12O5 (296.0685)


   

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 (296.0532)


   

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 (296.0685)


   

3',4'-methylenedioxy-7-methoxyflavone

NA

C17H12O5 (296.0685)


{"Ingredient_id": "HBIN007502","Ingredient_name": "3',4'-methylenedioxy-7-methoxyflavone","Alias": "NA","Ingredient_formula": "C17H12O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14369","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

aristololide; 9,10β-dihydro

NA

C17H12O5 (296.0685)


{"Ingredient_id": "HBIN016824","Ingredient_name": "aristololide; 9,10\u03b2-dihydro","Alias": "NA","Ingredient_formula": "C17H12O5","Ingredient_Smile": "NA","Ingredient_weight": "296.27","OB_score": "NA","CAS_id": "205241-14-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "6655","PubChem_id": "NA","DrugBank_id": "NA"}

   

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

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

C13H16N2O2S2 (296.0653)


   

(2s)-2-amino-4-{[(1r)-1-carboxy-2-methanesulfonylethyl]-c-hydroxycarbonimidoyl}butanoic acid

(2s)-2-amino-4-{[(1r)-1-carboxy-2-methanesulfonylethyl]-c-hydroxycarbonimidoyl}butanoic acid

C9H16N2O7S (296.0678)


   

(12r)-16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaene

(12r)-16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaene

C17H12O5 (296.0685)


   

(11r)-14-methoxy-3,5,10-trioxapentacyclo[9.7.1.0²,⁶.0⁸,¹⁹.0¹³,¹⁸]nonadeca-1(19),2(6),7,13(18),14,16-hexaen-9-one

(11r)-14-methoxy-3,5,10-trioxapentacyclo[9.7.1.0²,⁶.0⁸,¹⁹.0¹³,¹⁸]nonadeca-1(19),2(6),7,13(18),14,16-hexaen-9-one

C17H12O5 (296.0685)


   

3-methoxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

3-methoxy-1-methyl-9,10-dioxoanthracene-2-carboxylic acid

C17H12O5 (296.0685)


   

5,7-dihydroxy-4-[2-(4-hydroxyphenyl)ethenyl]chromen-2-one

5,7-dihydroxy-4-[2-(4-hydroxyphenyl)ethenyl]chromen-2-one

C17H12O5 (296.0685)


   

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

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

C17H12O5 (296.0685)


   

1-hydroxy-3-methoxy-10h-5,11-dioxatetraphen-12-one

1-hydroxy-3-methoxy-10h-5,11-dioxatetraphen-12-one

C17H12O5 (296.0685)


   

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

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

C13H12O8 (296.0532)


   

(2r,3r)-1,2-dimethoxy-5'-(methylsulfanyl)-2h,3'h-spiro[indole-3,2'-[1,4]thiazole]

(2r,3r)-1,2-dimethoxy-5'-(methylsulfanyl)-2h,3'h-spiro[indole-3,2'-[1,4]thiazole]

C13H16N2O2S2 (296.0653)


   

ethyl 1-hydroxy-9,10-dioxoanthracene-2-carboxylate

ethyl 1-hydroxy-9,10-dioxoanthracene-2-carboxylate

C17H12O5 (296.0685)


   

(3e)-3-(2h-1,3-benzodioxol-5-ylmethylidene)-7-hydroxy-2h-1-benzopyran-4-one

(3e)-3-(2h-1,3-benzodioxol-5-ylmethylidene)-7-hydroxy-2h-1-benzopyran-4-one

C17H12O5 (296.0685)


   

2-amino-4-[(1-carboxy-2-methanesulfonylethyl)-c-hydroxycarbonimidoyl]butanoic acid

2-amino-4-[(1-carboxy-2-methanesulfonylethyl)-c-hydroxycarbonimidoyl]butanoic acid

C9H16N2O7S (296.0678)


   

2-acetyl-1,8-dihydroxy-6-methylanthracene-9,10-dione

2-acetyl-1,8-dihydroxy-6-methylanthracene-9,10-dione

C17H12O5 (296.0685)


   

16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaene

16-methoxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0²,¹⁰.0⁴,⁸.0¹³,¹⁸]icosa-1(20),2,4(8),9,13,15,17-heptaene

C17H12O5 (296.0685)


   

5,11-dihydroxy-2-methyl-8h,9h-indeno[5,6-h]chromene-4,10-dione

5,11-dihydroxy-2-methyl-8h,9h-indeno[5,6-h]chromene-4,10-dione

C17H12O5 (296.0685)


   

3-(2h-1,3-benzodioxol-5-ylmethylidene)-7-hydroxy-2h-1-benzopyran-4-one

3-(2h-1,3-benzodioxol-5-ylmethylidene)-7-hydroxy-2h-1-benzopyran-4-one

C17H12O5 (296.0685)


   

3-acetyl-1,8-dihydroxy-2-methylphenanthrene-9,10-dione

3-acetyl-1,8-dihydroxy-2-methylphenanthrene-9,10-dione

C17H12O5 (296.0685)


   

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

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

C13H12O8 (296.0532)


   

2-[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxybutanedioic acid

2-[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxybutanedioic acid

C13H12O8 (296.0532)


   

(2z)-5-hydroxy-4-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]furan-3-one

(2z)-5-hydroxy-4-(4-hydroxyphenyl)-2-[(4-hydroxyphenyl)methylidene]furan-3-one

C17H12O5 (296.0685)


   

(2r)-2-[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxybutanedioic acid

(2r)-2-[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]-2-hydroxybutanedioic acid

C13H12O8 (296.0532)


   

(5e)-4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one

(5e)-4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one

C17H12O5 (296.0685)


   

2-acetyl-1,8-dihydroxy-3-methylanthracene-9,10-dione

2-acetyl-1,8-dihydroxy-3-methylanthracene-9,10-dione

C17H12O5 (296.0685)


   

2,3-dihydroxy-2-[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]butanedioic acid

2,3-dihydroxy-2-[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]butanedioic acid

C13H12O8 (296.0532)


   

9-methoxy-6-phenyl-2h-[1,3]dioxolo[4,5-g]chromen-8-one

9-methoxy-6-phenyl-2h-[1,3]dioxolo[4,5-g]chromen-8-one

C17H12O5 (296.0685)


   

5,7-dihydroxy-4-[(1e)-2-(4-hydroxyphenyl)ethenyl]chromen-2-one

5,7-dihydroxy-4-[(1e)-2-(4-hydroxyphenyl)ethenyl]chromen-2-one

C17H12O5 (296.0685)


   

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

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

C13H12O8 (296.0532)


   

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

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

C13H12O8 (296.0532)


   

4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one

4-hydroxy-3-(4-hydroxyphenyl)-5-[(4-hydroxyphenyl)methylidene]furan-2-one

C17H12O5 (296.0685)