Exact Mass: 296.0322
Exact Mass Matches: 296.0322
Found 399 metabolites which its exact mass value is equals to given mass value 296.0322,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Enilconazole
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
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
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
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
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
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
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-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
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
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
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
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].
5,5',6,6'-Tetrahydroxy-3,3'-biindolyl
3,3-Bi-1H-indole-5,5,6,6-tetrol is found in root vegetables. 3,3-Bi-1H-indole-5,5,6,6-tetrol is a constituent of beetroot peel, Beta vulgaris. A polyphenol compound found in foods of plant origin (PhenolExplorer).
N-Acetyldjenkolic acid
N-Acetyldjenkolic acid is isolated from Acacia farnesiana (sweet acacia
5-Hydroxy-4-methoxy-3-methyl-2,6-canthinedione
5-Hydroxy-4-methoxy-3-methyl-2,6-canthinedione is an alkaloid from the wood of Quassia amara (Surinam quassia).
Phenytoin methylcatechol
Phenytoin methylcatechol is a metabolite of phenytoin. Phenytoin sodium is a commonly used antiepileptic. Phenytoin acts to suppress the abnormal brain activity seen in seizure by reducing electrical conductance among brain cells by stabilizing the inactive state of voltage-gated sodium channels. Aside from seizures, it is an option in the treatment of trigeminal neuralgia in the event that carbamazepine or other first-line treatment seems inappropriate. It is sometimes considered a class 1b antiarrhythmic. (Wikipedia)
(2s)-2-[6-(Sulfooxy)naphthalen-2-yl]propanoic acid
Fenclofenac
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
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
Anhydropisatin
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
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.
(1alpha,3beta,5beta)-(-)-2-(3-Bromo-2,2,5-trimethylcyclopentyl)-5-methylphenol
Mono-trans-p-coumaroylmesotartaric acid
8-chloro-2-phenyl-6-(trifluoromethyl)imidazo[1,2-a]pyridine
2-(1,3-Benzothiazol-2-yl)-3-(4-chlorophenyl)acrylonitrile
1-(4-chlorophenyl)-N-(pyridin-3-ylmethyl)methanesulfonamide
Flunixin Meglumine
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
4,6-dichloro-3,7-dihydroxy-1,9-dimethyldibenzofuran
2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-carbaldehyde
(1S*,2R*,4R*,5R*,6R*,8R*)-4-bromo-2,5,6-trimethyl-11-methylenetricyclo<6.2.1.01,6>undecan-3-one|(1S*,2R*,4R*,5R*,6R*,8R*)-4-bromo-2,5,6-trimethyl-11-methylenetricyclo[6.2.1.01,6]undecan-3-one
1-(1-chloroethyl)-4-oxocyclopent-2-enyl 3-(3-oxocyclopent-1-enyl)propanoate|trichodermone B
(2S)-2-[(beta-D-Glucopyranosyl)oxy]butanedioic acid
7-hydroxy-3-[6-hydroxyphenyl-2-oxo-ethyl]chromone|terminalianone
(rel-1S,2R,6R,8S,9R)-8-bromo-2,5,6,9-tetramethyltricyclo[7.2.0.01,6]undec-4-en-3-one
6-O-(1-L-maloyl)-alpha/beta-D-glucopyranose|veracylglucan A
(1E,3E,5S,6S)-2-acetoxymethyl-1,5,6-trichloro-6-methyl-octa-1,3,7-triene
6-(2-Hydroxy-3-methyl-3-chlorobutyl)-7-methoxy-2H-1-benzopyran-2-one
Flunixine
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
3-(2,3-Dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-chromen-2-one
MLS001076475-01!TETRAETHYLTHIURAM DISULFIDE97-77-8
Aspulvinone E - Yellow pigment - Found in Aspergillus
Imazalil
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.
Trifluridine
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
5-Hydroxy-4-methoxy-3-methyl-2,6-canthinedione
N-Methoxyspirobrassinol methyl ether
tert-Butyl 4-bromo-1H-pyrrolo[2,3-c]pyridine-1-carboxylate
1-(4-(trifluoromethoxy)phenyl) piperazin-2-one hydrochloride
2-(6-CHLORO-4-ETHYL-2-OXO-2H-CHROMEN-7-YLOXY)-PROPIONIC ACID
4-Thiazolidinone,3-methyl-5-[2-(4-nitrophenyl)diazenyl]-2-thioxo-
2-(5-bromo-2-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
3,5-DICHLORO-5-METHOXY-[1,1-BIPHENYL]-3-CARBOXYLIC ACID
Octamethylcyclotetrasiloxane
D001697 - Biomedical and Dental Materials D007155 - Immunologic Factors
1-(4-CHLOROPHENYL)-2,2,3,3,3-PENTAFLUORO-PROPAN-1-ONE
(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
2-(3-methoxycarbonylphenyl)-3H-benzimidazole-5-carboxylic acid
7-Chloro-2-(3-(trifluoromethyl)phenyl)pyrazolo[1,5-a]pyridine
4-Chloro-2-(4-chloro-phenyl)-pyrimidine-5-carboxylic acid ethyl ester
Benzeneacetic acid,2-chloro-a-(2-chlorophenyl)-a-hydroxy-
5-BROMO-3-METHYL-N-CYCLOHEXYLPYRIDINE-2-CARBOXAMIDE
TERT-BUTYL 5-BROMO-1H-PYRROLO[2,3-B]PYRIDINE-1-CARBOXYLATE
5-(2-BROMO-5-FLUOROPHENYL)-1-(TERT-BUTYL)-1H-PYRAZOLE
1-(3-bromophenyl)-4-oxocyclohexane-1-carboxylic acid
6-[(2-chloro-6-nitrophenyl)methylamino]-1H-pyrimidine-2,4-dione
2-(3-chlorophenyl)-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
2-(4-(Bromomethyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
4-Chloro-7-(2-chloroethoxy)-6-methoxy-3-quinolinecarbonitrile
1-[4-(3-TRIFLUOROMETHOXY-PHENOXY)-PHENYL]-ETHANONE
1-[4-(4-TRIFLUOROMETHOXY-PHENOXY)-PHENYL]-ETHANONE
3-(4-ACETYL-PHENYL)-2-MERCAPTO-3H-QUINAZOLIN-4-ONE
tert-Butyl 4-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
Benzo[b]thiophene-2-carboximidamide, 6-(benzoyloxy)-
1-(3-(TRIFLUOROMETHOXY)PHENYL) PIPERAZIN-2-ONE HYDROCHLORIDE
ETHYL5-BROMO-1-(PYRIMIDIN-2-YL)-1H-PYRAZOLE-4-CARBOXYLATE
1-[7-AMINO-5-(2-BROMOPROPYL)-2,3-DIHYDRO-1H-INDOL-1-YL]ETHANONE
(1-(N,N-DIMETHYLSULFAMOYL)-3-(PYRIDIN-2-YL)-1H-PYRAZOL-4-YL)BORONIC ACID
methyl (Z)-3-(1-chloro-3,4-dihydronaphthalen-2-yl)-2-(chloromethyl)prop-2-enoate
methyl (2Z,4Z,6E)-5-chloro-2-(chloromethyl)-7-phenylhepta-2,4,6-trienoate
2-(4-bromophenyl)-1-(4-methylpiperazin-1-yl)ethanone
CIS-3-(8-AMINO-1-BROMOIMIDAZO[1,5-A]PYRAZIN-3-YL)-1-METHYLCYCLOBUTANOL
2-[(3-METHYLBENZO[B]THIOPHEN-2-YL)CARBONYL]BENZOIC ACID
2,2-dimethyl-6,6,7,7,8,8,8-heptafluoro-3,5-octanedione
2,4,6-Cycloheptatrien-1-one,3-[3-(1,3-benzodioxol-5-yl)-1-oxo-2-propen-1-yl]-2-hydroxy-
7-Chloro-2-(4-(trifluoromethyl)phenyl)pyrazolo[1,5-a]pyridine
ethyl 4-chloro-6,7-dimethoxyquinazoline-2-carboxylate
tert-butyl 3-bromo-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
2,6-Diamino-4-pyrimidinyl p-Toluenesulfonate 3-Oxide
2-Sulfo-1,4-benzenedicarboxylic acid 1,4-dimethyl ester sodium salt
2,3-dimethyl-6-(4-(trifluoromethyl)phenyl)imidazo[2,1-b]thiazole
2-Deoxy-2,2-difluoro-D-erythro-pentofuranose triacetate
[(6-METHYL-BENZOTHIAZOL-2-YLCARBAMOYL)-METHYLSULFANYL]-ACETIC ACID
[4-[(2,6-dichlorophenyl)methoxy]phenyl]boronic acid
[2-[(2,6-dichlorophenyl)methoxy]phenyl]boronic acid
[4-[(3,4-dichlorophenyl)methoxy]phenyl]boronic acid
8-bromo-7-(but-2-ynyl)-3-methyl-1H-purine-2,6(3H,7H)-dione
6-BROMOSPIRO[BENZO[E][1,3]OXAZINE-2,4-PIPERIDIN]-4(3H)-ONE
9,10-difluoro-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline,dihydrochloride
Z-3-Chloro-1-(2-chlorophenyl)-2-(4-fluorophenyl)-oxirane
2-(5,6-dihydroxy-1H-indol-2-yl)-1H-indole-5,6-diol
[5,7-Bis(trifluoromethyl)-1,8-naphthyridin-2-yl]hydrazine
1,3-Dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid phenyl ester
4-[(3-Mercapto-5-phenyl-[1,2,4]triazol-4-ylimino)-methyl]-phenol
4-(4-Chlorophenyl)sulfinyl-6-(methoxymethyl)-2-methylpyrimidine
2-[(5Z)-5-[(1-methylpyrrol-2-yl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoic acid
Fenclofenac
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-)
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
3-(3-Carboxy-5-hydroxy-2H-1,4-benzothiazine-7-yl)alanine
3-(3-Carboxy-5-hydroxy-2H-1,4-benzothiazine-8-yl)alanine
2-(5,6-dihydroxy-1H-indol-4-yl)-1H-indole-5,6-diol
2-(5,6-dihydroxy-1H-indol-7-yl)-1H-indole-5,6-diol
(2S)-2-hydroxy-4-oxo-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid
[(2R,3S,4R,5R)-5-(4-amino-1H-imidazol-3-ium-3-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
2-(4-Chlorophenyl)-6-(methylthio)-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile
N-(3-chloro-4-methoxyphenyl)-4,6-dimethoxy-1,3,5-triazin-2-amine
9-methyl-5H-quinolino[8,7-c][1,2]benzothiazine 6,6-dioxide
Isoaspulvinone E
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
4-[[5-(1-Naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]-2-butyn-1-ol
2-[(4-Oxo-2-phenyl-1-benzopyran-3-yl)oxy]acetic acid
3-(2-Furanyl)-2-methylsulfonyl-5-thiophen-2-yl-3,4-dihydropyrazole
4-[5-(3-Methoxyphenyl)-1,2,4-oxadiazol-3-yl]benzoic acid
4-[5-(2-Methoxyphenyl)-1,2,4-oxadiazol-3-yl]benzoic acid
(2R,3S)-cis-coutaric acid
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.
4-[5-(4-Methoxyphenyl)-1,2,4-oxadiazol-3-yl]benzoic acid
2-tert-butyl-4-[(4-chlorophenyl)thio]-5-methyl-1H-pyrazol-3-one
3-phenyl-5-[3-(trifluoromethyl)-1H-pyrazol-1-yl]-1,2,4-thiadiazole
N-[(E)-(3-phenyl-4-pyrazolylidene)methyl]-2-thiophenecarbohydrazide
[(3aR,4S,9bS)-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
Methyl 2-(6-hydroxy-5,7,8-trimethyl-2-oxo-1,4-benzoxathiin-3-yl)acetate
7-(2-amino-2-carboxyethyl)-5-hydroxy-2H-1,4-benzothiazine-3-carboxylic acid
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
2-[(2-oxo-2H-chromen-7-yl)oxy]-2-phenylacetic acid
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-hydroxy-2H-chromen-2-one
1-(p-Chlorophenyl)-2,2-dichloro-2-trimethylsilylethanol
5,5,6,6-Tetrahydroxy-3,3-biindolyl
A hydroxyindole that is 1H-indole-5,6-diol substituted by a 5,6-dihydroxy-1H-indol-3-yl group at position 3.
(2s)-2-[6-(Sulfooxy)naphthalen-2-yl]propanoic acid
4-amino-2-methyl-5-diphosphonatooxymethylpyrimidine(3-)
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-)
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
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
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
(2s)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanedioic acid
5,7-dihydroxy-3-methoxy-2-phenylnaphthalene-1,4-dione
(2r,3s)-2-bromo-1,1-dimethyl-5,9-dimethylidenespiro[5.5]undec-7-en-3-ol
4-bromo-2,5,6-trimethyl-11-methylidenetricyclo[6.2.1.0¹,⁶]undecan-3-one
(2r,3s,6r)-2-bromo-1,1-dimethyl-5,9-dimethylidenespiro[5.5]undec-7-en-3-ol
3-hydroxy-4-oxo-4-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]butanoic acid
10-bromo-3,7,11,11-tetramethylspiro[5.5]undeca-3,7,9-trien-1-ol
1-acetyl-4,5-dihydroxy-2-methylanthracene-9,10-dione
2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}butanedioic acid
2-hydroxy-2-[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]propanedioic acid
(2s,3s,9s)-3-bromo-2-ethyl-9-(pent-2-en-4-yn-1-yl)-2,3,6,7,8,9-hexahydrooxonine
2-(7-methoxy-2h-1,3-benzodioxol-5-yl)chromen-4-one
6-(3-chloro-2-hydroxy-3-methylbutyl)-7-methoxychromen-2-one
[4-(4-bromo-3,3-dimethylcyclohexyl)phenyl]methanol
3',4'-methylenedioxy-7-methoxyflavone
{"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
{"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"}
