Exact Mass: 326.0193
Exact Mass Matches: 326.0193
Found 233 metabolites which its exact mass value is equals to given mass value 326.0193,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
5-Fluorodeoxyuridine monophosphate
5-Fluorodeoxyuridine monophosphate is a metabolite of floxuridine. Floxuridine (also 5-fluorodeoxyuridine) is an oncology drug that belongs to the class known as antimetabolites. The drug is most often used in the treatment of colorectal cancer. (Wikipedia)
Gliotoxin
Gliotoxin is a pyrazinoindole with a disulfide bridge spanning a dioxo-substituted pyrazine ring; mycotoxin produced by several species of fungi. It has a role as a mycotoxin, an immunosuppressive agent, an EC 2.5.1.58 (protein farnesyltransferase) inhibitor, a proteasome inhibitor and an antifungal agent. It is an organic disulfide, a pyrazinoindole, an organic heterotetracyclic compound and a dipeptide. Gliotoxin is a natural product found in Streptomyces, Aspergillus cejpii, and other organisms with data available. Gliotoxin is a sulfur-containing antibiotic produced by several species of fungi, some of which are pathogens of humans such as Aspergillus, and also by species of Trichoderma, and Penicillium. Gliotoxin possesses immunosuppressive properties as it may suppress and cause apoptosis in certain types of cells of the immune system, including neutrophils, eosinophils, granulocytes, macrophages, and thymocytes. (L1941) A fungal toxin produced by various species of Trichoderma, Gladiocladium fimbriatum, Aspergillus fumigatus, and Penicillium. It is used as an immunosuppressive agent. A pyrazinoindole with a disulfide bridge spanning a dioxo-substituted pyrazine ring; mycotoxin produced by several species of fungi. D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins C308 - Immunotherapeutic Agent > C574 - Immunosuppressant
Niclosamide
Niclosamide is used for the treatment of most tapeworm infections. Helminths (worms) are multicellular organisms that infect very large numbers of humans and cause a broad range of diseases. Over 1 billion people are infected with intestinal nematodes, and many millions are infected with filarial nematodes, flukes, and tapeworms. They are an even greater problem in domestic animals. P - Antiparasitic products, insecticides and repellents > P02 - Anthelmintics > P02D - Anticestodals > P02DA - Salicylic acid derivatives D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D010575 - Pesticides > D008975 - Molluscacides D016573 - Agrochemicals Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Fertaric acid
Fertaric acid is a the ester of tartaric acid and the phenolic acid ferulic acid, a type of polyphenol. Polyphenol are secondary plant metabolites and components of grapes, wines and beers. They contribute to the sensory characteristics of wine. Yeast can influence the polyphenolic wine composition by adsorbing them throught its cell wall during wine making. [Caridi 2004]
Iberin-N-acetyl-cysteine
(2R)-2-{(1R)-2-Oxo-1-[(2-thienylacetyl)amino]ethyl}-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid
Gliotoxin
5'-Fluoro-2'-deoxyuridine monophosphate
Fluorodeoxyuridine monophosphate
Feruloyltartaric acid
Feruloyltartaric acid, also known as trans-fertaric acid or feruloyltartarate, belongs to coumaric acids and derivatives class of compounds. Those are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. Feruloyltartaric acid is practically insoluble (in water) and a moderately acidic compound (based on its pKa). Feruloyltartaric acid can be found in common grape, grape wine, sherry, and vinegar, which makes feruloyltartaric acid a potential biomarker for the consumption of these food products.
1,11-Dihydroxy-9,10-methylenedioxy-6a,12a-didehydrorotenone
Pyrithiobac
CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4676; ORIGINAL_PRECURSOR_SCAN_NO 4672 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4673; ORIGINAL_PRECURSOR_SCAN_NO 4671 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4704; ORIGINAL_PRECURSOR_SCAN_NO 4702 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4691; ORIGINAL_PRECURSOR_SCAN_NO 4686 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4777; ORIGINAL_PRECURSOR_SCAN_NO 4775 ORIGINAL_ACQUISITION_NO 4777; CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 4775 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4684; ORIGINAL_PRECURSOR_SCAN_NO 4679 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9063; ORIGINAL_PRECURSOR_SCAN_NO 9062 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9090; ORIGINAL_PRECURSOR_SCAN_NO 9088 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9119; ORIGINAL_PRECURSOR_SCAN_NO 9117 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9108; ORIGINAL_PRECURSOR_SCAN_NO 9106 CONFIDENCE standard compound; INTERNAL_ID 400; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9136; ORIGINAL_PRECURSOR_SCAN_NO 9132
3,5,7-Ttrihydroxylchromone 3-O-??-D-xylopyranoside
3,4,3,4-bis(O,O-methylene)ellagic acid|[1,3]dioxolo[6,7][2]benzopyrano[5,4,3-cde]-1,3-dioxolo[4,5-g][2]benzopyran-5,11-dione
(2R,2S,4S)-gamma-Glutamylmarasmine|gamma-Glutamylmarasmine
(-)-[(3SR,3aSR,8bSR)-7-bromo-1,2,3,8b-tetrahydro-3,6,8b-trimethyl-3aH-benzo[b]cyclopenta[d]furan-3a-yl]methyl hydroperoxide|laureperoxide
(-)-3-O-galloylshikimic acid|(-)-shikimic acid 3-O-gallate|3-O-galloyl shikimic acid|3-O-galloyl-(-)-shikimic acid|3-O-Galloylshikimic acid|5-O-galloylshikimic acid|shikimic acid 5-O-gallate
4-O-galloyl-(-)-shikimic acid|4-O-Galloylshikimic acid
5H-Phenanthro(4,5-bcd)pyran-5,9,10-trione, 1,8-dihydroxy-2-methoxy-6-methyl-
Ethyl 2-(2-pyridyl)-4-(bromomethyl)-thiazole-5-carboxylate
niclosamide
P - Antiparasitic products, insecticides and repellents > P02 - Anthelmintics > P02D - Anticestodals > P02DA - Salicylic acid derivatives D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D010575 - Pesticides > D008975 - Molluscacides D016573 - Agrochemicals Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; EAWAG_UCHEM_ID 3320
Tris(1-chloro-2-propyl)phosphate
CONFIDENCE standard compound; INTERNAL_ID 2470 CONFIDENCE standard compound; INTERNAL_ID 8810
6-(2-CHLORO-5-(TRIFLUOROMETHYL)PHENYL)-1-PHENYL-2-THIOBIUREA
ethyl-2-(2-pyridyl)-4-(bromomethyl)-Thiazole-5-Carboxylate
N-(2-bromophenyl)piperidin-4-amine,dihydrochloride
Methyl 2-bromo-3-[4-(trifluoromethoxy)phenyl]-propionate
METHYL 3-([[3-(TRIFLUOROMETHYL)PHENYL]THIO]METHYL)BENZOATE
3-bromo-4-(4-propan-2-ylpiperazin-1-yl)benzoic acid
3-bromo-4-[(4-ethylpiperazin-1-yl)methyl]benzoic acid
methyl 3-bromo-4-[(3-methylpiperazin-1-yl)methyl]benzoate
4-Boc-7-Bromo-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine
Pyridinium, 1-[2-oxo-2-(2-pyridinyl)ethyl]-, iodide
(6Z,6Z)-6,6-{1,2-Ethanediylbis[imino(Z)methylylidene]}bis(2,4-c yclohexadien-1-one) - nickel (1:1)
calcium; (E)-4-ethoxy-4-oxo-but-2-enoic acid; hydrogen(-1) anion
N-(5-CHLORO-2-METHYL-4-NITROPHENYL)-BENZENESULFONAMIDE
ethyl 2-[5,6-dichloro-2-(cyanoamino)-4H-quinazolin-3-yl]acetate
p-[[(4-chlorobutyl)sulphonyl]amino]benzenesulphonamide
tert-Butyl (6-bromofuro[3,2-b]pyridin-2-yl)methylcarbamate
[4-(6-acetyloxy-1-benzothiophen-2-yl)phenyl] acetate
N-(5-bromopyridin-3-yl)-4-methylbenzenesulfonamide
ETHYL 2-AMINO-4-(4-BROMOPHENYL)THIAZOLE-5-CARBOXYLATE
1-chloro-4-(diethoxyphosphorylsulfanylmethylsulfanyl)benzene
4-(4-ISOBUTYLPHENYL)-5-METHYL-1,3-THIAZOL-2-AMINE HYDROBROMIDE
2-Boc-5-bromo-1,2,3,4-tetrahydroisoquinolin-8-amine
3-(2-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
3-(3-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
3-(4-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
4-CHLORO-2-[2-PHENYLVINYL]-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDINE
4,6-DIPHENYLTHIENO[3,4-D]-1,3-DIOXOL-2-ONE 5,5-DIOXIDE
2-IODOMETHYL-CYCLOPROPANE-1,1-DICARBOXYLIC ACID DIETHYL ESTER
3-(4-Bromophenyl)-1-Phenyl-1H-Pyrazole-4-Carbaldehyde
2-(4-(2-Bromoethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-(3-(2-Bromoethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-(6-Bromobenzo[d][1,3]dioxol-4-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-(3-Bromo-5-ethoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
2-CHLORO-N-{4-[(PYRIMIDIN-2-YLAMINO)SULFONYL]PHENYL}ACETAMIDE
Dimethyl [2-oxo-3-[3-(trifluoromethyl)phenoxy]propyl]phosphonate
4-Bromo-1-{[2-(trimethylsilyl)ethoxy]methyl}-1H-pyrrolo[2,3-b]pyr idine
5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]pyrazole-3-carboxylic acid
ethyl 1-(3,4-dichlorophenyl)-4,5-dihydrofuro[2,3-c]pyrazole-3-carboxylate
2-(4-BROMOBUTYL)-5-NITRO-1H-ISOINDOLE-1,3(2H)-DIONE
METHYL 4-(TRIFLUOROMETHYL)-6-(THIOPHEN-2-YL)-1H-PYRROLO[2,3-B]PYRIDINE-2-CARBOXYLATE
7-(4-methylsulfanylphenyl)-5-thiophen-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
N,N-Dinitroso-p-phenylenediamine-N,N-diacetic Acid
Poly(3,4-ethylenedioxythiophene)-poly(styrenesulfonate)
Methyl 5-broMo-2-(2-Methoxy-2-oxoethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylate
Methyl 6-broMo-2-(2-Methoxy-2-oxoethyl)-1H-pyrrolo[2,3-b]pyridine-3-carboxylate
ethyl 2-(aMinoMethyl)-6-broMo-5-hydroxy-1-Methyl-1H-indole-3-carboxylate
N-(6-iodoquinolin-4-yl)diazenyl-N-methyl-methanamine
Methyl 2-(4-bromophenyl)-5,8-dioxaspiro[3.4]octane-2-carboxylate
5,7-bis(trifluoromethyl)-3-cyano-2-(methylthio)pyrazolo[1,5-a]pyrimidine
(2R)-2-[4-(2,4-dichlorophenoxy)phenoxy]propanoic acid
2-[[(4-Chlorophenyl)sulfonyl](2-pyridinyl)amino]acetic acid
4-(1-Methyltetrazol-5-yl)sulfanyl-5-phenylthieno[2,3-d]pyrimidine
(2S)-2-(4-(2,4-Dichlorophenoxy)phenoxy)propanoic acid
4-(2,6-Dichlorostyryl)-6,6-dimethyl-2-(methylsulfanyl)-1,6-dihydropyrimidine
2-[(4-Chlorophenyl)methyl]-4-(prop-2-enylthio)quinazoline
2,5-Dichloro-1,3,6-trihydroxy-8-methyl-9H-xanthen-9-one
Acetic acid, 2-(2,4,5-trichlorophenoxy)-, trimethylsilyl ester
4-(Aminosulfonyl)-N-[(2,4-difluorophenyl)methyl]-benzamide
4-(Aminosulfonyl)-N-[(2,5-difluorophenyl)methyl]-benzamide
(2R)-2-{(1R)-2-Oxo-1-[(2-thienylacetyl)amino]ethyl}-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid
10H-3,10a-Epidithiopyrazino[1,2-a]indole-1,4-dione, 2,3,5a,6-tetrahydro-6-hydroxy-3-(hydroxymethyl)-2-methyl-, [3R-(3alpha,5abeta,6beta,10aalpha)]-
(7S,8S)-7-hydroxy-11-(hydroxymethyl)-15-methyl-12,13-dithia-9,15-diazatetracyclo[9.2.2.01,9.03,8]pentadeca-3,5-diene-10,14-dione
2-amino-4,6-dimethyl-3-oxo-3H-phenoxazine-1,9-dicarboxylate
[5-(2,4-Dioxopyrimidin-1-yl)-5-fluoro-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate
[[5-(2,4-Dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]-fluoromethyl] dihydrogen phosphate
2-[2-oxo-1-[(2-thiophen-2-ylacetyl)amino]ethyl]-5,6-dihydro-2H-1,3-thiazine-4-carboxylic acid
2-(4-Benzofuro[3,2-d]pyrimidinylthio)-1-thiophen-2-ylethanone
(2S,3S)-trans-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of trans-ferulic acid with one of the hydroxy groups of D-tartaric acid.
3-Chloro-1-(2-chlorophenyl)-4-(4-morpholinyl)pyrrole-2,5-dione
4-[2,3,5,6-Tetrafluoro-4-(1-propen-1-yl)phenoxy]benzoic acid
(5E)-5-benzylidene-1-(4-fluorobenzoyl)-2-sulfanylideneimidazolidin-4-one
3-(4-Fluorophenyl)-6-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
N-(3-cyano-2-thiophenyl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]acetamide
1,1-Difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonic acid
(2R,3R)-cis-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of cis-ferulic acid with one of the hydroxy groups of L-tartaric acid.
(2S,3S)-cis-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of cis-ferulic acid with one of the hydroxy groups of D-tartaric acid.
2-(1,3-Benzothiazol-2-yl)-4-chloro-3-oxo-4-phenylbutanenitrile
2-(6-Carboxy-3,4,5-trihydroxyoxan-2-yl)oxy-3-hydroxybutanedioic acid
[1-(7-Hydroxy-2-oxochromen-8-yl)-3-methylbut-3-en-2-yl] hydrogen sulate
(2R,3R)-trans-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of trans-ferulic acid with one of the hydroxy groups of L-tartaric acid.
2,4,18-trihydroxy-7,9,13-trioxapentacyclo[10.8.0.0³,¹⁰.0⁴,⁸.0¹⁴,¹⁹]icosa-1,3(10),5,11,14,16,18-heptaen-20-one
(2-methylpropoxy)[(2-{[(2-methylpropoxy)methanethioyl]sulfanyl}ethyl)sulfanyl]methanethione
3a-chloro-6a-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-4-hydroxy-tetrahydrocyclopenta[c]furan-1-one
3,5,10,13,15,20-hexaoxahexacyclo[9.9.2.0²,⁶.0⁸,²¹.0¹²,¹⁶.0¹⁸,²²]docosa-1(21),2(6),7,11(22),12(16),17-hexaene-9,19-dione
2,4-dichloro-1,3,6-trihydroxy-8-methylxanthen-9-one
5,10-dihydroxy-4-(hydroxymethyl)-1h-anthra[1,2-c]furan-3,6,11-trione
3,5,7-ttrihydroxylchromone 3-o-β-d-xylopyra-noside
{"Ingredient_id": "HBIN007586","Ingredient_name": "3,5,7-ttrihydroxylchromone 3-o-\u03b2-d-xylopyra-noside","Alias": "NA","Ingredient_formula": "C14H14O9","Ingredient_Smile": "C1C(C(C(C(O1)OC2=COC3=CC(=CC(=C3C2=O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "22055","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
