Exact Mass: 201.0074
Exact Mass Matches: 201.0074
Found 500 metabolites which its exact mass value is equals to given mass value 201.0074,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Cysteine S-sulfate
Cysteine-S-sulfate (SSC) is produced by reaction of inorganic sulfite and cystine by a yet unknown pathway and is a very potent NMDA-receptor agonist. Electrophysiological studies have shown that SSC displays depolarizing properties similar to glutamate. Patients affected with either Molybdenum cofactor deficiency (MOCOD, an autosomal recessive disease that leads to a combined deficiency of the enzymes sulphite oxidase, an enzyme that catalyzes the conversion of sulfite to inorganic sulfate, xanthine dehydrogenase and aldehyde oxidase) or isolated sulphite oxidase deficiency (ISOD, an extremely rare autosomal recessive disorder with identical clinical manifestations to MOCOD) excrete elevated levels of SSC. This rare disorder is associated with brain damage (seizures, spastic quadriplegia, and cerebral atrophy), mental retardation, dislocated ocular lenses, blindness, and excretion in the urine of abnormally large amounts of SSC, sulfite, and thiosulfate but no inorganic sulfate (PMID: 17764028, 15558695). Acquisition and generation of the data is financially supported in part by CREST/JST. KEIO_ID C127; [MS2] KO008902 KEIO_ID C127
Thiabendazole
Thiabendazole is active against a variety of nematodes and is the drug of choice for strongyloidiasis. It has CNS side effects and hepatototoxic potential. (From Smith and Reynard, Textbook of Pharmacology, 1992, p919)The precise mode of action of thiabendazole on the parasite is unknown, but it most likely inhibits the helminth-specific enzyme fumarate reductase. Thiabendazole is also used as a postharvest treatment for bananas, plantains and oranges. Registered in Canada for control of silver scurf in stored potatoes Thiabendazole is a fungicide and parasiticide. Thiabendazole is also a chelating agent, which means that it is used medicinally to bind metals in cases of metal poisoning, such as lead poisoning, mercury poisoning or antimony poisoning. Thiabendazole is vermicidal and/or vermifugal against Ascaris lumbricoides ("common roundworm"), Strongyloides stercoralis (threadworm), Necator americanus, Ancylostoma duodenale (hookworm), Trichuris trichiura (whipworm), Ancylostoma braziliense (dog and cat hookworm), Toxocara canis, Toxocara cati (ascarids), and Enterobius vermicularis (pinworm). Thiabendazole also suppresses egg and/or larval production and may inhibit the subsequent development of those eggs or larvae which are passed in the feces CONFIDENCE standard compound; INTERNAL_ID 1201; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5826; ORIGINAL_PRECURSOR_SCAN_NO 5824 CONFIDENCE standard compound; INTERNAL_ID 1201; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5833; ORIGINAL_PRECURSOR_SCAN_NO 5831 CONFIDENCE standard compound; INTERNAL_ID 1201; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5856; ORIGINAL_PRECURSOR_SCAN_NO 5854 CONFIDENCE standard compound; INTERNAL_ID 1201; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5860; ORIGINAL_PRECURSOR_SCAN_NO 5859 CONFIDENCE standard compound; INTERNAL_ID 1201; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5848; ORIGINAL_PRECURSOR_SCAN_NO 5844 CONFIDENCE standard compound; INTERNAL_ID 1201; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5840; ORIGINAL_PRECURSOR_SCAN_NO 5838 Anthelmintic, pre- and postharvest fungicide, also freq. for vet. use. It is used as a postharvest treatment for bananas, plantains and oranges. Registered in Canada for control of silver scurf in stored potatoes D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AC - Imidazole and triazole derivatives P - Antiparasitic products, insecticides and repellents > P02 - Anthelmintics > P02C - Antinematodal agents > P02CA - Benzimidazole derivatives D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent CONFIDENCE standard compound; INTERNAL_ID 8788 INTERNAL_ID 2860; CONFIDENCE standard compound CONFIDENCE standard compound; INTERNAL_ID 4015 CONFIDENCE standard compound; INTERNAL_ID 1066 CONFIDENCE standard compound; INTERNAL_ID 2860 KEIO_ID T028 Thiabendazole is an orally available benzimidazole fungicide with repellent and anticancer activities. Thiabendazole can result in developmental malformations. Thiabendazole can be used for modeling[1][2][3][4][5].
Cyclamate
D000074385 - Food Ingredients > D005503 - Food Additives D010592 - Pharmaceutic Aids > D005421 - Flavoring Agents
2-Chloro-5-hydroxyphenylglycine
D018377 - Neurotransmitter Agents > D018683 - Excitatory Amino Acid Agents > D018690 - Excitatory Amino Acid Agonists
5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H imidazole-5-carboxylate
5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h imidazole-5-carboxylate, also known as (S)-ohcu, belongs to alpha amino acids and derivatives class of compounds. Those are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof. 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h imidazole-5-carboxylate is slightly soluble (in water) and a moderately acidic compound (based on its pKa). 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h imidazole-5-carboxylate can be found in a number of food items such as cumin, skunk currant, star fruit, and mustard spinach, which makes 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1h imidazole-5-carboxylate a potential biomarker for the consumption of these food products.
5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid
thiabendazole
D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AC - Imidazole and triazole derivatives P - Antiparasitic products, insecticides and repellents > P02 - Anthelmintics > P02C - Antinematodal agents > P02CA - Benzimidazole derivatives D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent Acquisition and generation of the data is financially supported in part by CREST/JST. CONFIDENCE standard compound; EAWAG_UCHEM_ID 3180 Thiabendazole is an orally available benzimidazole fungicide with repellent and anticancer activities. Thiabendazole can result in developmental malformations. Thiabendazole can be used for modeling[1][2][3][4][5].
S-sulfo-L-cysteine
An S-substituted L-cysteine where the S-substituent is specified as a sulfo group. S-sulphocysteine, also known as cysteinyl-S-sulfonate or L-cysteine hydrogen sulfuric acid, is a member of the class of compounds known as S-sulfo-l-cysteines. S-sulfo-l-cysteines are s-conjugated L-cysteine where the S-substituent is specified as a sulfo group. S-sulphocysteine is soluble (in water) and an extremely strong acidic compound (based on its pKa). S-sulphocysteine can be found in a number of food items such as hazelnut, star anise, agar, and sorghum, which makes S-sulphocysteine a potential biomarker for the consumption of these food products. S-sulphocysteine can be found primarily in blood and urine. S-sulphocysteine exists in all living organisms, ranging from bacteria to humans. Moreover, S-sulphocysteine is found to be associated with sulfite oxidase deficiency and molybdenum cofactor deficiency.
Cysteine-S-sulfate
MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; NOKPBJYHPHHWAN-REOHCLBHSA-N_STSL_0229_Cysteine-S-sulfate_8000fmol_190114_S2_LC02MS02_066; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. MS2 deconvoluted using CorrDec from all ion fragmentation data, MetaboLights identifier MTBLS1040; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I.
Merfect
D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AC - Imidazole and triazole derivatives P - Antiparasitic products, insecticides and repellents > P02 - Anthelmintics > P02C - Antinematodal agents > P02CA - Benzimidazole derivatives D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent Thiabendazole is an orally available benzimidazole fungicide with repellent and anticancer activities. Thiabendazole can result in developmental malformations. Thiabendazole can be used for modeling[1][2][3][4][5].
4-(ISOPROPYLAMINO-METHYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
[(5-ethyl-1,3,4-thiadiazol-2-yl)amino](oxo)acetic acid
[(3,5-difluorophenyl)amino](oxo)acetic acid(SALTDATA: FREE)
BENZO[C][1,2,5]THIADIAZOL-4-YLMETHANAMINE HYDROCHLORIDE
3-(5-OXO-3-THIOXO-2,3,4,5-TETRAHYDRO-[1,2,4]TRIAZIN-6-YL)-PROPIONIC ACID
2,3-dihydro-1,4-benzodioxin-5-ylmethylamine hydrochloride
2-(3-methoxy-phenyl)-2-oxo-ethyl-ammonium, chloride
5-Pyrimidinecarboxylic acid, 2-(4-pyridinyl)- (9CI)
7a-Methyl-5-oxohexahydropyrrolo[2,1-b][1,3]thiazole-3-carboxylic acid
6-(azidomethyl)-2,3-dihydrobenzo[b][1,4]dioxine hydrochloride
2-Bromo-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine
Ethanone,2-chloro-1-[6-(methylthio)-3-pyridinyl]-(9CI)
3-chloro-4H-thieno[3,2-b]pyrrole-5-carboxylic acid
ethyl 4-chloro-3,5-dimethyl-1H-pyrrole-2-carboxylate
(S)-(-)-3-Amino-3-phenylpropionic acid hydrochloride
(8-BETA)-9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-CARBONYLAZIDE
1H-Imidazole-4-carboxylicacid,2-ethoxy-5-nitro-(9CI)
methyl 6-cyano-1H-pyrrolo[3,2-b]pyridine-3-carboxylate
(4-amino-6-hydroxy-pyrimidin-2-ylsulfanyl)-acetic acid
DIMETHYL1,4-DIHYDRO-2,6-DIMETHYL-1,4-DIPHENYL-3,5-PYRIDINEDICARBOXYLATE
Tetramethylammonium iodide
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D005731 - Ganglionic Stimulants
3-(Trifluoromethyl)-1H-pyrrolo[2,3-b]pyridin-5-amine
7-HYDROXY-4-METHYL-2-OXO-2H-CHROMENE-3-CARBONITRILE
Thiazole, 2-[(1,2-epoxypropyl)thio]-4,5-dimethyl-, trans- (8CI)
8-methyl-2-(trifluoromethyl)imidazo[1,2-a]pyrazine
5-METHOXY-2,3-DIHYDRO-BENZOFURAN-3-YLAMINE HYDROCHLORIDE
2,2-Dimethylbenzo[d][1,3]dioxol-5-amine hydrochloride
3-(Cyanomethyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
methyl 6-cyano-1H-pyrrolo[3,2-b]pyridine-2-carboxylate
3-Bromo-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
3,4-Dihydro-1H-isothiochromen-4-amine hydrochloride
Ethyl 5-oxo-3-thioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxylate
7,8-Dichloro-1,2,3,4-tetrahydroisoquinoline
D004791 - Enzyme Inhibitors > D008996 - Monoamine Oxidase Inhibitors
Acetic acid, 2-[(6-chloro-3-pyridinyl)oxy]-, methyl ester
ethyl 5-chloro-3-methyl-1,2,4-triazine-6-carboxylate
5-Chloro-2-hydroxy-6-methyl-nicotinic acid methyl ester
ETHYL 2-(METHYLAMINO)-4-OXO-4,5-DIHYDRO-3-THIOPHENECARBOXYLATE
6-Chloro-4-methoxy-2-pyridinecarboxylic acid methyl ester
2-(2-Aminothiazole-4-yl)-2-methoxyiminoacetic acid
2-Chloro-4H-thieno[3,2-b]pyrrole-5-carboxylic acid
METHYL 1-BENZYL-2-OXO-1,2,3,4-TETRAHYDROPYRIDINE-5-CARBOXYLATE
Penicillanic acid
A penam that consits of 3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane bearing a carboxy group at position 2 and having (2S,5R)-configuration. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
3-Hydroxy-5-methyl-1-naphthoate
A member of the class of naphthoates that is 1-naphthoate substituted at positions 3 and 5 by hydroxy and methyl groups respectively; major species at pH 7.3.
N(3)-fumaroyl-(S)-2,3-diaminopropanoate
An alpha-amino-acid anion that is the conjugate base of N(3)-fumaroyl-(S)-2,3-diaminopropanoic acid; major species at pH 7.3.
2-Hydroxy-5-methyl-1-naphthoate
A member of the class of naphthoates that is 1-naphthoate substituted at positions 2 and 5 by hydroxy and methyl groups respectively; major species at pH 7.3.
5R)-2,5,6,7-tetrahydro-1,4-thiazepine-3,5-dicarboxylic acid
(2E,4E)-2-hydroxy-5-nitro-6-oxohepta-2,4-dienoic acid
4-(Carbamoylamino)-5-hydroxy-2-oxo-2,5-dihydro-1H-imidazole-5-carboxylate
Sodium cyclamate
D000074385 - Food Ingredients > D005503 - Food Additives D010592 - Pharmaceutic Aids > D005421 - Flavoring Agents
5-Hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylate
Conjugate base of 5-hydroxy-2-oxo-4-ureido-2,5-dihydro-1H-imidazole-5-carboxylic acid.
S-phospho-L-cysteine
A phosphoamino acid consisting of L-cysteine carrying an S-phospho substituent.
4-ethylphenyl sulfate(1-)
A phenyl sulfate oxoanion that is the conjugate base of 4-ethylphenyl sulfate, obtained by deprotonation of the sulfate group; major species at pH 7.3.
L-AP4 (monohydrate)
L-AP4 (L-APB) monohydrate is a potent and specific agonist for the group III mGluRs, with EC50s of 0.13, 0.29, 1.0, 249 μM for mGlu4, mGlu8, mGlu6 and mGlu7 receptors, respectively[1][2].
