Exact Mass: 180.998
Exact Mass Matches: 180.998
Found 392 metabolites which its exact mass value is equals to given mass value 180.998,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
2-(Methylthio)benzothiazole
2-(methylthio)benzothiazole, also known as mtbt, is a member of the class of compounds known as benzothiazoles. Benzothiazoles are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom). 2-(methylthio)benzothiazole is practically insoluble (in water) and a moderately basic compound (based on its pKa). 2-(methylthio)benzothiazole can be found in guava, which makes 2-(methylthio)benzothiazole a potential biomarker for the consumption of this food product. CONFIDENCE standard compound; EAWAG_UCHEM_ID 3646 CONFIDENCE standard compound; INTERNAL_ID 4198 CONFIDENCE standard compound; INTERNAL_ID 4058 CONFIDENCE standard compound; INTERNAL_ID 8817 KEIO_ID M150
Thiocyclam
CONFIDENCE standard compound; INTERNAL_ID 3825
2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one
2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is a benzoxazinoid precursor of 2-aminophenol sulfate. It is a metabolite found in urine of individuals that have consumed whole grains. It is a particularly strong biomarker for whole grain rye bread consumption (PMID: 23307617). Isolated from seedlings of rye and sweet corn (Zea mays). 2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products and fats and oils.
2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate
2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is an intermediate in vitamin B6 metabolism(KEGG ID C06050). It is the 4th to last step in the synthesis of succinate semialdehyde, which is an intermediate in butanoate metabolism. 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is converted from 4-pyridoxate and is then converted to 3-hydroxy-2-methylpyridine-4,5-dicarboxylate. [HMDB] 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is an intermediate in vitamin B6 metabolism(KEGG ID C06050). It is the 4th to last step in the synthesis of succinate semialdehyde, which is an intermediate in butanoate metabolism. 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is converted from 4-pyridoxate and is then converted to 3-hydroxy-2-methylpyridine-4,5-dicarboxylate.
Acamprosate
Acamprosate, also known by the brand name Campral™, is a drug used for treating alcohol dependence. Acamprosate is thought to stabilize the chemical balance in the brain that would otherwise be disrupted by alcoholism, possibly by blocking glutaminergic N-methyl-D-aspartate receptors, while gamma-aminobutyric acid type A receptors are activated. Reports indicate that acamprosate only works with a combination of attending support groups and abstinence from alcohol. Certain serious side effects include allergic reactions, irregular heartbeats, and low or high blood pressure, while less serious side effects include headaches, insomnia, and impotence. Acamprosate should not be taken by people with kidney problems or allergies to the drug. N - Nervous system > N07 - Other nervous system drugs > N07B - Drugs used in addictive disorders > N07BB - Drugs used in alcohol dependence D002491 - Central Nervous System Agents > D000427 - Alcohol Deterrents C26170 - Protective Agent > C1509 - Neuroprotective Agent
Tantalum
Tantalum is a transition metal (atomic number 73; atomic weight 180.05) that remains relatively inert in vivo. Dating back to the mid-1900s multiple medical devices have been fabricated that utilize this material, including: pacemaker electrodes, foil and mesh for nerve repair, radiopaque markers, and cranioplasty plates. Tantalum-based implants have displayed an exceptional biocompatibility and safety record in orthopedic, cranio-facial, and dentistry literature. The basic structure of this porous tantalum metal yields a high volumetric porosity, a low modulus of elasticity, and relatively high frictional characteristics.; Tantalum is known to be relatively inert in vivo and is now used as plates, sutures, radio-markers, and prostheses covering a wide variety of medical subspecialties and procedures. Dental implants have yielded excellent 8-year follow-up with tantalum-based components used for osseous anchorage. The oxide formed on the surface of tantalum implants (self-passivation) in vivo has been found to be quite stable over a wide range of pH and potential ranges. On high-resolution examination, titanium was found to have no multi-nucleated macrophages in the tissue surrounding the metallic implant, while tantalum implants displayed an occasional peri-implant macrophage. Physiologically, it ; exists as an ion in the body.; Overall porous tantalum is corrosion resistant, may be associated with less peri-implant stress shielding, and has the potential to allow for immediate weight bearing (given its high frictional characteristics). These inherent properties and proven biocompatibility make porous tantalum an intriguing metal for the design and manufacture of: press-fit or cementless components for total joint arthroplasty, bone graft substitute, or a scaffold for potential cartilage resurfacing. (PMID: 16737737). Tantalum is found in many foods, some of which are orange bell pepper, green bell pepper, yellow zucchini, and common hazelnut. Tantalum is a transition metal (atomic number 73; atomic weight 180.05) that remains relatively inert in vivo. Dating back to the mid-1900s multiple medical devices have been fabricated that utilize this material, including: pacemaker electrodes, foil and mesh for nerve repair, radiopaque markers, and cranioplasty plates. Tantalum-based implants have displayed an exceptional biocompatibility and safety record in orthopedic, cranio-facial, and dentistry literature. The basic structure of this porous tantalum metal yields a high volumetric porosity, a low modulus of elasticity, and relatively high frictional characteristics. Tantalum is known to be relatively inert in vivo and is now used as plates, sutures, radio-markers, and prostheses covering a wide variety of medical subspecialties and procedures. Dental implants have yielded excellent 8-year follow-up with tantalum-based components used for osseous anchorage. The oxide formed on the surface of tantalum implants (self-passivation) in vivo has been found to be quite stable over a wide range of pH and potential ranges. On high-resolution examination, titanium was found to have no multi-nucleated macrophages in the tissue surrounding the metallic implant, while tantalum implants displayed an occasional peri-implant macrophage. Physiologically, it exists as an ion in the body. Overall porous tantalum is corrosion resistant, may be associated with less peri-implant stress shielding, and has the potential to allow for immediate weight bearing (given its high frictional characteristics). These inherent properties and proven biocompatibility make porous tantalum an intriguing metal for the design and manufacture of: press-fit or cementless components for total joint arthroplasty, bone graft substitute, or a scaffold for potential cartilage resurfacing. (PMID: 16737737).
(R)-2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one
Identified in sweet corn extracts. (R)-2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products and fats and oils. (R)-2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products. Identified in sweet corn extracts.
Methionine sulfone
S-dioxymethionine, also known as (S)-amino-4-(methylsulphonyl)butyric acid or methionine sulfone, is a member of the class of compounds known as L-alpha-amino acids. L-alpha-amino acids are alpha amino acids which have the L-configuration of the alpha-carbon atom. S-dioxymethionine is soluble (in water) and a moderately acidic compound (based on its pKa). S-dioxymethionine can be found in garden onion, which makes S-dioxymethionine a potential biomarker for the consumption of this food product. Methionine sulfone (CAS: 820-10-0), also known as L-methionine-S-dioxide, belongs to the class of organic compounds known as L-alpha-amino acids. These are alpha-amino acids which have the L-configuration at the alpha-carbon atom. Methionine sulfone is a very strong basic compound (based on its pKa). Methionine sulfone has been detected, but not quantified, in garden onions. This could make methionine sulfone a potential biomarker for the consumption of these foods.
Dihydroxyethyldithiocarbamate
D064449 - Sequestering Agents > D002614 - Chelating Agents D020011 - Protective Agents > D000931 - Antidotes
2-Phenylethynesulfonamide
Pifithrin-μ is an inhibitor of p53 and HSP70, with antitumor and neuroprotective activity.
2-(4,5-Dichloro-1,4-dihydroimidazol-5-yl)ethanamine
3-phospho-hydroxypyruvate
3-phosphonatooxypyruvate(3-), also known as phosphohydroxypyruvic acid or 3-P-oh-pyr, is a member of the class of compounds known as glycerone phosphates. Glycerone phosphates are organic compounds containing a glycerone moiety that carries a phosphate group at the O-1 or O-2 position. 3-phosphonatooxypyruvate(3-) is soluble (in water) and a moderately acidic compound (based on its pKa). 3-phosphonatooxypyruvate(3-) can be found in a number of food items such as buffalo currant, sour cherry, black mulberry, and rowanberry, which makes 3-phosphonatooxypyruvate(3-) a potential biomarker for the consumption of these food products. 3-phosphonatooxypyruvate(3-) may be a unique S.cerevisiae (yeast) metabolite.
3-[formyl(hydroxy)amino]prop-1-enylphosphonic acid
L-Methionine sulfone
An L-methionine derivative in which the sulfur has been oxidised to the corresponding sulfone. MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; UCUNFLYVYCGDHP_STSL_0130_Methionine sulfone_8000fmol_180506_S2_LC02_MS02_203; 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. Acquisition and generation of the data is financially supported in part by CREST/JST.
5-(trans-2-Carbamoyl-vinyl)-furan-2-carbonsaeure|5-(trans-2-carbamoyl-vinyl)-furan-2-carboxylic acid
Acamprosate
N - Nervous system > N07 - Other nervous system drugs > N07B - Drugs used in addictive disorders > N07BB - Drugs used in alcohol dependence D002491 - Central Nervous System Agents > D000427 - Alcohol Deterrents C26170 - Protective Agent > C1509 - Neuroprotective Agent CONFIDENCE standard compound; INTERNAL_ID 2145 CONFIDENCE standard compound; EAWAG_UCHEM_ID 2848
Thiocyclam
CONFIDENCE standard compound; INTERNAL_ID 3825 INTERNAL_ID 3825; CONFIDENCE standard compound
Pifithrin-µ
Pifithrin-μ is an inhibitor of p53 and HSP70, with antitumor and neuroprotective activity.
2-Methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid
5-fluoro-1H-pyrazolo[3,4-b]pyridine-3-carboxylicacid
2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
2-Hydroxy-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
5-CYANO-2-METHYL-6-(METHYLTHIO)PYRIMIDIN-4(3H)-ONE
BENZENEETHANAMINE,N,N-DIMETHYL-, HYDROCHLORIDE (1:1)
N-(3-chloro-3-phenylprop-2-enylidene)hydroxylamine
4-METHYL-4H-THIENO[3,2-B]PYRROLE-5-CARBOXYLIC ACID
3-(Chloromethyl)-2-fluoropyridine hydrochloride (1:1)
2(3H)-Furanone,3-aminodihydro-, hydrobromide (1:1)
3-CHLORO-1H-PYRAZOLO[4,3-C]PYRIDINE-7-CARBALDEHYDE
1H,4H-Bis[1,2,5]oxadiazolo[3,4-b:3,4-e]pyrazin-4-amine(9CI)
5-Chloro-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-amine
2,3-dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic acid
2-Fluoro-5H-pyrrolo[3,2-b]pyrazine-6-carboxylic acid
4-fluoro-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid
4-Chloro-7H-Pyrrolo[2,3-D]Pyrimidine-5-Carbaldehyde
5-acetyl-2-hydroxy-4-methylthiophene-3-carbonitrile
1,4,5,6-Tetrahydropyrrolo[3,4-c]pyrazole dihydrochloride
3-hydroxypyrimido[4,5-e][1,2,4]triazine-6,8(5H,7H)-dione
Phosphohydroxypyruvate
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
5-Nitroanthranilate
An anthranilate obtained by removal of a proton from the carboxylic acid group of 5-nitroanthranilic acid.
3a,7a-Dihydrothieno[3,2-b]pyridine-5-carboxylic acid
Methionine sulfone zwitterion
An L-alpha-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of methionine sulfone; major miscrospecies at pH 7.3.
3,6-Dihydroxy-5-oxocyclohepta-1,3,6-triene-1-carboxylate
5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid
P-NITROPHENYLACETATE
An acetate ester resulting from the formal condensation of the hydroxy group of 4-nitrophenol with the carboxy group of acetic acid.
2-Methylthiobenzothiazole
An organic sulfide that is the methyl thioether of 1,3-benzothiazole-2-thiol.
3-phosphonatooxypyruvate(3-)
A carboxyalkyl phosphate oxoanion resuting from deprotonation of the carboxy and phosphate groups of 3-phosphooxypyruvic acid.
