Exact Mass: 190.0331436

CONFIDENCE standard compound; INTERNAL_ID 2518 CONFIDENCE standard compound; INTERNAL_ID 8294 CONFIDENCE standard compound; INTERNAL_ID 37 D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens

Carglumic acid

(2S)-2-(Carbamoylamino)pentanedioic acid

Carglumic acid is an orphan drug used for the treatment of hyperammonaemia in patients with N-acetylglutamate synthase deficiency. This rare genetic disorder results in elevated blood levels of ammonia, which can eventually cross the blood-brain barrier and cause neurologic problems, cerebral edema, coma, and death. Carglumic acid was approved by the U.S. Food and Drug Administration (FDA) on 18 March 2010. A - Alimentary tract and metabolism > A16 - Other alimentary tract and metabolism products > A16A - Other alimentary tract and metabolism products > A16AA - Amino acids and derivatives C78275 - Agent Affecting Blood or Body Fluid KEIO_ID C078

3-Dehydroquinic acid

(1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexane-1-carboxylic acid

3-Dehydroquinic acid belongs to the class of organic compounds known as alpha-hydroxy acids and derivatives. These are organic compounds containing a carboxylic acid substituted with a hydroxyl group on the adjacent carbon. 3-Dehydroquinic acid is an extremely weak basic (essentially neutral) compound (based on its pKa). In most organisms, 3-dehydroquinic acid is synthesized from D-erythrose-4-phosphate in two steps. However, archaea genomes contain no orthologs for the genes that encode these first two steps. Instead, archaeabacteria appear to utilize an alternative pathway in which 3-dehydroquinic acid is synthesized from 6-deoxy-5-ketofructose-1-phosphate and L-aspartate-semialdehyde. These two compounds are first condensed to form 2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate, which cyclizes to 3-dehydroquinic acid. From 3-dehydroquinic acid and on to chorismate, the archaeal pathway appears to be identical to the bacterial pathway. In most organisms, 3-dehydroquinate is synthesized from D-erythrose-4-phosphate in two steps . However, the genomes of the archaea contain no orthologs for the genes that encode these first two steps. Instead, archaeabacteria appear to utilize an alternative pathway in which 3-dehydroquinate is synthesized from 6-deoxy-5-ketofructose-1-phosphate and L-aspartate-semialdehyde . These two compounds are first condensed to form 2-amino-3,7-dideoxy-D-threo-hept-6-ulosonate , which cyclizes to 3-dehydroquinate . From 3-dehydroquinate and on to chorismate , the archaeal pathway appears to be identical to the bacterial pathway [HMDB]. 3-Dehydroquinate is found in many foods, some of which are allium (onion), cashew nut, american cranberry, and common wheat.

Naphthazarin

InChI=1\C10H6O4\c11-5-1-2-6(12)10-8(14)4-3-7(13)9(5)10\h1-4,11-12

A naphthoquinone that is 1,4-naphthoquinone in which the hydrogens at positions 5 and 8 are replaced by hydroxy groups. D000970 - Antineoplastic Agents

4-Hydroxy-4-methyl-2-oxoadipate

4-Hydroxy-4-methyl-2-oxohexanedioic acid

3,5-Dihydroxy-1,4-naphthoquinone

Oxalosuccinic acid

(2S)-1-oxopropane-1,2,3-tricarboxylic acid

Oxalosuccinic acid, also known as oxalosuccinate or 1-oxopropane-1,2,3-tricarboxylate, belongs to tricarboxylic acids and derivatives class of compounds. Those are carboxylic acids containing exactly three carboxyl groups. Oxalosuccinic acid is slightly soluble (in water) and a moderately acidic compound (based on its pKa). Oxalosuccinic acid can be found in a number of food items such as japanese chestnut, poppy, wax apple, and hyssop, which makes oxalosuccinic acid a potential biomarker for the consumption of these food products. Oxalosuccinic acid exists in all living species, ranging from bacteria to humans. Oxalosuccinic acid/oxalosuccinate is an unstable 6-carbon intermediate in the tricarboxylic acid cycle. Its an alpha-keto compound, formed during the oxidative decarboxylation of isocitrate to alpha-ketoglutarate, which is catalyzed by the enzyme isocitrate dehydrogenase. Oxalosuccinate never leaves the active site of the enzyme, however; its unstable and immediately undergoes decarboxylation to produce the 5-carbon compound, alpha-ketoglutarate . Oxalosuccinate is a substrate for cytoplasmic Isocitrate dehydrogenase and mitochondiral Isocitrate dehydrogenase (mitochondrial).

4-Hydroxy-2-oxoheptanedioic acid

2,4-dihydroxy-2-heptenedioc acid

2,4-Dihydroxyhept-2-enedioic acid

L-alpha-Amino-gamma-oxalylaminobutyric acid

2-Amino-4-((carboxycarbonyl)amino)butanoic acid, (2S)-

A monocarboxylic acid amide obtained by the formal condensation of the amino group at position 4 of L-2,4-diaminobutyric acid with the carboxy group of oxalic acid.

2-Keto-5-epi-valiolone

Ayapin

2H,6H-[1,3]dioxolo[4,5-g]chromen-6-one

Ayapin belongs to coumarins and derivatives class of compounds. Those are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one). Ayapin is slightly soluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Ayapin can be found in sunflower, which makes ayapin a potential biomarker for the consumption of this food product.

8H-1,3-Dioxolo[4,5-h][1]benzopyran-8-one

8H-1,3-dioxolo[4,5-H][1]Benzopyran-8-one, 9ci

8H-1,3-Dioxolo[4,5-h][1]benzopyran-8-one is found in green vegetables. 8H-1,3-Dioxolo[4,5-h][1]benzopyran-8-one is a constituent of Apium graveolens. Constituent of Apium graveolens. 8H-1,3-Dioxolo[4,5-h][1]benzopyran-8-one is found in green vegetables.

L-beta-aspartyl-L-glycine

2-Amino-3-[(carboxymethyl)-C-hydroxycarbonimidoyl]propanoate

L-beta-aspartyl-l-glycine is a proteolytic breakdown product of larger proteins. It belongs to the family of Acyl Glycines. These are organic compounds containing a glycine residue with the N-atom attached to another moiety through an N-ester bond. It is found in urine (PMID: 3782411). A dipeptide found in urine (PMID: 3782411). This is a proteolytic breakdown product of larger proteins. [HMDB]

Coumarin-4-carboxylic acid

2-Oxo-2H-chromene-4-carboxylic acid

Coumarin-4-carboxylic acid is found in herbs and spices. Coumarin-4-carboxylic acid occurs in Salvia triloba (Greek sage). Occurs in Salvia triloba (Greek sage). Coumarin-4-carboxylic acid is found in tea and herbs and spices.

6-Formylumbelliferone

7-hydroxy-2-oxo-2H-chromene-6-carbaldehyde

6-Formylumbelliferone is found in citrus. 6-Formylumbelliferone is a constituent of Citrus medica (citron). Constituent of Citrus medica (citron). 6-Formylumbelliferone is found in citrus.

Aspartyl-Glycine

3-Amino-3-[(carboxymethyl)-C-hydroxycarbonimidoyl]propanoate

Aspartyl-Glycine is a dipeptide composed of aspartate and glycine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

Nitroxoline

Nitroxoline, potassium salt

Nitroxoline is only found in individuals that have used or taken this drug. It is a urinary antibacterial agent active against susceptible gram-positive and gram-negative organisms commonly found in urinary tract infections. It is a fluorquinolone that is active against bacterial gyrases.This drug may also have antitumor activity by inhibition of ype 2 methionine aminopeptidase (MetAP2) protein which is involved in angiogenesis. Its antibacterial activity may stem from the metal ion complexation vital for bacterial growth. C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use D000890 - Anti-Infective Agents > D000935 - Antifungal Agents

Glycyl-Aspartate

2-[(2-Amino-1-hydroxyethylidene)amino]butanedioate

Glycyl-Aspartate is a dipeptide composed of glycine and aspartate. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

5-(Methylthio)-2-[(methylthio)methyl]-2-pentenal

(2E)-5-(Methylsulphanyl)-2-[(methylsulphanyl)methyl]pent-2-enal

C8H14OS2 (190.04860340000002)

5-(Methylthio)-2-[(methylthio)methyl]-2-pentenal is found in garden tomato. 5-(Methylthio)-2-[(methylthio)methyl]-2-pentenal is a flavouring ingredient and antioxidant. 5-(Methylthio)-2-[(methylthio)methyl]-2-pentenal is present in tomato juice and hydrolysed vegetable protein. 5-(Methylthio)-2-[(methylthio)methyl]-2-pentenal is a flavouring ingredient and antioxidant. It is found in tomato juice and hydrolysed vegetable protein.

2-Hydroxy-2-(2-oxopropyl)butanedioic acid

2-Hydroxy-2-(2-oxopropyl)butanedioic acid belongs to the family of Medium-chain Keto Acids and Derivatives. These are keto acids with a 6 to 12 carbon atoms long side chain.

N-carbamoylglutamic Acid

2-[(C-hydroxycarbonimidoyl)amino]pentanedioic acid

N-carbamoylglutamic Acid, also known as N-Carbamoylglutamate, is classified as a glutamic acid or a Glutamic acid derivative. Glutamic acids are compounds containing glutamic acid or a derivative thereof resulting from reaction of glutamic acid at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. N-carbamoylglutamic Acid is considered to be soluble (in water) and acidic

2-O-Methylascorbic acid

(5R)-5-[(1S)-1,2-dihydroxyethyl]-4-hydroxy-3-methoxy-2,5-dihydrofuran-2-one

C7H10O6 (190.047736)

2-O-Methylascorbic acid (2-O-MA) is a derivative of vitamin C (ascorbic acid). The enzyme catechol-O-methyltransferase catalyzes the methylation of L-ascorbic acid into 2-O-methylascorbic acid (PMID: 7129800). 2-O-Methylascorbic acid belongs to the class of organic compounds known as butenolides. These are dihydrofurans with a carbonyl group at the C2 carbon atom. 2-O-Methylascorbic acid has been identified in urine and was found to be higher in older women than in younger women (PMID: 28813537).

1,1'-Oxalyldiimidazole

bis(1H-imidazol-1-yl)ethane-1,2-dione

4-(Trifluoromethyl)benzoic acid

alpha,alpha,alpha-Trifluoro-p-toluic acid

Chromocarb

4-oxo-4H-1-Benzopyran-2-carboxylic acid

C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent

4-Methyl-1-homopiperazinedithiocarboxylic acid

C7H14N2S2 (190.0598364)

1-Nitro-3,5-dinitroso-1,3,5-triazinane

Hexahydro-1,3-dinitroso-5-nitro-1,3,5-triazine

C3H6N6O4 (190.0450516)

5,8-Dihydroxy-1,4-naphthoquinone

5,8-dihydroxy-1,4-dihydronaphthalene-1,4-dione

D000970 - Antineoplastic Agents

Allo-hydroxycitric acid lactone

3-Hydroxy-5-oxo-tetrahydro-furan-2,3-dicarboxylate

oxalosuccinate

1-oxopropane-1,2,3-tricarboxylic acid

2,4,6-decatriynedioic acid, 9CI|Deca-2,4,6-triin-disaeure|Decatriin-2,4,6-dicarbonsaeure-1,10|Octatriin-1,3,5-dicarbonsaeure-1,8

7-Formylcyclopenta[c]pyran-4-carboxylic acid

2,8-dihydroxy-1,4-naphthoquinone

ACMC-20n6bh

2,5-Dihydroxynaphthalene-1,4-dione

6,7-Methylendioxychromon

2,8-Decadiene-4,6-diynedioic acid-(E,E)-form|Deca-2t,8t-dien-4,6-diindisaeure|deca-2t,8t-diene-4,6-diynedioic acid|Decadien-2t,8t-diin-4,6-dicarbonsaeure-1,10|Decadien-2t,8t-diin-4,6-disaeure-1,10

L-Glutamic acid-??-methylamide

Dealanylalahopcin

Tetrahydro-thiopyran-2,6-dicarbonsaeure|tetrahydro-thiopyran-2,6-dicarboxylic acid

8-formyl-7-hydroxycoumarin

2-Amino-5-methyl-4-phenylthiazole

2-[(2-methylsulfanyl)ethyl]maleate

cyclic- 3,4-O-oxalyl-L-threonate

cyclic-2,3-O-oxalyl-L-threonate

Garcinia lactone

HYDROXYCITRIC ACID LACTONE (CONSTITUENT OF GARCINIA CAMBOGIA AND GARCINIA INDICA) [DSC]

(+)-garcinia acid is a butan-4-olide and a hydroxy carboxylic acid. It has a role as a metabolite. Hydroxycitric acid lactone is a natural product found in Garcinia gummi-gutta and Garcinia cowa with data available. See also: Garcinia gummi-gutta fruit (part of). A natural product found in Garcinia cambogia. (-)-Hydroxycitric acid lactone (Garcinia lactone) is an anti-obesity agent and a popular weight loss food supplement. (-)-Hydroxycitric acid lactone is a potent inhibitor of ATP-citrate lyase. (-)-Hydroxycitric acid lactone catalyzes the extramitochondrial cleavage of citrate to oxaloacetate and acetyl-CoA, limits the availability of acetyl-CoA units required for fatty acid synthesis[1][2]. (-)-Hydroxycitric acid lactone (Garcinia lactone) is an anti-obesity agent and a popular weight loss food supplement. (-)-Hydroxycitric acid lactone is a potent inhibitor of ATP-citrate lyase. (-)-Hydroxycitric acid lactone catalyzes the extramitochondrial cleavage of citrate to oxaloacetate and acetyl-CoA, limits the availability of acetyl-CoA units required for fatty acid synthesis[1][2]. (-)-Hydroxycitric acid lactone (Garcinia lactone) is an anti-obesity agent and a popular weight loss food supplement. (-)-Hydroxycitric acid lactone is a potent inhibitor of ATP-citrate lyase. (-)-Hydroxycitric acid lactone catalyzes the extramitochondrial cleavage of citrate to oxaloacetate and acetyl-CoA, limits the availability of acetyl-CoA units required for fatty acid synthesis[1][2]. (-)-Hydroxycitric acid lactone (Garcinia lactone) is an anti-obesity agent and a popular weight loss food supplement. (-)-Hydroxycitric acid lactone is a potent inhibitor of ATP-citrate lyase. (-)-Hydroxycitric acid lactone catalyzes the extramitochondrial cleavage of citrate to oxaloacetate and acetyl-CoA, limits the availability of acetyl-CoA units required for fatty acid synthesis[1][2].

4-Nitroquinoline-N-oxide

Ureidoglutaric acid

4-Nitroquinoline 1-oxide

D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens

3-(Trifluoromethyl)benzoic acid

3-(trifluoromethyl)-Benzoic acid

CONFIDENCE standard compound; INTERNAL_ID 531; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4456; ORIGINAL_PRECURSOR_SCAN_NO 4452 CONFIDENCE standard compound; INTERNAL_ID 531; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4463; ORIGINAL_PRECURSOR_SCAN_NO 4461 CONFIDENCE standard compound; INTERNAL_ID 531; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4428; ORIGINAL_PRECURSOR_SCAN_NO 4426 CONFIDENCE standard compound; INTERNAL_ID 531; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4454; ORIGINAL_PRECURSOR_SCAN_NO 4453 CONFIDENCE standard compound; INTERNAL_ID 531; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4452; ORIGINAL_PRECURSOR_SCAN_NO 4451 CONFIDENCE standard compound; INTERNAL_ID 531; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4437; ORIGINAL_PRECURSOR_SCAN_NO 4436

4-nitroquinoline 1-oxide_major

Asp Gly

Gly Asp

5-methyl-4-phenyl-2-thiazolamine

5-Methyl-4-phenyl-1,3-thiazol-2-amine

b-Asp-Gly

L-β-aspartyl-L-glycine

4-hydroxy-2-oxo-Heptanedioic acid

Nitroxoline

5-Nitroks;5-Nitrox;5-Nitroxine;5-NOK;Nitroxolina [inn-spanish];Nitroxolinum [inn-latin]

A monohydroxyquinoline in which the hydroxy group is positioned at C-8 with a nitro group trans to it at C-5. C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use D000890 - Anti-Infective Agents > D000935 - Antifungal Agents

Asp-gly

2-(2-aminoacetamido)butanedioic acid

A dipeptide composed of L-aspartic acid and glycine joined by a peptide linkage.

Gly-asp

3-amino-3-[(carboxymethyl)carbamoyl]propanoic acid

A dipeptide formed from glycyl and L-aspartic acid residues.

Coumarin-4-carboxylic acid

2-Oxo-2H-chromene-4-carboxylic acid

methialdol

(2E)-5-(methylsulfanyl)-2-[(methylsulfanyl)methyl]pent-2-enal

C8H14OS2 (190.04860340000002)

7,8-Methylenedioxycoumarin

8H-1,3-dioxolo[4,5-H][1]Benzopyran-8-one, 9ci

6-Formylumbelliferone

7-hydroxy-2-oxo-2H-chromene-6-carbaldehyde

Prevan

2H-Pyran-2,4(3H)-dione, 3-acetyl-6-methyl-, ion(1-), sodium

FA 10:7;O2

Deca-2,4,6-triynedioic acid

FA 7:2;O4

(4R,5S)-4,5-dihydroxy-2,6-dioxoheptanoic acid;3,7-dideoxy-D-threo-hepto-2,6-diuolosonic acid

2-methyl-4-phenylthiazol-5-ylamine

4-(4-Chlorophenyl)pyrimidine

4-nitro-1H-indole-3-carbaldehyde

Sulfamide, (1,2-dihydro-2-oxo-4-pyrimidinyl)- (9CI)

C4H6N4O3S (190.0160606)

5-Phenyl-1,2,4-oxadiazole-3-carboxylic acid

3-(2H-tetrazol-5-yl)benzoic acid

2,3,5-Trifluorophenylacetic acid

(2-Bromoethyl)cyclohexane

2-(2-Thenyl)phenol

6-Fluoro-2-naphthoic acid

2-Cyano-6-methoxybenzothiazole

2-Quinazolinecarboxylicacid, 3,4-dihydro-4-oxo-

5-FLUORO-2-PYRAZOL-1-YL-BENZALDEHYDE

C5H11NaO4S (190.02757259999998)

sodium n-pentyl sulphate

H-Gly-Asp-OH

Glycyl-L-aspartic acid

1,2,4-Butanetricarboxylic acid

(r)-1-[2-(trifluoromethyl)phenyl]ethanol

Methyl 2-methoxytetrafluoropropionate

4-OXO-3,4-DIHYDROPHTHALAZINE-1-CARBOXYLIC ACID

2-(3-NITROPHENYL)-2H-1,2,3-TRIAZOLE

5-nitroquinolin-6-ol

5-Chloro-2-phenylpyrimidine

1-chloronaphthalene-2-carbaldehyde

5-Fluoromethylene-4-phenyl-5H-furan-2-one

2-(tetrazol-1-yl)benzoic acid

Coumarin-3-carboxylic acid

Sodium N-(2-aminoethyl)aminoethanesulfonate

C4H11N2NaO3S (190.0388056)

2-Aminomethyl-3,4-dichlorophenylamine

5-(4-NITROPHENYL)ISOXAZOLE

1H,3H-Thiazolo[3,4-a]benzimidazol-1-one(9CI)

1H-Imidazole-5-propanoic acid methyl ester

3-CHLORO-3H-2,1-BENZOXATHIOLE-1,1-DIOXIDE

4-hydroxy-2-oxo-2h-chromene-3-carbaldehyde

1-(M-TOLYL)IMIDAZOLINE-2-THIONE

2-Amino-4,5,6,7-tetrahydrobenzothiazole Hydrochloride

3-(3-Nitrophenyl)-3-oxopropanenitrile

6-(Trifluoromethyl)nicotinamide

6-Nitro-1H-indole-3-carbaldehyde

[5-(2-PYRIDINYL)-2-THIENYL]METHYLAMINE

Thiazolo[4,5-h]isoquinoline, 6,7,8,9-tetrahydro- (9CI)

Potassium cyclohexyl(trifluoro)borate(1-)

C6H11BF3K (190.0542932)

(3S,7AR)-3-T-BUTYL-7A-METHYLBICYCLICLACTAM

sodium,4-ethenylbenzenesulfinate

C8H7NaO2S (190.0064442)

1-phenylimidazolidine-2,4,5-trione

3,3-Difluorobiphenyl

1-(Methoxymethyl)-4-(trifluoromethyl)benzene

4-Hydroxycinnoline-3-carboxylic acid

4-(1,3-THIAZOL-2-YL)PHENYL]METHYLAMINE

4-(4-Nitrophenyl)oxazole

3-Chlorbenzolcarboximidamidhydrochlorid(1:1)

4-(TRIFLUOROMETHOXY)BENZALDEHYDE

2-(TRIFLUOROMETHYL)NICOTINAMIDE

7-NITROISOQUINOLIN-1(2H)-ONE

5-Acetyl-2-nitrobenzonitrile

2-Hydroxy-6-(trifluoromethyl)benzaldehyde

C5H11NaO4S (190.02757259999998)

Sulfuric acid,monopentyl ester, sodium salt (1:1)

1-[2-(trifluoromethyl)pyrimidin-4-yl]ethanone

5-amino-2-(trifluoromethyl)pyridine-4-carbaldehyde

1-(2-Fluorophenyl)-1H-pyrazole-4-carboxaldehyde

1-(3-Fluorophenyl)-1H-pyrazole-4-carboxaldehyde

2,2,3,3-tetrafluorobutyl carbonate

(4-TERT-BUTYL-BENZYL)-FURAN-2-YLMETHYL-AMINE

3-(2-METHYL-1,3-THIAZOL-4-YL)ANILINE

2-Benzothiazolecarbonitrile,6-hydroxy-4-methyl-(9CI)

Chloro(dimethyl)(3,3,3-trifluoropropyl)silane

C5H10ClF3Si (190.0192366)

6-Chloroindole-3-acetonitrile

4-(TRIFLUOROACETAMIDO)PYRIDINE

5-Nitro-1H-indole-3-carbaldehyde

(2-MORPHOLIN-4-YLMETHYL-BENZOIMIDAZOL-1-YL)-ACETIC ACID

glycyl-d-aspartic acid

4-Oxo-4H-Pyrido[1,2-A]Pyrimidine-3-Carboxylic Acid

2,2,2-trifluoro-N-pyridin-2-yl-acetamide

5-Benzyl-thiazol-2-ylamine

5-Benzyl-1,3-thiazol-2-amine

5-(P-TOLYL)THIAZOL-2-AMINE

1-(Methoxymethyl)-2-(trifluoromethyl)benzene

1-(Methoxymethyl)-3-(trifluoromethyl)benzene

C7H6BF3O2 (190.04129220000002)

4-Trifluoromethylphenylboronic acid

(3,3-DIMETHYL-BUT-1-YNYL)-BENZENE

1-(Bromomethyl)-1-methylcyclohexane

5-FLUORO-1-NAPHTHOIC ACID

C10H8BFO2 (190.06013500000003)

4-Fluoronaphtalene-1-boronic acid

(BROMOMETHYL)-CYCLOHEPTANE

1-Piperazinecarboxaldehyde, 4-(chloroacetyl)- (9CI)

4,5-dichloro-6-ethyl-2-methylpyrimidine

2,3,6-Trifluorophenylacetic acid

3,4,5-Trifluorophenylacetic acid

5-Nitroquinolin-2(1H)-one

6H-Pyrazolo[3,4-g]benzothiazole,2-amino-(8CI)

C8H6N4S (190.0313156)

(4-THIEN-2-YLPHENYL)METHANOL

C7H6BF3O2 (190.04129220000002)

2-Trifluoromethylphenylboronic acid

Furil

C-(2-PHENYL-THIAZOL-5-YL)-METHYLAMINE

4-NITRO-ISOQUINOLIN-1-OL

ethyl 3-(chloromethyl)-1,2,4-oxadiazole-5-carboxylate

4-Hydroxy-1,5-naphthyridine-3-carboxylicacid

Benzaldehyde, 3-fluoro-4-(1H-imidazol-1-yl)

2-(4-nitrophenyl)triazole

Methanetriacetic acid

7-Hydroxyfuro[4,3,2-de]chromen-4(2H)-one

2-[4-(Trifluoromethyl)phenyl]ethanol

4-(4-Methyl-phenyl)-1,3-dihydro-imidazole-2-thione

(3R,2S)-2,3-Diaminobutyric acid 2HCl

1-BENZYL-1H-IMIDAZOLE-2-THIOL

3-(Trifluoromethoxy)benzaldehyde

3-(2,4,5-TRIFLUORO-PHENYL)-PROPAN-1-OL

3-(3-nitrophenyl)-1,2-oxazole

2-thiophen-2-ylpyrimidine-5-carbaldehyde

(4-Fluorophenyl)methanesulfonic acid

C7H7FO3S (190.00999240000002)

(2,3,3,3-TETRAFLUORO-2-(TRIFLUOROMETHOXY)PROPYL)EPOXIDE

C10H8BFO2 (190.06013500000003)

Boronic acid, (8-fluoro-2-naphthalenyl)- (9CI)

2,3-DIOXOINDOLINE-5-CARBOXAMIDE

5-(PYRIMIDIN-2-YL)THIOPHENE-2-CARBALDEHYDE

2,4,5-Trifluoro-3-methylbenzoic acid

5-(3-Fluorophenyl)-2-furancarboxaldehyde

1,3,5-O-METHYLIDYNE-MYO-INOSITOL

2,2,3,3,4,4,5,5-octadeuteriohexanedioyl dichloride

C6Cl2D8O2 (190.040350224)

4-OXO-4H-PYRIDO[1,2-A]PYRIMIDINE-2-CARBOXYLIC ACID, ETHYL ESTER

1-(Bromomethyl)-4-Methylcyclohexane

Adipic Acid Disodium Salt

C6H8Na2O4 (190.0217968)

3,4,6-Trifluoro-2-methylbenzoic acid

(2S-CIS)-5-(2-(DIMETHYLAMINO)ETHYL)-2,3-DIHYDRO-3-HYDROXY-2-(4-METHOXYPHENYL)-1,5-BENZOTHIAZEPIN-4(5H)-ONE

2-Oxo-2H-chromene-6-carboxylic acid

4-amino-1-methyl-1h-pyrrole-2-carboxylic acid-methyl ester hcl

3-fluoro-5-(trifluoromethyl)pyridine-2-carbonitrile

C7H2F4N2 (190.01540999999997)

2-(4-Nitrophenyl)oxazole

6-Fluoro-1-naphthoic acid

2,4-Dichloro-6-propyl-pyrimidine

D-2,4-Diaminobutyric acid dihydrochloride

6-nitroquinolin-8-ol

2-Chloro-4-phenylpyrimidine

5-(3-NITROPHENYL)-1,3-OXAZOLE

2-(4-methoxyphenyl)thiophene

(3S-CIS)-(-)-3-PHENYLTETRAHYDROPYRROLO-[2,1-B]-OXAZOL-5(6H)-ONE

4,5-DIHYDRO[1,2,5]OXADIAZOLO[3,4-F]CINNOLIN-3-IUM-3-OLATE

2,4-Difluorobiphenyl

SODIUM BITARTRATE, MONOHYDRATE

C4H7NaO7 (190.0089472)

5-(4-Pyridyl)isoxazole-3-carboxylic Acid

6-Nitroisoquinolin-1(2H)-one

4-Chloro-2,2-bipyridine

phenyl(thiophen-2-yl)methanol

1,3-DIOXOLANE-2,2-DIACETIC ACID

6-(4H-1,2,4-triazol-4-yl)pyridine-2-carboxylic acid(SALTDATA: FREE)

6-CHLORO-[3,4]-BIPYRIDINE

(3,4-DIMETHYL-BENZYL)-HYDRAZINE

6-NITROQUINOLIN-2(1H)-ONE

2-CHLOROBENZIMIDAMIDE HYDROCHLORIDE

7-hydroxy-4-oxochromene-3-carbaldehyde

3,5-Difluorobiphenyl

2-Hydroxy-5-(trifluoromethyl)benzaldehyde

2-(chloromethyl)indolizine-1-carbonitrile

calcium methoxyethoxide

C6H14CaO4 (190.0517954)

4-(1,2,3-THIADIAZOL-4-YL)BENZALDEHYDE

1-(2-Phenyl-1,3-thiazol-4-yl)methanamine

2,6-Dimethoxypyridin-3-amine hydrochloride

m-toluenesulfonic acid monohydrate

methyl (5-chloromethyl-dihydrofuran-2-ylidene)acetate

C8H11ClO3 (190.0396686)

1-(2-CHLOROETHYL) NAPHTHALENE

C12H11Cl (190.0549236)

2-Fluoro-4-methylsulfonylphenol

C7H7FO3S (190.00999240000002)

2-Chloro-6-phenylpyrazine

2-Thiazolamine,4-methyl-N-phenyl-

1,4-Dithiaspiro[4.5]decan-8-ol

C8H14OS2 (190.04860340000002)

6-nitroquinoxalin-2-amine

2-Benzofurylglyoxylic acid

Ethyl 3-amino-1H-pyrrole-2-carboxylate hydrochloride

5-(2-Fluorophenyl)-2-furaldehyde

6-Chloro-2,2-bipyridine

2-[3-(Trifluoromethyl)phenyl]ethanol

3-(1H-TETRAAZOL-1-YL)BENZOIC ACID

1-(2-METHYLAMINOPROPYL)-3-ADAMANTANOLHYDROCHLORIDE

2H-Benzimidazole-2-thione,1,3-dihydro-1-(2-propenyl)-(9CI)

2-Thiazolamine,4-(4-methylphenyl)-

4-(1H-Tetrazol-5-yl)benzoic Acid

(2,5-DIMETHYL-PHENYLSULFANYL)-ACETICACID

3-(2,4,6-TRIFLUORO-PHENYL)-PROPAN-1-OL

4,6-dichloro-5-propylpyrimidine

[4-(1,3,4-oxadiazol-2-yl)phenyl]boronic acid

C8H7BN2O3 (190.0549702)

(p-Nitrobenzoyl)acetonitrile

6-(4-FLUOROPHENYL)-3(2H)-PYRIDAZINONE

ADA

N-(2-Acetamido)iminodiacetic acid

C6H11BrN2 (190.01055459999998)

1-Ethyl-3-methylimidazolium Bromide

3-Acetyl-1-chlorocarbonyl-2-imidazolidone

2-Chloro-5-phenylpyrimidine

5-(2-NITROPHENYL)OXAZOLE

3-(4-fluorophenyl)-1H-pyrazole-4-carbaldehyde

1-(4-Nitrophenyl)-1H-1,2,4-Triazole

Methyl 2,4,5-trifluorobenzoate

4-CHLORO-2-NITROBENZYLALCOHOL

2-Benzothiazolecarbonitrile,4-methoxy

5-Methoxy-2-benzothiazolecarbonitrile

3-METHYL-4-METHYLENE-3,4-DIHYDROQUINAZOLINE-2(1H)-THIONE

3-methyl-4-phenyl-1H-imidazole-2-thione

6-Methoxy-5,8-quinazolinedione

3-Chloro-6-phenylpyridazine

4-tetrazol-1-yl-benzoic acid

5-(3-Pyridyl)isoxazole-3-carboxylic Acid

7-Methoxy-2-benzothiazolecarbonitrile

2-oxo-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)acetic acid

6-chloro-2-naphthyl sulfonyl chloride

4-chloro-6-phenylpyrimidine

2-Chloro-4,4-bipyridine

Thiazolo[3,2-a]benzimidazol-3(2H)-one

4-(4-Nitrobenzyl)piperazine-1-carboxylic acid tert-butyl ester

7-nitroindole-3-carboxaldehyde

2-(1H-TETRAZOL-5-YL)BENZOIC ACID

1-(Chloroacetyl)-L-prolinamide

ethyl 5-(chloromethyl)-1,2,4-oxadiazole-3-carboxylate

(3S,2S)-2,3-Diaminobutyric acid 2HCl

(5-PYRID-3-YLTHIEN-2-YL)METHYLAMINE

Methyl 2,2,3,3-tetrafluoro-3-methoxypropanoate

4-Formyl-1H-indazole-3-carboxylic acid

3-Formyl-1H-indazole-6-carboxylic acid

5-nitro-2H-isoquinolin-3-one

3-(2-Nitrophenyl)-3-oxopropanenitrile

8-Bromo-1-octene

6-hydroxy-4-oxochromene-3-carbaldehyde

5-(4-Fluorophenyl)-furan-2-carbaldehyde

(R)-3,4-DIAMINOBUTYRIC ACID DIHYDROCHLORIDE

2,2,2-trifluoro-1-(2-hydroxyphenyl)ethanone

4,4,5,5,5-PENTAFLUORO-3-METHYLPENT-1-ENE-3-OL

C6H7F5O (190.04170319999997)

2-hydroxy-3-(trifluoromethyl)benzaldehyde

3,5-dichloro-4,6-dimethylpyridin-2-amine

3-Nitro-4-methoxypyridine hydrochloride

C7H6BF3O2 (190.04129220000002)

3-(Trifluoromethyl)phenylboronic acid

2,4-Imidazolidinedione,5-(4-chlorobutyl)-

5-(4-Nitrophenyl)oxazole

2-chloro-3-phenylpyrazine

1-(4-FLUOROPHENYL)-1H-PYRAZOLE-4-CARBALDEHYDE

2-Amino-5-(trifluoromethyl)nicotinaldehyde

2,3,5-Trifluoro-4-methylbenzoic acid

4-Pyridinamine, 3,5-dichloro-2,6-dimethyl-

8-fluoronaphthalene-1-carboxylic acid

5-Chloro-2,2-bipyridine

trimethylmethane tricarboxylate

2-ETHYL-4-THIAZOL-2-YL-PYRIDINE

Bromocyclooctane

2-(5-chloro-1H-indol-3-yl)acetonitrile

4-(2-methyl-1,3-thiazol-4-yl)aniline

3,4-Dihydro-4-oxo-8-quinazolinecarboxylic acid

2-Thiazolamine,4-(2-methylphenyl)-

Naphthalene,1-(chloromethyl)-4-methyl-

C12H11Cl (190.0549236)

3,4-Dihydro-4-oxo-5-quinazolinecarboxylic acid

4-METHYL-3-PHENYLISOTHIAZOL-5-AMINE

[3-(1,3-Thiazol-2-yl)phenyl]methylamine

2-(Trifluoromethyl)benzoic acid

4,5,6,7-Tetrafluoro-1H-benzimidazole

C7H2F4N2 (190.01540999999997)

(4-Chloro-1H-indol-3-yl)acetonitrile

(2,3,4-Trifluorophenyl)acetic acid

4-Hydroxy-3-(trifluoromethyl)benzaldehyde

(4-PHENYLTHIAZOL-2-YL)METHANAMINE

6-Nitro-5-quinolinol

(trifluoromethyl)benzoic acid

2,2,2-trifluoro-N-pyridin-3-ylacetamide

4-Chlorobenzamidine hydrochloride

chromone-3-carboxylic acid

p-Toluenesulfonic acid monohydrate

1-(3-NITRO-2-PYRIDINYL)-2-PYRROLIDINECARBOXYLICACID

2,2-DIFLUOROBIPHENYL

Sodium 4-Hydroxy-3-methoxybenzoate

4-HYDROXY-3-METHOXYBENZOIC ACID SODIUM SALT

3-(3-Fluorophenyl)-1H-pyrazole-4-carboxaldehyde

H-Gly-DL-Asp-OH

Glycyl-dl-aspartic acid

5-FLUORO-2-PHENYLPYRIMIDIN-4(3H)-ONE

2-(PYRIDIN-4-YL)THIAZOLE-4-CARBALDEHYDE

6-(TRIFLUOROMETHYL)PICOLINAMIDE

Benzenesulfonamide, 2-amino-5-fluoro- (7CI,8CI,9CI)

C6H7FN2O2S (190.0212254)

2-Benzothiazolamine,N-2-propenyl-(9CI)

4-Chloro-6-hydrazino-2-(methylthio)pyrimidine

C5H7ClN4S (190.0079932)

2-Hydroxy-4-(trifluoromethyl)benzaldehyde

1H-Benzimidazole,2-(2-propenylthio)-(9CI)

2-pyridin-2-yl-1,3-thiazole-4-carbaldehyde

(6-Bromo-pyridin-3-ylmethyl)-isopropyl-amine

3-Hydroxy-2-quinoxalinecarboxylic acid

3-chloro-5-phenylpyridazine

Tetra(hydroxymethyl)phosphonium chloride

C4H12ClO4P (190.0161712)

(5-pyridin-4-ylthiophen-2-yl)methanamine

2-Phenyl-2H-tetrazole-5-carboxylic acid

4-hydroxy-8-nitroquinoline

4-Oxo-1,4-dihydro-6-quinazolinecarboxylic acid

DL-2,4-Diaminobutyric acid dihydrochloride

Acetic acid,2-(3-oxo-1(3H)-isobenzofuranylidene)-

3,4-Dihydro-4-oxoquinazoline-6-carboxylic acid

phenyl trifluoroacetate

1,1-oxalyldiimidazole

2-Oxo-1,2-dihydro-1,8-naphthyridine-3-carboxylic acid

2,4,5-Trifluorophenylacetic acid

5-Nitro-1(2H)-isoquinolinone

1-Naphthoyl chloride

4,4-Difluorobiphenyl

4-amino-2,3,5,6-tetrafluorobenzonitrile

C7H2F4N2 (190.01540999999997)

Sodium Urate

Monosodium urate

C5H3N4NaO3 (190.0102848)

D020011 - Protective Agents > D000975 - Antioxidants Uric acid sodium (Monosodium urate), scavenger of oxygen radical, is a very important antioxidant that help maintains the stability of blood pressure and antioxidant stress. Uric acid sodium can remove reactive oxygen species (ROS) such as singlet oxygen and peroxynitrite, inhibiting lipid peroxidation[1][2].

2-[4-(Chloromethyl)-1,3-thiazol-2-yl]guanidine

C5H7ClN4S (190.0079932)

(R)-1-(2-Chloroacetyl)pyrrolidine-2-carboxamide

1-chloro-4-(1,1-difluoropropyl)- Benzene

C9H9ClF2 (190.0360808)

4-Fluoro-1-naphthoic acid

Methyl 4-deoxy-alpha-L-threo-hex-4-enopyranosiduronic acid

1-Fluoro-4-[1-(trifluoromethyl)ethenyl]benzene

C9H6F4 (190.0405604)

5-(2-fluoropyridin-3-yl)-1H-pyrrole-3-carbaldehyde

1,3-Dioxolo[4,5-g]quinazolin-6(5H)-one

2-(Trifluoromethoxy)benzaldehyde

D(+)-CARNITINENITRILE CHLORIDE

Thiazolo[3,2-a]benzimidazol-7-ol (6CI)

Thiazolo[3,2-a]benzimidazol-6-ol (6CI,9CI)

1,3-Dioxolo[4,5-f]quinazolin-7(6H)-one

4-Methyl-5-phenyl-1,3-thiazol-2-amine

5-Phenyl-1,3,4-oxadiazole-2-carboxylic acid

7-nitro-1-oxidoquinolin-1-ium

sodium 4-hydroxyphenylglycolate

4-(METHYLTHIO)PHENYL]HYDRAZINEHYDROCHLORIDE

(2E)-2-Bromo-6-methyl-2-heptene

3-oxo-4H-quinoxaline-6-carboxylic acid

(2,4,6-Trifluorophenyl)acetic acid

3-fluoro-4-pyrazol-1-ylbenzaldehyde

2-naphthoic chloride

6-Nitro-4-quinolinol

Pyrimidine,4-chloro-2-phenyl-

4-benzyl-1,3-thiazol-2-amine

2-(2-methyl-1,3-thiazol-4-yl)aniline

[3-(Difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-acetic acid

C7H8F2N2O2 (190.0553812)

N-{[4-(Chloromethyl)-1,3-thiazol-2-yl]methyl}-N,N-dimethylamine

L-2,4-Diaminobutyric acid dihydrochloride

5-(Pyrazin-2-yl)-1H-pyrazole-3-carboxylic acid

4-(Difluoromethoxy)-2-fluorobenzaldehyde

4-Hydroxy-2-(trifluoromethyl)benzaldehyde

3,4-Dihydro-4-oxo-7-quinazolinecarboxylic acid

2-FLUORO-4-(1H-PYRAZOL-1-YL)BENZALDEHYDE

5-(PYRAZIN-2-YL)THIOPHENE-2-CARBALDEHYDE

5-(TRIFLUOROMETHYL)PICOLINAMIDE

4-(trifluoromethyl)pyridine-2-carboxamide

7-nitro-1H-quinolin-4-one

2,4,5-trifluoro-n-hydroxybenzenecarboximidamide

2-Hydroxy-2-methylpropane-1,2,3-tricarboxylic acid

1-Chloromethyl-2-methylnaphthalene

Naphthalene,1-(chloromethyl)-2-methyl-

C12H11Cl (190.0549236)

2-Oxo-1,2-dihydro-quinazoline-4-carboxylic acid

2-acetyl-3-methylbenzo[b]thiophene

4,6-DIMETHYL-PYRIMIDINE-2-SULFONYL FLUORIDE

C6H7FN2O2S (190.0212254)

CHEMBRDG-BB 5108929

2,2,2-Trifluoro-1-(4-hydroxyphenyl)ethanone

6-NITRO-2-QUINAZOLINAMINE

sodium,2-hydroxy-5-methoxybenzoate

(S)-3,4-DIAMINOBUTYRIC ACID DIHYDROCHLORIDE

5-(2-Pyridyl)isoxazole-3-carboxylic Acid

1-(PYRIMIDIN-2-YL)-1H-PYRAZOLE-4-CARBOXYLIC ACID

7-NITROQUINOLIN-2(1H)-ONE

2-oxo-2-(1H-pyrrolo[3,2-b]pyridin-3-yl)acetic acid

1-Nitro-3,5-dinitroso-1,3,5-triazinane

C3H6N6O4 (190.0450516)

1,2,3-Propanetriol, phosphate

C3H11O7P (190.0242386)

2-(1,3-Benzoxazol-2-ylsulfanyl)acetonitrile

1-oxo-1H-isochromene-3-carboxylic acid

2,4-Diaminopteridine-6-carbaldehyde

C7H6N6O (190.0603066)

3-(4-Nitrophenyl)isoxazole

2-(3-Fluorophenyl)pyrimidin-4-ol

2-(4-Fluorophenyl)-4(3H)-pyrimidinone

6-(4-Fluorophenyl)pyrimidin-4-ol

6-Oxo-4-(3-fluorophenyl)-1,6-dihydropyrimidine

2,3-Dimethylthiochromone

2,3-Dihydroxy-5-oxo-hexanedioate

Chromocarb

C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent

Ayapin

6H-1,3-Dioxolo(4,5-g)(1)benzopyran-6-one

Sodium dehydroacetate

Dehydroacetic acid sodium

It is used as a preservative for cut or peeled squash

2-(5,6-Dioxo-1,4-dioxan-2-yl)-2-hydroxyacetic acid

3-(Hydroxymethyl)-5,6-dioxo-1,4-dioxane-2-carboxylic acid

(5-Hydroxyindol-3-yl)acetate

The indol-3-yl carboxylic acid anion formed by loss of a proton from the carboxy group of (5-hydroxyindol-3-yl)acetic acid; principal microspecies at pH 7.3

Indole-5,6-quinone-2-carboxylate

C9H4NO4- (190.0140324)

An indolecarboxylate that is the conjugate base of indole-5,6-quinone-2-carboxylic acid resulting from the deprotonation of the carboxy group. Major microspecies at pH 7.3.

N-acetylmethioninate

C7H12NO3S- (190.0537862)

(2-hydroxy-1H-indol-3-yl)acetate

2-Oxoindole-3-acetic acid

2-dehydro-3-deoxy-D-glucarate(2-)

(2S)-3-(4-hydroxyphenyl)-2-isocyanopropanoate

2-keto-D-threo-4,5-dihydroxyadipate

4-deoxy-6-O-methyl-L-threo-hex-4-enopyranuronate

(S)-4-hydroxy-2-oxoheptanedioic acid

1,4,5-Trihydroxy-5-hydroxymethyl-cyclohex-1-en-3-one

(2Z)-2-[2-(methylsulfanyl)ethyl]but-2-enedioic acid

Indole-3-glycolate

Hydrogen isocitrate

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

beta-Aspartylglycine

2-(Carboxymethyl)-2-hydroxybutanedioate

3-Oxido-4,5-dihydro-[1,2,5]oxadiazolo[3,4-f]cinnolin-3-ium

N-acetyl-D-methionine(1-)

C7H12NO3S- (190.0537862)

A D-alpha-amino acid anion resulting from the removal of the proton from the carboxy group of N-acetyl-D-methionine.

2-Acetamido-4-(methylsulfanyl)butanoate

C7H12NO3S- (190.0537862)

3-Carboxy-3-hydroxypentanedioate

C6H8NO4S- (190.01740279999999)

(3R,5R)-1,4-thiomorpholine-3,5-dicarboxylate

Nitrilotriacetate(1-)

C6H8NO6- (190.0351608)

5,6-Dioxidoindole-2-carboxylate

C9H4NO4-3 (190.0140324)

7-Hydroxy-1-oxoisochromene-3-carbaldehyde

2-Trideutromethyl-3-methylthiochromone

5_Hydroxy_3_indole_acetic_acid

Carglumic Acid

A - Alimentary tract and metabolism > A16 - Other alimentary tract and metabolism products > A16A - Other alimentary tract and metabolism products > A16AA - Amino acids and derivatives C78275 - Agent Affecting Blood or Body Fluid

3-Dehydroquinic acid

A 4-oxo monocarboxylic acid derived from quinic acid by oxidation of the hydroxy group at position 3 to the corresponding keto group.

Oxalosuccinic acid

1-oxopropane-1,2,3-tricarboxylic acid