Exact Mass: 324.03586580000007

Exact Mass Matches: 324.03586580000007

Found 231 metabolites which its exact mass value is equals to given mass value 324.03586580000007, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Uridine 5'-monophosphate

{[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid

C9H13N2O9P (324.03586580000007)


Uridine 5-monophosphate (UMP), also known as uridylic acid or uridylate, belongs to the class of organic compounds known as pyrimidine ribonucleoside monophosphates. These are pyrimidine ribobucleotides with monophosphate group linked to the ribose moiety. UMP consists of a phosphate group, a pentose sugar ribose, and the nucleobase uracil; hence, it is a ribonucleotide monophosphate. Uridine 5-monophosphate exists in all living species, ranging from bacteria to plants to humans. UMP is a nucleotide that is primarily used as a monomer in RNA biosynthesis. Uridine monophosphate is formed from Orotidine 5-monophosphate (orotidylic acid) in a decarboxylation reaction catalyzed by the enzyme orotidylate decarboxylase. Within humans, uridine 5-monophosphate participates in a number of enzymatic reactions. In particular, uridine 5-monophosphate can be converted into uridine 5-diphosphate through the action of the enzyme UMP-CMP kinase. In addition, uridine 5-monophosphate can be biosynthesized from uridine 5-diphosphate through its interaction with the enzyme soluble calcium-activated nucleotidase 1. In brain research studies, uridine monophosphate has been used as a convenient delivery compound for uridine. Uridine is present in many foods, mainly in the form of RNA. Non-phosphorylated uridine is not bioavailable beyond first-pass metabolism. In a study, gerbils fed a combination of uridine monophosphate, choline, and docosahexaenoic acid (DHA) were found to have significantly improved performance in running mazes over those not fed the supplements, implying an increase in cognitive function (PMID: 18606862). 5′-UMP. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=58-97-9 (retrieved 2024-07-02) (CAS RN: 58-97-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). Uridine 5'-monophosphate (5'-?Uridylic acid), a monophosphate form of UTP, can be acquired either from a de novo pathway or degradation products of nucleotides and nucleic acids in vivo and is a major nucleotide analogue in mammalian milk[1]. Uridine 5'-monophosphate (5'-?Uridylic acid), a monophosphate form of UTP, can be acquired either from a de novo pathway or degradation products of nucleotides and nucleic acids in vivo and is a major nucleotide analogue in mammalian milk[1]. Uridine 5'-monophosphate (5'-?Uridylic acid), a monophosphate form of UTP, can be acquired either from a de novo pathway or degradation products of nucleotides and nucleic acids in vivo and is a major nucleotide analogue in mammalian milk[1].

   

Sterigmatocystin

15-hydroxy-11-methoxy-6,8,20-trioxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1(12),2(9),4,10,14,16,18-heptaen-13-one

C18H12O6 (324.06338519999997)


Sterigmatocystin is a mycotoxin of Aspergillus versicolor and Chaetomium species Sterigmatocystin is a poison of the type dermatoxin, from the fungi genus Aspergillus. It appears on crusts of cheese with mold. Sterigmatocystin is a toxic metabolite structurally closely related to the aflatoxins (compare general fact sheet number 2), and consists of a xanthone nucleus attached to a bifuran structure. Sterigmatocystin is mainly produced by the fungi Aspergillus nidulans and A. versicolor. It has been reported in mouldy grain, green coffee beans and cheese although information on its occurrence in foods is limited. It appears to occur much less frequently than the aflatoxins, although analytical methods for its determination have not been as sensitive until recently, and so it is possible that small concentrations in food commodities may not always have been detected. Although it is a potent liver carcinogen similar to aflatoxin B1, current knowledge suggests that it is nowhere near as widespread in its occurrence. If this is the true situation it would be justified to consider sterigmatocystin as no more than a risk to consumers in special or unusual circumstances. Sterigmatocystin is a number of closely related compounds such o-methyl sterigmatocystin are known and some may also occur naturally. The IARC-classification of sterigmatocystin is group 2B, which means it is possibly carcinogenic to humans. In practice, the risk is quite low however, because this substance only appears on cheese crusts with mold, and because of that the chance of daily exposure is very low. Sterigmatocystin is a molded crust is best not to be consumed in whole, but after removing the crust, the cheese can still be consumed. Sterigmatocystin is a different kind of mold than that which appears on cheese itself, which can simply be removed before further consumption D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 2320

   

Cyazofamid

Pesticide5_Cyazofamid_C13H13ClN4O2S_4-Chloro-1-(dimethylaminosulfonyl)-5-(p-tolyl)imidazole-2-carbonitrile

C13H13ClN4O2S (324.04477080000004)


   

Pyochelin

2-(2-o-hydroxyphenyl-2-thiazolin-4-yl)-3-methylthiazolidine-4-carboxylic acid

C14H16N2O3S2 (324.0602306)


A member of the class of thiazolidines that is (4R)-3-methyl-1,3-thiazolidine-4-carboxylic acid which is substituted at position 2 by a (4R)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl group. A siderophore that is produced by Pseudomonas aeruginosa (via condensation of salicylic acid and two molecules of cysteine) as a mixture of two easily interconvertible diastereoisomers, pyochelin I (major) and pyochelin II (minor). The enantiomeric compounds, enant-pyochelin, are produced by Pseudomonas fluorescens. D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents

   

Pseudouridine 5'-phosphate

{[(2R,3S,4R,5S)-5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid

C9H13N2O9P (324.03586580000007)


Pseudouridine (5-ribosyluracil) is a ubiquitous yet enigmatic constituent of structural RNAs (transfer, ribosomal, small nuclear, and small nucleolar). Although pseudouridine (psi) was the first modified nucleoside to be discovered in RNA, and is the most abundant, its biosynthesis and biological roles have remained poorly understood since its identification as a "fifth nucleoside" in RNA. Recently, a combination of biochemical, biophysical, and genetic approaches has helped to illuminate the structural consequences of psi in polyribonucleotides, the biochemical mechanism of U-->psi isomerization in RNA, and the role of modification enzymes (psi synthases) and box H/ACA snoRNAs, a class of eukaryotic small nucleolar RNAs, in the site-specific biosynthesis of psi. Through its unique ability to coordinate a structural water molecule via its free N1-H, psi exerts a subtle but significant "rigidifying" influence on the nearby sugar-phosphate backbone and also enhances base stacking. These effects may underlie the biological role of most (but perhaps not all) of the psi residues in RNA. Certain genetic mutants lacking specific psi residues in tRNA or rRNA exhibit difficulties in translation, display slow growth rates, and fail to compete effectively with wild-type strains in mixed culture. In particular, normal growth is severely compromised in an Escherichia coli mutant deficient in a pseudouridine synthase responsible for the formation of three closely spaced psi residues in the mRNA decoding region of the 23S rRNA. Such studies demonstrate that pseudouridylation of RNA confers an important selective advantage in a natural biological context. PMID: 10902565 [HMDB]. Pseudouridine 5-phosphate is found in many foods, some of which are garland chrysanthemum, chives, broad bean, and green bell pepper. Pseudouridine (5-ribosyluracil) is a ubiquitous yet enigmatic constituent of structural RNAs (transfer, ribosomal, small nuclear, and small nucleolar). Although pseudouridine (psi) was the first modified nucleoside to be discovered in RNA, and is the most abundant, its biosynthesis and biological roles have remained poorly understood since its identification as a "fifth nucleoside" in RNA. Recently, a combination of biochemical, biophysical, and genetic approaches has helped to illuminate the structural consequences of psi in polyribonucleotides, the biochemical mechanism of U-->psi isomerization in RNA, and the role of modification enzymes (psi synthases) and box H/ACA snoRNAs, a class of eukaryotic small nucleolar RNAs, in the site-specific biosynthesis of psi. Through its unique ability to coordinate a structural water molecule via its free N1-H, psi exerts a subtle but significant "rigidifying" influence on the nearby sugar-phosphate backbone and also enhances base stacking. These effects may underlie the biological role of most (but perhaps not all) of the psi residues in RNA. Certain genetic mutants lacking specific psi residues in tRNA or rRNA exhibit difficulties in translation, display slow growth rates, and fail to compete effectively with wild-type strains in mixed culture. In particular, normal growth is severely compromised in an Escherichia coli mutant deficient in a pseudouridine synthase responsible for the formation of three closely spaced psi residues in the mRNA decoding region of the 23S rRNA. Such studies demonstrate that pseudouridylation of RNA confers an important selective advantage in a natural biological context. PMID: 10902565.

   

5-O-(1-Carboxyvinyl)-3-phosphoshikimate

5-(1-carboxyethenoxy)-4-hydroxy-3-phosphonooxycyclohexene-1-carboxylic acid

C10H13O10P (324.0246328)


   

Uridine 3'-monophosphate

{[(2R,3S,4R,5R)-4-hydroxy-5-(4-hydroxy-2-oxo-1,2-dihydropyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid

C9H13N2O9P (324.03586580000007)


Uridine 3-monophosphate (3-UMP) belongs to the class of compounds called pentose phosphates. These are carbohydrate derivatives containing a pentose substituted by one or more phosphate groups. Uridine 3-monophosphate has been identified in the human placenta (PMID: 32033212). COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Uridine 2'-phosphate

{[(2R,3R,4R,5R)-2-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid

C9H13N2O9P (324.03586580000007)


Uridine 2- phosphate is a product of the decylclization reaction carried out by the enzyme 2,3-cyclic nucleotide-3-phosphodiesterase (CNPase, EC 3.1.4.37) which hydrolyses Uridine 2,3-cyclic phosphate to Uridine 2-phosphate. CNPase is a unique RNase in that it only cleaves nucleoside 2,3-cyclic phosphates and not the RNA internucleotide linkage, like other RNases such as RNase A and RNase T1. [HMDB] Uridine 2- phosphate is a product of the decylclization reaction carried out by the enzyme 2,3-cyclic nucleotide-3-phosphodiesterase (CNPase, EC 3.1.4.37) which hydrolyses Uridine 2,3-cyclic phosphate to Uridine 2-phosphate. CNPase is a unique RNase in that it only cleaves nucleoside 2,3-cyclic phosphates and not the RNA internucleotide linkage, like other RNases such as RNase A and RNase T1.

   

Dorzolamide

(4S,6S)-4-Ethylamino-6-methyl-7,7-dioxo-4,5,6,7-tetrahydro-7lambda*6*-thieno[2,3-b]thiopyran-2-sulphonic acid amide

C10H16N2O4S3 (324.0272176)


Dorzolamide is only found in individuals that have used or taken this drug. It is a carbonic anhydrase (CA) inhibitor. It is used in ophthalmic solutions (Trusopt) to lower intraocular pressure (IOP) in open-angle glaucoma and ocular hypertension.Dorzolamide is a sulfonamide and a highly specific carbonic anhydrase II (CA-II) inhibitor, which is the main CA isoenzyme involved in aqueous humor secretion. Inhibition of CA-II in the ciliary processes of the eye decreases aqueous humor secretion, presumably by slowing the formation of bicarbonate ions with subsequent reduction in sodium and fluid transport. Dorzolamide also accumulates in red blood cells as a result of CA-II binding, as CA-II is found predominantly in erythrocytes. However, sufficient CA-II activity remains so that adverse effects due to systemic CA inhibition are not observed. S - Sensory organs > S01 - Ophthalmologicals > S01E - Antiglaucoma preparations and miotics > S01EC - Carbonic anhydrase inhibitors D004791 - Enzyme Inhibitors > D002257 - Carbonic Anhydrase Inhibitors D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents C471 - Enzyme Inhibitor > C29577 - Carbonic Anhydrase Inhibitor

   

Ethyl-4,4-dichlorobenzilate

Ethyl 2-hydroxy-2,2-bis(4-chlorophenyl)acetate

C16H14Cl2O3 (324.0319954)


   

6-Deoxy-6-sulfo-D-fructose 1-phosphate

6-deoxy-6-sulfo-D-fructofuranose 1-phosphate

C6H13O11PS (323.9916198)


   

4-hydroxyalprazolam

12-chloro-3-methyl-9-phenyl-2,4,5,8-tetraazatricyclo[8.4.0.0²,⁶]tetradeca-1(10),3,5,8,11,13-hexaen-7-ol

C17H13ClN4O (324.0777838)


4-Hydroxyalprazolam is a metaboltie of Alprazolam. Alprazolam (trade name Xanax, available among other generic names) is a short-acting anxiolytic of the benzodiazepine class of psychoactive drugs. Alprazolam is extensively metabolized in humans, primarily by cytochrome P450 3A4 (Cyp3A4), to two major metabolites in plasma: 4-hydroxyalprazolam and α- hydroxyalprazolam. (Wikipedia)

   

Alpha-hydroxyalprazolam

{12-chloro-9-phenyl-2,4,5,8-tetraazatricyclo[8.4.0.0²,⁶]tetradeca-1(10),3,5,8,11,13-hexaen-3-yl}methanol

C17H13ClN4O (324.0777838)


Alpha-hydroxyalprazolam is a metabolite of both alprazolam and adinazolam. Alprazolam (trade name Xanax, available among other generic names) is a short-acting anxiolytic of the benzodiazepine class of psychoactive drugs. Alprazolam, like other benzodiazepines, binds to specific sites on the GABAA gamma-amino-butyric acid receptor. Adinazolam (marketed under the brand name Deracyn) is a benzodiazepine derivative. It possesses anxiolytic, anticonvulsant, sedative, and antidepressant properties. Adinazolam was developed by Dr. Jackson B. Hester, who was seeking to enhance the antidepressant properties of alprazolam, which he also developed. (Wikipedia) Alpha-hydroxyalprazolam belongs to the family of Benzodiazepines. These are organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).

   

6-Chlorocatechin

6-chloro-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol, 9ci

C15H13ClO6 (324.0400628)


6-Chlorocatechin is a constituent of the roots of Rumex patientia (patience dock). Constituent of the roots of Rumex patientia (patience dock)

   

Grevilline A

(6E)-3-hydroxy-4-(4-hydroxyphenyl)-6-[(4-hydroxyphenyl)methylidene]-5,6-dihydro-2H-pyran-2,5-dione

C18H12O6 (324.06338519999997)


Grevilline A is found in mushrooms. Grevilline A is a pigment from Suillus grevillei (larch bolete

   

Mahaleboside

5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one

C15H16O8 (324.0845136)


Mahaleboside is found in fruits. Mahaleboside is a constituent of Prunus mahaleb (mahaleb cherry). Constituent of Prunus mahaleb (mahaleb cherry). Mahaleboside is found in fruits.

   

Urolithin c 3-sulfate

{8,9-dihydroxy-6-oxo-6H-benzo[c]chromen-3-yl}oxidanesulphonic acid

C13H8O8S (323.9939888)


   

(2R)-2-Acetamido-3-[[(2R)-2-acetamido-2-carboxyethyl]disulfanyl]propanoic acid

(2R)-2-Acetamido-3-[[(2R)-2-acetamido-2-carboxyethyl]disulphanyl]propanoic acid

C10H16N2O6S2 (324.0449756)


   

1-(4-Chlorophenyl)-3-((4-methylphenyl)sulfonyl)urea

N-(4-Chlorophenyl)-n-(4-methylbenzenesulphonyl)carbamimidic acid

C14H13ClN2O3S (324.03353780000003)


   

4'-Hydroxy Nimesulide

N-[2-(4-Hydroxyphenoxy)-4-nitrophenyl]methanesulphonamide

C13H12N2O6S (324.04160520000005)


   

[(2S,3R,4R,5R)-5-(2,4-Dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

{[5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid

C9H13N2O9P (324.03586580000007)


   

2-(2-Hydroxyethoxy)-6-(2H-tetrazol-5-yl)xanthen-9-one

2-(2-hydroxyethoxy)-6-(2H-1,2,3,4-tetrazol-5-yl)-9H-xanthen-9-one

C16H12N4O4 (324.08585120000004)


   

1-(3',4'-Dichloro-2-fluoro(1,1'-biphenyl)-4-yl)cyclopropanecarboxylic acid

1-(3,4-Dichloro-2-fluoro(1,1-biphenyl)-4-yl)cyclopropanecarboxylic acid

C16H11Cl2FO2 (324.0120098)


D004791 - Enzyme Inhibitors > D000091062 - Gamma Secretase Inhibitors and Modulators C471 - Enzyme Inhibitor

   

Dulofibrate

4-Chlorophenyl 2-(4-chlorophenoxy)-2-methylpropanoic acid

C16H14Cl2O3 (324.0319954)


C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98150 - Fibrate Antilipidemic Agent

   

2'-Deoxy-5'-O-thiophosphonouridine

{[5-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy}phosphonothioic acid

C9H13N2O7PS (324.01810780000005)


   

Glucose pyruvate acetate

2-[2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]acetyl 2-oxopropaneperoxoic acid

C11H16O11 (324.0692586)


   

Pyochelin

2-[2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-3-methyl-1,3-thiazolidine-4-carboxylic acid

C14H16N2O3S2 (324.0602306)


D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents

   

Ribavirin monophosphate

[(2R,3S,4R,5R)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

C8H13N4O8P (324.0470988)


   

2-Amino-3-[[(2R)-2-carboxy-2-(diacetylamino)ethyl]disulfanyl]propanoic acid

2-Amino-3-[[(2R)-2-carboxy-2-(diacetylamino)ethyl]disulphanyl]propanoic acid

C10H16N2O6S2 (324.0449756)


   

Skimmin

7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one

C15H16O8 (324.0845136)


Skimmin is a member of the class of compounds known as coumarin glycosides. Coumarin glycosides are aromatic compounds containing a carbohydrate moiety glycosidically bound to a coumarin moiety. Skimmin is soluble (in water) and a very weakly acidic compound (based on its pKa). Skimmin can be found in sweet potato, which makes skimmin a potential biomarker for the consumption of this food product. Skimmin is a glucoside of umbelliferone . Skimmin (Umbelliferone glucoside) is a coumarin found in Hydrangea paniculata, inhibits immune complex deposition, with anti-inflammatory activity[1]. Skimmin (Umbelliferone glucoside) is a coumarin found in Hydrangea paniculata, inhibits immune complex deposition, with anti-inflammatory activity[1].

   

(-)-Homoeriodictyol, sodium salt

sodium (2S)-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-olate

C16H13NaO6 (324.06097980000004)


It is used as a food additive .

   

Skimmin

7-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-2H-chromen-2-one

C15H16O8 (324.0845136)


Skimmin is a member of coumarins and a glycoside. Skimmin is a natural product found in Artemisia ordosica, Astragalus brachycarpus, and other organisms with data available. Skimmin (Umbelliferone glucoside) is a coumarin found in Hydrangea paniculata, inhibits immune complex deposition, with anti-inflammatory activity[1]. Skimmin (Umbelliferone glucoside) is a coumarin found in Hydrangea paniculata, inhibits immune complex deposition, with anti-inflammatory activity[1].

   
   
   

Neobanol

(6aR) -6H- [ 1,3 ] Dioxolo [ 5,6 ] benzofuro [ 3,2-c ] furo [ 3,2-g ] [ 1 ] benzopyran-6abeta (12abetaH) -ol

C18H12O6 (324.06338519999997)


   

(-)-6-Chloroepicatechin

(-)-6-Chloroepicatechin

C15H13ClO6 (324.0400628)


   
   
   
   

SSR180711

4-Bromophenyl 1,4-diazabicyclo(3.2.2)nonane-4-carboxylate

C14H17BrN2O2 (324.04733219999997)


CONFIDENCE standard compound; INTERNAL_ID 540; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6821; ORIGINAL_PRECURSOR_SCAN_NO 6820 CONFIDENCE standard compound; INTERNAL_ID 540; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6858; ORIGINAL_PRECURSOR_SCAN_NO 6856 CONFIDENCE standard compound; INTERNAL_ID 540; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6861; ORIGINAL_PRECURSOR_SCAN_NO 6859 CONFIDENCE standard compound; INTERNAL_ID 540; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6885; ORIGINAL_PRECURSOR_SCAN_NO 6883 CONFIDENCE standard compound; INTERNAL_ID 540; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6890; ORIGINAL_PRECURSOR_SCAN_NO 6888 CONFIDENCE standard compound; INTERNAL_ID 540; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6898; ORIGINAL_PRECURSOR_SCAN_NO 6895

   
   

1-Propyl-1-[2-(2,4,6-trichlorophenoxy)ethyl]urea

Urea, N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-

C12H15Cl3N2O2 (324.019906)


   
   

2-prop-1-ynyl-5-(1-acetoxy-2-chloroethyl)-dithiophene|2-prop-1-ynyl-5-<1-acetoxy-2-chloroethyl>-dithiophene

2-prop-1-ynyl-5-(1-acetoxy-2-chloroethyl)-dithiophene|2-prop-1-ynyl-5-<1-acetoxy-2-chloroethyl>-dithiophene

C15H13ClO2S2 (324.0045468)


   

4-(3,4-dihydroxyphenyl)-6,7-dihydroxy-3H-benzo[f]isobenzofuran-1-one

4-(3,4-dihydroxyphenyl)-6,7-dihydroxy-3H-benzo[f]isobenzofuran-1-one

C18H12O6 (324.06338519999997)


   
   
   

2-(4-carboxy-3-methoxystyryl)-2-methoxysuccinic acid|5-(4-carboxy-3-methoxyphenyl)-3-methoxy-3-carboxy-4-pentenoic acid

2-(4-carboxy-3-methoxystyryl)-2-methoxysuccinic acid|5-(4-carboxy-3-methoxyphenyl)-3-methoxy-3-carboxy-4-pentenoic acid

C15H16O8 (324.0845136)


   
   

debromoisocymobarbatol

debromoisocymobarbatol

C16H21BrO2 (324.0724826)


   
   

Atromentin

Atromentin

C18H12O6 (324.06338519999997)


A member of the class of dihydroxy-1,4-benzoquinones that is 2,5-dihydroxycyclohexa-2,5-diene-1,4-dione which is substituted by a 4-hydroxyphenyl group at positions 3 and 6. It is a mushroom pigment isolated from several fungi species and acts as a smooth muscle stimulant, and exhibits anticoagulant, antibacterial and antineoplastic properties.

   

9,10-Anthracenedione, 1,4-bis(acetyloxy)-

9,10-Anthracenedione, 1,4-bis(acetyloxy)-

C18H12O6 (324.06338519999997)


   
   
   
   
   

(3R)-6-hydroxy-3-hydroxymethyl-2-methyl-2,3-dihydro-10H-3r,10ac-epidisulfano-pyrazino[1,2-a]indole-1,4-dione|Dehydrogliotoxin|Dehydroglyotoxin

(3R)-6-hydroxy-3-hydroxymethyl-2-methyl-2,3-dihydro-10H-3r,10ac-epidisulfano-pyrazino[1,2-a]indole-1,4-dione|Dehydrogliotoxin|Dehydroglyotoxin

C13H12N2O4S2 (324.0238472)


   
   

UMBELLIFERONE GLUCOSIDE

UMBELLIFERONE GLUCOSIDE

C15H16O8 (324.0845136)


   

6-O-p-coumaroyl-L-galactono-1,4-lactone

6-O-p-coumaroyl-L-galactono-1,4-lactone

C15H16O8 (324.0845136)


   
   
   
   

9,10-Dioxo-9,10-dihydroanthracene-1,2-diyl diacetate

9,10-Dioxo-9,10-dihydroanthracene-1,2-diyl diacetate

C18H12O6 (324.06338519999997)


   
   

Sterigmatocystin

Sterigmatocystine

C18H12O6 (324.06338519999997)


An organic heteropentacyclic compound whose skeleton comprises a xanthene ring system ortho-fused to a dihydrofuranofuran moiety. The parent of the class of sterigmatocystins. D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins CONFIDENCE Reference Standard (Level 1)

   
   

Uridine 5-monophosphate

Uridine 5-monophosphate

C9H13N2O9P (324.03586580000007)


relative retention time with respect to 9-anthracene Carboxylic Acid is 0.085

   

Uridine monophosphate

Uridine 5_-monophosphate

C9H13N2O9P (324.03586580000007)


A pyrimidine ribonucleoside 5-monophosphate having uracil as the nucleobase. COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Uridine 5'-monophosphate (5'-?Uridylic acid), a monophosphate form of UTP, can be acquired either from a de novo pathway or degradation products of nucleotides and nucleic acids in vivo and is a major nucleotide analogue in mammalian milk[1]. Uridine 5'-monophosphate (5'-?Uridylic acid), a monophosphate form of UTP, can be acquired either from a de novo pathway or degradation products of nucleotides and nucleic acids in vivo and is a major nucleotide analogue in mammalian milk[1]. Uridine 5'-monophosphate (5'-?Uridylic acid), a monophosphate form of UTP, can be acquired either from a de novo pathway or degradation products of nucleotides and nucleic acids in vivo and is a major nucleotide analogue in mammalian milk[1].

   

7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

NCGC00384579-01!7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

C15H16O8 (324.0845136)


   

PRZ_M325

Urea, N-propyl-N-[2-(2,4,6-trichlorophenoxy)ethyl]-

C12H15Cl3N2O2 (324.019906)


CONFIDENCE Transformation product, tentative ID (Level 2b); INTERNAL_ID 2007

   
   
   
   
   
   
   

5-Azacytidine 5-monophosphate

5-Azacytidine 5-monophosphate

C8H13N4O8P (324.0470988)


   

Ribavirin 5-phosphate

Ribavirin 5-phosphate

C8H13N4O8P (324.0470988)


   

ML-9

1-[(5-chloro-1-naphthalenyl)sulfonyl]hexahydro-1H-1,4-diazepine, monohydrochloride

C15H17ClN2O2S (324.0699212)


   

(2R,2R)-3,3-disulfanediylbis(2-acetamidopropanoic acid)

(2R,2R)-3,3-disulfanediylbis(2-acetamidopropanoic acid)

C10H16N2O6S2 (324.0449756)


   
   
   

Grevilline A

(6E)-3-hydroxy-4-(4-hydroxyphenyl)-6-[(4-hydroxyphenyl)methylidene]-5,6-dihydro-2H-pyran-2,5-dione

C18H12O6 (324.06338519999997)


   

Mahaleboside

5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2H-chromen-2-one

C15H16O8 (324.0845136)


   

UNII:U0COM4319X

4-Hydroxyalprazolam

C17H13ClN4O (324.0777838)


   

6-Chlorocatechin

6-chloro-2-(3,4-Dihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-3,5,7-triol, 9ci

C15H13ClO6 (324.0400628)


   

1-Hydroxyalprazolam

alpha-Hydroxyalprazolam

C17H13ClN4O (324.0777838)


   

4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]benzaldehyde

4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]benzaldehyde

C16H14Cl2O3 (324.0319954)


   
   

4-(2,6-DICHLORO-BENZYLOXY)-3-ETHOXY-BENZALDEHYDE

4-(2,6-DICHLORO-BENZYLOXY)-3-ETHOXY-BENZALDEHYDE

C16H14Cl2O3 (324.0319954)


   

7,7,8,8-TETRACYANO-2,5-BIS(2-HYDROXYETHOXY)QUINODIMETHANE

7,7,8,8-TETRACYANO-2,5-BIS(2-HYDROXYETHOXY)QUINODIMETHANE

C16H12N4O4 (324.08585120000004)


   

2,3,6,7,10,11-Triphenylenehexol

2,3,6,7,10,11-Triphenylenehexol

C18H12O6 (324.06338519999997)


   

(R)-[3,4-(METHYLENEDIOXY)PHENYL]-1-BUTYLAMINEHYDROCHLORIDE

(R)-[3,4-(METHYLENEDIOXY)PHENYL]-1-BUTYLAMINEHYDROCHLORIDE

C15H17BrO3 (324.03609919999997)


   

3-[3-(4-chloro-phenyl)-1-phenyl-1h-pyrazol-4-yl]-acrylic acid

3-[3-(4-chloro-phenyl)-1-phenyl-1h-pyrazol-4-yl]-acrylic acid

C18H13ClN2O2 (324.0665508)


   

1-(2-CHLOROBENZYLOXY)-3-(3-CHLORO-4-METHYLPHENYL)UREA

1-(2-CHLOROBENZYLOXY)-3-(3-CHLORO-4-METHYLPHENYL)UREA

C15H14Cl2N2O2 (324.0432284)


   

3-BROMO-2-(2-FLUOROBENZYLOXY)PHENYLBOR&

3-BROMO-2-(2-FLUOROBENZYLOXY)PHENYLBOR&

C13H11BBrFO3 (323.99685980000004)


   

3-BROMO-2-(4-FLUOROBENZYLOXY)PHENYLBOR&

3-BROMO-2-(4-FLUOROBENZYLOXY)PHENYLBOR&

C13H11BBrFO3 (323.99685980000004)


   
   

7-(BENZYLOXY)-4-CHLORO-6-METHOXYQUINOLINE-3-CARBONITRILE

7-(BENZYLOXY)-4-CHLORO-6-METHOXYQUINOLINE-3-CARBONITRILE

C18H13ClN2O2 (324.0665508)


   

DL-ALPHA-GLYCEROPHOSPHATE DISODIUM SALT

DL-ALPHA-GLYCEROPHOSPHATE DISODIUM SALT

C3H19Na2O12P (324.04095040000004)


   

3-(Benzyloxy)-6-bromo-2-fluorophenylboronic acid

3-(Benzyloxy)-6-bromo-2-fluorophenylboronic acid

C13H11BBrFO3 (323.99685980000004)


   

4-hydroxy-1-methyl-3-[(3-nitrophenyl)azo]-2-quinolone

4-hydroxy-1-methyl-3-[(3-nitrophenyl)azo]-2-quinolone

C16H12N4O4 (324.08585120000004)


   

1H-Pyrrolo[2,3-b]pyridine, 1-(phenylsulfonyl)-5-(1H-pyrazol-4-yl)-

1H-Pyrrolo[2,3-b]pyridine, 1-(phenylsulfonyl)-5-(1H-pyrazol-4-yl)-

C16H12N4O2S (324.0680932)


   

diethoxy-(4-methylsulfonylphenoxy)-sulfanylidene-λ5-phosphane

diethoxy-(4-methylsulfonylphenoxy)-sulfanylidene-λ5-phosphane

C11H17O5PS2 (324.0255002)


   
   

4-(4-Methylpiperazinylmethyl)benzoyl chloride dihydrochloride

4-(4-Methylpiperazinylmethyl)benzoyl chloride dihydrochloride

C13H19Cl3N2O (324.0562894)


   

4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL

4-(2,4-DICHLOROPHENYL)-5-(1-METHYL-1H-PYRROL-2-YL)-4H-1,2,4-TRIAZOLE-3-THIOL

C13H10Cl2N4S (324.00032000000004)


   
   
   

1H-Pyrrolo[2,3-b]pyridine, 4-chloro-5-fluoro-1-[(4-methylphenyl)sulfonyl]-

1H-Pyrrolo[2,3-b]pyridine, 4-chloro-5-fluoro-1-[(4-methylphenyl)sulfonyl]-

C14H10ClFN2O2S (324.0135522)


   

1H-Pyrrolo[2,3-b]pyridine, 4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]-

1H-Pyrrolo[2,3-b]pyridine, 4-chloro-3-fluoro-1-[(4-methylphenyl)sulfonyl]-

C14H10ClFN2O2S (324.0135522)


   

6-(Benzyloxy)-4-chloro-7-methoxy-3-quinolinecarbonitrile

6-(Benzyloxy)-4-chloro-7-methoxy-3-quinolinecarbonitrile

C18H13ClN2O2 (324.0665508)


   

Monosodium PIPES

1,4-Piperazinediethanesulfonic acid, monosodium salt

C8H17N2NaO6S2 (324.0425702)


   

1-(4-iodophenyl)piperazine,hydrochloride

1-(4-iodophenyl)piperazine,hydrochloride

C10H14ClIN2 (323.9890224)


   

4-(5-Brom-2-chlorbenzyl)phenyl-ethylether

4-(5-Brom-2-chlorbenzyl)phenyl-ethylether

C15H14BrClO (323.99164840000003)


   

1-(4-CARBOXYPHENYL)-5-(MERCAPTOTETRAZOLE)-DISODIUMSALT

1-(4-CARBOXYPHENYL)-5-(MERCAPTOTETRAZOLE)-DISODIUMSALT

C16H11Cl3O (323.9875446)


   
   

5-(3-chloro-2-fluorobenzyl)-2,4-diMethoxybenzoic acid

5-(3-chloro-2-fluorobenzyl)-2,4-diMethoxybenzoic acid

C16H14ClFO4 (324.05646060000004)


   

1,3-BIS(4-CHLOROPHENYL)-1H-IMIDAZOL-3-IUM CHLORIDE

1,3-BIS(4-CHLOROPHENYL)-1H-IMIDAZOL-3-IUM CHLORIDE

C15H11Cl3N2 (323.9987776)


   

2,5-Anhydroglucitol-1,6-Biphosphate

2,5-Anhydro-D-glucitol-1,6-diphosphate

C6H14O11P2 (324.0011354)


   

1-(3,4,5-TRIMETHOXY-PHENYL)-ETHYLAMINE

1-(3,4,5-TRIMETHOXY-PHENYL)-ETHYLAMINE

C15H14Cl2N2O2 (324.0432284)


   

methyl 3-(2,4-dinitrophenoxy)thiophene-2-carboxylate

methyl 3-(2,4-dinitrophenoxy)thiophene-2-carboxylate

C12H8N2O7S (324.0052218)


   

1,3,5-TRI(THIOPHEN-2-YL)BENZENE

1,3,5-TRI(THIOPHEN-2-YL)BENZENE

C18H12S3 (324.0101112)


   

1,7-Dioxaspiro[4.4]nonane-2,6-dione,8-[(1S)-1,2-dihydroxyethyl]-9-hydroxy-4-(4-hydroxyphenyl)-, (4R,5S,8R,9R)-(9CI)

1,7-Dioxaspiro[4.4]nonane-2,6-dione,8-[(1S)-1,2-dihydroxyethyl]-9-hydroxy-4-(4-hydroxyphenyl)-, (4R,5S,8R,9R)-(9CI)

C15H16O8 (324.0845136)


   

Allyl 4-(4-bromophenyl)piperazine-1-carboxylate

Allyl 4-(4-bromophenyl)piperazine-1-carboxylate

C14H17BrN2O2 (324.04733219999997)


   

BIS(1-BENZOTRIAZOLYL) OXALATE

BIS(1-BENZOTRIAZOLYL) OXALATE

C14H8N6O4 (324.0607008)


   
   

1-(4-TRIFLUOROMETHYL-BENZYL)-PYRROLIDIN-3-YLAMINEDIHYDROCHLORIDE

1-(4-TRIFLUOROMETHYL-BENZYL)-PYRROLIDIN-3-YLAMINEDIHYDROCHLORIDE

C13H13Cl2F3N2 (324.0407834)


   

1H-Pyrrolo[2,3-b]pyridine, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-

1H-Pyrrolo[2,3-b]pyridine, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-

C11H9IN4 (323.98719439999996)


   

Methyl 3-{[(trifluoromethyl)sulfonyl]oxy}-1H-pyrrolo[2,3-b]pyridi ne-2-carboxylate

Methyl 3-{[(trifluoromethyl)sulfonyl]oxy}-1H-pyrrolo[2,3-b]pyridi ne-2-carboxylate

C10H7F3N2O5S (324.00277680000005)


   

10-(2,5-Dihydroxyphenyl)-10H-9-Oxa-10-Phospha-Phenantbrene-10-Oxide

10-(2,5-Dihydroxyphenyl)-10H-9-Oxa-10-Phospha-Phenantbrene-10-Oxide

C18H13O4P (324.05514280000006)


   

trans-6-Methyl-4-ethylamino-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide-7,7-dioxide

trans-6-Methyl-4-ethylamino-5,6-dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide-7,7-dioxide

C10H16N2O4S3 (324.0272176)


   

Bis-(toluene-4-sulfonyl)-methane

Bis-(toluene-4-sulfonyl)-methane

C15H16O4S2 (324.0489976)


   

3-[(4-CHLOROPHENYL)SULFONYL]METHYL-N-HYDROXYBENZENECARBOXIMIDAMIDE

3-[(4-CHLOROPHENYL)SULFONYL]METHYL-N-HYDROXYBENZENECARBOXIMIDAMIDE

C14H13ClN2O3S (324.03353780000003)


   

Vinylidene chloride, methyl acrylate, glycidyl methacrylate polymer

Vinylidene chloride, methyl acrylate, glycidyl methacrylate polymer

C13H18Cl2O5 (324.05312380000004)


   

5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yltrifluoromethanesulfonate

5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yltrifluoromethanesulfonate

C11H8F4N2O3S (324.01917460000004)


   

CHLOROPHOSPHORIC ACID BIS(2,6-DIMETHYLPHENYL) ESTER

CHLOROPHOSPHORIC ACID BIS(2,6-DIMETHYLPHENYL) ESTER

C16H18ClO3P (324.06820380000005)


   

N-Succinimidyl 4-(Azidosulfonyl)benzoate

N-Succinimidyl 4-(Azidosulfonyl)benzoate

C11H8N4O6S (324.0164548)


   

4,4-Azobis(4-Cyanovaleric Acid)Sodium Salt

4,4-Azobis(4-Cyanovaleric Acid)Sodium Salt

C12H14N4O4.Na2 (324.0810404)


   

2-ethenylsulfonyl-N-[2-[(2-ethenylsulfonylacetyl)amino]ethyl]acetamide

2-ethenylsulfonyl-N-[2-[(2-ethenylsulfonylacetyl)amino]ethyl]acetamide

C10H16N2O6S2 (324.0449756)


   
   

4-(3-BUTYLUREIDO)-2-CHLOROBENZENESULFONYLCHLORIDE

4-(3-BUTYLUREIDO)-2-CHLOROBENZENESULFONYLCHLORIDE

C11H14Cl2N2O3S (324.0102154)


   

2-(4-CHLOROSULPHONYLPHENYL)ETHYLTRIMETHOXYSILANE50 IN METHYLENE CHLORIDE

2-(4-CHLOROSULPHONYLPHENYL)ETHYLTRIMETHOXYSILANE50 IN METHYLENE CHLORIDE

C11H17ClO5SSi (324.02544620000003)


   

2-(TRIFLUOROMETHYL)-5-[4-(TRIFLUOROMETHYL)PHENYL]-3-FUROIC ACID

2-(TRIFLUOROMETHYL)-5-[4-(TRIFLUOROMETHYL)PHENYL]-3-FUROIC ACID

C13H6F6O3 (324.02211179999995)


   
   

(3Z)-1-methyl-3-[(4-nitrophenyl)hydrazinylidene]quinoline-2,4-dione

(3Z)-1-methyl-3-[(4-nitrophenyl)hydrazinylidene]quinoline-2,4-dione

C16H12N4O4 (324.08585120000004)


   
   

Nacubactam

Nacubactam

C9H16N4O7S (324.07396660000006)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic C471 - Enzyme Inhibitor

   

Odiparcil

Odiparcil

C15H16O6S (324.0667556)


C78275 - Agent Affecting Blood or Body Fluid > C29750 - Thrombolytic Agent

   

6-[(5-Chloro-3-methyl-1-benzofuran-2-YL)sulfonyl]pyridazin-3(2H)-one

6-[(5-Chloro-3-methyl-1-benzofuran-2-YL)sulfonyl]pyridazin-3(2H)-one

C13H9ClN2O4S (323.9971544)


   

3-Fluoro-3-deoxythymidine 5-monophosphate

3-Fluoro-3-deoxythymidine 5-monophosphate

C10H14FN2O7P (324.0522636)


   

Ethacrynate sodium

Ethacrynate sodium

C13H11Cl2NaO4 (323.99320660000006)


C78275 - Agent Affecting Blood or Body Fluid > C448 - Diuretic > C49184 - Loop Diuretic D002317 - Cardiovascular Agents > D045283 - Natriuretic Agents D045283 - Natriuretic Agents > D004232 - Diuretics D004791 - Enzyme Inhibitors

   

(2r,4r)-2-[(4r)-2-(2-Hydroxyphenyl)-4,5-Dihydro-1,3-Thiazol-4-Yl]-3-Methyl-1,3-Thiazolidine-4-Carboxylic Acid

(2r,4r)-2-[(4r)-2-(2-Hydroxyphenyl)-4,5-Dihydro-1,3-Thiazol-4-Yl]-3-Methyl-1,3-Thiazolidine-4-Carboxylic Acid

C14H16N2O3S2 (324.0602306)


D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents

   
   

1-(4-Chlorophenyl)-3-((4-methylphenyl)sulfonyl)urea

1-(4-Chlorophenyl)-3-((4-methylphenyl)sulfonyl)urea

C14H13ClN2O3S (324.03353780000003)


   
   

9H-Xanthen-9-one, 2-(2-hydroxyethoxy)-6-(1H-tetrazol-5-yl)-

9H-Xanthen-9-one, 2-(2-hydroxyethoxy)-6-(1H-tetrazol-5-yl)-

C16H12N4O4 (324.08585120000004)


   

2-(2-bromophenyl)-2,3-dihydro-1H-perimidine

2-(2-bromophenyl)-2,3-dihydro-1H-perimidine

C17H13BrN2 (324.0262038)


   
   

N-tert-butyl-2-[[4-(4-fluorophenyl)-2-thiazolyl]thio]acetamide

N-tert-butyl-2-[[4-(4-fluorophenyl)-2-thiazolyl]thio]acetamide

C15H17FN2OS2 (324.0766284)


   
   

N-[4-(4-morpholinyl)phenyl]-2-thiophenesulfonamide

N-[4-(4-morpholinyl)phenyl]-2-thiophenesulfonamide

C14H16N2O3S2 (324.0602306)


   

N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-2-thiophenecarboxamide

N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-2-thiophenecarboxamide

C11H8N4O6S (324.0164548)


   

N-[(E)-(2-hydroxy-5-nitrophenyl)methylidene]-1H-indole-3-carbohydrazide

N-[(E)-(2-hydroxy-5-nitrophenyl)methylidene]-1H-indole-3-carbohydrazide

C16H12N4O4 (324.08585120000004)


   

Pyochelin II

Pyochelin II

C14H16N2O3S2 (324.0602306)


A pyochelin that has S-stereochemistry at the thioaminal centre; the diastereoisomer with R-stereochemistry at this centre is pyochelin I. Pseudomonas aeruginosa produces a mixture of pyochelin I (major) and pyochelin I (minor) via condensation of salicylic acid and two molecules of cysteine. The enantiomeric compounds, enant-pyochelin I and II, are produced by Pseudomonas fluorescens.

   

7-[(4-Chlorophenyl)methylthio]-3-methyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

7-[(4-Chlorophenyl)methylthio]-3-methyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

C12H9ClN4OS2 (323.9906294)


   

7-[(3-Chlorophenyl)methylthio]-3-methyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

7-[(3-Chlorophenyl)methylthio]-3-methyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one

C12H9ClN4OS2 (323.9906294)


   

Ribavirin monophosphate

Ribavirin monophosphate

C8H13N4O8P (324.0470988)


D000890 - Anti-Infective Agents > D000998 - Antiviral Agents D004791 - Enzyme Inhibitors

   

5-[1-(4-methoxyphenyl)-1H-benzimidazol-6-yl]-1,3,4-oxadiazole-2(3H)-thione

5-[1-(4-methoxyphenyl)-1H-benzimidazol-6-yl]-1,3,4-oxadiazole-2(3H)-thione

C16H12N4O2S (324.0680932)


   

(5z)-12-Chloro-13,15-Dihydroxy-4,7,8,9-Tetrahydro-2-Benzoxacyclotridecine-1,10(3h,11h)-Dione

(5z)-12-Chloro-13,15-Dihydroxy-4,7,8,9-Tetrahydro-2-Benzoxacyclotridecine-1,10(3h,11h)-Dione

C16H17ClO5 (324.0764462)


   
   

(5e)-12-Chloro-13,15-Dihydroxy-4,7,8,9-Tetrahydro-2-Benzoxacyclotridecine-1,10(3h,11h)-Dione

(5e)-12-Chloro-13,15-Dihydroxy-4,7,8,9-Tetrahydro-2-Benzoxacyclotridecine-1,10(3h,11h)-Dione

C16H17ClO5 (324.0764462)


   

N-(4-{[amino(imino)methyl]amino}butyl)-2,4-bi-1,3-thiazole-4-carboxamide

N-(4-{[amino(imino)methyl]amino}butyl)-2,4-bi-1,3-thiazole-4-carboxamide

C12H16N6OS2 (324.08269659999996)


   

1-[2-Deoxyribofuranosyl]-2,4-difluoro-5-methyl-benzene-5monophosphate

1-[2-Deoxyribofuranosyl]-2,4-difluoro-5-methyl-benzene-5monophosphate

C12H15F2O6P (324.0574284)


   

2-Amino-3-[[(2R)-2-carboxy-2-(diacetylamino)ethyl]disulfanyl]propanoic acid

2-Amino-3-[[(2R)-2-carboxy-2-(diacetylamino)ethyl]disulphanyl]propanoic acid

C10H16N2O6S2 (324.0449756)


   
   

a 2,4-dioxotetrahydropyrimidine D-ribonucleotide

a 2,4-dioxotetrahydropyrimidine D-ribonucleotide

C9H13N2O9P-2 (324.03586580000007)


   

2-Deoxy-5-fluoro-uridine 5-monophosphate

2-Deoxy-5-fluoro-uridine 5-monophosphate

C9H10FN2O8P-2 (324.0158802)


   

Sinapoyltartronate(2-)

Sinapoyltartronate(2-)

C14H12O9-2 (324.0481302)


   

3,8,10,11-tetrahydroxy-1-methyl-12H-benzo[b]xanthen-12-one

3,8,10,11-tetrahydroxy-1-methyl-12H-benzo[b]xanthen-12-one

C18H12O6 (324.06338519999997)


   

(2S,4S)-2-[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-3-methyl-1,3-thiazolidine-4-carboxylic acid

(2S,4S)-2-[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-3-methyl-1,3-thiazolidine-4-carboxylic acid

C14H16N2O3S2 (324.0602306)


   

3-Hydroxycoumarin glucoside

3-Hydroxycoumarin glucoside

C15H16O8 (324.0845136)


   

3-Hydroxy-6-(4-hydroxybenzylidene)-4-(4-hydroxyphenyl)-2H-pyran-2,5(6H)-dione

3-Hydroxy-6-(4-hydroxybenzylidene)-4-(4-hydroxyphenyl)-2H-pyran-2,5(6H)-dione

C18H12O6 (324.06338519999997)


   

[2-[2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]acetyl] 2-oxopropaneperoxoate

[2-[2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]acetyl] 2-oxopropaneperoxoate

C11H16O11 (324.0692586)


   

1-[5-(Dihydroxyphosphinothioyloxymethyl)-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione

1-[5-(Dihydroxyphosphinothioyloxymethyl)-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione

C9H13N2O7PS (324.01810780000005)


   

Urolithin c 3-sulfate

Urolithin c 3-sulfate

C13H8O8S (323.9939888)


   

N-benzoyl-2-(3-pyridinyl)-4-thiazolecarbohydrazide

N-benzoyl-2-(3-pyridinyl)-4-thiazolecarbohydrazide

C16H12N4O2S (324.0680932)


   

5,6-Dihydrothymidine 5-monophosphate

5,6-Dihydrothymidine 5-monophosphate

C10H17N2O8P (324.07224920000004)


A pyrimidine 2-deoxyribonucleoside 5-monophosphate having dihydrothymine as the nucleobase.

   

N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-chloro-2-methyl-3-pyrazolecarboxamide

N-(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-4-chloro-2-methyl-3-pyrazolecarboxamide

C13H13ClN4O2S (324.04477080000004)


   

N-[(E)-(3,5-dichloro-2-hydroxyphenyl)methylidene]-2-hydroxybenzohydrazide

N-[(E)-(3,5-dichloro-2-hydroxyphenyl)methylidene]-2-hydroxybenzohydrazide

C14H10Cl2N2O3 (324.006845)


   

N-(5-bromo-2-hydroxyphenyl)-5-propyl-3-isoxazolecarboxamide

N-(5-bromo-2-hydroxyphenyl)-5-propyl-3-isoxazolecarboxamide

C13H13BrN2O3 (324.01094880000005)


   

1-(3,4-Dichlorophenyl)-3-(3,5-dimethylphenyl)thiourea

1-(3,4-Dichlorophenyl)-3-(3,5-dimethylphenyl)thiourea

C15H14Cl2N2S (324.0254704)


   

5-bromo-3-hydroxy-3-(4-methyl-1-piperidinyl)-1H-indol-2-one

5-bromo-3-hydroxy-3-(4-methyl-1-piperidinyl)-1H-indol-2-one

C14H17BrN2O2 (324.04733219999997)


   

1-(4-Bromophenyl)-3-(diethylamino)pyrrolidine-2,5-dione

1-(4-Bromophenyl)-3-(diethylamino)pyrrolidine-2,5-dione

C14H17BrN2O2 (324.04733219999997)


   

4-(2,4-dichlorophenoxy)-N-(3-pyridinyl)butanamide

4-(2,4-dichlorophenoxy)-N-(3-pyridinyl)butanamide

C15H14Cl2N2O2 (324.0432284)


   

1-[4-(Difluoromethylthio)phenyl]-3-(phenylmethyl)thiourea

1-[4-(Difluoromethylthio)phenyl]-3-(phenylmethyl)thiourea

C15H14F2N2S2 (324.0566428)


   

2-Pyridinecarboxylic acid [2-(2,3-dichloroanilino)-2-oxoethyl] ester

2-Pyridinecarboxylic acid [2-(2,3-dichloroanilino)-2-oxoethyl] ester

C14H10Cl2N2O3 (324.006845)


   

2-(4-Chlorophenyl)-5-[2-(2-pyridinyl)ethylamino]-4-oxazolecarbonitrile

2-(4-Chlorophenyl)-5-[2-(2-pyridinyl)ethylamino]-4-oxazolecarbonitrile

C17H13ClN4O (324.0777838)


   

2-[[(5-Ethyl-2-thiophenyl)-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester

2-[[(5-Ethyl-2-thiophenyl)-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester

C14H16N2O3S2 (324.0602306)


   

1-(5-Chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone

1-(5-Chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone

C13H13ClN4O2S (324.04477080000004)


   

Methyl 6-{[4-(trifluoromethyl)anilino]carbonyl}nicotinate

Methyl 6-{[4-(trifluoromethyl)anilino]carbonyl}nicotinate

C15H11F3N2O3 (324.07217319999995)


   

2-(2,1,3-Benzothiadiazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole

2-(2,1,3-Benzothiadiazol-5-yl)-5-[(3-methoxyphenyl)methyl]-1,3,4-oxadiazole

C16H12N4O2S (324.0680932)


   

N-(6-methyl-4-oxo-1H-quinazolin-2-yl)-4-nitrobenzamide

N-(6-methyl-4-oxo-1H-quinazolin-2-yl)-4-nitrobenzamide

C16H12N4O4 (324.08585120000004)


   

1-(2-Bromo-1-(trifluoromethoxy)ethyl)-4-(tert-butyl)benzene

1-(2-Bromo-1-(trifluoromethoxy)ethyl)-4-(tert-butyl)benzene

C13H16BrF3O (324.0336542)


   

4-Oxo-1-adamantyl difluorosulfoacetate

4-Oxo-1-adamantyl difluorosulfoacetate

C12H14F2O6S (324.04791280000006)


   

Methyl 6-[(4-chlorophenyl)thio]-5-nitronicotinate

Methyl 6-[(4-chlorophenyl)thio]-5-nitronicotinate

C13H9ClN2O4S (323.9971544)


   

[(8S,9R,10S)-9-(4-bromophenyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

[(8S,9R,10S)-9-(4-bromophenyl)-1,6-diazabicyclo[6.2.0]decan-10-yl]methanol

C15H21BrN2O (324.0837156)


   

Zofenoprilat(1-)

Zofenoprilat(1-)

C15H18NO3S2- (324.0728058)


A monocarboxylic acid anion that is the conjugate base of zofenoprilat, obtained by deprotonation of the carboxy group.

   

3,4,5-trihydroxy-6-[(E)-3-phenylprop-2-enoyl]oxyoxane-2-carboxylic acid

3,4,5-trihydroxy-6-[(E)-3-phenylprop-2-enoyl]oxyoxane-2-carboxylic acid

C15H16O8 (324.0845136)


   

[4-[3-(3,5-Dihydroxyphenyl)oxiran-2-yl]phenyl] hydrogen sulate

[4-[3-(3,5-Dihydroxyphenyl)oxiran-2-yl]phenyl] hydrogen sulate

C14H12O7S (324.0303722)


   

Tetrakis(dimethylsiloxy)silane

Tetrakis(dimethylsiloxy)silane

C8H24O4Si5 (324.0520904)


   

1-[(1S,2S)-2-[(2,5-dichlorophenyl)methoxy]cyclohexyl]imidazole

1-[(1S,2S)-2-[(2,5-dichlorophenyl)methoxy]cyclohexyl]imidazole

C16H18Cl2N2O (324.0796118)


   

Dorzolamide

Dorzolamide

C10H16N2O4S3 (324.0272176)


S - Sensory organs > S01 - Ophthalmologicals > S01E - Antiglaucoma preparations and miotics > S01EC - Carbonic anhydrase inhibitors D004791 - Enzyme Inhibitors > D002257 - Carbonic Anhydrase Inhibitors D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents C471 - Enzyme Inhibitor > C29577 - Carbonic Anhydrase Inhibitor

   

3-Uridylic acid

3-Uridylic acid

C9H13N2O9P (324.03586580000007)


COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   
   

Pseudouridine 5-phosphate

Pseudouridine 5-phosphate

C9H13N2O9P (324.03586580000007)


A C-nucleoside phosphate consisting of pseudouridine having a monophosphate group at the 5-position.

   

5-O-(1-carboxyvinyl)-3-phosphoshikimic acid

5-O-(1-carboxyvinyl)-3-phosphoshikimic acid

C10H13O10P (324.0246328)


   

6-deoxy-6-sulfo-D-fructofuranose 1-phosphate

6-deoxy-6-sulfo-D-fructofuranose 1-phosphate

C6H13O11PS (323.9916198)


A carbohydrate sulfonate that is D-fructofuranose-1-phosphate in which the hydroxy group at at position 6 is replaced by a sulfo group.

   

pyochelin I

pyochelin I

C14H16N2O3S2 (324.0602306)


A pyochelin that has R-stereochemistry at the thioaminal centre; the diastereoisomer with S-stereochemistry at this centre is pyochelin II. Pseudomonas aeruginosa produces a mixture of pyochelin I (major) and pyochelin II (minor) via condensation of salicylic acid and two molecules of cysteine. The enantiomeric compounds, enant-pyochelin I and II, are produced by Pseudomonas fluorescens.

   

alpha-Hydroxyalprazolam

alpha-Hydroxyalprazolam

C17H13ClN4O (324.0777838)


   

[5-(2,4-Dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

[5-(2,4-Dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate

C9H13N2O9P (324.03586580000007)


   

3-UMP

3-UMP

C9H13N2O9P (324.03586580000007)


A pyrimidine ribonucleoside 3-monophosphate having uracil as the nucleobase.

   

ribavirin 5-monophosphate

ribavirin 5-monophosphate

C8H13N4O8P (324.0470988)


A 1-ribosyltriazole that is ribavirin in which the hydroxy group at the 5-position is replaced by a phosphonooxy group. It is the active metabolite of the antiviral agent ribavirin.

   

Iperoxo

Iperoxo

C10H17IN2O2 (324.0334732)


Iperoxo is a potent superagonist of muscarinic acetylcholine receptor (mAChR). [3H]Iperoxo can be used for direct probing activation-related conformational transitions of muscarinic receptors[1][2]. Iperoxo is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.