Exact Mass: 324.0246328
Exact Mass Matches: 324.0246328
Found 234 metabolites which its exact mass value is equals to given mass value 324.0246328,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Uridine 5'-monophosphate
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
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
C13H13ClN4O2S (324.04477080000004)
Pyochelin
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
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
Uridine 3'-monophosphate
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
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
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
6-Chlorocatechin
6-Chlorocatechin is a constituent of the roots of Rumex patientia (patience dock). Constituent of the roots of Rumex patientia (patience dock)
Grevilline A
Grevilline A is found in mushrooms. Grevilline A is a pigment from Suillus grevillei (larch bolete
(2R)-2-Acetamido-3-[[(2R)-2-acetamido-2-carboxyethyl]disulfanyl]propanoic acid
1-(4-Chlorophenyl)-3-((4-methylphenyl)sulfonyl)urea
C14H13ClN2O3S (324.03353780000003)
4'-Hydroxy Nimesulide
C13H12N2O6S (324.04160520000005)
[(2S,3R,4R,5R)-5-(2,4-Dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
C9H13N2O9P (324.03586580000007)
1-(3',4'-Dichloro-2-fluoro(1,1'-biphenyl)-4-yl)cyclopropanecarboxylic acid
D004791 - Enzyme Inhibitors > D000091062 - Gamma Secretase Inhibitors and Modulators C471 - Enzyme Inhibitor
Dulofibrate
C78276 - Agent Affecting Digestive System or Metabolism > C29703 - Antilipidemic Agent > C98150 - Fibrate Antilipidemic Agent
2'-Deoxy-5'-O-thiophosphonouridine
C9H13N2O7PS (324.01810780000005)
Glucose pyruvate acetate
Pyochelin
D064449 - Sequestering Agents > D002614 - Chelating Agents > D007502 - Iron Chelating Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents
Ribavirin monophosphate
2-Amino-3-[[(2R)-2-carboxy-2-(diacetylamino)ethyl]disulfanyl]propanoic acid
(-)-Homoeriodictyol, sodium salt
C16H13NaO6 (324.06097980000004)
It is used as a food additive .
Neobanol
SSR180711
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
2-prop-1-ynyl-5-(1-acetoxy-2-chloroethyl)-dithiophene|2-prop-1-ynyl-5-<1-acetoxy-2-chloroethyl>-dithiophene
4-(3,4-dihydroxyphenyl)-6,7-dihydroxy-3H-benzo[f]isobenzofuran-1-one
Atromentin
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.
(3R)-6-hydroxy-3-hydroxymethyl-2-methyl-2,3-dihydro-10H-3r,10ac-epidisulfano-pyrazino[1,2-a]indole-1,4-dione|Dehydrogliotoxin|Dehydroglyotoxin
9,10-Dioxo-9,10-dihydroanthracene-1,2-diyl diacetate
Sterigmatocystin
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
C9H13N2O9P (324.03586580000007)
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.085
Uridine 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].
PRZ_M325
CONFIDENCE Transformation product, tentative ID (Level 2b); INTERNAL_ID 2007
(2R,2R)-3,3-disulfanediylbis(2-acetamidopropanoic acid)
Grevilline A
4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]benzaldehyde
(R)-[3,4-(METHYLENEDIOXY)PHENYL]-1-BUTYLAMINEHYDROCHLORIDE
C15H17BrO3 (324.03609919999997)
3-[3-(4-chloro-phenyl)-1-phenyl-1h-pyrazol-4-yl]-acrylic acid
1-(2-CHLOROBENZYLOXY)-3-(3-CHLORO-4-METHYLPHENYL)UREA
3-BROMO-2-(2-FLUOROBENZYLOXY)PHENYLBOR&
C13H11BBrFO3 (323.99685980000004)
3-BROMO-2-(4-FLUOROBENZYLOXY)PHENYLBOR&
C13H11BBrFO3 (323.99685980000004)
7-(BENZYLOXY)-4-CHLORO-6-METHOXYQUINOLINE-3-CARBONITRILE
DL-ALPHA-GLYCEROPHOSPHATE DISODIUM SALT
C3H19Na2O12P (324.04095040000004)
3-(Benzyloxy)-6-bromo-2-fluorophenylboronic acid
C13H11BBrFO3 (323.99685980000004)
1H-Pyrrolo[2,3-b]pyridine, 1-(phenylsulfonyl)-5-(1H-pyrazol-4-yl)-
diethoxy-(4-methylsulfonylphenoxy)-sulfanylidene-λ5-phosphane
4-(4-Methylpiperazinylmethyl)benzoyl chloride dihydrochloride
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-3-fluoro-1-[(4-methylphenyl)sulfonyl]-
6-(Benzyloxy)-4-chloro-7-methoxy-3-quinolinecarbonitrile
4-(5-Brom-2-chlorbenzyl)phenyl-ethylether
C15H14BrClO (323.99164840000003)
3-Iodo-N-phenyl-2-pyridinecarboxamide
C12H9IN2O (323.97596139999996)
1-(4-CARBOXYPHENYL)-5-(MERCAPTOTETRAZOLE)-DISODIUMSALT
5-(3-chloro-2-fluorobenzyl)-2,4-diMethoxybenzoic acid
C16H14ClFO4 (324.05646060000004)
1,3-BIS(4-CHLOROPHENYL)-1H-IMIDAZOL-3-IUM CHLORIDE
methyl 3-(2,4-dinitrophenoxy)thiophene-2-carboxylate
Allyl 4-(4-bromophenyl)piperazine-1-carboxylate
C14H17BrN2O2 (324.04733219999997)
1-bromomethyl-2-[(phenylsulfonyl)methyl]benzene
C14H13BrO2S (323.98195780000003)
5-Bromo-1H-indazole-3-carbaldehyde
C13H13BrN2O3 (324.01094880000005)
1-(4-TRIFLUOROMETHYL-BENZYL)-PYRROLIDIN-3-YLAMINEDIHYDROCHLORIDE
1H-Pyrrolo[2,3-b]pyridine, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-
Methyl 3-{[(trifluoromethyl)sulfonyl]oxy}-1H-pyrrolo[2,3-b]pyridi ne-2-carboxylate
C10H7F3N2O5S (324.00277680000005)
5-bromo-N-(4-methoxy-2-nitrophenyl)pyrazin-2-amine
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
3-[(4-CHLOROPHENYL)SULFONYL]METHYL-N-HYDROXYBENZENECARBOXIMIDAMIDE
C14H13ClN2O3S (324.03353780000003)
Vinylidene chloride, methyl acrylate, glycidyl methacrylate polymer
C13H18Cl2O5 (324.05312380000004)
5-(4-fluorophenyl)-1-methyl-1H-pyrazol-3-yltrifluoromethanesulfonate
C11H8F4N2O3S (324.01917460000004)
CHLOROPHOSPHORIC ACID BIS(2,6-DIMETHYLPHENYL) ESTER
C16H18ClO3P (324.06820380000005)
2-ethenylsulfonyl-N-[2-[(2-ethenylsulfonylacetyl)amino]ethyl]acetamide
2-(4-CHLOROSULPHONYLPHENYL)ETHYLTRIMETHOXYSILANE50 IN METHYLENE CHLORIDE
C11H17ClO5SSi (324.02544620000003)
2-(TRIFLUOROMETHYL)-5-[4-(TRIFLUOROMETHYL)PHENYL]-3-FUROIC ACID
C13H6F6O3 (324.02211179999995)
3-bromo-4-[(2-fluorophenyl)methoxy]benzoic acid
C14H10BrFO3 (323.97973019999995)
Nacubactam
C9H16N4O7S (324.07396660000006)
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic C471 - Enzyme Inhibitor
6-[(5-Chloro-3-methyl-1-benzofuran-2-YL)sulfonyl]pyridazin-3(2H)-one
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
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
C14H13ClN2O3S (324.03353780000003)
N-[4-(4-morpholinyl)phenyl]-2-thiophenesulfonamide
N-[5-(2,3-dihydro-1,4-dioxin-5-yl)-1,3,4-oxadiazol-2-yl]-5-nitro-2-thiophenecarboxamide
Pyochelin II
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-[(3-Chlorophenyl)methylthio]-3-methyl-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one
Ribavirin monophosphate
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
1-[2-Deoxyribofuranosyl]-2,4-difluoro-5-methyl-benzene-5monophosphate
2-Amino-3-[[(2R)-2-carboxy-2-(diacetylamino)ethyl]disulfanyl]propanoic acid
a 2,4-dioxotetrahydropyrimidine D-ribonucleotide
C9H13N2O9P-2 (324.03586580000007)
3,8,10,11-tetrahydroxy-1-methyl-12H-benzo[b]xanthen-12-one
(2S,4S)-2-[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-3-methyl-1,3-thiazolidine-4-carboxylic acid
3-Hydroxy-6-(4-hydroxybenzylidene)-4-(4-hydroxyphenyl)-2H-pyran-2,5(6H)-dione
[2-[2,3,4,5-Tetrahydroxy-6-(hydroxymethyl)oxan-2-yl]acetyl] 2-oxopropaneperoxoate
1-[5-(Dihydroxyphosphinothioyloxymethyl)-4-hydroxyoxolan-2-yl]pyrimidine-2,4-dione
C9H13N2O7PS (324.01810780000005)
N-benzoyl-2-(3-pyridinyl)-4-thiazolecarbohydrazide
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
C13H13ClN4O2S (324.04477080000004)
N-[(E)-(3,5-dichloro-2-hydroxyphenyl)methylidene]-2-hydroxybenzohydrazide
N-(5-bromo-2-hydroxyphenyl)-5-propyl-3-isoxazolecarboxamide
C13H13BrN2O3 (324.01094880000005)
1-(3,4-Dichlorophenyl)-3-(3,5-dimethylphenyl)thiourea
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
C14H17BrN2O2 (324.04733219999997)
1-[4-(Difluoromethylthio)phenyl]-3-(phenylmethyl)thiourea
2-Pyridinecarboxylic acid [2-(2,3-dichloroanilino)-2-oxoethyl] ester
2-[[(5-Ethyl-2-thiophenyl)-oxomethyl]amino]-4-methyl-5-thiazolecarboxylic acid ethyl ester
1-(5-Chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone
C13H13ClN4O2S (324.04477080000004)
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
1-(2-Bromo-1-(trifluoromethoxy)ethyl)-4-(tert-butyl)benzene
4-Oxo-1-adamantyl difluorosulfoacetate
C12H14F2O6S (324.04791280000006)
Zofenoprilat(1-)
A monocarboxylic acid anion that is the conjugate base of zofenoprilat, obtained by deprotonation of the carboxy group.
[4-[3-(3,5-Dihydroxyphenyl)oxiran-2-yl]phenyl] hydrogen sulate
Dorzolamide
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
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
C9H13N2O9P (324.03586580000007)
A C-nucleoside phosphate consisting of pseudouridine having a monophosphate group at the 5-position.
6-deoxy-6-sulfo-D-fructofuranose 1-phosphate
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
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.
[5-(2,4-Dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
C9H13N2O9P (324.03586580000007)
3-UMP
C9H13N2O9P (324.03586580000007)
A pyrimidine ribonucleoside 3-monophosphate having uracil as the nucleobase.
ribavirin 5-monophosphate
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 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.
2-bromo-5-(3,7-dimethylocta-2,6-dien-1-yl)benzene-1,4-diol
(2s,3r)-6-chloro-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
2-(3,4-dihydroxyphenyl)-3,6-dihydroxy-5-phenylcyclohexa-2,5-diene-1,4-dione
(3r,4s,6s)-3,10,13-trihydroxy-6-methyl-5-oxapentacyclo[9.7.0.0²,⁸.0⁴,⁶.0¹²,¹⁷]octadeca-1(11),2(8),9,12,14,16-hexaene-7,18-dione
3-hydroxy-4-(4-hydroxyphenyl)-6-[(4-hydroxyphenyl)methylidene]pyran-2,5-dione
7-hydroxy-11-(hydroxymethyl)-15-methyl-12,13-dithia-9,15-diazatetracyclo[9.2.2.0¹,⁹.0³,⁸]pentadeca-3,5,7-triene-10,14-dione
(?)-6-chloroepicatechin
{"Ingredient_id": "HBIN012295","Ingredient_name": "(?)-6-chloroepicatechin","Alias": "NA","Ingredient_formula": "C15H13ClO6","Ingredient_Smile": "C1C(C(OC2=CC(=C(C(=C21)O)Cl)O)C3=CC(=C(C=C3)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3550","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1r,13s)-7,11,17,19,23-pentaoxahexacyclo[11.10.0.0²,¹⁰.0⁴,⁸.0¹⁴,²².0¹⁶,²⁰]tricosa-2(10),3,5,8,14,16(20),21-heptaen-13-ol
[(2r,3s,5r)-3-fluoro-5-(4-hydroxy-5-methyl-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid
2-bromo-4-[(4z)-2,5-dihydroxyimidazol-4-ylidene]-1h,5h,6h,7h-pyrrolo[2,3-c]azepin-8-one
3,4,5-trihydroxy-4-(3,4,5-trihydroxybenzoyl)cyclohexa-1,5-diene-1-carboxylic acid
1-benzyl-4-(hydroxymethyl)-5,7-dimethyl-2,3-dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione
(4s)-1-benzyl-4-(hydroxymethyl)-5,7-dimethyl-2,3-dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione
(2r,3s)-6-chloro-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
(3r,4s,5r)-5-[(1-carboxyeth-1-en-1-yl)oxy]-4-hydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid
[3,4-dihydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid
C9H13N2O9P (324.03586580000007)
(4s)-2-[(4s)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-3-methyl-1,3-thiazolidine-4-carboxylic acid
3-bromo-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5h-xanthen-2-ol
(4s)-2-[(4s)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-4-methyl-1,3-thiazolidine-4-carboxylic acid
(8as,10as)-3-bromo-8,8,10a-trimethyl-6,7,8a,9-tetrahydro-5h-xanthen-2-ol
(6z)-3-hydroxy-4-(4-hydroxyphenyl)-6-[(4-hydroxyphenyl)methylidene]pyran-2,5-dione
11-hydroxy-15-methoxy-6,8,20-trioxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1,4,9,11,14,16,18-heptaen-13-one
18-methoxy-5,7,12,21-tetraoxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-1(13),2,4(8),9,15,17,19-heptaen-14-one
3,4,5-trihydroxy-5-(3,4,5-trihydroxybenzoyl)cyclohexa-1,3-diene-1-carboxylic acid
(1r)-2-chloro-1-[5'-(prop-1-yn-1-yl)-[2,2'-bithiophen]-5-yl]ethyl acetate
(2r,3r)-6-chloro-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
2-bromo-5-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]benzene-1,4-diol
(3s,7r)-11-hydroxy-15-methoxy-6,8,20-trioxapentacyclo[10.8.0.0²,⁹.0³,⁷.0¹⁴,¹⁹]icosa-1,4,9,11,14,16,18-heptaen-13-one
(2s)-3-(6-bromo-1h-indol-3-yl)-2-(trimethylammonio)propanoate
C14H17BrN2O2 (324.04733219999997)
[(2s,3s,4s,5r)-3,4-dihydroxy-5-(4-hydroxy-2-oxopyrimidin-1-yl)oxolan-2-yl]methoxyphosphonic acid
C9H13N2O9P (324.03586580000007)