Exact Mass: 247.0336828
Exact Mass Matches: 247.0336828
Found 364 metabolites which its exact mass value is equals to given mass value 247.0336828,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Forchlorfenuron
CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8757; ORIGINAL_PRECURSOR_SCAN_NO 8756 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8835; ORIGINAL_PRECURSOR_SCAN_NO 8832 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4401; ORIGINAL_PRECURSOR_SCAN_NO 4396 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4419; ORIGINAL_PRECURSOR_SCAN_NO 4414 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4428; ORIGINAL_PRECURSOR_SCAN_NO 4427 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8765; ORIGINAL_PRECURSOR_SCAN_NO 8763 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4391; ORIGINAL_PRECURSOR_SCAN_NO 4390 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8800; ORIGINAL_PRECURSOR_SCAN_NO 8798 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4416; ORIGINAL_PRECURSOR_SCAN_NO 4415 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8810; ORIGINAL_PRECURSOR_SCAN_NO 8809 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8790; ORIGINAL_PRECURSOR_SCAN_NO 8788 CONFIDENCE standard compound; INTERNAL_ID 811; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4435; ORIGINAL_PRECURSOR_SCAN_NO 4431 D006133 - Growth Substances > D010937 - Plant Growth Regulators CONFIDENCE standard compound; EAWAG_UCHEM_ID 3601 Forchlorfenuron is plant growth regulator and cytokinin; can be used to increase fruit size of fruits, such as kiwi fruit and grapes.
Pyridoxal 5'-phosphate
Pyridoxal phosphate, also known as PLP, pyridoxal 5-phosphate or P5P, is the active form of vitamin B6. It is a coenzyme in a variety of enzymatic reactions. Pyridoxal 5-phosphate belongs to the class of organic compounds known as pyridoxals and derivatives. Pyridoxals and derivatives are compounds containing a pyridoxal moiety, which consists of a pyridine ring substituted at positions 2,3,4, and 5 by a methyl group, a hydroxyl group, a carbaldehyde group, and a hydroxymethyl group, respectively. Pyridoxal 5-phosphate is a drug which is used for nutritional supplementation and for treating dietary shortage or imbalance. Pyridoxal 5-phosphate exists in all living species, ranging from bacteria to humans. In humans, pyridoxal 5-phosphate is involved in glycine and serine metabolism. Outside of the human body, pyridoxal 5-phosphate is found, on average, in the highest concentration within cow milk. Pyridoxal 5-phosphate has also been detected, but not quantified in several different foods, such as soursops, italian sweet red peppers, muscadine grapes, european plums, and blackcurrants. Pyridoxal 5-phosphate, with regard to humans, has been found to be associated with several diseases such as epilepsy, early-onset, vitamin B6-dependent, odontohypophosphatasia, pyridoxamine 5-prime-phosphate oxidase deficiency, and hypophosphatasia. Pyridoxal 5-phosphate has also been linked to the inborn metabolic disorder celiac disease. This is the active form of vitamin B6 serving as a coenzyme for synthesis of amino acids, neurotransmitters (serotonin, norepinephrine), sphingolipids, aminolevulinic acid. During transamination of amino acids, pyridoxal phosphate is transiently converted into pyridoxamine phosphate (pyridoxamine). -- Pubchem; Pyridoxal-phosphate (PLP, pyridoxal-5-phosphate) is a cofactor of many enzymatic reactions. It is the active form of vitamin B6 which comprises three natural organic compounds, pyridoxal, pyridoxamine and pyridoxine. -- Wikipedia [HMDB]. Pyridoxal 5-phosphate is found in many foods, some of which are linden, kai-lan, nance, and rose hip. Acquisition and generation of the data is financially supported in part by CREST/JST. A - Alimentary tract and metabolism > A11 - Vitamins D018977 - Micronutrients > D014815 - Vitamins KEIO_ID P038 Pyridoxal phosphate is the active form of vitamin B6, acts as an inhibitor of reverse transcriptases, and is used for the treatment of tardive dyskinesia.
Emtricitabine
C8H10FN3O3S (247.04268820000001)
Emtricitabine is only found in individuals that have used or taken this drug. It is a nucleoside reverse transcriptase inhibitor (NRTI) for the treatment of human immunodeficiency virus type 1 (HIV-1) infection in adults. Emtricitabine works by inhibiting reverse transcriptase (RT), an enzyme that allows the virus to multiply by copying HIV RNA into new viral DNA. The drug competes with the reverse transcriptases natural substrate deoxycytidine 5-triphosphate and also becomes incorporated into viral DNA. This is a result of emtricitabine being a synthetic nucleoside analogue of cytidine. It is phosphorylated by cellular enzymes to form emtricitabine 5-triphosphate which competes with the natural substrate deoxycytidine 5-triphosphate and becomes incorporated into nascent viral DNA, resulting in early chain termination. By inhibiting HIV-1 reverse transcriptase, emtricitabine can help to lower the amount of HIV (viral load) in a patients body and can indirectly increase the number of immune system cells (T cells or CD4+ T-cells). Both of these changes are associated with healthier immune systems and a decreased likelihood of serious illness. Emtricitabine is always used in conjunction with other HIV medicine to treat people with HIV infection. J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AF - Nucleoside and nucleotide reverse transcriptase inhibitors C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97452 - Nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C254 - Anti-Infective Agent > C281 - Antiviral Agent CONFIDENCE standard compound; EAWAG_UCHEM_ID 3106 Same as: D01199
1-Nitropyrene
CONFIDENCE standard compound; INTERNAL_ID 34 D009676 - Noxae > D009153 - Mutagens
3-NITROFLUORANTHENE
D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens
Forchlorfenuron
Forchlorfenuron is a member of the class of phenylureas that is urea substituted by a phenyl group and a 2-chloropyridin-4-yl group at positions 1 and 3 respectively. It is a plant growth regulator widely used in agriculture for improving fruit quality and fruit size. It has a role as a plant growth regulator. It is a member of phenylureas and a monochloropyridine. Forchlorfenuron is a diphenylurea-derivative cytokinin growth stimulating substance used as plant growth regulator (PGR) to enhance fruit set, size and increase yields. It is absorbed by most plant parts and acts synergistically with natural auxins to promote cell division and growth. It has been approved for use on kiwi fruit and grapes in the USA, and it has been associated with exploding watermelons in China. Forchlorfenuronis is commonly used in horticulture to stimulate the growth of kiwi fruit and grapes. D006133 - Growth Substances > D010937 - Plant Growth Regulators Forchlorfenuron is plant growth regulator and cytokinin; can be used to increase fruit size of fruits, such as kiwi fruit and grapes.
Tinidazole
Tinidazole is only found in individuals that have used or taken this drug. It is a nitroimidazole antitrichomonal agent effective against Trichomonas vaginalis, Entamoeba histolytica, and Giardia lamblia infections. [PubChem]Tinidazole is a prodrug and antiprotozoal agent. The nitro group of tinidazole is reduced in Trichomonas by a ferredoxin-mediated electron transport system. The free nitro radical generated as a result of this reduction is believed to be responsible for the antiprotozoal activity. It is suggested that the toxic free radicals covalently bind to DNA, causing DNA damage and leading to cell death. The mechanism by which tinidazole exhibits activity against Giardia and Entamoeba species is not known, though it is probably similar. G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AF - Imidazole derivatives P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01A - Agents against amoebiasis and other protozoal diseases > P01AB - Nitroimidazole derivatives J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01X - Other antibacterials > J01XD - Imidazole derivatives D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents D009676 - Noxae > D000477 - Alkylating Agents
Asparaginylaspartic acid
Asparaginylaspartic acid is a dipeptide composed of asparagine and aspartic acid. 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.
Aspartyl-Asparagine
Aspartyl-Asparagine is a dipeptide composed of aspartate and asparagine. 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.
2-Hydroxyacetaminophen sulfate
2-Hydroxyacetaminophen sulfate is a member of the class of compounds known as phenylsulfates. Phenylsulfates are compounds containing a sulfuric acid group conjugated to a phenyl group. 2-Hydroxyacetaminophen sulfate is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). 2-Hydroxyacetaminophen sulfate can be found in feces.
HHPAA sulfate
2-Hydroxy-N-(2-hydroxyphenyl)acetamide sulfate (HHPAA sulfate) is a benzoxazinoid metabolite. It is a potential plasma biomarker of whole grain intake (PMID: 24812068).
(2-Amino-6-oxo-1H-purin-9-yl) dihydrogen phosphate
C5H6N5O5P (247.01065559999998)
Dichloroisoproterenol
C11H15Cl2NO (247.05306399999998)
ent-Emtricitabine
C8H10FN3O3S (247.04268820000001)
2-Hydroxy-4-(3-azidomethylphenyl)-4-oxo-2-butenoic acid
C11H9N3O4 (247.05930339999998)
Fluoroazomycin arabinoside
Benzamide, N-[thioxo(1H-1,2,4-triazol-3-ylamino)methyl]-
4-hydroxy-4-(1H-indol-3-yl)-5-thioxoimidazolidin-2-one
2-(beta-D-glucopyranosyl)-3-isoxazolin-5-one|N-beta-D-Glucopyranosyl-2H-Oxo-5(4H)-Isoxazolone
tinidazole
G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AF - Imidazole derivatives P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01A - Agents against amoebiasis and other protozoal diseases > P01AB - Nitroimidazole derivatives J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01X - Other antibacterials > J01XD - Imidazole derivatives D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents D009676 - Noxae > D000477 - Alkylating Agents
pyridoxal phosphate
A - Alimentary tract and metabolism > A11 - Vitamins D018977 - Micronutrients > D014815 - Vitamins Pyridoxal phosphate is the active form of vitamin B6, acts as an inhibitor of reverse transcriptases, and is used for the treatment of tardive dyskinesia.
Pidopidon
Pyridoxal phosphate is the active form of vitamin B6, acts as an inhibitor of reverse transcriptases, and is used for the treatment of tardive dyskinesia.
Forchlorfenuron
Forchlorfenuron is plant growth regulator and cytokinin; can be used to increase fruit size of fruits, such as kiwi fruit and grapes.
5-Chlorosalicylanilide
CONFIDENCE standard compound; INTERNAL_ID 1371; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4680; ORIGINAL_PRECURSOR_SCAN_NO 4677 CONFIDENCE standard compound; INTERNAL_ID 1371; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4721; ORIGINAL_PRECURSOR_SCAN_NO 4719 ORIGINAL_ACQUISITION_NO 4721; CONFIDENCE standard compound; INTERNAL_ID 1371; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_PRECURSOR_SCAN_NO 4719 CONFIDENCE standard compound; INTERNAL_ID 1371; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4704; ORIGINAL_PRECURSOR_SCAN_NO 4701 CONFIDENCE standard compound; INTERNAL_ID 1371; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4699; ORIGINAL_PRECURSOR_SCAN_NO 4697 CONFIDENCE standard compound; INTERNAL_ID 1371; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4708; ORIGINAL_PRECURSOR_SCAN_NO 4706 CONFIDENCE standard compound; INTERNAL_ID 1371; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4715; ORIGINAL_PRECURSOR_SCAN_NO 4713
Pyridoxal 5-phosphate
The monophosphate ester obtained by condensation of phosphoric acid with the primary hydroxy group of pyridoxal.
Asn-asp
A dipeptide composed of L-asparagine and L-aspartic acid joined by a peptide linkage.
BENZENEBUTANOIC ACID, BETA-AMINO-2,4-DICHLORO-, (BETAR)-
C10H11Cl2NO2 (247.01668060000003)
Benzenebutanoic acid, β-amino-2,4,5-trifluoro-, methyl ester, (βR)-
C11H12F3NO2 (247.08200879999998)
Imidodicarbonimidicdiamide, N-(4-chlorophenyl)-, hydrochloride (1:1)
C8H11Cl2N5 (247.03914660000004)
3-(((5-METHYLTHIEN-2-YL)METHYL)AMINO)BENZOIC ACID
C13H13NO2S (247.06669580000002)
5-(3-(Methoxycarbonyl)pyridin-2-yl)-furan-2-carboxylic acid
Benzenesulfonamide,N-(2-methylphenyl)-
C13H13NO2S (247.06669580000002)
5-(TRIFLUOROMETHYL)THIENO[3,2-B]PYRIDINE-6-CARBOXYLICACID
C9H4F3NO2S (246.99148399999999)
2-Thiazolecarboxylic acid,4-(4-methylphenyl)-,ethyl ester
C13H13NO2S (247.06669580000002)
4-[4-(1-METHYLETHYL)PHENYL]-2-THIAZOLECARBOXYLICACID
C13H13NO2S (247.06669580000002)
Benzenesulfonyl chloride, 4-(acetylamino)-2-methyl- (9CI)
4-(4-HYDRAZINYLPHENYL)-4H-1,2,4-TRIAZOLE DIHYDROCHLORIDE
C8H11Cl2N5 (247.03914660000004)
6-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)hexanoic acid
1-fluoro-2-nitro-3-phenylmethoxybenzene
C13H10FNO3 (247.06446820000002)
2-AMINO-4-P-TOLYL-THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER
C13H13NO2S (247.06669580000002)
2-AMINO-5-BENZYL-THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER
C13H13NO2S (247.06669580000002)
BENZENESULFONYL CHLORIDE, 4-(ACETYLAMINO)-3-METHYL-
1-Chloro-6-(trifluoromethoxy)isoquinoline
C10H5ClF3NO (247.00117459999998)
5-(2-(Methoxycarbonyl)pyridin-4-yl)-furan-2-carboxylic acid
2-(O-TOLYL)THIAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
C13H13NO2S (247.06669580000002)
3-(cyclopropylsulfamoyl)thiophene-2-carboxylic acid
5-chloro-2-octyl-1,2-thiazol-3-one
C11H18ClNOS (247.07975679999998)
ETHYL 2-(P-TOLYL)THIAZOLE-4-CARBOXYLATE
C13H13NO2S (247.06669580000002)
(2-AMINO-5-CHLOROPHENYL)(3-HYDROXYPHENYL)METHANONE
3-AMINO-3-(4-PHENYL-THIOPHEN-2-YL)-PROPIONIC ACID
C13H13NO2S (247.06669580000002)
5-(2,1,3-benzoxadiazol-5-ylmethylidene)-1,3-thiazolidine-2,4-dione
2-chloro-5-(chloromethyl)-Nneopentylpyrimidin-4-amine
C10H15Cl2N3 (247.06429699999998)
3-[(THIEN-2-YLCARBONYL)AMINO]BENZOIC ACID
C12H9NO3S (247.03031239999999)
3H-1,2,4-Triazole-3-thione,5-benzo[b]thien-3-yl-2,4-dihydro-4-methyl-(9CI)
C11H9N3S2 (247.02378739999997)
ethyl 2-(2-phenyl-1,3-thiazol-4-yl)acetate
C13H13NO2S (247.06669580000002)
1-(4-CHLOROPHENYL)-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBONITRILE
methyl 3-oxo-3-(6-(trifluoromethyl)pyridin-3-yl)propanoate
2-(1H-PYRROL-1-YL)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLIC ACID
C13H13NO2S (247.06669580000002)
4-[(2-Thienylcarbonyl)amino]benzoic acid
C12H9NO3S (247.03031239999999)
N-(2-amino-4,6-dihydroxy-pyrimidin-5-yl)pyridine-3-carboxamide
2-{[(3-methyl-2-thienyl)methyl]amino}benzoic acid
C13H13NO2S (247.06669580000002)
6-AMINO-2-CHLORO-6,7,8,9-TETRAHYDRO-5H-BENZOCYCLOHEPTEN-5-OL HYDROCHLORIDE
C11H15Cl2NO (247.05306399999998)
4-(4-Chlorophenoxy)piperidine hydrochloride (1:1)
C11H15Cl2NO (247.05306399999998)
Ethyl 2-amino-5-phenylthiophene-3-carboxylate
C13H13NO2S (247.06669580000002)
2-(2,3-dihydro-1-benzofuran-5-yl)-1,3-thiazole-4-carboxylic acid
C12H9NO3S (247.03031239999999)
L-3,4-Dihydroxyphenylalanine Methyl ester hydrochloride
3-Pyridazinamine, 6-[[(4-methoxyphenyl)methyl]thio]-
Methyl 1-(4-fluorophenyl)-6-oxo-1,6-dihydropyridine-3-carboxylate
C13H10FNO3 (247.06446820000002)
4-ALLYL-5-(4-METHOXYPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
methyl 4-nitro-1-phenylpyrazole-3-carboxylate
C11H9N3O4 (247.05930339999998)
3-AMINOADAMANTAN-1-OL HYDROBROMIDE
C10H18BrNO (247.05716779999997)
4-(1H-TETRAZOL-5-YLMETHYL)-4H-BENZO[1,4]THIAZIN-3-ONE
8-ACETYL-6-HYDROXY-7-METHYL-6H-[1,2,5]OXADIAZOLO[3,4-E]INDOLE 3-OXIDE
C11H9N3O4 (247.05930339999998)
4-Nitro-1-(phenylmethyl)-1H-imidazole-5-carboxylic acid
C11H9N3O4 (247.05930339999998)
9-Chloro-2-methyl-5H-pyrazolo[1,5-d][1,4]benzodiazepin-6(7H)-one
N-Methyl-N-phenylbenzenesulfonamide
C13H13NO2S (247.06669580000002)
1-[5-[(2-HYDROXYETHYL)THIO]-4-NITRO-2-THIENYL]ETHAN-1-ONE
(4-((2,2,2-TRIFLUOROETHYL)CARBAMOYL)PHENYL)BORONIC ACID
C9H9BF3NO3 (247.06275499999998)
1-(2-CHLOROPHENYL)-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBONITRILE
Ethyl 2-amino-4-phenyl-3-thiophenecarboxylate
C13H13NO2S (247.06669580000002)
4-ALLYL-5-(2-METHOXYPHENYL)-4H-1,2,4-TRIAZOLE-3-THIOL
4-(3-Chlorophenoxy)piperidine hydrochloride (1:1)
C11H15Cl2NO (247.05306399999998)
3-[(4-CHLOROPHENYL)METHYL]-PYRIDINE-4-CARBOXYLIC ACID
8-Chloro-2-(trifluoromethyl)-4-quinolinol
C10H5ClF3NO (247.00117459999998)
3-Amino-2-(3,4-dichlorobenzyl)propanoic Acid
C10H11Cl2NO2 (247.01668060000003)
5-AMINO-4-BROMO-1-METHYL-1H-PYRAZOLE-3-CARBOXYLICACIDETHYLESTER
6-Chloro-2-(4-fluorophenyl)imidazo[1,2-b]pyridazine
5-(4-METHYL-2-NITRO-PHENYL)-FURAN-2-CARBOXYLIC ACID
methyl 2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetate
C13H13NO2S (247.06669580000002)
2-methyl-6-[(2,2,2-trifluoroacetyl)amino]benzoic acid
5-Nitro-1-(phenylmethyl)-1H-imidazole-4-carboxylic acid
C11H9N3O4 (247.05930339999998)
ethyl 4-methyl-2-phenyl-1,3-thiazole-5-carboxylate
C13H13NO2S (247.06669580000002)
3-acetamido-4-methoxybenzenesulfinic acid hydrate, 97
2-(4-FLUOROBENZYLSULFONYL)THIOACETAMIDE
C9H10FNO2S2 (247.01369720000002)
SR 57227 hydrochloride
C10H15Cl2N3 (247.06429699999998)
SR 57227A is a potent, orally active and selective 5-HT3 receptor agonist, with ability to cross the blood brain barrier. SR 57227A has affinities (IC50) varying between 2.8 and 250 nM for 5-HT3 receptor binding sites in rat cortical membranes and on whole NG 108-15 cells or their membranes. Anti-depressant effects[1][2].
4-(Benzyloxy)-1-fluoro-2-nitrobenzene
C13H10FNO3 (247.06446820000002)
1H-Benzimidazol-5-amine,2-ethyl-1-methyl-(9CI)
C10H15Cl2N3 (247.06429699999998)
2-(6-methyl-1H-benzimidazol-2-yl)ethanamine
C10H15Cl2N3 (247.06429699999998)
4-[3-(Methoxycarbonyl)-1,2-oxazol-5-yl]benzoic acid
ethyl 3-amino-3-(3-fluorophenyl)propanoate,hydrochloride
C11H15ClFNO2 (247.07752920000001)
Imidodicarbonimidicdiamide, N-(2-chlorophenyl)-, hydrochloride (1:1)
C8H11Cl2N5 (247.03914660000004)
4-chloro-8-(trifluoromethoxy)quinoline
C10H5ClF3NO (247.00117459999998)
N-((5-BROMOTHIOPHEN-2-YL)METHYL)-2-METHYLPROPAN-1-AMINE
Methyl 3-amino-4-(2,4,5-trifluorophenyl)butanoate
C11H12F3NO2 (247.08200879999998)
Benzenesulfonamide,N-(phenylmethyl)-
C13H13NO2S (247.06669580000002)
5-(4-NITROPHENYL)FURAN-2-CARBOXYLIC ACID METHYL ESTER
4-METHYL-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE-7-SULFONYL CHLORIDE
7-Chloro-4-(trifluoromethyl)-1H-indole-2-carbaldehyde
C10H5ClF3NO (247.00117459999998)
1-[2-amino-5-(trifluoromethyl)-1H-imidazol-4-yl]-2,2,2-trifluoroethanone
C6H3F6N3O (247.01802999999998)
2-AMINO-4-M-TOLYL-THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER
C13H13NO2S (247.06669580000002)
2-AMINO-5-METHYL-4-PHENYL-THIOPHENE-3-CARBOXYLIC ACID METHYL ESTER
C13H13NO2S (247.06669580000002)
4-(5-chloro-2-pyridylazo)benzene-1,3-diamine
C11H10ClN5 (247.06246900000002)
1-aMino-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxaMide
2,4-Dichloro-N-(2-hydroxypropyl)benzamide
C10H11Cl2NO2 (247.01668060000003)
2-(2-Chloropyridin-4-yl)-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-4(5H)-one
2-CHLORO-N-(5-PENTYL-[1,3,4]THIADIAZOL-2-YL)-ACETAMIDE
C9H14ClN3OS (247.05460639999998)
ETHYL 2-M-TOLYLTHIAZOLE-4-CARBOXYLATE
C13H13NO2S (247.06669580000002)
2-chloro-5-(5-ethyl-1,3-oxazol-2-yl)-6-methylpyridine-3-carbonitrile
4-(2-Chlorophenoxy)piperidine hydrochloride
C11H15Cl2NO (247.05306399999998)
(S)-[(4S,5R,7R)-5-ETHENYL-1-AZABICYCLO[2.2.2]OCTAN-7-YL]-(6-METHOXYQUINOLIN-4-YL)METHANOLSULFATEDIHYDRATE
C11H15Cl2NO (247.05306399999998)
4-Oxo-4-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-butenoic acid
2-Chloro-N-[2-(4-chlorophenoxy)ethyl]acetamide
C10H11Cl2NO2 (247.01668060000003)
5,6-DIHYDROXY-2-PYRIDIN-2-YL-PYRIMIDINE-4-CARBOXYLIC ACID METHYL ESTER
C11H9N3O4 (247.05930339999998)
Aciclovir sodium
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
1-benzyl-1,2,3-triazole-4,5-dicarboxylic acid
C11H9N3O4 (247.05930339999998)
2-chloro-1-(2,5-dimethyl-1-phenylpyrrol-3-yl)ethanone
3-(4-CHLORO-PHENOXY)PIPERIDINE HYDROCHLORIDE
C11H15Cl2NO (247.05306399999998)
2,4,5-trifluoro-n-(1-hydroxy-2-methylpropan-2-yl)benzamide
C11H12F3NO2 (247.08200879999998)
1-(4-Chlorophenyl)-3-(dimethylamino)propan-1-one Hydrochloride
C11H15Cl2NO (247.05306399999998)
tert-Butyl 2,6-Dichloroisonicotinate
C10H11Cl2NO2 (247.01668060000003)
ethyl 6-nitroquinoxaline-2-carboxylate
C11H9N3O4 (247.05930339999998)
(4-(PHENYLSULFONYL)PHENYL)METHANAMINE
C13H13NO2S (247.06669580000002)
6-chloro-4-(1,2,4-triazol-1-yl)pyrido[3,2-d]pyrimidin-2-amine
2-(5-methyl-2-phenyl-1,3-thiazol-4-yl)acetohydrazide
3-chloro-7-(trifluoromethyl)-1H-quinolin-4-one
C10H5ClF3NO (247.00117459999998)
3-(8-chloroquinoline-4-yl)acrylic acid methyl ester
1-(3-chlorophenyl)biguanide hydrochloride
C8H11Cl2N5 (247.03914660000004)
m-CPBG (1-(3-Chlorophenyl)biguanide) hydrochloride is a selective 5-HT3 agonist. m-CPBG hydrochloride can be used for the research of neurological disease[1].
Cyclopropanamine,2-fluoro-,(1S,2R)-,4-methylbenzenesulfonate(9CI)
6-Chloro-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid hydrochloride
C10H11Cl2NO2 (247.01668060000003)
ethyl 2-methyl-5-phenyl-1,3-thiazole-4-carboxylate
C13H13NO2S (247.06669580000002)
7-Chloro-1,2,3,4-tetrahydro-isoquinoline-1-carboxylic acid hydrochloride
C10H11Cl2NO2 (247.01668060000003)
4-METHYL-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE-6-SULFONYL CHLORIDE
7-Chloro-4-hydroxy-2-(trifluoromethyl)quinoline
C10H5ClF3NO (247.00117459999998)
1-(Benzyloxy)-2-fluoro-4-nitrobenzene
C13H10FNO3 (247.06446820000002)
4-((S)-1-AMINO-2,2,2-TRIFLUORO-ETHYL)-BENZOIC ACID ETHYL ESTER
C11H12F3NO2 (247.08200879999998)
3-(METHYLSULFONYL)-1,1-BIPHENYL-4-AMINE
C13H13NO2S (247.06669580000002)
methyl-(2-amino-6-chloro-pyrimidin-4-ylthio)propanoate
5-(2-Methyl-1H-imidazol-1-yl)-2-nitrobenzoic acid
C11H9N3O4 (247.05930339999998)
Ethyl 1-(N,N-dimethylsulfamoyl)-1H-imidazole-4-carboxylate
2-(Benzyloxy)-4-fluoro-1-nitrobenzene
C13H10FNO3 (247.06446820000002)
4-chloro-2-octyl-2H-isothiazol-3-one
C11H18ClNOS (247.07975679999998)
4-Chloro-7-trifluoro methoxyquinoline
C10H5ClF3NO (247.00117459999998)
4-(BENZYLOXY)-2-FLUORO-1-NITROBENZENE
C13H10FNO3 (247.06446820000002)
8-Chloro-4-hydroxy-2-(trifluoromethyl)quinoline
C10H5ClF3NO (247.00117459999998)
1-(2-bromobutanoyl)-3-methylpiperidine
C10H18BrNO (247.05716779999997)
Methyl 2-amino-4-(4-fluorophenyl)pyrimidine-5-carboxylate
C12H10FN3O2 (247.07570120000003)
4-(4-FLUOROPHENYLSULFANYL)PIPERIDINE HYDROCHLORIDE
4-(4-Amino-3-fluorophenoxy)-pyridine-2-carboxylic acid amide
C12H10FN3O2 (247.07570120000003)
2-(4-(TRIFLUOROMETHOXY)PHENYL)MORPHOLINE
C11H12F3NO2 (247.08200879999998)
Fluoroazomycin arabinoside F-18
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D019275 - Radiopharmaceuticals C1446 - Radiopharmaceutical Compound > C2124 - Radioconjugate
3-[(2-Nitro-1H-imidazol-1-yl)methoxy]-1,2,4-butanetriol
Benzo[b]thiophen-2-yl(morpholino)methanone
C13H13NO2S (247.06669580000002)
Ethyl 3-amino-5-phenylthiophene-2-carboxylate
C13H13NO2S (247.06669580000002)
Methyl 2-(2-methylquinolin-4-ylthio)acetate
C13H13NO2S (247.06669580000002)
5-methyl-N-[2-(methylthio)phenyl]-2-furancarboxamide
C13H13NO2S (247.06669580000002)
2-[2-(3,5-Dimethylphenyl)-2-oxoethylidene]-1,3-thiazolidin-4-one
C13H13NO2S (247.06669580000002)
4-(2,2,2-Trifluoroethyl)-L-phenylalanine
C11H12F3NO2 (247.08200879999998)
Emtricitabine
C8H10FN3O3S (247.04268820000001)
J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AF - Nucleoside and nucleotide reverse transcriptase inhibitors C471 - Enzyme Inhibitor > C1589 - Reverse Transcriptase Inhibitor > C97452 - Nucleoside Reverse Transcriptase Inhibitor D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D018894 - Reverse Transcriptase Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors C254 - Anti-Infective Agent > C281 - Antiviral Agent Same as: D01199
[5-Hydroxy-4-(hydroxymethyl)-6-methylpyridin-3-yl]methyl phosphate
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Pyridoxamine 5-phosphate(1-)
C8H12N2O5P- (247.04838119999997)
An organophosphate oxoanion that is the conjugate base of pyridoxamine 5-phosphate. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
2-Amino-3-[hydroxy(phosphonomethyl)phosphoryl]propanoic acid
(2-Amino-6-oxo-1H-purin-9-yl) dihydrogen phosphate
C5H6N5O5P (247.01065559999998)
7-Chloro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid
N-(4-methyl-2-pyridinyl)-5-nitro-2-furancarboxamide
C11H9N3O4 (247.05930339999998)
N-(1,2-dihydroacenaphthylen-5-yl)methanesulfonamide
C13H13NO2S (247.06669580000002)
N-methyl-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)methyl]propanamide
C13H13NO2S (247.06669580000002)
4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylthiazole
C13H13NO2S (247.06669580000002)
3-methyl-4-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide
N-(6-methyl-2-pyridinyl)-5-nitro-2-furancarboxamide
C11H9N3O4 (247.05930339999998)
5-Amino-4-(1,3-benzodioxol-5-ylhydrazo)-3-pyrazolone
(2S,3R)-3-[(2-nitroimidazol-1-yl)methoxy]butane-1,2,4-triol
4-methyl-2-nitro-6-[(4H-1,2,4-triazol-4-ylimino)methyl]phenol
4-chloro-N-(1H-pyrrol-2-ylmethylene)benzohydrazide
4-(3-Hydroxy-1-benzothiophen-2-yl)-2-oxobut-3-enoate
cis-4-(3-Hydroxy-1-benzothiophen-2-yl)-2-oxobut-3-enoate
3-acetamido-3,5-dideoxy-L-lyxo-hept-6-ulopyranosuronic acid
4-(acetylamino)-3-hydroxyphenyl hydrogen sulfate
An aryl sulfate that is the 3-hydroxy derivative of paracetamol sulfate.
4-Iodo-2,6-dimethylaniline
{"Ingredient_id": "HBIN010581","Ingredient_name": "4-Iodo-2,6-dimethylaniline","Alias": "NA","Ingredient_formula": "C8H10IN","Ingredient_Smile": "CC1=CC(=CC(=C1N)C)I","Ingredient_weight": "247.08 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40749","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "278942","DrugBank_id": "NA"}