Exact Mass: 359.0648344
Exact Mass Matches: 359.0648344
Found 205 metabolites which its exact mass value is equals to given mass value 359.0648344,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Sinigrin
C10H17NO9S2 (359.03447120000004)
Sinigrin is found in brassicas. Sinigrin is isolated from seeds of black mustard (Brassica nigra) and cabbage, as K salt. Sinigrin is present in many crucifers, major glucosinolate in Brussels sprouts (Brassica oleraceae). Sinigrin is isolated from seeds of black mustard (Brassica nigra) and cabbage, as a K salt. It is found in many crucifers, major glucosinolate in Brussels sprouts (Brassica oleraceae). Acquisition and generation of the data is financially supported in part by CREST/JST.
Florasulam
C12H8F3N5O3S (359.0299934000001)
CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7356; ORIGINAL_PRECURSOR_SCAN_NO 7353 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7334; ORIGINAL_PRECURSOR_SCAN_NO 7332 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3508; ORIGINAL_PRECURSOR_SCAN_NO 3504 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7314; ORIGINAL_PRECURSOR_SCAN_NO 7312 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7299; ORIGINAL_PRECURSOR_SCAN_NO 7295 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3579; ORIGINAL_PRECURSOR_SCAN_NO 3576 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3499; ORIGINAL_PRECURSOR_SCAN_NO 3497 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7330; ORIGINAL_PRECURSOR_SCAN_NO 7326 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7351; ORIGINAL_PRECURSOR_SCAN_NO 7349 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3513; ORIGINAL_PRECURSOR_SCAN_NO 3511 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3508; ORIGINAL_PRECURSOR_SCAN_NO 3505 CONFIDENCE standard compound; INTERNAL_ID 386; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3510; ORIGINAL_PRECURSOR_SCAN_NO 3508 INTERNAL_ID 386; CONFIDENCE standard compound; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7351; ORIGINAL_PRECURSOR_SCAN_NO 7349
Triglochinin
C14H17NO10 (359.08524220000004)
Isotriglochinin is found in green vegetables. Isotriglochinin is a constituent of the famine food Alocasia macrorrhiza (wild taro). Constituent of the famine food Alocasia macrorrhiza (wild taro). Triglochinin is found in green vegetables.
Flindokalner
Same as: D04192 C26170 - Protective Agent > C1509 - Neuroprotective Agent
TRIBOA-glucoside
C14H17NO10 (359.08524220000004)
Boniva
C9H24NNaO8P2 (359.08748039999995)
C78281 - Agent Affecting Musculoskeletal System > C67439 - Bone Resorption Inhibitor D050071 - Bone Density Conservation Agents > D004164 - Diphosphonates
Isoxaflutole
C15H12F3NO4S (359.04391080000005)
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3488
Clovamide
(S,Z)-Clovamide is found in herbs and spices. (S,Z)-Clovamide is isolated from Trifolium pratense (red clover). A polyphenol compound found in foods of plant origin (PhenolExplorer)
Gravacridonechlorine
C19H18ClNO4 (359.09242980000005)
Gravacridonechlorine is found in herbs and spices. Gravacridonechlorine is an alkaloid from Ruta graveolens (rue
Romucosine B
C19H18ClNO4 (359.09242980000005)
Romucosine B is found in alcoholic beverages. Romucosine B is an alkaloid from Rollinia mucosa (biriba). Alkaloid from Rollinia mucosa (biriba). Romucosine B is found in alcoholic beverages and fruits.
Isogravacridonechlorine
C19H18ClNO4 (359.09242980000005)
Isogravacridonechlorine is found in herbs and spices. Isogravacridonechlorine is an alkaloid from Ruta graveolens (rue
Avenanthramide 2s
Avenanthramide 2s is a polyphenol compound found in foods of plant origin (PMID: 20428313)
Tiazuril
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent Coccidiostat for poultr
Avenanthramide 2
Avenanthramide 2 is found in cereals and cereal products. Avenanthramide 2 is a constituent of Avena sativa (oat). Constituent of Avena sativa (oat). Avenanthramide 2 is found in oat and cereals and cereal products.
N-Desmethyl-O-hydroxy rosiglitazone
C17H17N3O4S (359.09397220000005)
N-Desmethyl-O-hydroxy rosiglitazone is a metabolite of rosiglitazone. Rosiglitazone is an antidiabetic drug in the thiazolidinedione class of drugs. It works as an insulin sensitizer, by binding to the PPAR receptors in fat cells and making the cells more responsive to insulin. It is marketed by the pharmaceutical company GlaxoSmithKline (GSK) as a stand-alone drug (Avandia) and in combination with metformin (Avandamet) or with glimepiride (Avandaryl). Annual sales peaked at approximately $2.5bn in 2006, but declined after reports of adverse effects. (Wikipedia)
N-Desmethyl-p-hydroxyrosiglitazone
C17H17N3O4S (359.09397220000005)
N-Desmethyl-p-hydroxyrosiglitazone is a metabolite of rosiglitazone. Rosiglitazone is an antidiabetic drug in the thiazolidinedione class of drugs. It works as an insulin sensitizer, by binding to the PPAR receptors in fat cells and making the cells more responsive to insulin. It is marketed by the pharmaceutical company GlaxoSmithKline (GSK) as a stand-alone drug (Avandia) and in combination with metformin (Avandamet) or with glimepiride (Avandaryl). Annual sales peaked at approximately $2.5bn in 2006, but declined after reports of adverse effects. (Wikipedia)
beta-D-Glucopyranose, 1-[N-(sulfooxy)-3-butenimidate], monopotassium salt
C10H17NO9S2 (359.03447120000004)
(6S)-6,7-Dihydro-2-nitro-6-[[4-(trifluoromethoxy)phenyl]methoxy]-5H-imidazo[2,1-b][1,3]oxazine
(S)-2-Biphenyl-4-yl-1-(1H-tetrazol-5-yl)ethylaminomethyl phosphonic acid
C16H18N5O3P (359.11472080000004)
[(2S)-1-(4-Amino-2-oxopyrimidin-1-yl)-3-hydroxypropan-2-yl]oxymethyl-phosphonooxyphosphinic acid
Isoxaflutole
C15H12F3NO4S (359.04391080000005)
3-(3-Chloro-4-hydroxyphenyl)imino-4-(4-nitrophenyl)pyrrolidine-2,5-dione
C16H10ClN3O5 (359.03089600000004)
3-(3-Chloro-4-hydroxyphenylamino)-4-(4-nitrophenyl)-1H-pyrrole-2,5-dione
C16H10ClN3O5 (359.03089600000004)
(2S)-2-Amino-4-[2-amino-3-(2-amino-3-hydroxybenzoyl)oxyphenyl]-4-oxobutanoic acid
2-amino-4,6-dinitrotoluene glucoside
2-amino-4,6-dinitrotoluene glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 2-amino-4,6-dinitrotoluene glucoside can be found in a number of food items such as abalone, common verbena, durian, and burbot, which makes 2-amino-4,6-dinitrotoluene glucoside a potential biomarker for the consumption of these food products.
4-amino-2,6-dinitrotoluene glucoside
4-amino-2,6-dinitrotoluene glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 4-amino-2,6-dinitrotoluene glucoside can be found in a number of food items such as yellow zucchini, garden onion (variety), jerusalem artichoke, and mung bean, which makes 4-amino-2,6-dinitrotoluene glucoside a potential biomarker for the consumption of these food products.
2-Propenyl glucosinolate
C10H17NO9S2 (359.03447120000004)
Annotation level-1
(6S)-6,7-Dihydro-2-nitro-6-[[4-(trifluoromethoxy)phenyl]methoxy]-5H-imidazo[2,1-b][1,3]oxazine
2-[(4-Bromo-2-pyrrolyl)carbonylamino]-6-guanidinohexanoic acid
2-Hydroxy-5-(1-sulfo-[2]naphthylamino)-benzoesaeure|2-hydroxy-5-(1-sulfo-[2]naphthylamino)-benzoic acid
SB 415286
C16H10ClN3O5 (359.03089600000004)
Clovamide
Trans-Clovamide is a tyrosine derivative. trans-Clovamide is a natural product found in Dalbergia melanoxylon, Theobroma cacao, and Trifolium pratense with data available. See also: Cocoa (part of); Trifolium pratense flower (part of). cis-Clovamide is a natural product found in Theobroma cacao and Trifolium pratense with data available. See also: Cocoa (part of); Trifolium pratense flower (part of). Clovamide (trans-Clovamide), a natural phenolic compound, is a potent antioxidant. Clovamide is an excellent ROS and oxygen radical scavenger. Clovamide also has anti-inflammatory and neuroprotective effects[1][2]. Clovamide is an anti-microbial with activity against the human pathogens influenza A subtype H5N1, Trypanosoma evansi, and Heliobacter pylori[3].
Demethyleneberberine
C19H18ClNO4 (359.09242980000005)
Demethyleneberberine chloride is a natural mitochondria-targeted antioxidant. Demethyleneberberine chloride alleviates mice colitis and inhibits the inflammatory responses by inhibiting NF-κB pathway and regulating the balance of Th cells. Demethyleneberberine chloride could serve as a AMPK activator for researching non-alcoholic fatty liver disease (NAFLD)[1][2][3]. Demethyleneberberine chloride is a natural mitochondria-targeted antioxidant. Demethyleneberberine chloride alleviates mice colitis and inhibits the inflammatory responses by inhibiting NF-κB pathway and regulating the balance of Th cells. Demethyleneberberine chloride could serve as a AMPK activator for researching non-alcoholic fatty liver disease (NAFLD)[1][2][3].
Stylopine hydrochloride
C19H18ClNO4 (359.09242980000005)
(±)-Stylopine (Tetrahydrocoptisine) hydrochloride is an alkaloid compound originally isolated from Corydalis tubers that exhibits anti-inflammatory and anti-parasitic activities[1][2]. (±)-Stylopine (Tetrahydrocoptisine) hydrochloride is an alkaloid compound originally isolated from Corydalis tubers that exhibits anti-inflammatory and anti-parasitic activities[1][2].
Sinigrin
C10H17NO9S2 (359.03447120000004)
An alkenylglucosinolic acid that consists of 1-thio-beta-D-glucopyranose having a 4-[(sulfooxy)imino]but-1-en-4-yl group attached to the anomeric sulfur.
(2S)-3-(3,4-dihydroxyphenyl)-2-[[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]amino]propanoic acid
(-)-n-[3,4-dihydroxy-(e)-cinnamoyl]-3-hydroxy-l-tyrosine
Clovamide (trans-Clovamide), a natural phenolic compound, is a potent antioxidant. Clovamide is an excellent ROS and oxygen radical scavenger. Clovamide also has anti-inflammatory and neuroprotective effects[1][2]. Clovamide is an anti-microbial with activity against the human pathogens influenza A subtype H5N1, Trypanosoma evansi, and Heliobacter pylori[3].
S1P Lyase Fluorogenic Substrate
Isogravacridonchlorine
C19H18ClNO4 (359.09242980000005)
Gravacridonechlorine
C19H18ClNO4 (359.09242980000005)
Tiazuril
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
Avenanthramide 2
Romucosine B
C19H18ClNO4 (359.09242980000005)
2-Methyl-2-propanyl (5-bromo-2-chlorobenzyl)cyclopropylcarbamate
3-(BENZO[D][1,3]DIOXOL-5-YL)-2-(((BENZYLOXY)CARBONYL)AMINO)-3-HYDROXYPROPANOIC ACID
N,N,N,N-Tetramethyl-O-(N-succinimidyl)uronium hexafluorophosphate
(5-bromo-2-phenylmethoxyphenyl)-pyrrolidin-1-ylmethanone
N-BOC-BELTA-ALANINE-BELTA-4-TRIFLUOROMETHYLPHENYL-N-CARBOXYANHYDRIDE
C16H16F3NO5 (359.09805220000004)
METHYL A-HYDROXY-A-METHYL-1-(PHENYLSULFONYL)INDOLE-2-ACETATE
C18H17NO5S (359.08273920000005)
PA-824
J - Antiinfectives for systemic use > J04 - Antimycobacterials > J04A - Drugs for treatment of tuberculosis C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent
4-(2,4-dichlorophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
C16H19Cl2NO4 (359.06910740000006)
4-((8-HYDROXY-6-SULFONAPHTHALEN-2-YL)AMINO)BENZOIC ACID
6-chloro-2-(furan-2-yl)imidazo[1,2-a]pyridine
C18H18ClN3O3 (359.10366280000005)
4-[[4-(3,4-dichlorophenoxy)piperidin-1-yl]methyl]cyclopentane-1,2-diol
6-amino-4-(2-chlorophenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carbonitrile
C20H14ClN5 (359.09376740000005)
p-[(2-hydroxy-1-naphthyl)azo]benzenesulphonic acid, compound with methylamine (1:1)
C17H17N3O4S (359.09397220000005)
6-Fluoro-1-(phenylsulfonyl)-2-[(2R)-2-pyrrolidinylmethyl]-1H-pyrr olo[2,3-b]pyridine
C18H18FN3O2S (359.11037000000005)
6-Fluoro-1-(phenylsulfonyl)-2-[(2S)-2-pyrrolidinylmethyl]-1H-pyrr olo[2,3-b]pyridine
C18H18FN3O2S (359.11037000000005)
4-(8-Hydroxy-6-sulfonaphthalen-2-ylamino)benzoic acid
PD153035
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents > D007364 - Intercalating Agents D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors
(S)-N,N-DIMETHYLDINAPHTHO[2,1-D:1,2-F][1,3,2]DIOXAPHOSPHEPIN-4-AMINE
Uldazepam
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C1012 - Benzodiazepine C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent
(4-Nitrophenyl)[2-(4-nitrophenyl)-1,3-thiazolidin-3-yl]methanone
METHYL 4-[3,5-BIS(METHOXYCARBONYL)PHENOXY]-3-AMINOBENZOATE
(R)-(-)-[4-N,N-Dimethylamino]dinaphtho[2,1-d:1,2-f][1,3,2]dioxaphosphepin
3-Bromo-8-(phenylsulfonyl)-1-oxa-8-azaspiro[4.5]decane
Phenol, 4-[(1E)-2-(3,5-dimethoxyphenyl)ethenyl]-, 1-(dihydrogen phosphate), sodium salt
C16H17NaO6P (359.06604120000003)
Benzyloxycarbonylamino-(diethoxy-phosphoryl)-acetic acid methyl ester
SGX-523
C18H13N7S (359.09530980000005)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C164000 - c-Met-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
6-amino-4-(4-chlorophenyl)-3-methyl-1-phenylpyrazolo[3,4-b]pyridine-5-carbonitrile
C20H14ClN5 (359.09376740000005)
5-BROMO-2,3-DIHYDRO-BENZOFURAN-3-YLAMINEHYDROCHLORIDE
4-(3,4-dichlorophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
C16H19Cl2NO4 (359.06910740000006)
6-ACETYL-5-(4-CHLOROPHENYL)-1,3,7-TRIMETHYL-5,8-DIHYDROPYRIDO[2,3-D]PYRIMIDINE-2,4(1H,3H)-DIONE
C18H18ClN3O3 (359.10366280000005)
N-Methylguanosine cyclic 3,5-(hydrogen phosphate)
C11H14N5O7P (359.06308240000004)
3-(4-CHLORO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C16H22ClNO4S (359.09580020000004)
3-Cyclopropyl-2-[2-(methylsulfonyl)-4-(trifluoromethyl)benzoyl]-3 -oxopropanenitrile
C15H12F3NO4S (359.04391080000005)
5,6-Dichloro-1,3-diethyl-2-(2-phenylimino ethylidene) benzimidazoline
C19H19Cl2N3 (359.09559540000004)
1H-Indazole-1-acetamide,N-(5-ethyl-1,3,4-thiadiazol-2-yl)-4,5,6,7-tetrahydro-3-(trifluoromethyl)-(9CI)
C14H16F3N5OS (359.10276020000003)
3-iodo-4-[(2-methylpiperidin-1-yl)methyl]benzoic acid
3-iodo-4-[(3-methylpiperidin-1-yl)methyl]benzoic acid
N-((2S,3R)-3-Amino-2-hydroxy-5-(isopropylsulfanyl)pentanoyl)-N-3-chlorobenzoyl hydrazide
C15H22ClN3O3S (359.10703320000005)
[[2-(4-phenylphenyl)-1-(2H-tetrazol-5-yl)ethyl]amino]methylphosphonic acid
C16H18N5O3P (359.11472080000004)
3-(3-Bromobenzyl)-1-Tert-Butyl-1h-Pyrazolo[3,4-D]pyrimidin-4-Amine
N-(1,3-benzodioxol-5-yl)-2-chloro-N-[(2-prop-2-enoxyphenyl)methyl]acetamide
C19H18ClNO4 (359.09242980000005)
(3R)-3-(5-chloro-2-methoxy-phenyl)-3-fluoro-6-(trifluoromethyl)indolin-2-one
2-[(4-chlorophenyl)sulfanyl]-N-(5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-3-yl)acetamide
5-Benzyl-2-(3-carboxy-acryloylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester
C18H17NO5S (359.08273920000005)
1-(3-Chlorophenyl)-3-[4-[4-morpholinyl(oxo)methyl]phenyl]urea
C18H18ClN3O3 (359.10366280000005)
N-(6-fluoro-1,3-benzothiazol-2-yl)-6,7-dihydro-[1,4]dioxino[2,3-f][1,3]benzothiazol-2-amine
2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)acetamide
C17H17N3O4S (359.09397220000005)
3-[(3-Chlorophenyl)methyl]-5-ethoxy-1,6-dimethylpyrido[2,3-d]pyrimidine-2,4-dione
C18H18ClN3O3 (359.10366280000005)
1-(Thiophen-2-ylacetyl)-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)piperidine
2-chloro-4-{[(1R,3Z,7S,7aS)-7-hydroxy-1-(trifluoromethyl)tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-3-ylidene]amino}-3-methylbenzonitrile
4-{4-[4-(3-Aminopropoxy)phenyl]-1H-pyrazol-5-YL}-6-chlorobenzene-1,3-diol
C18H18ClN3O3 (359.10366280000005)
2-(Hydroxymethyl)-6-(4-methyl-3,5-dinitroanilino)oxane-3,4,5-triol
1,3,6,8-tetrahydroxy-3-[(2S)-1,4-dihydroxybutan-2-yl]anthracene-5,10-dione
2-Methyladenine ribotide phosphate
C11H14N5O7P-2 (359.06308240000004)
beta-D-Glucopyranose, 1-[N-(sulfooxy)-3-butenimidate], monopotassium salt
C10H17NO9S2 (359.03447120000004)
(2S)-2-Amino-4-[2-amino-3-(2-amino-3-hydroxybenzoyl)oxyphenyl]-4-oxobutanoic acid
N-[2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-yl]butanamide
N-{3-nitrobenzylidene}naphtho[2,1-b]furan-2-carbohydrazide
C20H13N3O4 (359.09060180000006)
2-[[Oxo-(2,3,4,5,6-pentafluorophenyl)methyl]amino]benzoic acid ethyl ester
(E)-4-[(3-ethoxycarbonyl-5-methyl-4-phenylthiophen-2-yl)amino]-4-oxobut-2-enoic acid
C18H17NO5S (359.08273920000005)
2-(4-Bromophenyl)-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone
N-(5-chloro-2-methylphenyl)-4-[(4-chloro-1-pyrazolyl)methyl]benzamide
1-[[2-(2,4-Difluorophenoxy)-1-oxopropyl]amino]-3-(2-oxolanylmethyl)thiourea
2-[(3,6-dimethyl-4-oxo-2-thieno[2,3-d]pyrimidinyl)thio]-N-(4-methylphenyl)acetamide
2-(2-bromo-4-chlorophenoxy)-N-cyclohexyl-N-methylacetamide
(S)-versiconol(1-)
A phenolate anion obtained by deprotonation of the 2-hydroxy group of (S)-versiconol. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
2-[2-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one
4-methoxy-N-{[2-(phenoxyacetyl)hydrazino]carbothioyl}benzamide
C17H17N3O4S (359.09397220000005)
5-(2,5-dichlorophenyl)-N-(2,4-dimethylphenyl)-2-furancarboxamide
[4-[(3-Bromophenyl)methyl]-1-piperazinyl]-(3-pyridinyl)methanone
N-(3-bicyclo[2.2.1]heptanyl)-3-bromo-4-methoxybenzenesulfonamide
2-[[[5-(Dimethylsulfamoyl)-2-methylanilino]-sulfanylidenemethyl]hydrazo]-2-oxoacetamide
N-[2-(2-imidazo[1,2-a]pyridinyl)ethyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide
C17H17N3O4S (359.09397220000005)
N,N-bis(but-2-ynyl)-3-methoxy-4-(1-tetrazolyl)benzenesulfonamide
2-Chloro-5-[(2E)-2-[(4-morpholin-4-ylphenyl)methylidene]hydrazinyl]benzoic acid
C18H18ClN3O3 (359.10366280000005)
N-[1-(2,4-difluorophenyl)-4,5,6,7-tetrahydroindazol-4-yl]-2-thiophenecarboxamide
C18H15F2N3OS (359.09038440000006)
9-{2,5-anhydro-4-[(phosphonooxy)methyl]-alpha-L-lyxofuranosyl}-9H-purin-6-amine
C11H14N5O7P (359.06308240000004)
N-[(2-chloro-6-luorophenyl)methyl]-3,4-dimethoxybenzenesulonamide
C15H15ClFNO4S (359.0394312000001)
2-[(2S,3S,6R)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
2-[(2S,3R,6R)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
2-[(2R,3S,6R)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
2-[(2S,3S,6S)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
2-[(2R,3S,6S)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
2-[(2S,3R,6S)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
2-[(2R,3R,6S)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
2-[(2R,3R,6R)-3-[(2-fluorophenyl)sulfonylamino]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-6-yl]acetic acid methyl ester
N(2)-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]-N-butyl-L-cysteinamide
C13H21N5O3S2 (359.10857560000005)
[(2R,3R,4S,5R)-3,5-dihydroxy-2-(hydroxymethyl)-6-indol-1-yloxan-4-yl] dihydrogen phosphate
4-[(2-Chloro-4,4,4-trifluoro-3-oxobutylidene)amino]-1,5-dimethyl-2-phenylpyrazol-3-one
1-(4-Fluorophenyl)-4-oxo-7-(4-pyridyl)quinoline-3-carboxamide
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] N-sulfooxybut-3-enimidothioate
C10H17NO9S2 (359.03447120000004)
N-Desmethyl-p-hydroxyrosiglitazone
C17H17N3O4S (359.09397220000005)
N-Desmethyl-O-hydroxy rosiglitazone
C17H17N3O4S (359.09397220000005)
VU0422288
VU0422288 (ML396) is a positive allosteric modulator of group III mGluRs. VU0422288 inhibits mGluRs with EC50s of 125 nM, 146 nM, and 108 nM for mGluR4, mGluR7, and mGluR8, respectively in calcium mobilization assays. VU0422288 reverses deficits in contextual fear memory, social recognition, and apneas in Rett syndrome (RTT) model mice[1][2].
(2r)-2-({hydroxy[2-(3-hydroxyquinolin-2-yl)-1,3-oxazol-4-yl]methylidene}amino)-3-sulfanylpropanoic acid
4-[cyano({[(1s,2r,3r,4r,5s,6s)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})methylidene]hex-2-enedioic acid
C14H17NO10 (359.08524220000004)
3,11-dihydroxy-16-oxa-4,14,22-triazahexacyclo[15.6.1.0²,⁶.0⁷,¹⁵.0⁸,¹³.0²¹,²⁴]tetracosa-1(23),3,7(15),8,10,12,17(24),18,20-nonaen-5-one
C20H13N3O4 (359.09060180000006)
(2r)-2-[(4-bromo-1h-pyrrol-2-yl)formamido]-6-carbamimidamidohexanoic acid
3-(3,4-dihydroxyphenyl)-2-{[3-(3,4-dihydroxyphenyl)-1-hydroxyprop-2-en-1-ylidene]amino}propanoic acid
(2s)-2-[(2r)-1-chloro-2-hydroxypropan-2-yl]-5-hydroxy-11-methyl-1h,2h-furo[2,3-c]acridin-6-one
C19H18ClNO4 (359.09242980000005)
(2e,4e)-4-[cyano({[(1s,2r,3r,4r,5s,6s)-2,3,4,5,6-pentahydroxycyclohexyl]oxy})methylidene]hex-2-enedioic acid
C14H17NO10 (359.08524220000004)
9-{2,7-dihydroxy-2-oxo-tetrahydro-4h-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl}-2-imino-1-methyl-3h-purin-6-one
C11H14N5O7P (359.06308240000004)
methyl (9s)-14-chloro-15-hydroxy-16-methoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene-10-carboxylate
C19H18ClNO4 (359.09242980000005)
methyl 14-chloro-15-hydroxy-16-methoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene-10-carboxylate
C19H18ClNO4 (359.09242980000005)
(2s)-2-[(2s)-1-chloro-2-hydroxypropan-2-yl]-5-hydroxy-11-methyl-1h,2h-furo[2,3-c]acridin-6-one
C19H18ClNO4 (359.09242980000005)
(2r)-2-[(2s)-2-chloro-1-hydroxypropan-2-yl]-5-hydroxy-11-methyl-1h,2h-furo[2,3-c]acridin-6-one
C19H18ClNO4 (359.09242980000005)
2-[(4-bromo-1h-pyrrol-2-yl)formamido]-6-carbamimidamidohexanoic acid
[(z)-(1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}but-3-en-1-ylidene)amino]oxysulfonic acid
C10H17NO9S2 (359.03447120000004)
5-hydroxy-3,4-bis(6-hydroxy-1h-indol-3-yl)pyrrol-2-one
C20H13N3O4 (359.09060180000006)
9-[(4ar,6r,7r,7as)-2,7-dihydroxy-2-oxo-tetrahydro-4h-2λ⁵-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-imino-1-methyl-3h-purin-6-one
C11H14N5O7P (359.06308240000004)
[(e)-(1-{[(2r,3r,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}but-3-en-1-ylidene)amino]oxysulfonic acid
C10H17NO9S2 (359.03447120000004)
3-[(3-chloro-4-hydroxyphenyl)amino]-5-hydroxy-4-(2-nitrophenyl)pyrrol-2-one
C16H10ClN3O5 (359.03089600000004)
n-[(14e)-1,1,15-trichloropentadeca-1,14-dien-3,12-diyn-8-yl]ethanimidic acid
C17H20Cl3NO (359.06104000000005)