Exact Mass: 396.12739939999994
Exact Mass Matches: 396.12739939999994
Found 500 metabolites which its exact mass value is equals to given mass value 396.12739939999994,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Gartanin
Gartanin is a member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, 5 and 8 and prenyl groups at positions 2 and 4. It has a role as an antineoplastic agent and a plant metabolite. It is a member of xanthones and a polyphenol. Gartanin is a natural product found in Morus insignis, Pentadesma butyracea, and other organisms with data available. A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, 5 and 8 and prenyl groups at positions 2 and 4. Constituent of the fruits of Garcinia mangostana (mangosteen). Gartanin is found in fruits and purple mangosteen. Gartanin is found in fruits. Gartanin is a constituent of the fruits of Garcinia mangostana (mangosteen) Gartanin is a natural xanthone of mangosteen, with antioxidant, anti-inflammatory, antifungal, neuroprotective and antineoplastic properties. Gartanin induces cell cycle arrest and autophagy and suppresses migration in human glioma cells[1][2]. Gartanin is a natural xanthone of mangosteen, with antioxidant, anti-inflammatory, antifungal, neuroprotective and antineoplastic properties. Gartanin induces cell cycle arrest and autophagy and suppresses migration in human glioma cells[1][2].
Sulfazecin
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
[(2E)-3,7-dimethylocta-2,6-dienyl] [(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
[(E)-3-methyl-5-[(1S,4R,5R)-1,2,3,4,5-pentamethylcyclopent-2-en-1-yl]pent-2-enyl] phosphono hydrogen phosphate
gamma-Mangostin
Gamma-mangostin is a member of the class of xanthones that is 9H-xanthene substituted by hydroxy group at positions 1, 3, 6 and 7, an oxo group at position 9 and prenyl groups at positions 2 and 8. Isolated from the stems of Cratoxylum cochinchinense, it exhibits antitumour activity. It has a role as an antineoplastic agent, a protein kinase inhibitor and a plant metabolite. It is a member of xanthones and a member of phenols. gamma-Mangostin is a natural product found in Hypericum androsaemum, Garcinia xipshuanbannaensis, and other organisms with data available. See also: Garcinia mangostana fruit rind (part of). A member of the class of xanthones that is 9H-xanthene substituted by hydroxy group at positions 1, 3, 6 and 7, an oxo group at position 9 and prenyl groups at positions 2 and 8. Isolated from the stems of Cratoxylum cochinchinense, it exhibits antitumour activity. Constituent of Garcinia mangostana (mangosteen). gamma-Mangostin is found in fruits and purple mangosteen. gamma-Mangostin is found in fruits. gamma-Mangostin is a constituent of Garcinia mangostana (mangosteen) Gamma-Mangostin is a novel competitive 5-hydroxytryptamine 2A (5-HT2A) receptors antagonist, purified from the fruit hull of the medicinal plant Garcinia mangostana. Gamma-Mangostin is a inhibitor of Transthyretin (TTR) fibrillization, it binds to the thyroxine (T4)-binding sites and stabilized the TTR tetramer[2]. Gamma-Mangostin inhibits [3H] spiperone binding to cultured rat aortic myocytes (IC50=3.5 nM) and reduces The perfusion pressure response of rat coronary artery to 5-HT2A (IC50=0.32 μM) [1]. Gamma-Mangostin is a novel competitive 5-hydroxytryptamine 2A (5-HT2A) receptor antagonist and potent epoxidase 2 (COX-2) inhibitor, as well as a transthyroxin protein (TTR) profibrosis inhibitor. Gamma-Mangostin binds to the thyroxine (T4)-binding sites and stabilized the TTR tetramer[2]. Gamma-Mangostin inhibits [3H] spiperone binding to cultured rat aortic myocytes (IC50=3.5 nM) and reduces The perfusion pressure response of rat coronary artery to 5-HT2A (IC50=0.32 μM). Gamma-Mangostin has anti-inflammatory, antibacterial, antioxidant and anticancer activities, and can be used in the study of metabolic disorders such as diabetes[1][2][3][4][5]. Gamma-Mangostin is a novel competitive 5-hydroxytryptamine 2A (5-HT2A) receptors antagonist, purified from the fruit hull of the medicinal plant Garcinia mangostana. Gamma-Mangostin is a inhibitor of Transthyretin (TTR) fibrillization, it binds to the thyroxine (T4)-binding sites and stabilized the TTR tetramer[2]. Gamma-Mangostin inhibits [3H] spiperone binding to cultured rat aortic myocytes (IC50=3.5 nM) and reduces The perfusion pressure response of rat coronary artery to 5-HT2A (IC50=0.32 μM) [1].
4-(1,1-Dimethyl-2-propenyl)-1,3,5,6-tetrahydroxy-7-prenylxanthone
4-(1,1-Dimethyl-2-propenyl)-1,3,5,6-tetrahydroxy-7-prenylxanthone is found in fruits. 4-(1,1-Dimethyl-2-propenyl)-1,3,5,6-tetrahydroxy-7-prenylxanthone is a constituent of the root bark of Rheedia brasiliensis (bakupari). Constituent of the root bark of Rheedia brasiliensis (bakupari). 4-(1,1-Dimethyl-2-propenyl)-1,3,5,6-tetrahydroxy-7-prenylxanthone is found in herbs and spices and fruits.
Artonin L
Artonin L is found in fruits. Artonin L is a constituent of the root bark of Artocarpus heterophyllus (jackfruit). Constituent of the root bark of Artocarpus heterophyllus (jackfruit). Artonin L is found in jackfruit and fruits.
6,8-Di-O-methylaverufin
6,8-Di-O-methylaverufin is found in cereals and cereal products. 6,8-Di-O-methylaverufin is produced by rice inoculated with Emericella foeniculicola and from a fungal isolate SIPI-891 Production by rice inoculated with Emericella foeniculicola and from a fungal isolate SIPI-8917. 6,8-Di-O-methylaverufin is found in cereals and cereal products.
Methyl (3x,4E,10R)-3,10-dihydroxy-4,11-dodecadiene-6,8-diynoate 10-glucoside
Methyl (3x,4E,10R)-3,10-dihydroxy-4,11-dodecadiene-6,8-diynoate 10-glucoside is found in root vegetables. Methyl (3x,4E,10R)-3,10-dihydroxy-4,11-dodecadiene-6,8-diynoate 10-glucoside is a constituent of Helianthus tuberosus (Jerusalem artichoke). Constituent of Helianthus tuberosus (Jerusalem artichoke). Methyl (3x,4E,10R)-3,10-dihydroxy-4,11-dodecadiene-6,8-diynoate 10-glucoside is found in root vegetables.
1-(3-Methylbutanoyl)-6-apiosylglucose
C16H28O11 (396.16315380000003)
1-(3-Methylbutanoyl)-6-apiosylglucose is found in coffee and coffee products. 1-(3-Methylbutanoyl)-6-apiosylglucose is a constituent of green coffee beans (Coffea arabica). Constituent of green coffee beans (Coffea arabica). 1-(3-Methylbutanoyl)-6-apiosylglucose is found in coffee and coffee products.
Eremopetasitenin A2
C20H28O6S (396.16065080000004)
Eremopetasitenin A2 is found in green vegetables. Eremopetasitenin A2 is a constituent of Petasites japonicus (sweet coltsfoot) Constituent of Petasites japonicus (sweet coltsfoot). Eremopetasitenin A2 is found in green vegetables.
Aloesol 7-glucoside
Aloesol 7-glucoside is found in green vegetables. Aloesol 7-glucoside is a constituent of rhubarb Rheum sp. Constituent of rhubarb Rheum species Aloesol 7-glucoside is found in green vegetables.
BR-Xanthone A
Constituent of the dry fruit hulls of Garcinia mangostana (mangosteen). BR-Xanthone A is found in fruits and purple mangosteen. BR-Xanthone A is found in fruits. BR-Xanthone A is a constituent of the dry fruit hulls of Garcinia mangostana (mangosteen).
Curcumin I
Curcumin I is found in herbs and spices. Curcumin I is isolated from the rhizomes of Curcuma longa (turmeric). Isolated from the rhizomes of Curcuma longa (turmeric). Curcumin I is found in herbs and spices.
Cudratricusxanthone A
Glucocorticoid receptor agonist
Phosphine oxide, diphenyl(2,4,6-trimethoxybenzoyl)-
C22H21O5P (396.11265460000004)
Mirabegron
Pradofloxacin
C21H21FN4O3 (396.15976079999996)
Tiaprost
C20H28O6S (396.16065080000004)
Isonormangostin
Dimethylcurcumin
Dimethylcurcumin is a synthetic chemical compound that is loosely based on a compound found in curcumin. It is a novel anti-androgen that enhances androgen receptor degradation. Dimethylcurcumin (ASC-J9) is an androgen receptor degradation enhancer that effectively suppresses castration resistant prostate cancer cell proliferation and invasion. Dimethylcurcumin (ASC-J9) is an androgen receptor degradation enhancer that effectively suppresses castration resistant prostate cancer cell proliferation and invasion.
Dihydrorotenone
Dihydrorotenone, a natural pesticide, is a potent mitochondrial inhibitor. Dihydrorotenone probably induces Parkinsonian syndrome. Dihydrorotenone induces human plasma cell apoptosis by triggering endoplasmic reticulum stress and activating p38 signaling pathway[1]. Dihydrorotenone, a natural pesticide, is a potent mitochondrial inhibitor. Dihydrorotenone probably induces Parkinsonian syndrome. Dihydrorotenone induces human plasma cell apoptosis by triggering endoplasmic reticulum stress and activating p38 signaling pathway[1].
8-C-Methylvelloquercetin 3-methyl ether
Artoindonesianin S
Rotenonic acid
cudraxanthone L
Rotenol
7a-O-Methyldeguelol
cudratricusxanthone A
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 2, 3, 6 and 8, an isoprenyl group at position 1 and a 2-methylbut-3-en-2-yl group at position 5. It is isolated from the root barks of Cudrania tricuspidata and exhibits cytotoxicity towards human cancer cell lines.
Macluraxanthone B
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, 6 and 7, a dimethylallyl group at position 2 and a prenyl group at position 4. Isolated from Maclura tinctoria and Cudrania tricuspidata, it exhibits anti-HIV and antineoplastic activity.
Macluraxanthone C
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, 5 and 6, a dimethylallyl group at position 2 and a prenyl group at position 4. Isolated from Maclura tinctoria and Cudrania tricuspidata, it exhibits anti-HIV and antineoplastic activity.
Xanthone V1a
Xanthone V1a is a natural product found in Garcinia lancilimba, Maclura tricuspidata, and Vismia guineensis with data available.
Muxiangrin III
5-Hydroxy-8-(4-hydroxy-3,5-dimethoxyphenyl)-2,2-dimethyl-2H,6H-benzo[1,2-b:5,4-b]dipyran-6-one
6,6-Dimethylpyrano[2,3:6,5]-2-hydroxy-3,4,4-trimethoxychalcone
Elongatin
Artonin L
1R,cis-RU 15525
C23H24O4S (396.13952240000003)
D010575 - Pesticides > D007306 - Insecticides > D011722 - Pyrethrins
5-Chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8a-dihydroxy-1-methoxy-7-methyl-1H-isochromene-6,8-dione
1-beta-vicianosyl-(S)-2-methylbutyrate
C16H28O11 (396.16315380000003)
mollicellin L
A member of the class of depsidones that is 11H-dibenzo[b,e][1,4]dioxepine substituted by a hydroxy group at position 3, a methoxy group at position 7, methyl groups at positions 1 and 9, a 3-methylbut-2-enoyl group at position 8, a formyl group at position 4 and an oxo group at position 11. Isolated from Chaetomium brasiliense, it exhibits antimalarial and cytotoxic activities.
Egonolbutanoate
A butanoate ester of egonol isolated from the fruits of Styrax agrestis.
12-O-beta-glucopyranosyl-9beta,12-dihydroxytremetone
(1R*,4R*,8S*,10R*)-1,4-epoxy-1,8-dihydroxy-10,13-diacetoxy-germacra-5E,7(11)-dien-6,12-olide
1,7-dihydroxy-3-(6-hydroxy-3,7-dimethylocta-2,7-dienyloxy)-xanthen-9-one|cochinxanthone B
2-(butan-2-y)-5-hydroxy-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside|5,7-dihydroxy-2-isobutylchromone-7-O-beta-D-glucopyranoside|petiolin E|urachromone B
2-Methyl-5-(2-hydroxypropyl)-7-hydroxy-chromone-2-O-??-D-glucopyranoside
(2R*,3S*)-1-(2-[1-(Hydroxymethyl)vinyl]-3-[??-D-glucosyloxy]-2,3-dihydrobenzo[b]furan-5-yl)-1-ethanone|{(2R*,3S*)-3-(beta-D-glucopyranosyloxy)-2,3-dihydro-2-[1-(hydroxymethyl)ethenyl]-1-benzofuran-5-yl}ethanone
6-deoxy-4-O-[(2E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-en-1-yl]-alpha-L-mannopyranose 2-acetate|asiatiside C
3beta-hydroxy-8beta-(p-hydroxyphenylacetyloxy)guaia-4(15),10(14),11(13)-trien-1alpha,5alpha,6beta,7alphaH-12,6-olide|8-O-p-hydroxyphenylacetylintegrifolin|ixerochinolide
7-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-1,3,5,6-tetrahydroxy-9H-xanthen-9-one
CRATOXYARBORENONE B
A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 1, 3, 5 and 7 and two isoprenyl groups at positions 2 and 8 respectively. It is isolated from Cratoxylum Sumatranum and exhibits cytotoxicity towards the KB (human oral epidermoid) cancer cell line.
10-Cinnamoyloxy-8,9-epoxy-6-hydroxythymol-isobutyrat
1,3-dihydroxy-7-(6-hydroxy-3,7-dimethylocta-2,7-dienyloxy)-xanthen-9-one|cochinxanthone A
3-(Prenyloxy)-5-hydroxy-7-methoxy-3,4-(methylenebisoxy)flavone
(1S)-1,5-anhydro-1-[5,7-dihydroxy-2-(2-methylpropyl)-4-oxo-4H-1-benzopyran-8-yl]-D-glucitol|8-beta-C-glucopyranosyl-5,7-dihydroxy-2-isobutylchromone
1,3,7-trihydroxy-2-(2-hydroxy-3-methylbut-3-enyl)-4-(3-methylbut-2-enyl)-xanthone
1-(3-hydroxy-4-methoxy-phenyl)-4,6,7-trimethoxy-2,3-naphthalide|pronaphthalide A
7,9-dimethoxy-11-hydroxy-2-methyl-3,4,5,6-tetrahydro-2h-2,6-epoxyanthra[2,3-b]oxocin-8,13-dione
6-(2-carboxyvinyl)-7-methoxy-5-hydroxybenzofuran-5-O-beta-D-glucopyranoside
2,8-dihydroxy-3,10-dimethoxy-6-(2-methyl-1-propen-1?yl)-6H,7H-[1]benzopyrano[4,3-b][1]benzopyran-7-one
propyl (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylate|propyl chlorogenate
(+)-(1S,3R,4R,5R,6S,7R,8S)-8-angeloyloxy-1,4-dihydroxy-3-chloroguai-9,11(13)-dien-6,12-olide|argyinolide E
isopropyl (1S,3R,4R,5R)-3-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylate
(3-methyl-2-butenyl)-6-O-beta-D-glucopyranosyl-1(3H)-isobenzofuranone|nigelactone
1,3,5,8-tetrahydroxy-2-(3-methylbut-2-enyl)-4-(1,1-dimethylprop-2-enyl)xanthone|pedunxanthone B
methyl rel-(1S,2R,3R,5S,7R)-7-[(E)-caffeoyloxymethyl]-2,3-dihydroxy-6,8-dioxabicyclo[3.2.1]octane-5-carboxylate
(E)-1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(3,4,5-trimethoxy-phenyl)prop-2-en-1-one
2,8-Diisopropyl-peri-xanthenoxanthene-4,10-quinone
1,3-dihydroxy-7-(7-hydroxy-3,7-dimethylocta-2,5-dienyloxy)-xanthen-9-one|cochinxanthone C
(E)-1-(5-hydroxy-2,2-dimethyl-2H-chromen-6-yl)-3-(2,4,5-trimethoxyphenyl)prop-2-en-1-one|Glabrachalcone
2-(3,4-dimethoxyphenyl)-5-methoxy-8,8-dimethyl-2,3-dihydro-8H-pyrano[2,3-f]chromen-4-one
3-(3,4-dimethoxyphenyl)-1-(5-hydroxy-7-methoxy-2,2-dimethyl-2H-chromen-6-yl)propenone|glychalcone B
N-Hydroxy-N-[1-[6-[1-(benzo[b]thiophene-2-yl)ethyl]benzo[b]thiophene-2-yl]ethyl]urea
2-hydroxy-3,4,4-trimethoxy-5,6-(2,2-dimethylpyrano)chalcone
1,9-bis(3,4-methylenedioxyphenyl)-1 ,3-nonanedione
4,4-Dimethoxy-O-methyl-pulvinsaeuremethylester|E-permethylatromentic acid|methyl 4,4-dimethoxyvulpinate|per-O-methylatromentic acid
Thymidine, 5-o-(p-toluenesulfonyl)-
C17H20N2O7S (396.09911700000004)
9-(beta-D-glucopyranosyl)-10H-indolo[3,2-b]quinoline|9-(beta-D-glucopyranosyloxy)-10H-indolo[3,2-b]quinoline|jusbetonin
Tri(trimethylsilyl)-caffeinsaeure|Tris(?)-trimethylsilylcaffeinsaeure
Quinine 2HCl
β-Apopicropodophyllin
beta-Apopicropodophyllin is a component of the freshwater plant Micranthemum umbrosum. beta-Apopicropodophyllin is a natural product found in Micranthemum umbrosum and Condea verticillata with data available.
Thiazopyr
Pre-emergence control herbicide, inhibitor of cell division. It is used on fruit trees, vines sugar cane, pineapples and citrus fruits CONFIDENCE standard compound; INTERNAL_ID 1070; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9520; ORIGINAL_PRECURSOR_SCAN_NO 9518 CONFIDENCE standard compound; INTERNAL_ID 1070; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9530; ORIGINAL_PRECURSOR_SCAN_NO 9527 CONFIDENCE standard compound; INTERNAL_ID 1070; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9534; ORIGINAL_PRECURSOR_SCAN_NO 9533 CONFIDENCE standard compound; INTERNAL_ID 1070; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9569; ORIGINAL_PRECURSOR_SCAN_NO 9568 CONFIDENCE standard compound; INTERNAL_ID 1070; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9593; ORIGINAL_PRECURSOR_SCAN_NO 9591 CONFIDENCE standard compound; INTERNAL_ID 1070; DATASET 20200303_ENTACT_RP_MIX503; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9579; ORIGINAL_PRECURSOR_SCAN_NO 9577 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3052
Mirabegron
G - Genito urinary system and sex hormones > G04 - Urologicals > G04B - Urologicals > G04BD - Drugs for urinary frequency and incontinence C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D000089162 - Genitourinary Agents > D064804 - Urological Agents Mirabegron is a selective β3-adrenoceptor agonist with EC50 of 22.4 nM.
5,7-dihydroxy-2-(2-methylpropyl)-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
1,3,6,7-tetrahydroxy-2,8-bis(3-methylbut-2-enyl)xanthen-9-one
[7-methyl-6,8-dioxo-3-[(E)-prop-1-enyl]isochromen-7-yl] 4-hydroxy-2-methoxy-6-methylbenzoate
Gartanin
Gartanin is a natural xanthone of mangosteen, with antioxidant, anti-inflammatory, antifungal, neuroprotective and antineoplastic properties. Gartanin induces cell cycle arrest and autophagy and suppresses migration in human glioma cells[1][2]. Gartanin is a natural xanthone of mangosteen, with antioxidant, anti-inflammatory, antifungal, neuroprotective and antineoplastic properties. Gartanin induces cell cycle arrest and autophagy and suppresses migration in human glioma cells[1][2].
[7-methyl-6,8-dioxo-3-[(E)-prop-1-enyl]isochromen-7-yl] 4-hydroxy-2-methoxy-6-methylbenzoate [IIN-based on: CCMSLIB00000848013]
[7-methyl-6,8-dioxo-3-[(E)-prop-1-enyl]isochromen-7-yl] 4-hydroxy-2-methoxy-6-methylbenzoate [IIN-based: Match]
CI-1018
CONFIDENCE standard compound; INTERNAL_ID 1217; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8920; ORIGINAL_PRECURSOR_SCAN_NO 8918 CONFIDENCE standard compound; INTERNAL_ID 1217; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8923; ORIGINAL_PRECURSOR_SCAN_NO 8921 CONFIDENCE standard compound; INTERNAL_ID 1217; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8935; ORIGINAL_PRECURSOR_SCAN_NO 8933 CONFIDENCE standard compound; INTERNAL_ID 1217; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8956; ORIGINAL_PRECURSOR_SCAN_NO 8954 CONFIDENCE standard compound; INTERNAL_ID 1217; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8964; ORIGINAL_PRECURSOR_SCAN_NO 8961 CONFIDENCE standard compound; INTERNAL_ID 1217; DATASET 20200303_ENTACT_RP_MIX504; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8965; ORIGINAL_PRECURSOR_SCAN_NO 8963
Ala Cys Cys Thr
Ala Cys Phe Gly
Ala Cys Gly Phe
Ala Cys Thr Cys
Ala Phe Cys Gly
Ala Phe Gly Cys
Ala Gly Cys Phe
Ala Gly Phe Cys
Ala Gly Ser Tyr
Ala Gly Tyr Ser
Ala Ser Gly Tyr
Ala Ser Tyr Gly
Ala Thr Cys Cys
Ala Tyr Gly Ser
Ala Tyr Ser Gly
Cys Ala Cys Thr
Cys Ala Phe Gly
Cys Ala Gly Phe
Cys Ala Thr Cys
Cys Cys Ala Thr
Cys Cys Thr Ala
Cys Phe Ala Gly
Cys Phe Gly Ala
Cys Gly Ala Phe
Cys Gly Phe Ala
Cys Gly Met Ser
Cys Gly Ser Met
Cys Met Gly Ser
Cys Met Ser Gly
Cys Ser Gly Met
Cys Ser Met Gly
Cys Ser Ser Thr
Cys Ser Thr Ser
Cys Thr Ala Cys
Cys Thr Cys Ala
Cys Thr Ser Ser
Phe Ala Cys Gly
Phe Ala Gly Cys
Phe Cys Ala Gly
Phe Cys Gly Ala
Phe Gly Ala Cys
Phe Gly Cys Ala
Phe Gly Ser Ser
Gly Ala Cys Phe
Gly Ala Phe Cys
Gly Cys Ala Phe
Gly Cys Phe Ala
Gly Cys Met Ser
Gly Cys Ser Met
Gly Phe Ala Cys
Gly Phe Cys Ala
Gly Met Cys Ser
Gly Met Ser Cys
Gly Ser Cys Met
Gly Ser Met Cys
Met Cys Gly Ser
Met Cys Ser Gly
Met Gly Cys Ser
Met Gly Ser Cys
Met Ser Cys Gly
Met Ser Gly Cys
Ser Cys Gly Met
Ser Cys Met Gly
Ser Cys Ser Thr
Ser Cys Thr Ser
Ser Gly Cys Met
Ser Gly Met Cys
Ser Met Cys Gly
Ser Met Gly Cys
Ser Ser Cys Thr
Ser Ser Thr Cys
Ser Thr Cys Ser
Ser Thr Ser Cys
Thr Ala Cys Cys
Thr Cys Ala Cys
Thr Cys Cys Ala
Thr Cys Ser Ser
Thr Ser Cys Ser
Thr Ser Ser Cys
Rotenone
Dihydrorotenone, a natural pesticide, is a potent mitochondrial inhibitor. Dihydrorotenone probably induces Parkinsonian syndrome. Dihydrorotenone induces human plasma cell apoptosis by triggering endoplasmic reticulum stress and activating p38 signaling pathway[1]. Dihydrorotenone, a natural pesticide, is a potent mitochondrial inhibitor. Dihydrorotenone probably induces Parkinsonian syndrome. Dihydrorotenone induces human plasma cell apoptosis by triggering endoplasmic reticulum stress and activating p38 signaling pathway[1].
Eremopetasitenin A2
C20H28O6S (396.16065080000004)
BR-xanthone A
SIPI 8917-I
Normangostin
Gamma-Mangostin is a novel competitive 5-hydroxytryptamine 2A (5-HT2A) receptors antagonist, purified from the fruit hull of the medicinal plant Garcinia mangostana. Gamma-Mangostin is a inhibitor of Transthyretin (TTR) fibrillization, it binds to the thyroxine (T4)-binding sites and stabilized the TTR tetramer[2]. Gamma-Mangostin inhibits [3H] spiperone binding to cultured rat aortic myocytes (IC50=3.5 nM) and reduces The perfusion pressure response of rat coronary artery to 5-HT2A (IC50=0.32 μM) [1]. Gamma-Mangostin is a novel competitive 5-hydroxytryptamine 2A (5-HT2A) receptor antagonist and potent epoxidase 2 (COX-2) inhibitor, as well as a transthyroxin protein (TTR) profibrosis inhibitor. Gamma-Mangostin binds to the thyroxine (T4)-binding sites and stabilized the TTR tetramer[2]. Gamma-Mangostin inhibits [3H] spiperone binding to cultured rat aortic myocytes (IC50=3.5 nM) and reduces The perfusion pressure response of rat coronary artery to 5-HT2A (IC50=0.32 μM). Gamma-Mangostin has anti-inflammatory, antibacterial, antioxidant and anticancer activities, and can be used in the study of metabolic disorders such as diabetes[1][2][3][4][5]. Gamma-Mangostin is a novel competitive 5-hydroxytryptamine 2A (5-HT2A) receptors antagonist, purified from the fruit hull of the medicinal plant Garcinia mangostana. Gamma-Mangostin is a inhibitor of Transthyretin (TTR) fibrillization, it binds to the thyroxine (T4)-binding sites and stabilized the TTR tetramer[2]. Gamma-Mangostin inhibits [3H] spiperone binding to cultured rat aortic myocytes (IC50=3.5 nM) and reduces The perfusion pressure response of rat coronary artery to 5-HT2A (IC50=0.32 μM) [1].
Visor
1-(3-Methylbutanoyl)-6-apiosylglucose
C16H28O11 (396.16315380000003)
Aloesol 7-glucoside
Methyl (3x,4E,10R)-3,10-dihydroxy-4,11-dodecadiene-6,8-diynoate 10-glucoside
4-(1,1-Dimethyl-2-propenyl)-1,3,5,6-tetrahydroxy-7-prenylxanthone
2-[2-[bis(carboxymethyl)amino]ethyl-(3-trimethoxysilylpropyl)amino]acetic acid
2,4-difluoro-N-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl]benzenesulfonamide
C17H19BF2N2O4S (396.1126588000001)
2-Hydroxy-N-(4-methoxy-2-methylphenyl)-11H-benzo[a]carbazole-3-carboxamide
1-BOC-3-([2-(2-BROMO-PHENYL)-ETHYLAMINO]-METHYL)-PIPERIDINE
1-BOC-4-([2-(2-BROMO-PHENYL)-ETHYLAMINO]-METHYL)-PIPERIDINE
1-BOC-3-([2-(3-BROMO-PHENYL)-ETHYLAMINO]-METHYL)-PIPERIDINE
1-BOC-3-([2-(4-BROMO-PHENYL)-ETHYLAMINO]-METHYL)-PIPERIDINE
fosbretabulin
C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C273 - Antimitotic Agent D000970 - Antineoplastic Agents
butane-1,4-diol,1,4-diisocyanatobenzene,hexanedioic acid
C18H24N2O8 (396.15325839999997)
2,3-BIS(4-METHOXYPHENYL)-5-PHENYLTETRAZOLIUM CHLORIDE
Thymidine,5-(4-methylbenzenesulfonate)
C17H20N2O7S (396.09911700000004)
5-BENZYL 3-METHYL 1-(P-FLUOROPHENYL)-4-ISOPROPYL-1H-PYRAZOLE-3,5-DICARBOXYLATE
(R)-TERT-BUTYL (1-(3-(6-(TRIFLUOROMETHYL)-1H-BENZO[D]IMIDAZOL-2-YL)ISOXAZOL-5-YL)ETHYL)CARBAMATE
C18H19F3N4O3 (396.14091799999994)
2-piperazinecarboxylic acid, 1,4-bis(phenylmethyl)-methyl ester,dihydrochloride
(1R)-2-{[2-(4-Aminophenyl)ethyl]amino}-1-phenylethyl (2-amino-1,3-thiazol-4-yl)acetate
Phenyl 3,4-O-(1-methylethylidene)-1-thio-beta-D-galactopyranoside diacetate
[trans(trans)]-1-(4-Ethyl[1,1-bicyclohexyl]-4-yl)-4-iodobenzene
1H-Benzimidazole-1-acetamide,N-(1,1-dimethylethyl)-2-[[2-oxo-2-(phenylamino)ethyl]thio]-(9CI)
LY450108
C19H22F2N2O3S (396.1319126000001)
LY450108 is a potent AMPA receptor potentiator. LY450108 has the potential for depression and Parkinson's disease research[1][2][3][4].
2,4,6-TRIPHENYLPYRYLIUM TETRAFLUOROBORATE
C23H17BF4O (396.13085099999995)
Pradofloxacin
C21H21FN4O3 (396.15976079999996)
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D024841 - Fluoroquinolones C254 - Anti-Infective Agent > C258 - Antibiotic > C795 - Quinolone Antibiotic
3-Pyridinecarboxylic acid, 6-(((2S)-3-cyclopentyl-1-oxo-2-(4-(trifluoromethyl)-1H-imidazol-1-yl)propyl)amino)-
C18H19F3N4O3 (396.14091799999994)
D004791 - Enzyme Inhibitors
3-(2-Aminoquinazolin-6-Yl)-4-Methyl-1-[3-(Trifluoromethyl)phenyl]pyridin-2(1h)-One
N-(4-Phenoxyphenyl)-2-[(Pyridin-4-Ylmethyl)amino]nicotinamide
5-[4-(4-Chlorobenzoyl)-1-piperazinyl]-8-nitroquinoline
SIRT2-IN-8 is a potent SIRT2 inhibitor. SIRT2-IN-8 can be used for Huntington’s and Parkinson’s diseases research[1].
methyl (2R)-2-phenyl-2-[(2-phenylquinoline-4-carbonyl)amino]acetate
SB 218795 is a potent and selective non-peptide NK3 receptor antagonist, with a Ki 13 nM for hNK3. SB 218795 shows about 90-fold and 7000-fold selectivity for hNK3 over hNK2 and hNK1, respectively. SB 218795 can inhibit NK3 receptor-mediated pupillary constriction of the rabbit[1][2].
Egonol-2-Methylpropanoate
A fatty acid ester obtained by the formal condensation of egonol with isobutyric acid. It has been isolated from the fruits of Styrax agrestis.
[3-Amino-4-(methoxymethyl)-6-methyl-2-thieno[2,3-b]pyridinyl]-(4-phenyl-1-piperazinyl)methanone
3-(2-Furanylmethyl)-5,6-dimethyl-2-[(3-methylphenyl)methylthio]-4-thieno[2,3-d]pyrimidinone
N-(4-methylphenyl)-2-[[(4-methylphenyl)-oxomethyl]hydrazo]-4-oxo-5,6-dihydro-1,3-thiazine-6-carboxamide
C20H20N4O3S (396.12560500000006)
4-Pyridinecarboxamide, N-((3R)-3,4,6,7-tetrahydro-9-methyl-4-oxo-1-phenylpyrrolo(3,2,1-jk)(1,4)benzodiazepin-3-yl)-
8-beta-D-Glucopyranosyl-5,7-dihydroxy-2-(2-methylpropyl)-4H-1-benzopyran-4-one
(5S)-1-benzyl-3-(1,1-dioxido-1,2-benzisothiazol-3-yl)-4-hydroxy-5-(1-methylethyl)-1,5-dihydro-2H-pyrrol-2-one
C21H20N2O4S (396.11437200000006)
(1R,6S,13R)-16,17-Dimethoxy-6-propan-2-yl-2,7,20-trioxapentacyclo[11.8.0.03,11.04,8.014,19]henicosa-3(11),4(8),9,14,16,18-hexaen-12-one
[(1S,2R,3S,10R,11S)-11-acetyloxy-3,10-dihydroxy-1,5-dimethyl-4-oxospiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2-oxirane]-2-yl]methyl acetate
[beta-N-acetyl-D-glucosaminyl(1->4)beta-D-glucuronate
C14H22NO12- (396.11419520000004)
Trans-combretastatin A-4 phosphate (*disodium salt*)
Cochinchinoxanthone
A polycyclic cage xanthone isolated from the stems of Cratoxylum cochinchinense and has been shown to exhibit cytotoxic activity against human colon cancer cell line.
Ixerochinolide
A sesquiterpene lactone isolated from Ixeris chinensis and has been shown to exhibit cytotoxic activity against human PC-3 tumor cells.
5-O-Demethylpaxanthonin
A member of the class of xanthones consisting of paxanthonin in which the methoxy group at position 5 is replaced by a hydroxy group. Isolated from the roots of Hypericum roeperianum and leaves of Hypericum styphelioides, it exhibits antioxidant and antifungal activities.
1-(4-Fluorophenyl)-3-[4-(4-fluorophenyl)-2-methyl-5-(trifluoromethyl)-3-pyrazolyl]urea
N-(4-acetamidophenyl)-2-[[1-(4-ethylphenyl)-5-tetrazolyl]thio]acetamide
N-tert-butyl-2-[(2-chloro-1-oxoethyl)-(2-furanylmethyl)amino]-2-(4-chlorophenyl)acetamide
1,3,8-Trimethyl-5,10-diphenylpyrimido[1,2]pyrrolo[4,5-b]pyridazine-2,4-dione
N-[(3Z)-3-[2-(benzylamino)-1-cyano-2-oxoethylidene]isoindol-1-yl]furan-2-carboxamide
C23H16N4O3 (396.12223459999996)
N-[3-[[diethylamino(sulfanylidene)methyl]thio]-1-oxopropyl]carbamic acid (4-tert-butylphenyl) ester
C19H28N2O3S2 (396.15412580000003)
[4-(2,7-Dimethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-piperazinyl]-(2-furanyl)methanone
7-(3-Methoxypropyl)-3-(phenylmethyl)-8-(3-thiophenyl)purine-2,6-dione
C20H20N4O3S (396.12560500000006)
7-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-3,4-dihydro-2H-[1,3]thiazino[3,2:1,2]pyrimido[5,4-b]indol-6(7H)-one
N-[[2-cyanoethyl(methyl)amino]-sulfanylidenemethyl]-4-(4-morpholinylsulfonyl)benzamide
1,7-Bis(3,4-dimethoxyphenyl)hepta-1,6-diene-3,5-dione
(2S,3S,4S,5R,6R)-6-[(2R,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylate
C14H22NO12- (396.11419520000004)
(4R,5R)-5-(2-azidophenyl)-2-[4-(3-hydroxypropoxy)phenyl]-4,5-dihydrooxazole-4-carboxylic acid methyl ester
(2Z)-2-[(3-Hydroxyphenyl)methylidene]-5,6-diphenylimidazo[2,1-b][1,3]thiazol-3-one
[(2S,3S)-1-[(4-chlorophenyl)methyl]-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-cyclopropylmethanone
[(2S,3R)-1-[(4-chlorophenyl)methyl]-2-(hydroxymethyl)-3-phenyl-1,6-diazaspiro[3.3]heptan-6-yl]-cyclopropylmethanone
3,4,5-trihydroxy-6-[5-methoxy-2-[(Z)-4-methyl-3-oxopent-1-enyl]phenoxy]oxane-2-carboxylic acid
N-[4-[3-[(E)-(2-Acetamido-4-oxo-1,3-thiazol-5-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]phenyl]acetamide
C20H20N4O3S (396.12560500000006)
3,4,5-trihydroxy-6-[(E)-5-(4-methoxyphenyl)-2-methyl-3-oxopent-4-en-2-yl]oxyoxane-2-carboxylic acid
(2S,2AR,5AS)-1-Benzoyl-3,5-dioxo-2,4-diphenyl-1,2,3,4,5,6-hexahydropyrrolo(3,4-C)pyrrole
(3ar,4r,6r,6as,7r,9ar,9br)-6-(chloromethyl)-6,7-dihydroxy-9-methyl-3-methylidene-2-oxo-3ah,4h,5h,6ah,7h,9ah,9bh-azuleno[4,5-b]furan-4-yl (2e)-2-methylbut-2-enoate
2-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-1,3,6,7-tetrahydroxyxanthen-9-one
3,6,8-trihydroxy-1,1-bis(3-methylbut-2-en-1-yl)xanthene-2,9-dione
3-(2h-1,3-benzodioxol-5-yl)-1-[2,4-dimethoxy-5-(3-methylbut-2-en-1-yl)phenyl]-3-hydroxyprop-2-en-1-one
(2s,3r,4r,5r,6r)-5-(acetyloxy)-4,6-dihydroxy-2-methyloxan-3-yl (2e)-3-(3,4-dimethoxyphenyl)prop-2-enoate
10,16-dihydroxy-6,6,19,19-tetramethyl-5,13,18-trioxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁷,²²]docosa-1(22),3,9,11,14,16-hexaen-2-one
1,3,7-trihydroxy-2-[(2r)-2-hydroxy-3-methylbut-3-en-1-yl]-4-(3-methylbut-2-en-1-yl)xanthen-9-one
4-(3,7-dimethylocta-2,6-dien-1-yl)-1,3,5,6-tetrahydroxyxanthen-9-one
3-[4,5-dimethoxy-2-(2-methylbut-3-en-2-yl)phenyl]-5-hydroxy-7-methoxychromen-4-one
(3as,4r,5r,6s,6ar,8r,9bs)-4-(acetyloxy)-8-hydroperoxy-6-hydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,6ah,7h,8h,9bh-azuleno[4,5-b]furan-5-yl acetate
(1r)-1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methylpent-3-en-1-yl 5-methylhexa-3,5-dienoate
(4s)-6-methoxy-4,5-dimethyl-3-methylidene-8-{[(2s,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4h-2-benzopyran-1-one
(2r,3r,4s,5r,6s)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(6-methoxy-2-oxochromen-7-yl)oxy]oxan-4-yl acetate
1,3-dihydroxy-7-{[(2e,6r)-6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl]oxy}xanthen-9-one
4-chloro-3-ethenyl-8-hydroxy-2-isocyano-3,7,7,10-tetramethyl-10-azatetracyclo[6.6.1.1²,⁶.0¹¹,¹⁵]hexadeca-1(15),4,11,13-tetraene-9,16-dione
4,8,9-trihydroxy-2,3,3-trimethyl-11-(3-methylbut-2-en-1-yl)-2h-furo[3,2-b]xanthen-5-one
(2s)-4,7,8-trihydroxy-2,3,3-trimethyl-9-(3-methylbut-2-en-1-yl)-2h-furo[3,2-b]xanthen-5-one
(2s)-4,7-dihydroxy-2-(2-hydroxypropan-2-yl)-6-(3-methylbut-2-en-1-yl)-2h,3h-furo[3,2-b]xanthen-5-one
1,9-bis(2h-1,3-benzodioxol-5-yl)-3-hydroxynon-2-en-1-one
1,3,5,6-tetrahydroxy-4-[(2s)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]xanthen-9-one
(1s,2r,3r,4s,6r,7r,10r,11r,12r)-2,6,11,12-tetrahydroxy-4,10-dimethyl-4-[(2r)-3-methyl-5-oxo-2h-furan-2-yl]-9,14-dioxatetracyclo[8.4.0.0³,⁷.0⁷,¹¹]tetradecan-13-one
5,10-dihydroxy-7-(3-hydroxy-3-methylbutyl)-2,2-dimethyl-1,11-dioxatetracen-6-one
2,6,7-trihydroxy-3-methyl-4,11-dioxo-1h,2h,3h-cyclohexa[a]fluoren-1-yl 2-methylpropanoate
(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl (2s)-2-methylbutanoate
C16H28O11 (396.16315380000003)