Exact Mass: 452.1546322
Exact Mass Matches: 452.1546322
Found 500 metabolites which its exact mass value is equals to given mass value 452.1546322
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Aspalathin
C21H24O11 (452.13185539999995)
Aspalathin is found in tea. Aspalathin is a constituent of Aspalathus linearis (rooibos) Aspalathin is a C-linked dihydrochalcone glycoside and flavonoid found in rooibos, a common herbal tea. (Aspalathus linearis). Aspalathin is a chalcone and has shown antimutagenic, and antioxidant properties
(-)-Epicatechin 8-C-glucoside
C21H24O11 (452.13185539999995)
(-)-Epicatechin 8-C-glucoside is found in chinese cinnamon. (-)-Epicatechin 8-C-glucoside is isolated from bark of Chinese cinnamon Cinnamomum cassia. Isolated from bark of Chinese cinnamon Cinnamomum cassia. Epicatechin 8-C-glucoside is found in chinese cinnamon and herbs and spices.
Epicatechin 3-glucoside
C21H24O11 (452.13185539999995)
Epicatechin 3-glucoside is found in chinese cinnamon. Epicatechin 3-glucoside is isolated from Chinese cinnamon (Cinnamomum cassia) bark. Isolated from Chinese cinnamon (Cinnamomum cassia) bark. Epicatechin 3-glucoside is found in chinese cinnamon and herbs and spices.
Viniferifuran
Viniferifuran is found in alcoholic beverages. Viniferifuran is isolated from Riesling wine. Viniferifuran is a constituent of wine grapes (Vitis vinifera Kyohou) and amur grape (Vitis amurensis). Isolated from Riesling wine. Constituent of wine grapes (Vitis vinifera Kyohou) and amur grape (Vitis amurensis). Viniferifuran is found in alcoholic beverages and fruits.
Catechin 7-glucoside
C21H24O11 (452.13185539999995)
Isolated from commercial rhubarb (Rheum subspecies,) and azuki bean (Vigna angularis). Catechin 7-glucoside is found in many foods, some of which are barley, green vegetables, adzuki bean, and pulses. Catechin 7-glucoside is found in adzuki bean. Catechin 7-glucoside is isolated from commercial rhubarb (Rheum species,) and azuki bean (Vigna angularis).
(-)-Epicatechin 6-C-glucoside
C21H24O11 (452.13185539999995)
(-)-Epicatechin 6-C-glucoside is found in chinese cinnamon. (-)-Epicatechin 6-C-glucoside is isolated from bark of Chinese cinnamon Cinnamomum cassia. Isolated from bark of Chinese cinnamon Cinnamomum cassia. Epicatechin 6-C-glucoside is found in chinese cinnamon and herbs and spices.
Catechin 5-glucoside
C21H24O11 (452.13185539999995)
Catechin 5-glucoside is found in green vegetables. Catechin 5-glucoside is isolated from commercial rhubarb Rheum species. Isolated from commercial rhubarb Rheum subspecies Catechin 5-glucoside is found in green vegetables and garden rhubarb.
(-)-epicatechin-3'-O-glucuronide
C21H24O11 (452.13185539999995)
(-)-Epicatechin-3-O-glucuronide is a cocoa metabolite from gut microflora. It is found in urine.
Melleolide M
Melleolide M is found in mushrooms. Melleolide M is a metabolite of Armillariella mellea (honey mushroom Metabolite of Armillariella mellea (honey mushroom). Melleolide M is found in mushrooms.
7-Hydroxybutylidenephthalide 7-(6-malonylglucoside)
C21H24O11 (452.13185539999995)
7-Hydroxybutylidenephthalide 7-(6-malonylglucoside) is found in herbs and spices. 7-Hydroxybutylidenephthalide 7-(6-malonylglucoside) is isolated from elicitor-treated cultures of Petroselinum crispum (parsley Isolated from elicitor-treated cultures of Petroselinum crispum (parsley). 7-Hydroxybutylidenephthalide 7-(6-malonylglucoside) is found in herbs and spices.
Precarthamin
C21H24O11 (452.13185539999995)
Precarthamin is found in fats and oils. Red pigment from the flowers of Carthamus tinctorius (safflower
(+)-Catechin 6-C-glucoside
C21H24O11 (452.13185539999995)
(+)-Catechin 6-C-glucoside is found in green vegetables. (+)-Catechin 6-C-glucoside is isolated from Rheum sp. (rhubarb). Isolated from Rheum species (rhubarb). Catechin 6-C-glucoside is found in green vegetables.
(+)-Catechin 8-C-glucoside
C21H24O11 (452.13185539999995)
(+)-Catechin 8-C-glucoside is found in green vegetables. (+)-Catechin 8-C-glucoside is isolated from Rheum sp. (rhubarb). Isolated from Rheum species (rhubarb). Catechin 8-C-glucoside is found in green vegetables.
Catechin 3'-glucoside
C21H24O11 (452.13185539999995)
Catechin 4-glucoside is found in green vegetables. Catechin 4-glucoside is isolated from commercial rhubarb (Rheum species). Isolated from Rheum subspecies roots. Catechin 3-glucoside is found in green vegetables.
(-)-Epicatechin 8-C-galactoside
C21H24O11 (452.13185539999995)
(-)-Epicatechin 8-C-galactoside is found in cocoa and cocoa products. (-)-Epicatechin 8-C-galactoside is a constituent of cacao liquor (Theobroma cacao).
5alpha-Androstan-3alpha,17beta-diol disulfate
C19H32O8S2 (452.15385119999996)
5alpha-Androstan-3alpha,17beta-diol disulfate, also known as 5α-androstan-3α,17β-diol disulfuric acid, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 5alpha-Androstan-3alpha,17beta-diol disulfate is considered to be a practically insoluble (in water) and an extremely strong acidic compound. 5alpha-Androstan-3alpha,17beta-diol disulfate can be found in feces.
3,4,5-trihydroxy-6-({2-[3-(7-methoxy-2-oxo-2H-chromen-6-yl)oxiran-2-yl]propan-2-yl}oxy)oxane-2-carboxylic acid
C21H24O11 (452.13185539999995)
Maltohexaose is a member of the class of compounds known as oligosaccharides. Oligosaccharides are carbohydrates made up of 3 to 10 monosaccharide units linked to each other through glycosidic bonds. Maltohexaose is soluble (in water) and a very weakly acidic compound (based on its pKa). A 1,4-alpha-D-glucan reacts with H2O to produce maltohexaose. alpha-Amylase is responsible for catalyzing the reaction.
5alpha-Androstan-3beta,17alpha-diol disulfate
C19H32O8S2 (452.15385119999996)
5alpha-Androstan-3beta,17alpha-diol disulfate belongs to the class of organic compounds known as sulfated steroids. These are sterol lipids containing a sulfate group attached to the steroid skeleton. 5alpha-Androstan-3beta,17alpha-diol disulfate was identified as one of forty plasma metabolites that could be used to predict gut microbiome Shannon diversity (PMID: 31477923). Shannon diversity is a metric that summarizes both species abundance and evenness, and it has been suggested as a marker for microbiome health.
3-Hydroxyphloretin 2'-O-glucoside
C21H24O11 (452.13185539999995)
3-hydroxyphloretin 2-o-glucoside is a member of the class of compounds known as flavonoid o-glycosides. Flavonoid o-glycosides are compounds containing a carbohydrate moiety which is O-glycosidically linked to the 2-phenylchromen-4-one flavonoid backbone. 3-hydroxyphloretin 2-o-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 3-hydroxyphloretin 2-o-glucoside can be found in apple, which makes 3-hydroxyphloretin 2-o-glucoside a potential biomarker for the consumption of this food product.
Cichorioside J
C22H28O10 (452.16823880000004)
Cichorioside j is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Cichorioside j can be found in endive, which makes cichorioside j a potential biomarker for the consumption of this food product.
5-O-Methylvisammioside
C22H28O10 (452.16823880000004)
5-O-Methylvisammioside is a natural product found in Saposhnikovia divaricata with data available. 5-O-Methylvisammioside is a natural product isolated from Saposhnikovia Divaricata. 5-O-Methylvisammioside is a natural product isolated from Saposhnikovia Divaricata.
Epicatechin 3-O-beta-D-allopyranoside
C21H24O11 (452.13185539999995)
Leucopelargonidin 3-O-glucoside
C21H24O11 (452.13185539999995)
Sieboldin
C21H24O11 (452.13185539999995)
[4R-(4R*,S*,7R*,10S*)]- 4,6-bis(Acetyloxy)-3-[(acetyloxy)methyl]-5,6,7,8,9,10-hexahydro-7-methoxy-6,10-dimethyl-7,10-epoxycyclodeca[b]furan-2(4H)-one
C22H28O10 (452.16823880000004)
[1aR-(1aR*,5R*,7S*,10aS*,10bR*)]-5-(Acetyloxy)-8-[(acetyloxy)methyl]-2,3,6,7,10a,10b-hexahydro-1a,5-dimethyl-7-(1-oxopropoxy)-oxireno[9,10]cyclodeca[1,2-b]furan-4,9(1aH,5H)-dione
C22H28O10 (452.16823880000004)
1,8-Bis(4-hydroxybenzyl)-2,7-dihydroxy-4-methoxyphenanthrene
Catechin 3-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
Epimedokoreanin A
Ovatolactone 7-O-(6-O-p-hydroxybenzoyl)-beta-D-glucopyranoside
C22H28O10 (452.16823880000004)
Catechin-4-ol 3-O-alpha-L-rhamnopyranoside
C21H24O11 (452.13185539999995)
(9R,10S)-rel-(-)-9,10-bis(Acetyloxy)-9,10-dihydro-5-methoxy-8,8-dimethyl-2-phenyl-4H,8H-benzo[1,2-b:3,4-b]dipyran-4-one
Epicatechin-5-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
ent-Catechin 7-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
Epicatechin 8-C-beta-D-galactoside
C21H24O11 (452.13185539999995)
Chamuvaritin
Aspalathin
C21H24O11 (452.13185539999995)
A member of the class of dihydrochalcones that is the 2-C-beta-D-glucopyranide of phloroglucinol and which is substituted at position 4 by a 3-(3,4-dihydroxyphenyl)propanoyl group. A metabolite of red bush, Aspalathus linearis (and present in the herbal tea made from the leaves), aspalathin exhibits significant hypoglycemic activity.
Epicatechin 3-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
6-C-Glucopyranosylcatechin
C21H24O11 (452.13185539999995)
6-C-Glucopyranosylepicatechin
C21H24O11 (452.13185539999995)
4-O-beta-D-Glucosyl-5-O-methylvisamminol
C22H28O10 (452.16823880000004)
5-hydroxymorusin|5-hydroxy-8,8-dimethyl-3-(3-methyl-2-butenyl)-2-(2,4,5-trihydroxyphenyl)-4H,8H-benzo(1,2-b:3,4-b)-pyran-4-one|5-hydroxymorusin|artonin E|hydroxyartoflavone A
8alpha-(4-hydroxymethacryloyloxy)-10alpha-hydroxy-1-O-methyl-hirsutinolide-13-O-acetate|8alpha-<4-hydroxymethacryloyloxy>-10alpha-hydroxy-1-O-methyl-hirsutinolide-13-O-acetate
C22H28O10 (452.16823880000004)
(2S)-2-hydroxy-7-O-methylallopeucenin 2-O-beta-D-glucopyranoside
C22H28O10 (452.16823880000004)
1-Benzoyl,2,3,4,6-tetra-Ac-alpha-D-Pyranose-Glucose
C21H24O11 (452.13185539999995)
8-Propanoyl,1,13-di-Ac-1,4-Epoxy-1,8,10,13-tetrahydroxy-5,7(11)-germacradien-12,6-olide|8-Propanoyl,13-Ac-1,4-Epoxy-1,8,10,13-tetrahydroxy-5,7(11)-germacradien-12,6-olide
C22H28O10 (452.16823880000004)
3-hydroxy phloridzin|3-hydroxyphioreti 4-O-beta glucoside|3-hydroxyphloridzin|3-Hydroxyphlorizin|Phlo-OH
C21H24O11 (452.13185539999995)
2-(3,4-dihydroxyphenyl)ethyl 6-O-protocatechuoyl-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
4-beta-D-glucopyranosyloxy-3-hydroxybenzyl 4-O-methylprotocatechuate|oreganol-B
C21H24O11 (452.13185539999995)
(6R,9R)-9-hydroxymegastigman-4-en-3-one 9-O-beta-D-glucopyranoside 6-O-sulfate|byzantionoside B 6-O-sulfate
C19H32O10S (452.17160920000003)
(2E)-3-[3-(3,4-dihydroxybenzyl)-6-hydroxy-2,4-dimethoxyphenyl]-1-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one|3,6-dihydroxy-2,4,4-trimethoxy-3-(3,4-dihydroxybenzyl)chalcone
5,5-dimethoxy-3,3-dimethyl[1,1-bi-9H-carbazole]-2,2-diol
Vanilloyl calleryanin|vanilloylcalleryanin
C21H24O11 (452.13185539999995)
4-hydroxy-2-methoxyphenol beta-D-{3-O-[4-hydroxy-3-methoxy(benzoate)]glucopyranoside}
C21H24O11 (452.13185539999995)
1-(3-hydroxy-4,5-dimethoxyphenyl)-6-(p-hydroxybenzoyl)-beta-D-glucopyranose|dunnianoside F
C21H24O11 (452.13185539999995)
4-O-(6-O-Galloyl-beta-D-glucopyranoside)-2-(4-Hydroxyphenyl)ethanol|p-hydroxyphenethylalcohol 4-O-beta-D-(6-O-galloyl)-glucoside
C21H24O11 (452.13185539999995)
12-Acetyl-13,21-dihydroeurycomanone
C22H28O10 (452.16823880000004)
Isochamuvaritin
A member of the class of a xanthenes that is 9H-xanthene substituted by hydroxy groups at positions 1 and 3, a 2-hydroxybenzyl group at position 2 and a 3-phenylpropanoyl group at position 4. Isolated from the roots of Uvaria acuminata, it exhibits potent cytotoxicity against human promyelocytic leukemia HL-60 cells.
robustaside E
C21H24O11 (452.13185539999995)
A beta-glucoside having 4-hydroxyphenoxy residue as the anomeric substituent and a [(2E)-3-(1,4-dihydroxy-6-oxocyclohex-2-en-1-yl)prop-2-enoyl]oxy residue at position 6. Isolated from Grevillea, it exhibits antimalarial activity.
9-(1-Hydroperoxy-isopropyl)-6,12-dihydroxy-3,3-dimethyl-8H,9H-benzo[f]pyrano[6,5-8,7]chromeno[3,2-d]oxepin-7-one
1alpha-acetoxy-2beta,3alpha,6beta,7beta,12beta-pentahydroxy-7,20;19,20-diepoxy-ent-kaur-16-en-15-one|taibaijaponicain D
C22H28O10 (452.16823880000004)
5-Methoxy-(3,4-dihydro-3,4-diacetoxy)-2,2-dimethylpyrano-(7,8:5,6)-flavone
8alpha-(4-hydroxytigloyloxy)-10alpha-hydroxyhirsutinolide-13-O-acetate|8alpha-<4-hydroxytigloyloxy>-10alpha-hydroxyhirsutinolide-13-O-acetate
C22H28O10 (452.16823880000004)
(E)-1-(glutathion-S-yl)-N-hydroxy-omega-(methylsulfanyl)pentan-1-imine
Curculigoside B
C21H24O11 (452.13185539999995)
Curculigoside B is a natural product found in Curculigo orchioides with data available. Curculigoside B, a phenolic glycoside isolated from Curculigo orchioides, enhances the osteoblast proliferation, decreases the area of bone resorption pit, osteoclastic formation and TRAP activity. Antiosteoporotic and antioxidative activities[1]. Curculigoside B, a phenolic glycoside isolated from Curculigo orchioides, enhances the osteoblast proliferation, decreases the area of bone resorption pit, osteoclastic formation and TRAP activity. Antiosteoporotic and antioxidative activities[1].
epicatechin 8-C-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
(2R,3R,4S,5S,6R)-2-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate
C21H24O11_(3R,3R,4R,6S,7R)-5-Hydroxy-6,7-dimethyl-6,8-dioxo-3,4,4,5,6,6,7,8-octahydrospiro[isochromene-3,2-pyran]-3,4,7-triyl triacetate
C21H24O11 (452.13185539999995)
(2R)-3-(3,4-dihydroxyphenyl)-1-[2,4-dihydroxy-3-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]-2-hydroxypropan-1-one
C21H24O11 (452.13185539999995)
(2R,3R,4S,5S,6R)-2-[[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol [IIN-based: Match]
C21H24O11 (452.13185539999995)
methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based on: CCMSLIB00000846691]
methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate [IIN-based: Match]
(2R)-3-(3,4-dihydroxyphenyl)-1-[2,4-dihydroxy-3-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl]-2-hydroxypropan-1-one_major
C21H24O11 (452.13185539999995)
Ala Cys Glu Met
Ala Cys Met Glu
Ala Cys Pro Tyr
C20H28N4O6S (452.17294680000003)
Ala Cys Tyr Pro
C20H28N4O6S (452.17294680000003)
Ala Glu Cys Met
Ala Glu Met Cys
Ala Met Cys Glu
Ala Met Glu Cys
Ala Met Met Thr
Ala Met Thr Met
Ala Pro Cys Tyr
C20H28N4O6S (452.17294680000003)
Ala Pro Tyr Cys
C20H28N4O6S (452.17294680000003)
Ala Thr Met Met
Ala Tyr Cys Pro
C20H28N4O6S (452.17294680000003)
Ala Tyr Pro Cys
C20H28N4O6S (452.17294680000003)
Cys Ala Glu Met
Cys Ala Met Glu
Cys Ala Pro Tyr
C20H28N4O6S (452.17294680000003)
Cys Ala Tyr Pro
C20H28N4O6S (452.17294680000003)
Cys Cys Asp Ile
Cys Cys Asp Leu
Cys Cys Glu Val
Cys Cys Ile Asp
Cys Cys Leu Asp
Cys Cys Val Glu
Cys Asp Cys Ile
Cys Asp Cys Leu
Cys Asp Ile Cys
Cys Asp Leu Cys
Cys Glu Ala Met
Cys Glu Cys Val
Cys Glu Met Ala
Cys Glu Thr Thr
C16H28N4O9S (452.15769180000007)
Cys Glu Val Cys
Cys Phe Pro Ser
C20H28N4O6S (452.17294680000003)
Cys Phe Ser Pro
C20H28N4O6S (452.17294680000003)
Cys Gly His His
Cys His Gly His
Cys His His Gly
Cys Ile Cys Asp
Cys Ile Asp Cys
Cys Ile Met Ser
Cys Ile Ser Met
Cys Leu Cys Asp
Cys Leu Asp Cys
Cys Leu Met Ser
Cys Leu Ser Met
Cys Met Ala Glu
Cys Met Glu Ala
Cys Met Ile Ser
Cys Met Leu Ser
Cys Met Ser Ile
Cys Met Ser Leu
Cys Met Thr Val
Cys Met Val Thr
Cys Pro Ala Tyr
C20H28N4O6S (452.17294680000003)
Cys Pro Phe Ser
C20H28N4O6S (452.17294680000003)
Cys Pro Ser Phe
C20H28N4O6S (452.17294680000003)
Cys Pro Tyr Ala
C20H28N4O6S (452.17294680000003)
Cys Ser Phe Pro
C20H28N4O6S (452.17294680000003)
Cys Ser Ile Met
Cys Ser Leu Met
Cys Ser Met Ile
Cys Ser Met Leu
Cys Ser Pro Phe
C20H28N4O6S (452.17294680000003)
Cys Thr Glu Thr
C16H28N4O9S (452.15769180000007)
Cys Thr Met Val
Cys Thr Thr Glu
C16H28N4O9S (452.15769180000007)
Cys Thr Val Met
Cys Val Cys Glu
Cys Val Glu Cys
Cys Val Met Thr
Cys Val Thr Met
Cys Tyr Ala Pro
C20H28N4O6S (452.17294680000003)
Cys Tyr Pro Ala
C20H28N4O6S (452.17294680000003)
Asp Cys Cys Ile
Asp Cys Cys Leu
Asp Cys Ile Cys
Asp Cys Leu Cys
Asp Asp Phe Gly
C19H24N4O9 (452.15432139999996)
Asp Asp Gly Phe
C19H24N4O9 (452.15432139999996)
Asp Phe Asp Gly
C19H24N4O9 (452.15432139999996)
Asp Phe Gly Asp
C19H24N4O9 (452.15432139999996)
Asp Gly Asp Phe
C19H24N4O9 (452.15432139999996)
Asp Gly Phe Asp
C19H24N4O9 (452.15432139999996)
Asp Gly Met Met
Asp Ile Cys Cys
Asp Leu Cys Cys
Asp Met Gly Met
Asp Met Met Gly
Asp Met Ser Thr
C16H28N4O9S (452.15769180000007)
Asp Met Thr Ser
C16H28N4O9S (452.15769180000007)
Asp Ser Met Thr
C16H28N4O9S (452.15769180000007)
Asp Ser Thr Met
C16H28N4O9S (452.15769180000007)
Asp Thr Met Ser
C16H28N4O9S (452.15769180000007)
Asp Thr Ser Met
C16H28N4O9S (452.15769180000007)
Glu Ala Cys Met
Glu Ala Met Cys
Glu Cys Ala Met
Glu Cys Cys Val
Glu Cys Met Ala
Glu Cys Thr Thr
C16H28N4O9S (452.15769180000007)
Glu Cys Val Cys
Glu Met Ala Cys
Glu Met Cys Ala
Glu Met Ser Ser
C16H28N4O9S (452.15769180000007)
Glu Ser Met Ser
C16H28N4O9S (452.15769180000007)
Glu Ser Ser Met
C16H28N4O9S (452.15769180000007)
Glu Thr Cys Thr
C16H28N4O9S (452.15769180000007)
Glu Thr Thr Cys
C16H28N4O9S (452.15769180000007)
Glu Val Cys Cys
Phe Cys Pro Ser
C20H28N4O6S (452.17294680000003)
Phe Cys Ser Pro
C20H28N4O6S (452.17294680000003)
Phe Asp Asp Gly
C19H24N4O9 (452.15432139999996)
Phe Asp Gly Asp
C19H24N4O9 (452.15432139999996)
Phe Gly Asp Asp
C19H24N4O9 (452.15432139999996)
Phe Pro Cys Ser
C20H28N4O6S (452.17294680000003)
Phe Pro Ser Cys
C20H28N4O6S (452.17294680000003)
Phe Ser Cys Pro
C20H28N4O6S (452.17294680000003)
Phe Ser Pro Cys
C20H28N4O6S (452.17294680000003)
Gly Cys His His
Gly Asp Asp Phe
C19H24N4O9 (452.15432139999996)
Gly Asp Phe Asp
C19H24N4O9 (452.15432139999996)
Gly Asp Met Met
Gly Phe Asp Asp
C19H24N4O9 (452.15432139999996)
Gly His Cys His
Gly His His Cys
Gly Met Asp Met
Gly Met Met Asp
His Cys Gly His
His Cys His Gly
His Gly Cys His
His Gly His Cys
His His Cys Gly
His His Gly Cys
Ile Cys Cys Asp
Ile Cys Asp Cys
Ile Cys Met Ser
Ile Cys Ser Met
Ile Asp Cys Cys
Ile Met Cys Ser
Ile Met Ser Cys
Ile Ser Cys Met
Ile Ser Met Cys
Leu Cys Cys Asp
Leu Cys Asp Cys
Leu Cys Met Ser
Leu Cys Ser Met
Leu Asp Cys Cys
Leu Met Cys Ser
Leu Met Ser Cys
Leu Ser Cys Met
Leu Ser Met Cys
Met Ala Cys Glu
Met Ala Glu Cys
Met Ala Met Thr
Met Ala Thr Met
Met Cys Ala Glu
Met Cys Glu Ala
Met Cys Ile Ser
Met Cys Leu Ser
Met Cys Ser Ile
Met Cys Ser Leu
Met Cys Thr Val
Met Cys Val Thr
Met Asp Gly Met
Met Asp Met Gly
Met Asp Ser Thr
C16H28N4O9S (452.15769180000007)
Met Asp Thr Ser
C16H28N4O9S (452.15769180000007)
Met Glu Ala Cys
Met Glu Cys Ala
Met Glu Ser Ser
C16H28N4O9S (452.15769180000007)
Met Gly Asp Met
Met Gly Met Asp
Met Ile Cys Ser
Met Ile Ser Cys
Met Leu Cys Ser
Met Leu Ser Cys
Met Met Ala Thr
Met Met Asp Gly
Met Met Gly Asp
Met Met Thr Ala
Met Ser Cys Ile
Met Ser Cys Leu
Met Ser Asp Thr
C16H28N4O9S (452.15769180000007)
Met Ser Glu Ser
C16H28N4O9S (452.15769180000007)
Met Ser Ile Cys
Met Ser Leu Cys
Met Ser Ser Glu
C16H28N4O9S (452.15769180000007)
Met Ser Thr Asp
C16H28N4O9S (452.15769180000007)
Met Thr Ala Met
Met Thr Cys Val
Met Thr Asp Ser
C16H28N4O9S (452.15769180000007)
Met Thr Met Ala
Met Thr Ser Asp
C16H28N4O9S (452.15769180000007)
Met Thr Val Cys
Met Val Cys Thr
Met Val Thr Cys
Pro Ala Cys Tyr
C20H28N4O6S (452.17294680000003)
Pro Ala Tyr Cys
C20H28N4O6S (452.17294680000003)
Pro Cys Ala Tyr
C20H28N4O6S (452.17294680000003)
Pro Cys Phe Ser
C20H28N4O6S (452.17294680000003)
Pro Cys Ser Phe
C20H28N4O6S (452.17294680000003)
Pro Cys Tyr Ala
C20H28N4O6S (452.17294680000003)
Pro Phe Cys Ser
C20H28N4O6S (452.17294680000003)
Pro Phe Ser Cys
C20H28N4O6S (452.17294680000003)
Pro Ser Cys Phe
C20H28N4O6S (452.17294680000003)
Pro Ser Phe Cys
C20H28N4O6S (452.17294680000003)
Pro Tyr Ala Cys
C20H28N4O6S (452.17294680000003)
Pro Tyr Cys Ala
C20H28N4O6S (452.17294680000003)
Ser Cys Phe Pro
C20H28N4O6S (452.17294680000003)
Ser Cys Ile Met
Ser Cys Leu Met
Ser Cys Met Ile
Ser Cys Met Leu
Ser Cys Pro Phe
C20H28N4O6S (452.17294680000003)
Ser Asp Met Thr
C16H28N4O9S (452.15769180000007)
Ser Asp Thr Met
C16H28N4O9S (452.15769180000007)
Ser Glu Met Ser
C16H28N4O9S (452.15769180000007)
Ser Glu Ser Met
C16H28N4O9S (452.15769180000007)
Ser Phe Cys Pro
C20H28N4O6S (452.17294680000003)
Ser Phe Pro Cys
C20H28N4O6S (452.17294680000003)
Ser Ile Cys Met
Ser Ile Met Cys
Ser Leu Cys Met
Ser Leu Met Cys
Ser Met Cys Ile
Ser Met Cys Leu
Ser Met Asp Thr
C16H28N4O9S (452.15769180000007)
Ser Met Glu Ser
C16H28N4O9S (452.15769180000007)
Ser Met Ile Cys
Ser Met Leu Cys
Ser Met Ser Glu
C16H28N4O9S (452.15769180000007)
Ser Met Thr Asp
C16H28N4O9S (452.15769180000007)
Ser Pro Cys Phe
C20H28N4O6S (452.17294680000003)
Ser Pro Phe Cys
C20H28N4O6S (452.17294680000003)
Ser Ser Glu Met
C16H28N4O9S (452.15769180000007)
Ser Ser Met Glu
C16H28N4O9S (452.15769180000007)
Ser Thr Asp Met
C16H28N4O9S (452.15769180000007)
Ser Thr Met Asp
C16H28N4O9S (452.15769180000007)
Thr Ala Met Met
Thr Cys Glu Thr
C16H28N4O9S (452.15769180000007)
Thr Cys Met Val
Thr Cys Thr Glu
C16H28N4O9S (452.15769180000007)
Thr Cys Val Met
Thr Asp Met Ser
C16H28N4O9S (452.15769180000007)
Thr Asp Ser Met
C16H28N4O9S (452.15769180000007)
Thr Glu Cys Thr
C16H28N4O9S (452.15769180000007)
Thr Glu Thr Cys
C16H28N4O9S (452.15769180000007)
Thr Met Ala Met
Thr Met Cys Val
Thr Met Asp Ser
C16H28N4O9S (452.15769180000007)
Thr Met Met Ala
Thr Met Ser Asp
C16H28N4O9S (452.15769180000007)
Thr Met Val Cys
Thr Ser Asp Met
C16H28N4O9S (452.15769180000007)
Thr Ser Met Asp
C16H28N4O9S (452.15769180000007)
Thr Thr Cys Glu
C16H28N4O9S (452.15769180000007)
Thr Thr Glu Cys
C16H28N4O9S (452.15769180000007)
Thr Val Cys Met
Thr Val Met Cys
Val Cys Cys Glu
Val Cys Glu Cys
Val Cys Met Thr
Val Cys Thr Met
Val Glu Cys Cys
Val Met Cys Thr
Val Met Thr Cys
Val Thr Cys Met
Val Thr Met Cys
Tyr Ala Cys Pro
C20H28N4O6S (452.17294680000003)
Tyr Ala Pro Cys
C20H28N4O6S (452.17294680000003)
Tyr Cys Ala Pro
C20H28N4O6S (452.17294680000003)
Tyr Cys Pro Ala
C20H28N4O6S (452.17294680000003)
Tyr Pro Ala Cys
C20H28N4O6S (452.17294680000003)
Tyr Pro Cys Ala
C20H28N4O6S (452.17294680000003)
8-C-Glucopyranosylepicatechin
C21H24O11 (452.13185539999995)
8-C-Glucopyranosylcatechin
C21H24O11 (452.13185539999995)
Catechin 5-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
Epicatechin 5-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
Catechin 7-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
Catechin 4-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
(-)-epicatechin-3-O-glucuronide
C21H24O11 (452.13185539999995)
Precarthamin
C21H24O11 (452.13185539999995)
Amurensin H
7-Hydroxybutylidenephthalide 7-(6-malonylglucoside)
C21H24O11 (452.13185539999995)
Melleolide M
Epicatechin 3-glucoside
C21H24O11 (452.13185539999995)
Catechin 3'-glucoside
C21H24O11 (452.13185539999995)
Catechin 5-glucoside
C21H24O11 (452.13185539999995)
(-)-Epicatechin 8-C-galactoside
C21H24O11 (452.13185539999995)
17-Acetyloxy-6-chloro-1α-chloromethylpregna-4,6-diene-3,20-dione
merimepodib
C471 - Enzyme Inhibitor > C2087 - Inosine Monophosphate Dehydrogenase Inhibitor COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C254 - Anti-Infective Agent > C281 - Antiviral Agent Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
4-[6-(1-benzylpyrrol-2-yl)-4-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-1H-1,3,5-triazin-2-ylidene]-3-hydroxycyclohexa-2,5-dien-1-one
C26H20N4O4 (452.14844800000003)
CARBONYLHYDRIDO[6-(DI-T-BUTYLPHOSPHINOMETHYLENE)-2-(N,N-DIETHYLAMINOMETHYL)-1,6-DIHYDROPYRIDINE]RUTHENIUM(II)
2-[(S)-(4-Chlorophenyl)(4-piperidinyloxy)methyl]pyridine (2R,3R)-2,3-Dihydroxybutanedioate
C17H19ClN2O.C4H6O6 (452.135021)
Clocortolone acetate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D005938 - Glucocorticoids C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D000893 - Anti-Inflammatory Agents
SS58Uxz8ZU
C24H25FN4O2S (452.16821619999996)
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists
Aiphanol
A lignan that is (2R)-2,3-dihydro-1,4-benzodioxin-2-ylmethanol which is substituted by a 2-(3,5-dihydroxyphenyl)ethenyl group at position 6 and a 4-hydroxy-3,5-dimethoxyphenyl group at position 3. It is a stilbenolignan isolated from the seeds of Aiphanes aculeata and exhibits potent inhibitory efficacy against cyclooxygenase-1 and -2 (COX-1 and COX-2).
6-[3-(cyclopropylmethoxy)-4-methoxyphenyl]-3-(2,5-dimethoxyphenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Ethyl 2-[2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]-1-oxoisoquinolin-5-yl]oxypropanoate
2-[[1,3-dimethyl-7-(4-methylphenyl)-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl]thio]-N-(5-methyl-3-isoxazolyl)acetamide
C21H20N6O4S (452.12666800000005)
(-)-Epicatechin 8-C-galactoside
C21H24O11 (452.13185539999995)
(-)-Epicatechin 8-C-galactoside is found in cocoa and cocoa products. (-)-Epicatechin 8-C-galactoside is a constituent of cacao liquor (Theobroma cacao). Constituent of cacao liquor (Theobroma cacao). Epicatechin 8-C-galactoside is found in cocoa and cocoa products and cocoa bean.
(-)-epicatechin-3'-O-glucuronide
C21H24O11 (452.13185539999995)
(-)-Epicatechin-3-O-glucuronide is a cocoa metabolite from gut microflora. It is found in urine.
N-[[1-(beta-D-Glucopyranosyl)-1H-indole-3-yl]acetyl]-L-aspartic acid
3,5,7,9,11,13,15,17,19-Nonaoxohenicosanoic acid
C21H24O11 (452.13185539999995)
(2S)-2-amino-5-[[(2R)-1-(carboxymethylamino)-3-[(E)-N-hydroxy-C-(4-methylsulfanylbutyl)carbonimidoyl]sulfanyl-1-oxopropan-2-yl]amino]-5-oxopentanoic acid
5-Hydroxy-3-(4-hydroxy-3-methyl-but-2-enyl)-8,8-dimethyl-2-(2,4,5-trihydroxy-phenyl)-8H-pyrano[2,3-f]chromen-4-one
An extended flavonoid that is flavone substituted by hydroxy groups at positions 5, 2, 4 and 5, a 3-(hydroxymethyl)but-2-en-1-yl group at position 3 and a 6,6-dimethyl-3,6-dihydro-2H-pyran group across positions 7 and 8. It has been isolated from Artocarpus odoratissimus.
1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[[2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]ethanone
N-[4-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-2,4,6-trioxo-1,3-diazinan-5-ylidene]methylamino]phenyl]acetamide
2-(4-butyl-4-methyl-2,5-dioxo-1-imidazolidinyl)-N-[4-(4-morpholinylsulfonyl)phenyl]acetamide
C20H28N4O6S (452.17294680000003)
[4-(2,3-Dimethylphenyl)-1-piperazinyl]-[5-[(4-methylphenyl)sulfonylmethyl]-2-furanyl]methanone
C25H28N2O4S (452.17696880000005)
[4-[4-[2-Furanyl(oxo)methyl]-1-piperazinyl]-[1,2,4]triazolo[4,3-a]quinoxalin-8-yl]-phenylmethanone
3,4-dimethoxy-N-[(E)-(2-morpholin-4-yl-4-phenyl-1,3-thiazol-5-yl)methylideneamino]benzamide
1-[3-[(5-bromo-2-pyridinyl)-butylamino]propyl]-3-[3-(1H-imidazol-5-yl)propyl]thiourea
Methyl 3-(3,4-dihydroxyphenyl)-2-[(2,2-dimethylchromen-6-yl)methyl]-4-methoxy-5-oxofuran-2-carboxylate
5alpha-Androstane-3beta,17beta-diol disulfate
C19H32O8S2 (452.15385119999996)
(6R,7S,8R)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
(6S,7R,8R)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
(6S,7R,8S)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
(6R,7R,8S)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
(6R,7R,8R)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
(6R,7S,8S)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
(6S,7S,8R)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
(6S,7S,8S)-8-(hydroxymethyl)-4-(2-methylphenyl)sulfonyl-7-(4-pent-1-ynylphenyl)-1,4-diazabicyclo[4.2.0]octan-2-one
C25H28N2O4S (452.17696880000005)
3,4,5-Trihydroxy-6-[3-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenoxy]oxane-2-carboxylic acid
C21H24O11 (452.13185539999995)
7-(2-Hydroxy-3-amino-3-carboxypropyl)wyosine 5-monophosphate zwitterion
C18H24N6O8 (452.16555439999996)
3,4,5-Trihydroxy-6-[3-(hydroxymethyl)-1-(7-methoxy-2-oxochromen-8-yl)but-3-en-2-yl]oxyoxane-2-carboxylic acid
C21H24O11 (452.13185539999995)
2-(3-hydroxyphenyl)-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-chromene-3,5,6,7-tetrol
C21H24O11 (452.13185539999995)
(2S)-2-amino-4-[3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4,6-dimethyl-9-oxoimidazo[1,2-a]purin-7-yl]-3-hydroxybutanoic acid
C18H24N6O8 (452.16555439999996)
(2S)-2-amino-6-[[4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(phosphonooxymethyl)oxolan-2-yl]pyrimidin-1-ium-2-yl]amino]hexanoic acid
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychroman-3-yl beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
9-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]-3,8-dihydroxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
(2R,3R)-2-(3,4-dihydroxyphenyl)-8-[(2R,3S,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
C21H24O11 (452.13185539999995)
5alpha-Androstane-3alpha,17beta-diol disulfate
C19H32O8S2 (452.15385119999996)
2,4,6-Trihydroxy-3-[1-hydroxy-3-(4-hydroxyphenyl)-2-propenyl]phenyl b-D-glucopyranoside, 9ci
C21H24O11 (452.13185539999995)
5alpha-Androstane-3beta,17alpha-diol disulfate
C19H32O8S2 (452.15385119999996)
IEM-1460
C19H38Br2N2 (452.14015479999995)
IEM-1460 blocks both AMPA and NMDA glutamate receptor with anticonvulsant effect in vivo[1].
Methiothepin (mesylate)
C21H28N2O3S3 (452.12619780000006)
Methiothepin (Metitepine) mesylate is a potent and non-selective 5-HT2 receptor antagonist, with pKds of 7.10 (5-HT1A), 7.28 (5HT1B), 7.56 (5HT1C), 6.99 (5HT1D), 7.0 (5-HT5A), 7.8 (5-HT5B), 8.74 (5-HT6), and 8.99 (5-HT7), and pKis of 8.50 (5HT2A), 8.68 (5HT2B), and 8.35 (5HT2C).
(2s)-4-methoxy-7-methyl-2-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-2h,3h-furo[3,2-g]chromen-5-one
C22H28O10 (452.16823880000004)
4-methoxy-7-methyl-2-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-2h,3h-furo[3,2-g]chromen-5-one
C22H28O10 (452.16823880000004)
(3,4,5-trihydroxy-6-{[(2r)-4-[(1r)-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]butan-2-yl]oxy}oxan-2-yl)methoxysulfonic acid
C19H32O10S (452.17160920000003)
(16s)-16-(2-hydroperoxypropan-2-yl)-11,20-dihydroxy-7,7-dimethyl-2,8,17-trioxapentacyclo[12.9.0.0³,¹².0⁴,⁹.0¹⁸,²³]tricosa-1(14),3,5,9,11,18,20,22-octaen-13-one
3-{3-[(3,4-dihydroxyphenyl)methyl]-6-hydroxy-2,4-dimethoxyphenyl}-1-(3-hydroxy-4-methoxyphenyl)prop-2-en-1-one
1,8-bis[(4-hydroxyphenyl)methyl]-4-methoxyphenanthrene-2,7-diol
[3,4,5-trihydroxy-6-({7-methyl-1-oxo-hexahydro-3h-cyclopenta[c]pyran-6-yl}oxy)oxan-2-yl]methyl 4-hydroxybenzoate
C22H28O10 (452.16823880000004)
(2s)-1-{2,4-dihydroxy-3-[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}-3-(3,4-dihydroxyphenyl)-2-hydroxypropan-1-one
C21H24O11 (452.13185539999995)
2-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
C21H24O11 (452.13185539999995)
(8r)-5-hydroxy-8-(prop-1-en-2-yl)-2-[(3s,4s)-3,4,8-trihydroxy-2,2-dimethyl-3,4-dihydro-1-benzopyran-6-yl]-8h,9h-furo[2,3-h]chromen-4-one
3,5-dihydroxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxan-4-yl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
[8,10-bis(acetyloxy)-11-methoxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-6-yl]methyl acetate
C22H28O10 (452.16823880000004)
{3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl}methyl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)