Exact Mass: 452.0847786
Exact Mass Matches: 452.0847786
Found 359 metabolites which its exact mass value is equals to given mass value 452.0847786
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Cinchonain Ib
Acid Orange 3
C18H13N4NaO7S (452.04026280000005)
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.
6,12-bis(3,4-dihydroxyphenyl)-8,13-dihydroxy-3,11-dioxatricyclo[8.4.0.0(2),]tetradeca-1(10),2(7),8-trien-4-one
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.
3,4-Hexahydroxydiphenoylarabinose
3,4-Hexahydroxydiphenoylarabinose is found in fruits. 3,4-Hexahydroxydiphenoylarabinose is isolated from fruits of Psidium guajava (guava). Isolated from fruits of Psidium guajava (guava). 3,4-Hexahydroxydiphenoylarabinose is found in fruits.
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.
(-)-Epigallocatechin 3-p-coumaroate
(-)-Epigallocatechin 3-p-coumaroate is found in tea. (-)-Epigallocatechin 3-p-coumaroate is isolated from leaves of green tea (Thea sinensis). Isolated from leaves of green tea (Thea sinensis). Epigallocatechin 3-p-coumarate is found in tea.
(-)-epicatechin-3'-O-glucuronide
C21H24O11 (452.13185539999995)
(-)-Epicatechin-3-O-glucuronide is a cocoa metabolite from gut microflora. It is found in urine.
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.
Torvanol A
Torvanol A is found in fruits. Torvanol A is a constituent of the fruit of Solanum torvum. Constituent of the fruit of Solanum torvum. Torvanol A is found in fruits.
Precarthamin
C21H24O11 (452.13185539999995)
Precarthamin is found in fats and oils. Red pigment from the flowers of Carthamus tinctorius (safflower
Allura red AC
C18H16N2O8S2 (452.03480559999997)
Colour additive used in gelatins, puddings, custards, beverages, sauces, toppings, fruits, dairy products, bakery products, jams, jellies, condiments, meat and poultry Allura Red AC is a red azo dye that goes by several names including: Allura Red, Food Red 17, C.I. 16035, FD&C Red 40, 2-naphthalenesulfonic acid, 6-hydroxy-5-((2-methoxy-5-methyl-4-sulfophenyl)azo)-, disodium salt, and disodium 6-hydroxy-5-((2-methoxy-5-methyl-4-sulfophenyl)azo)-2-naphthalene-sulfonate. It is used as a food dye and has the E number E129. Allura Red AC was originally introduced in the United States as a replacement for the use of amaranth as a food coloring. Allura Red AC is one of many High Production Volume Chemicals. Some manufacturers of Allura Red AC include: Asim Products, Sanchi Chemicals Pvt. Ltd., and Warner-Jenkinson Europe Ltd. Upon its introduction into the market, there were fears that Allura Red AC was carcinogenic; however, studies have since shown that this is not the case.[citation needed] The initial reports of its consumption causing tumors have since been shown to have been caused by the presence of para-cresidine.[citation needed] Although para-cresidine is an important reactant in the manufacture of Allura Red AC and is a known carcinogen, further studies conducted since have found no trace of para-cresidine to be present in food-grade Allura Red AC.[citation needed]. Colour additive used in gelatins, puddings, custards, beverages, sauces, toppings, fruits, dairy products, bakery products, jams, jellies, condiments, meat and poultry
(+)-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).
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.
Lumacaftor
C24H18F2N2O5 (452.11837219999995)
C87006 - Pharmacological Chaperone
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.
Lirodenine
C26H18N2O2P2 (452.08434679999993)
Lirodenine is a member of the class of compounds known as benzonitriles. Benzonitriles are organic compounds containing a benzene bearing a nitrile substituent. Lirodenine is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Lirodenine can be found in custard apple, which makes lirodenine a potential biomarker for the consumption of this food product.
Nüzhendic acid
Epicatechin 3-O-beta-D-allopyranoside
C21H24O11 (452.13185539999995)
Leucopelargonidin 3-O-glucoside
C21H24O11 (452.13185539999995)
Sieboldin
C21H24O11 (452.13185539999995)
Catechin 3-O-beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
Catechin-4-ol 3-O-alpha-L-rhamnopyranoside
C21H24O11 (452.13185539999995)
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)
Arabinopyranose cyclic 3,4-(4,4,5,5,6,6-hexahydroxydiphenate)
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)
[(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate
C20H20O12 (452.09547200000003)
1-O-p-hydroxybenzoyl-6-O-galloyl-beta-D-glucoside|1-O-p-hydroxybenzoyl-6-O-galloyl-beta-glucose
C20H20O12 (452.09547200000003)
1-Benzoyl,2,3,4,6-tetra-Ac-alpha-D-Pyranose-Glucose
C21H24O11 (452.13185539999995)
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)
2-O-beta-D-(6-O-gentisoylglucopyranosyl)gentisic acid
C20H20O12 (452.09547200000003)
4-methoxy-3,5,7-trihydroxy-8-(1-(3,4,5-trihydroxyphenyl)ethyl)flavone
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)
2-C-beta-D-glycopyranosyl-1,6,7-trihydroxy-3-methoxyxanthone|homomangiferin
C20H20O12 (452.09547200000003)
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)
2-O-p-hydroxybenzoyl-6-O-galloyl-glucopyranose
C20H20O12 (452.09547200000003)
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.
(8S,9R,10Xi)-10-iodo-6-methoxy-10,11-dihydro-cinchonan-9-ol|(8S,9R,10Xi)-10-Jod-6-methoxy-10,11-dihydro-cinchonan-9-ol
C20H25IN2O2 (452.09606999999994)
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)
1,5,8-trihydroxy-4-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one
C20H20O12 (452.09547200000003)
[(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate
C20H20O12 (452.09547200000003)
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)
[(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate [IIN-based: Match]
C20H20O12 (452.09547200000003)
(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)
Cys Cys Met Pro
C16H28N4O5S3 (452.12217580000004)
Cys Cys Asn Asn
C14H24N6O7S2 (452.11478339999996)
Cys Cys Pro Met
C16H28N4O5S3 (452.12217580000004)
Cys Asp Asp Thr
Cys Asp Glu Ser
Cys Asp Ser Glu
Cys Asp Thr Asp
Cys Glu Asp Ser
Cys Glu Ser Asp
Cys Met Cys Pro
C16H28N4O5S3 (452.12217580000004)
Cys Met Pro Cys
C16H28N4O5S3 (452.12217580000004)
Cys Asn Cys Asn
C14H24N6O7S2 (452.11478339999996)
Cys Asn Asn Cys
C14H24N6O7S2 (452.11478339999996)
Cys Pro Cys Met
C16H28N4O5S3 (452.12217580000004)
Cys Pro Met Cys
C16H28N4O5S3 (452.12217580000004)
Cys Ser Asp Glu
Cys Ser Glu Asp
Cys Thr Asp Asp
Asp Cys Asp Thr
Asp Cys Glu Ser
Asp Cys Ser Glu
Asp Cys Thr Asp
Asp Asp Cys Thr
Asp Asp Thr Cys
Asp Glu Cys Ser
Asp Glu Ser Cys
Asp Ser Cys Glu
Asp Ser Glu Cys
Asp Thr Cys Asp
Asp Thr Asp Cys
Glu Cys Asp Ser
Glu Cys Ser Asp
Glu Asp Cys Ser
Glu Asp Ser Cys
Glu Ser Cys Asp
Glu Ser Asp Cys
Met Cys Cys Pro
C16H28N4O5S3 (452.12217580000004)
Met Cys Pro Cys
C16H28N4O5S3 (452.12217580000004)
Met Pro Cys Cys
C16H28N4O5S3 (452.12217580000004)
Asn Cys Cys Asn
C14H24N6O7S2 (452.11478339999996)
Asn Cys Asn Cys
C14H24N6O7S2 (452.11478339999996)
Asn Asn Cys Cys
C14H24N6O7S2 (452.11478339999996)
Pro Cys Cys Met
C16H28N4O5S3 (452.12217580000004)
Pro Cys Met Cys
C16H28N4O5S3 (452.12217580000004)
Pro Met Cys Cys
C16H28N4O5S3 (452.12217580000004)
Ser Cys Asp Glu
Ser Cys Glu Asp
Ser Asp Cys Glu
Ser Asp Glu Cys
Ser Glu Cys Asp
Ser Glu Asp Cys
Thr Cys Asp Asp
Thr Asp Cys Asp
Thr Asp Asp Cys
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)
9,10-Dihydro-10-(3,4-dihydroxyphenyl)-pyrano[2,3-h]catechin-8-one
(-)-epicatechin-3-O-glucuronide
C21H24O11 (452.13185539999995)
Precarthamin
C21H24O11 (452.13185539999995)
Curry red
C18H16N2O8S2 (452.03480559999997)
Amurensin H
3,4-Hexahydroxydiphenoylarabinose
7-Hydroxybutylidenephthalide 7-(6-malonylglucoside)
C21H24O11 (452.13185539999995)
Epicatechin 3-glucoside
C21H24O11 (452.13185539999995)
Catechin 3'-glucoside
C21H24O11 (452.13185539999995)
Catechin 5-glucoside
C21H24O11 (452.13185539999995)
Torvanol A
(-)-Epicatechin 8-C-galactoside
C21H24O11 (452.13185539999995)
1,5,8-Trihydroxy-4-methoxy-9-oxo-9H-xanthen-3-yl ?-D-glucopyranoside
C20H20O12 (452.09547200000003)
1,6-Bis-O-(3,4-dihydroxybenzoyl)-?-D-glucopyranose
C20H20O12 (452.09547200000003)
Samarium,tris(2,4-pentanedionato-kO2,kO4)-, (OC-6-11)-
1H,1H,2H,2H-PERFLUOROOCTYLMETHYLDIMETHOXYSILANE
C11H13F13O2Si (452.04771939999995)
1-O-Acetyl-3,5-bis-O-(4-chlorobenzoyl)-2-deoxy-β-D-erythro-pentof uranose
C21H18Cl2O7 (452.04295379999996)
1,1-((1,4-phenylenebis(oxy))bis(4,1-phenylene))bis(1H-pyrrole-2,5-dione)
(3-trimethylsilyl-2-propynyl)triphenylphosphonium bromide
C24H26BrPSi (452.07246660000004)
Bispyribac sodium
C19H17N4NaO8 (452.09440420000004)
D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals
N-(6-((4,5-DICYANO-1-METHYL-1H-IMIDAZOL-2-YL)DIAZENYL)-1-METHYL-1,2,3,4-TETRAHYDROQUINOLIN-7-YL)-1,1,1-TRIFLUOROMETHANESULFONAMIDE
8-Bromo-7-but-2-ynyl-3-methyl-1-(4-methyl-quinazolin-2-ylmethyl)-3,7-dihydro-purine-2,6-dione
C20H17BrN6O2 (452.05962819999996)
1-O-Acetyl-3,5-bis-(4-chlorobenzoyl)-2-deoxy-D-ribose
C21H18Cl2O7 (452.04295379999996)
2-Deoxy-beta-D-erythro-pentofuranose 1-acetate 3,5-bis(4-chlorobenzoate)
C21H18Cl2O7 (452.04295379999996)
Amyltriethylammonium Bis(trifluoromethanesulfonyl)imide
1-Thio-beta-D-glucopyranose 2,3,4,6-tetraacetate 1-(O-ethylcarbonodithioate)
C17H24O10S2 (452.08108439999995)
LY-487379
C21H19F3N2O4S (452.1017570000001)
LY487379 is a selective human mGluR2 positive allosteric modulator (PAM). LY487379 potentiates glutamate-stimulated [35S]GTPγS binding with EC50 values of 1.7 μM and >10 μM for mGlu2 and mGlu3 receptors respectively. LY487379 promotes cognitive flexibility and facilitates behavioral inhibition in a rat model. LY487379 can be used for schizophrenia research[2].
Tjp6T3tjp4
C18H16N2O8S2 (452.03480559999997)
D000074385 - Food Ingredients > D005503 - Food Additives > D005505 - Food Coloring Agents D004396 - Coloring Agents
1-(2,6-Difluorophenyl)sulfonyl-4-(2-naphthalenylsulfonyl)piperazine
C20H18F2N2O4S2 (452.06760119999996)
N-[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]-4-[methyl(phenyl)sulfamoyl]benzamide
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.
2-Acetyl-1,3,7,9,11-pentahydroxy-3-(3-oxobutanoyl)cyclopenta[b]anthracene-5,10-dione
(-)-epicatechin-3'-O-glucuronide
C21H24O11 (452.13185539999995)
(-)-Epicatechin-3-O-glucuronide is a cocoa metabolite from gut microflora. It is found in urine.
3,5,7,9,11,13,15,17,19-Nonaoxohenicosanoic acid
C21H24O11 (452.13185539999995)
[(1R,2R,3R,4S)-1,3-diacetyloxy-2,4,9-trihydroxy-2-methyl-5,10-dioxo-3,4-dihydro-1H-benzo[b]fluoren-11-ylidene]methylideneazanide
2-[4-(Benzenesulfonyl)phenyl]-5-(3,4,5-trimethoxyphenyl)-1,3,4-oxadiazole
C23H20N2O6S (452.10420200000004)
N-[1-[(4-chlorophenyl)methyl]-5-methyl-3-pyrazolyl]-5-(3,4-dimethoxyphenyl)-3-isoxazolecarboxamide
C23H21ClN4O4 (452.12512560000005)
Glycosmisic acid sulfate
A guaiacyl lignin that is glycosmisic acid in which the alcoholic hydrogen is replaced by a sulfo group.
Glycosmisic acid 4-sulfate
A guaiacyl lignin that is glycosmisic acid in which the phenolic hydrogen is replaced by a sulfo group.
1-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-[[2-(3-indolylidene)-3H-1,3,4-oxadiazol-5-yl]thio]ethanone
2-[[4-(4-fluorophenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]-N-[(2-furanylmethylamino)-oxomethyl]acetamide
C21H17FN6O3S (452.10668239999995)
N-[1-[(4-chlorophenyl)methyl]-5-methyl-3-pyrazolyl]-5-(2,5-dimethoxyphenyl)-3-isoxazolecarboxamide
C23H21ClN4O4 (452.12512560000005)
N-[2,6-bis(4-morpholinyl)-4-pyrimidinyl]-3,4-dichlorobenzohydrazide
2-[[6-(butylsulfamoyl)-1H-benzimidazol-2-yl]thio]-N-(2-chlorophenyl)acetamide
C19H21ClN4O3S2 (452.07435460000005)
[2-[(2-Bromophenyl)methoxy]phenyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone
N-[2,6-bis(4-morpholinyl)-4-pyrimidinyl]-2,4-dichlorobenzohydrazide
2-[4-Chloro-2-[3-(4-methoxyphenyl)-4-oxo-1,2-dihydroquinazolin-2-yl]phenoxy]acetic acid methyl ester
C24H21ClN2O5 (452.11389260000004)
2-{[(4-{[2-(4-Chloro-2-methylphenoxy)propanoyl]amino}phenyl)carbonyl]amino}benzoic acid
C24H21ClN2O5 (452.11389260000004)
3,4,5-Trihydroxy-6-[3-[2-hydroxy-3-(2,4,6-trihydroxyphenyl)propyl]phenoxy]oxane-2-carboxylic acid
C21H24O11 (452.13185539999995)
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)
4-[2,5-dimethyl-3-[(E)-(4-oxo-2-phenylimino-1,3-thiazolidin-5-ylidene)methyl]pyrrol-1-yl]benzenesulfonamide
C22H20N4O3S2 (452.09767700000003)
[(2R,4R,5R)-3,4,6-trihydroxy-5-(4-hydroxybenzoyl)oxyoxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C20H20O12 (452.09547200000003)
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] pyridine-3-carboxylate
C16H17N6O8P (452.08454520000004)
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxychroman-3-yl beta-D-glucopyranoside
C21H24O11 (452.13185539999995)
1,5,8-trihydroxy-4-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one
C20H20O12 (452.09547200000003)
(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)
2,4,6-Trihydroxy-3-[1-hydroxy-3-(4-hydroxyphenyl)-2-propenyl]phenyl b-D-glucopyranoside, 9ci
C21H24O11 (452.13185539999995)
Glutaminase-IN-3
Glutaminase-IN-3 (compound 657) is a potent glutaminase inhibitor with an IC50 of 0.24 μM for Glutaminase 1 (GLS1). Glutaminase-IN-3 is extracted from patent WO2014089048A1, compound 657[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).
Rovazolac
C21H19F3N2O4S (452.1017570000001)
Rovazolac is a liver x receptor (LXR) modulator extracted from patent WO2013130892A1.
4,14-bis(3,4-dihydroxyphenyl)-5,8-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8-trien-12-one
(2s,3s)-9-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-(hydroxymethyl)-12-methoxy-2,3-dihydro-1,4,5-trioxatetraphen-10-one
[(2r,3s,4s,5r,6r)-3,4,6-trihydroxy-5-(4-hydroxybenzoyloxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C20H20O12 (452.09547200000003)
(1r,16r)-8,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.0²,⁷.0¹⁴,¹⁷]heptadeca-2,4,6,8,10,12,14(17)-heptaene-4,6,12-triol
(2r,3r)-9-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-7-methoxy-2,3-dihydro-1,4,5-trioxatetraphen-10-one
[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-(4-hydroxybenzoyloxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C20H20O12 (452.09547200000003)
(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)
(1r,4s,5s,9r,11r,14s,15s,19r)-5,15-dihydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icos-6-ene-2,8,12,18-tetrone
3,5-dihydroxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxan-4-yl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
[(2s,3s,4r)-4-(carboxymethyl)-3-hydroxy-5-(methoxycarbonyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydropyran-3-yl]acetic acid
{3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl}methyl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
3-hydroxyphlorizin
C21H24O11 (452.13185539999995)
{"Ingredient_id": "HBIN008738","Ingredient_name": "3-hydroxyphlorizin","Alias": "3-hydroxy-phlorizin","Ingredient_formula": "C21H24O11","Ingredient_Smile": "C1=CC(=C(C=C1CCC(=O)C2=C(C=C(C=C2OC3C(C(C(C(O3)CO)O)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10644;39081","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(4R,8R,9R)-4,8-bis(3,4-dihydroxyphenyl)-5,9-dihydroxy-4,8,9,10-tetrahydro-3H-pyrano[6,5-h]chromen-2-one
{"Ingredient_id": "HBIN010873","Ingredient_name": "(4R,8R,9R)-4,8-bis(3,4-dihydroxyphenyl)-5,9-dihydroxy-4,8,9,10-tetrahydro-3H-pyrano[6,5-h]chromen-2-one","Alias": "NA","Ingredient_formula": "C24H20O9","Ingredient_Smile": "NA","Ingredient_weight": "452.41","OB_score": "58.1634287","CAS_id": "85081-22-7","SymMap_id": "SMIT13323","TCMID_id": "NA","TCMSP_id": "MOL012579","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5-[6-hydroxy-2-(4-hydroxyphenyl)-4-[(1e)-2-(4-hydroxyphenyl)ethenyl]-1-benzofuran-3-yl]benzene-1,3-diol
1-(2,4-dihydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-(3,4-dihydroxyphenyl)propan-1-one
C21H24O11 (452.13185539999995)
(1r,2r,4as,5s,5's,8as)-5-(chloromethyl)-5'-(furan-3-yl)-5-hydroxy-2-methyl-2',4,6-trioxo-tetrahydro-2h-spiro[naphthalene-1,3'-oxolan]-4a-ylmethyl acetate
[(2r,3s,4s,5r,6r)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate
C21H24O11 (452.13185539999995)
3-hydroxy-9-{[(2s,3r)-6-hydroxy-2-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]oxy}-10-methoxybenzo[c]chromen-6-one
{3,4,5-trihydroxy-6-[4-(2-hydroxyethyl)phenoxy]oxan-2-yl}methyl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
(2r,3r,4r,5s,6r)-2-{[(2r,3r)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
6,12-bis(3,4-dihydroxyphenyl)-8,13-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-trien-4-one
5,22-dihydroxy-11-(methylsulfanyl)-19,20-dithia-3,13-diazahexacyclo[13.5.1.1¹⁴,¹⁸.0¹,¹³.0³,¹¹.0⁴,⁹]docosa-6,8-diene-2,12,16-trione
C19H20N2O5S3 (452.05343100000005)
1-(2,6-dihydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-(3,4-dihydroxyphenyl)propan-1-one
C21H24O11 (452.13185539999995)
(4r,5s,14s)-4,14-bis(3,4-dihydroxyphenyl)-5,8-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8-trien-12-one
(2s,3r)-5,7-dihydroxy-3-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one
C20H20O12 (452.09547200000003)
3,11-bis(4-hydroxyphenyl)-4,12-dioxapentacyclo[8.6.1.1²,⁵.0¹³,¹⁷.0⁹,¹⁸]octadeca-1(17),5(18),6,8,13,15-hexaene-7,15-diol
(2r,3r)-12-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4,5-trioxatetraphen-10-one
[3,4,6-trihydroxy-5-(4-hydroxybenzoyloxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C20H20O12 (452.09547200000003)
5-(chloromethyl)-5'-(furan-3-yl)-5-hydroxy-2-methyl-2',4,6-trioxo-tetrahydro-2h-spiro[naphthalene-1,3'-oxolan]-4a-ylmethyl acetate
12-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4,5-trioxatetraphen-10-one
(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 3-hydroxy-4-methoxybenzoate
C21H24O11 (452.13185539999995)
(4s,5s)-5-(3,5-dihydroxyphenyl)-4-(4-hydroxyphenyl)-4,5-dihydroacephenanthrylene-1,3,9-triol
(2r,3s)-2-(4-hydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
C21H24O11 (452.13185539999995)
(6s,12r,13s)-6,12-bis(3,4-dihydroxyphenyl)-8,13-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-trien-4-one
(1r,2r,4as,5s,8as)-5-(chloromethyl)-5'-(furan-3-yl)-5-hydroxy-2-methyl-2',4,6-trioxo-tetrahydro-2h-spiro[naphthalene-1,3'-oxolan]-4a-ylmethyl acetate
9-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-(hydroxymethyl)-12-methoxy-2,3-dihydro-1,4,5-trioxatetraphen-10-one
(2r,3r)-2-(3,4-dihydroxyphenyl)-6-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
C21H24O11 (452.13185539999995)
(2s,3r,4s,5s,6r)-2-{[(2r,3r)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
5-[4-hydroxy-2-(4-hydroxyphenyl)-6-[(1e)-2-(4-hydroxyphenyl)ethenyl]-1-benzofuran-3-yl]benzene-1,3-diol
4-methyl-6-oxo-2,3-dihydropyran-3-yl (2z)-3-(3-hydroxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoate
C21H24O11 (452.13185539999995)
(2s,3r,4s,5s,6r)-2-{[(2s,3r)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
(2e)-3-{4-hydroxy-3-methoxy-5-[(3s,4r)-6-methoxy-4-(sulfooxy)-3,4-dihydro-2h-1-benzopyran-3-yl]phenyl}prop-2-enoic acid
5,15-dihydroxy-16-methoxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.0¹,¹³.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]docos-6-ene-2,8,12,18-tetrone
(6r,7s,9r,10s)-7,9-bis(4-hydroxyphenyl)-8,18-dioxapentacyclo[13.2.1.0⁵,¹⁷.0⁶,¹⁰.0¹¹,¹⁶]octadeca-1(17),2,4,11,13,15-hexaene-3,13-diol
4-hydroxy-2,5-bis(4-hydroxyphenyl)-3,6-dioxocyclohexa-1,4-dien-1-yl 4,5-dihydroxyhex-2-enoate
(6r,12r,13r)-6,12-bis(3,4-dihydroxyphenyl)-8,13-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-trien-4-one
(2s,3s)-12-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4,5-trioxatetraphen-10-one
(1r,4s,5s,9s,11r,14s,15r,16s,19r)-5,15-dihydroxy-16-methoxy-21,22-dithia-3,13-diazahexacyclo[9.9.2.0¹,¹³.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]docos-6-ene-2,8,12,18-tetrone
(2r,3r)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-3-yl 3-(4-hydroxyphenyl)prop-2-enoate
ethyl (2z)-3-(3,4-dihydroxyphenyl)-2-{6-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-oxopyran-3-yl}prop-2-enoate
methyl 9-[(acetyloxy)methyl]-5,7-dihydroxy-2,2-dimethyl-6,11-dioxo-1-oxatetracene-8-carboxylate
(4r,5s,14r)-4,14-bis(3,4-dihydroxyphenyl)-5,8-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8-trien-12-one
(2s,3s,4s,5s,6s)-2-{[(2r,3r)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
13,14-dihydroxy-3-(4-methoxyphenyl)-7-phenyl-5,10-dioxatetracyclo[7.7.0.0²,⁶.0¹¹,¹⁶]hexadeca-1(9),2,6,11,13,15-hexaene-4,8-dione
(2r,3r)-3-(3,5-dihydroxyphenyl)-2-(4-hydroxyphenyl)-2h,3h-phenanthro[2,1-b]furan-8,10-diol
5-(3,5-dihydroxyphenyl)-4-(4-hydroxyphenyl)-4,5-dihydroacephenanthrylene-1,3,9-triol
(3s)-1-(2,4-dihydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-hydroxy-3-(4-hydroxyphenyl)propan-1-one
C21H24O11 (452.13185539999995)
(5-hydroxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2-hydroxy-6-methoxybenzoate
C21H24O11 (452.13185539999995)
(2r)-1-{2,4-dihydroxy-3-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}-3-(3,4-dihydroxyphenyl)-2-hydroxypropan-1-one
C21H24O11 (452.13185539999995)
4-hydroxy-2,5-bis(4-hydroxyphenyl)-3,6-dioxocyclohexa-1,4-dien-1-yl (2z,4r,5s)-4,5-dihydroxyhex-2-enoate
5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-3-yl 3-(4-hydroxyphenyl)prop-2-enoate
(1r,4s,5s,11r,14s,15r,18r,22r)-5,22-dihydroxy-11-(methylsulfanyl)-19,20-dithia-3,13-diazahexacyclo[13.5.1.1¹⁴,¹⁸.0¹,¹³.0³,¹¹.0⁴,⁹]docosa-6,8-diene-2,12,16-trione
C19H20N2O5S3 (452.05343100000005)
5-[6-hydroxy-2-(4-hydroxyphenyl)-4-[2-(4-hydroxyphenyl)ethenyl]-1-benzofuran-3-yl]benzene-1,3-diol
5,15-dihydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icos-6-ene-2,8,12,18-tetrone
5-[6-hydroxy-2-(4-hydroxyphenyl)-4-[(1z)-2-(4-hydroxyphenyl)ethenyl]-1-benzofuran-3-yl]benzene-1,3-diol
(1e,4s,5r,7r,10r,12e)-17-bromo-1-chloro-12-(chloromethylidene)-5,7-dimethylheptadec-1-en-16-yne-4,10-diol
C20H31BrCl2O2 (452.08843459999997)
[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
(2s,3r,4s,5s,6s)-2-{[(2r,3s)-2-(3,4-dihydroxyphenyl)-3,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
3-hydroxy-9-{[6-hydroxy-2-(hydroxymethyl)-7-methoxy-2,3-dihydro-1-benzofuran-3-yl]oxy}-10-methoxybenzo[c]chromen-6-one
(2r,3s)-2-(3-hydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
C21H24O11 (452.13185539999995)
1-(2,4-dihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-3-hydroxy-3-(4-hydroxyphenyl)propan-1-one
C21H24O11 (452.13185539999995)
(2r,3r)-2-(3,4-dihydroxyphenyl)-8-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
C21H24O11 (452.13185539999995)
(1r,4r,5r,9r,11r,14r,15s,19s)-5,15-dihydroxy-1,11-bis(methylsulfanyl)-3,13-diazapentacyclo[11.7.0.0³,¹¹.0⁴,⁹.0¹⁴,¹⁹]icos-6-ene-2,8,12,18-tetrone
[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[4-(2-hydroxyethyl)phenoxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
5-hydroxy-2-(hydroxymethyl)-9-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-8h,11h-oxepino[2,3-h]chromen-4-one
C21H24O11 (452.13185539999995)
(6r,12r,13s)-6,12-bis(3,4-dihydroxyphenyl)-8,13-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1,7,9-trien-4-one
5-[4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethenyl]-1-benzofuran-3-yl]benzene-1,3-diol
7,9-bis(4-hydroxyphenyl)-8,18-dioxapentacyclo[13.2.1.0⁵,¹⁷.0⁶,¹⁰.0¹¹,¹⁶]octadeca-1(17),2,4,11,13,15-hexaene-3,13-diol
[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
5-hydroxy-2-(hydroxymethyl)-9-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-8h,11h-oxepino[2,3-h]chromen-4-one
C21H24O11 (452.13185539999995)
(2r,5s)-2-{[(2r,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
(2r,3r,4s,5r,6r)-3,5-dihydroxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxan-4-yl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)
(5-hydroxy-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 2-hydroxy-6-methoxybenzoate
C21H24O11 (452.13185539999995)
ethyl 3-(3,4-dihydroxyphenyl)-2-{6-[2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-2-oxopyran-3-yl}prop-2-enoate
(2r,3r,4s,5r,6r)-2-{[(2r,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
(2r,3r,4s,5s,6r)-2-{[(2r,3r)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
(2r,3r,4s,5s,6r)-2-{[(2r,3s)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
1,3,6-trihydroxy-7-methoxy-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}xanthen-9-one
C20H20O12 (452.09547200000003)
(1r,16r)-9,16-bis(4-hydroxyphenyl)-15-oxatetracyclo[8.6.1.0²,⁷.0¹⁴,¹⁷]heptadeca-2,4,6,8,10,12,14(17)-heptaene-4,6,12-triol
(3-hydroxy-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methyl 3-hydroxy-4-methoxybenzoate
C21H24O11 (452.13185539999995)
(2r,3r)-5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2h-1-benzopyran-3-yl (2z)-3-(4-hydroxyphenyl)prop-2-enoate
9-hydroxy-2-(2-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-12-methoxy-2,3-dihydro-1,4,5-trioxatetraphen-10-one
{6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl}methyl 3,4-dihydroxybenzoate
C21H24O11 (452.13185539999995)
5,7-dihydroxy-3-[(3,4,5-trihydroxyoxan-2-yl)oxy]-2-(3,4,5-trihydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one
C20H20O12 (452.09547200000003)
(4s,5s,14r)-4,14-bis(3,4-dihydroxyphenyl)-5,8-dihydroxy-3,11-dioxatricyclo[8.4.0.0²,⁷]tetradeca-1(10),2(7),8-trien-12-one
(2s,3r,4r,5s,6r)-2-[3-(3,4-dimethoxybenzoyl)-2,4,6-trihydroxyphenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
C21H24O11 (452.13185539999995)
(2r,3r,10r,11r)-3,11-bis(4-hydroxyphenyl)-4,12-dioxapentacyclo[8.6.1.1²,⁵.0¹³,¹⁷.0⁹,¹⁸]octadeca-1(17),5(18),6,8,13,15-hexaene-7,15-diol
[3,4,5-trihydroxy-6-(4-hydroxybenzoyloxy)oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C20H20O12 (452.09547200000003)
(2r,3s)-2-(3,4-dihydroxyphenyl)-6-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-3,4-dihydro-2h-1-benzopyran-3,5,7-triol
C21H24O11 (452.13185539999995)
[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl]methyl 3,4,5-trihydroxybenzoate
C21H24O11 (452.13185539999995)