Exact Mass: 592.1851
Exact Mass Matches: 592.1851
Found 389 metabolites which its exact mass value is equals to given mass value 592.1851
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
1,2-di-O-sinapoyl-beta-D-glucose
http://casmi-contest.org/challenges-cat1-2.shtml; CASMI2012 LC Challenge 2
Isowertin 2'-rhamnoside
Isolated from Avena sativa (coats) and Gnetum africanum. Isoswertin 2-rhamnoside is found in oat, cereals and cereal products, and green vegetables. Isowertin 2-rhamnoside is found in cereals and cereal products. Isowertin 2-rhamnoside is isolated from Avena sativa (coats) and Gnetum africanum.
Pentamidine isethionate
P - Antiparasitic products, insecticides and repellents > P01 - Antiprotozoals > P01C - Agents against leishmaniasis and trypanosomiasis D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent
Mulberrofuran Q
Mulberrofuran Q is a member of benzofurans. Mulberrofuran Q is a natural product found in Morus mongolica with data available. Mulberrofuran Q is found in fruits. Mulberrofuran Q is a constituent of Morus alba (white mulberry). Constituent of Morus alba (white mulberry). Mulberrofuran Q is found in fruits.
6'-O-(3-Hydroxy-3-methylglutaroyl)astragalin
6-O-(3-Hydroxy-3-methylglutaroyl)astragalin is found in citrus. 6-O-(3-Hydroxy-3-methylglutaroyl)astragalin is a constituent of aged callus cultures of lime (Citrus aurantifolia). Constituent of aged callus cultures of lime (Citrus aurantifolia). 6-(3-Hydroxy-3-methylbutanoyl)astragalin is found in citrus.
Apigenin 7-[rhamnosyl-(1->2)-galacturonide]
Apigenin 7-[rhamnosyl-(1->2)-galacturonide] is found in green vegetables. Apigenin 7-[rhamnosyl-(1->2)-galacturonide] is isolated from flowers of Silybum marianum (milk thistle) Apigenin is a flavone that is the aglycone of several glycosides. It is a yellow crystalline solid that has been used to dye wool. Apigenin is a plant-derived flavonoid that has significant promise as a skin cancer chemopreventive agent. Apigenin inhibits the expression of involucrin (hINV), a marker of keratinocyte differentiation, is increased by differentiating agents via a protein kinase Cdelta (PKCdelta), Ras, MEKK1, MEK3 cascade that increases AP1 factor level and AP1 factor binding to DNA elements in the hINV promoter. Apigenin suppresses the 12-O-tetradeconylphorbol-13-acetate-dependent increase in AP1 factor expression and binding to the hINV promoter and the increase in hINV promoter activity. Apigenin also inhibits the increase in promoter activity observed following overexpression of PKCdelta, constitutively active Ras, or MEKK1. The suppression of PKCdelta activity is associated with reduced phosphorylation of PKCdelta-Y311. Activation of hINV promoter activity by the green tea polyphenol, (-)-epigellocathecin-3-gallate, is also inhibited by apigenin, suggesting that the two chemopreventive agents can produce opposing actions in keratinocytes. (PMID: 16982614); Apigenin, a flavone abundantly found in fruits and vegetables, exhibits antiproliferative, anti-inflammatory, and antimetastatic activities through poorly defined mechanisms. This flavonoid provides selective activity to promote caspase-dependent-apoptosis of leukemia cells and uncover an essential role of PKCdelta during the induction of apoptosis by apigenin. (PMID: 16844095); Apigenin markedly induces the expression of death receptor 5 (DR5) and synergistically acts with exogenous soluble recombinant human tumor necrosis factor-related apoptosis-inducing ligand (TRAIL) to induce apoptosis in malignant tumor cells. On the other hand, apigenin-mediated induction of DR5 expression is not observed in normal human peripheral blood mononuclear cells. Moreover, apigenin does not sensitize normal human peripheral blood mononuclear cells to TRAIL-induced apoptosis. (PMID: 16648565). Isolated from flowers of Silybum marianum (milk thistle). Apigenin 7-[rhamnosyl-(1->2)-galacturonide] is found in green vegetables.
Osmanthuside B
Osmanthuside B is found in herbs and spices. Osmanthuside B is isolated from leaves of Osmanthus fragrans (sweet osmanthus). Isolated from leaves of Osmanthus fragrans (sweet osmanthus). Osmanthuside B is found in herbs and spices.
Margaritene
Margaritene is found in fruits. Margaritene is isolated from Fortunella margarita (oval kumquat) and Fortunella japonica (round kumquat). Isolated from Fortunella margarita (oval kumquat) and Fortunella japonica (round kumquat). Margaritene is found in fruits.
Aurasperone C
Aurasperone C is a mycotoxin pigment from Aspergillus niger and Aspergillus awamor
8-Acetoxy-4'-methoxypinoresinol 4-glucoside
8-Acetoxy-4-methoxypinoresinol 4-glucoside is found in fats and oils. 8-Acetoxy-4-methoxypinoresinol 4-glucoside is a constituent of Olea europaea (olive). Constituent of Olea europaea (olive). 8-Acetoxy-4-methoxypinoresinol 4-glucoside is found in pomes, fats and oils, and herbs and spices.
8,8'-Methylenebiscatechin
8,8-Methylenebiscatechin is found in cocoa and cocoa products. 8,8-Methylenebiscatechin is a constituent of cacao liquor, Theobroma cacao. Constituent of cacao liquor, Theobroma cacao. 8,8-Methylenebiscatechin is found in cocoa and cocoa products and cocoa bean.
ax-4'-Hydroxy-3-'-methoxymaysin
ax-4-Hydroxy-3--methoxymaysin is found in cereals and cereal products. ax-4-Hydroxy-3--methoxymaysin is isolated from corn silk (Zea mays
Isomargaritene
Isomargaritene is found in fruits. Isomargaritene is isolated from Fortunella margarita (oval kumquat) and Fortunella japonica (round kumquat). Isolated from Fortunella margarita (oval kumquat) and Fortunella japonica (round kumquat). Isomargaritene is found in fruits.
Liquiritigenin 4'-[3-acetylapiosyl-(1->2)-glucoside]
Liquiritigenin 4-[3-acetylapiosyl-(1->2)-glucoside] is found in herbs and spices. Liquiritigenin 4-[3-acetylapiosyl-(1->2)-glucoside] is a constituent of the roots of Glycyrrhiza uralensis (Chinese licorice) Constituent of the roots of Glycyrrhiza uralensis (Chinese licorice). Liquiritigenin 4-[3-acetylapiosyl-(1->2)-glucoside] is found in herbs and spices.
Daidzin 4'-O-glucuronide
Daidzin 4-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
Fomidacillin
Linarin
Acacetin 7-rutinoside is a member of the class of compounds known as flavonoid-7-o-glycosides. Flavonoid-7-o-glycosides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Acacetin 7-rutinoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Acacetin 7-rutinoside can be found in linden, orange mint, and spearmint, which makes acacetin 7-rutinoside a potential biomarker for the consumption of these food products. Linarin (Buddleoside), isolated from the flower extract of Mentha arvensis, shows selective dose dependent inhibitory effect on acetylcholinesterase (AChE)[1]. Linarin (Buddleoside), isolated from the flower extract of Mentha arvensis, shows selective dose dependent inhibitory effect on acetylcholinesterase (AChE)[1].
Proanthocyanidin
Isoswertisin 4'-rhamnoside
Isoswertisin 4-rhamnoside 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. Isoswertisin 4-rhamnoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Isoswertisin 4-rhamnoside can be found in oat, which makes isoswertisin 4-rhamnoside a potential biomarker for the consumption of this food product.
2'-O-alpha-L-Rhamnosyl-6-C-fucosyl-3'-methoxyluteolin
2-o-alpha-l-rhamnosyl-6-c-fucosyl-3-methoxyluteolin is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 2-o-alpha-l-rhamnosyl-6-c-fucosyl-3-methoxyluteolin can be found in corn, which makes 2-o-alpha-l-rhamnosyl-6-c-fucosyl-3-methoxyluteolin a potential biomarker for the consumption of this food product.
Proanthocyanidins
Proanthocyanidins, also known as zangrado or polyhydroxyflavan-3-ol, is a member of the class of compounds known as biflavonoids and polyflavonoids. Biflavonoids and polyflavonoids are organic compounds containing at least two flavan/flavone units. These units are usually linked through CC or C-O-C bonds. Some examples include C2-O-C3, C2-O-C4, C3-C3, and C6-C8. Proanthocyanidins is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Proanthocyanidins can be found in a number of food items such as roselle, allspice, cocoa bean, and sweet bay, which makes proanthocyanidins a potential biomarker for the consumption of these food products. Proanthocyanidins were discovered in 1947 by Jacques Masquelier, who developed and patented techniques for the extraction of oligomeric proanthocyanidins from pine bark and grape seeds. Often associated with consumer products made from cranberries, grape seeds or red wine, proanthocyanidins were once proposed as factors inhibiting urinary tract infections in women, but this research has been refuted by expert scientific committees . D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D020011 - Protective Agents > D000975 - Antioxidants
Linarin
Acquisition and generation of the data is financially supported in part by CREST/JST. Linarin is a natural product found in Silene firma, Scoparia dulcis, and other organisms with data available. Linarin (Buddleoside), isolated from the flower extract of Mentha arvensis, shows selective dose dependent inhibitory effect on acetylcholinesterase (AChE)[1]. Linarin (Buddleoside), isolated from the flower extract of Mentha arvensis, shows selective dose dependent inhibitory effect on acetylcholinesterase (AChE)[1].
Fortunellin
Annotation level-1 Acquisition and generation of the data is financially supported in part by CREST/JST. Fortunellin, is a flavonoid, that can be isolated from the fruits of Fortunella margarita (kumquat). Fortunellin exhibits little toxicity to mice and suppresses inflammation and ROS generation in H9C2 cells induced by LPS. Fortunellin protects against fructose-induced inflammation and oxidative stress by enhancing AMPK/Nrf2 pathway. Fortunellin can be used for diabetic cardiomyopathy research[1].
Liquiritigenin 7-(3-acetylapiofuranoside)-4-glucoside
Isocytisoside 3-O-alpha-L-rhamnopyranoside
Luteolin 7-[6-(3-hydroxy-3-methylglutaryl)glucoside]
2-O-alpha-L-Rhamnosyl-6-C-fucosyl-3-methoxyluteoiin
6)-glucoside
Scutellarein 7-[6-(3-Hydroxy-3-methylglutaryl)glucoside]
Syringetin 3-(2,3-diacetylglucoside)
Isomollupentin 7,4-dimethyl ether 2-O-glucoside
4,5-Dihydroxy-7-methoxyisoflavone 3-O-(3-E-cinnamoylglucoside)
Torosaflavone B 3-O-beta-D-glucopyranoside
Mulberrofuran Q
2'-O-alpha-L-Rhamnosyl-6-C-fucosyl-3-methoxyluteolin
Apigenin 7-rhamnosyl- (1->2) -galacturonide
Baicalein 6-methyl ether 7-glucosyl- (1->3) -rhamnoside
Isomargaritene
Luteolin 7- (3'-acetylapiosyl- (1->2) -xyloside)
7-hydroxy-4,8-dimethoxyisoflavone 7-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
7-hydroxy-6,4-dimethoxyisoflavone 7-O-beta-D-xylopyranosyl-(1-6)-O-beta-D-glucopyranoside|gehuain
3-hydroxy-1-methoxy-2-methoxymethyl-9,10-anthraquinone-3-O-beta-D-primeveroside|lasianthuoside C
5-O-[beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranosyl]-7,4-dimethoxy-4-phenylcoumarin
1,8-dihydroxy-6-methoxy-3-methylanthraquinone 8-O-rhamnosyl-(1->2)-glucoside|Physcion-8-O-rhamnosyl-(1鈥樏傗垎2)-glucoside
1,6-di-O-(E)-sinapoyl-beta-glucopyranose|1,6-Di-O-sinapoylglucose
5,7-dimethoxyflavone 4-O-[beta-D-apiofuranosyl(1-5)-beta-D-glucopyranoside]
Me glycoside,hexa-Ac-4-O-alpha-D-Mannopyranosyl-L-rhamnose
beta-Gal-(1<*>2)-alpha-GlcA-(1<*>3)-alpha-Man-(1<*>2)-glycerol|beta-Gal-(1[*]2)-alpha-GlcA-(1[*]3)-alpha-Man-(1[*]2)-glycerol
digiferruginol-1-methylether-11-O-beta-gentobioside
7-hydroxy-4,8-dimethoxyisoflavone 7-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|7-hydroxy-4,8-dimethoxyisoflavone-7-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside
genkwanin 4-O-[alpha-L-rhamnopyranosyl(1->2)-beta-D-glucopyranoside]
2-methyl-1,3,6-trihydroxy-9,10-anthraquinone-3-O-alpha-L-rhamnopyranosyl (1->2)-beta-D-glucopyranoside
eriocauloside A|hispidulin 7-O-beta-D-(6-O-cinnamoyl)glucopyranoside
6-alpha-rhamnopyranosyl-7-O-methylvitexin|arnoldioside B
Osmanthuside B
chrysoeriol 6-C-beta-boivinopyranosyl-7-O-beta-glucopyranoside
quercetin-3-O-[4-O-(3-hydroxy-3-methylglutaroyl)]-alpha-rhamnopyranoside
7-hydroxy-4,6-dimethoxyisoflavone 7-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside|7-hydroxy-4,6-dimethoxyisoflavone-7-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|afromosin 7-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside
kaempferol 3-O-<6-O-(3-hydroxy-3-methylglutaroyl)-beta-glucoside>|kaempferol 3-O-[6-O-(3-hydroxy-3-methylglutaroyl)-beta-glucoside]
1-[O-beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranosyloxy]-3-methoxy-6-methyl-9,10-anthraquinone|3-methylxanthopurpurin 6-O-methyl ether 8-O-beta-D-gentiobioside
kaempferol 3-O-(4-beta-D-glucopyranosyl)-alpha-L-rhamnopyranoside|multiflorin B
3-hydroxy-6-[O-alpha-apiofuranosyl-(1->6)-beta-D-glucopyranosyloxy]-3,4-methylenedioxyflavonol
8-O-methyl retusin 7-O-beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranoside|mucodianin F
1,7a,8a,15-tetrahydroxy-6,10-diphenyl-7a,8a,15b,15c-tetrahydro, 7H,9H-diphenalen-[1,2-b:1,2-d]-furane-7,9-dione
Acacetin-7-(beta-D-glucopyranosyl-2-alpha-L-Rhamnopyranosid)
5-O-methylgenistein 7-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside|hirsutissimiside B
14-hydroxy-11,13-dihydrohypocretenolide-beta-D-glucopyranoside tetraacetate
Baicalein 6-methyl ether 7-glucosyl-(1->3)-rhamnoside
Bruceantinol A
Bruceantinol A is a natural product found in Brucea javanica with data available.
7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methoxy-3-(4-methoxyphenyl)chromen-4-one
7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-8-methoxy-3-(4-methoxyphenyl)chromen-4-one
5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one
5-hydroxy-3-(4-methoxyphenyl)-7-[3,4,5-trihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxychromen-4-one [IIN-based: Match]
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one [IIN-based: Match]
Asp Ser Trp Trp
Asp Trp Ser Trp
Asp Trp Trp Ser
Glu Met Gln Trp
Glu Met Trp Gln
Glu Gln Met Trp
Glu Gln Trp Met
Glu Trp Met Gln
Glu Trp Gln Met
Met Glu Gln Trp
Met Glu Trp Gln
Met Gln Glu Trp
Met Gln Trp Glu
Met Trp Glu Gln
Met Trp Gln Glu
Gln Glu Met Trp
Gln Glu Trp Met
Gln Met Glu Trp
Gln Met Trp Glu
Gln Trp Glu Met
Gln Trp Met Glu
Ser Asp Trp Trp
Ser Trp Asp Trp
Ser Trp Trp Asp
Trp Asp Ser Trp
Trp Asp Trp Ser
Trp Glu Met Gln
Trp Glu Gln Met
Trp Met Glu Gln
Trp Met Gln Glu
Trp Gln Glu Met
Trp Gln Met Glu
Trp Ser Asp Trp
Trp Ser Trp Asp
Trp Trp Asp Ser
Trp Trp Ser Asp
Kaempferol 3-[6-(3-hydroxy-3-methylglutaryl)glucoside]
Liquiritigenin 4-[3-acetylapiosyl-(1->2)-glucoside]
ISOPHORONE DIISOCYANATE
Aurasperone C
A dimeric naphtho-gamma-pyrone with formula C31H28O12, originally isolated from Aspergillus niger
8-Acetoxy-4'-methoxypinoresinol 4-glucoside
Apigenin 7-[rhamnosyl-(1->2)-galacturonide]
8,8-Methylenebiscatechin
6''-O-(3-Hydroxy-3-methylglutaroyl)astragalin
Daidzin 4'-O-glucuronide
[4-[(2-oxido-4-phenyl-1,2,5-oxadiazol-2-ium-3-yl)methoxy]phenyl]methyl 2-(5-hydroxy-4-oxo-2-phenylchromen-7-yl)oxyacetate
(S,S)-2,2-Bis[(S)-4-isopropyloxazolin-2-yl]-1,1-biferrocene
11-[4-[2-[2-(Dibenzo[b,f][1,4]thiazepin-11-yloxy)ethoxy]ethyl]-1-piperazinyl]dibenzo[b,f][1,4]thiazepine
acacetin-8-C-neohesperidoside
A flavone C-glycoside that is acacetin substituted by an alpha-rhamnosyl-(1->2)-beta-glucopyranosyl residue at position 8 via a C-glycosidic linkage. It has been isolated from Fortunella japonica and Fortunella margarita.
7-O-Methylvitexin 2-O-beta-L-rhamnoside
A dihydroxyflavone that is vitexin having a beta-L-rhamnosyl residue attached at the 2-position of the glucitol moiety and a methyl group attached at the O-7 position of the chromene.
2-O-alpha-L-Rhamnosyl-6-C-fucosyl-3-methoxyluteolin
3-(1,3-benzodioxol-5-yl)-1-[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
3-(1,3-benzodioxol-5-yl)-1-[[(4R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
3-(1,3-benzodioxol-5-yl)-1-[[(4R,5S)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
(1R)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-(3-methylphenyl)sulfonyl-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
(1S)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-(3-methylphenyl)sulfonyl-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
4-fluoro-N-[[(4S,5R)-2-[(2S)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
3-(1,3-benzodioxol-5-yl)-1-[[(4S,5R)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
3-(1,3-benzodioxol-5-yl)-1-[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
3-(1,3-benzodioxol-5-yl)-1-[[(4S,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
3-(1,3-benzodioxol-5-yl)-1-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
N-[[(4R,5R)-8-(3-fluorophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide
3-(1,3-benzodioxol-5-yl)-1-[[(4S,5R)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-8-(2-pyridin-4-ylethynyl)-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
4-fluoro-N-[[(4S,5R)-2-[(2R)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
4-fluoro-N-[[(4R,5R)-2-[(2S)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
4-fluoro-N-[[(4S,5S)-2-[(2R)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
4-fluoro-N-[[(4R,5S)-2-[(2R)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
4-fluoro-N-[[(4R,5S)-2-[(2S)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
4-fluoro-N-[[(4S,5S)-2-[(2S)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
4-fluoro-N-[[(4R,5R)-2-[(2R)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methylbenzenesulfonamide
N-[[(4S,5S)-8-(3-fluorophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide
N-[[(4R,5R)-8-(3-fluorophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide
N-[[(4R,5S)-8-(3-fluorophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide
N-[[(4S,5R)-8-(3-fluorophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-4-methoxy-N-methylbenzenesulfonamide
(5Z)-5-[[4-[(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)oxy]-3-methoxyphenyl]methylidene]-3-phenyl-2-sulfanylidene-1,3-thiazolidin-4-one
3,4,5-Trihydroxy-6-[5-hydroxy-4-oxo-2-phenyl-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-7-yl]oxyoxane-2-carboxylic acid
7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-6-methoxy-3-(4-methoxyphenyl)chromen-4-one
7-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-8-methoxy-3-(4-methoxyphenyl)chromen-4-one
7-O-methylvitexin 2-O-alpha-L-rhamnoside
A derivative of vitexin having a alpha-L-rhamnosyl residue attached at the 2-position of the glucitol moiety and a methyl group attached at the O-7 position of the chromene.
Aldometanib
Aldometanib (LXY-05-029) is an orally active aldolase inhibitor. Aldometanib can activate lysosomal adenosine monophosphate-activated protein kinase (AMPK) and decreases blood glucose. Aldometanib can be used for the research of metabolic homeostasis[1].
(2s,3r,4s,5r,6r)-3-(acetyloxy)-2-{[5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-4-oxochromen-3-yl]oxy}-5-hydroxy-6-(hydroxymethyl)oxan-4-yl acetate
7-({3,4-dihydroxy-5-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxolan-3-yl}methoxy)-8-methoxy-3-(4-methoxyphenyl)chromen-4-one
(1r,2r,4s,7s,8s,11r,12r,18r)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-5,15,20-trioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icosan-13-yl 4-hydroxybenzoate
n-{3-[n-(3-{[(2,3-dihydroxyphenyl)(hydroxy)methylidene]amino}propyl)-1-[2-(2-hydroxyphenyl)-4,5-dihydro-1,3-oxazol-4-yl]formamido]propyl}-2,3-dihydroxybenzenecarboximidic acid
2-(4-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}phenyl)-5-hydroxy-7-methoxychromen-4-one
3-(4-hydroxyphenyl)-5-methoxy-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}chromen-4-one
8-[3,5-dihydroxy-6-(hydroxymethyl)-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
7-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-5-hydroxy-2-(4-methoxyphenyl)chromen-4-one
(2s,3r,4s,5r,6s)-3,4-dihydroxy-6-{[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-5-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxane-2-carboxylic acid
methyl 1-hydroxy-9,10-dioxo-3-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]anthracene-2-carboxylate
8-hydroxy-3-(4-methoxyphenyl)-7-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-({[(2s,3s,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}chromen-4-one
7-methoxy-4-(4-methoxyphenyl)-5-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]chromen-2-one
6-[(2s,3r,4s,5r)-4,5-dihydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
6-[(2s,3r,4s,5s)-4,5-dihydroxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]-5-hydroxy-7-methoxy-2-(4-methoxyphenyl)chromen-4-one
5-[(5r,6r,10r,11r)-10-(3,5-dihydroxyphenyl)-8-(hydroxymethyl)-5,11-bis(4-hydroxyphenyl)-4,12-dioxatricyclo[7.3.0.0³,⁷]dodeca-1,3(7),8-trien-6-yl]benzene-1,3-diol
methyl (1's,2r,2'r,4'r,6's,7's)-4-(4-hydroxy-3-methoxybenzoyl)-5-oxo-7'-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3',8'-dioxaspiro[furan-2,5'-tricyclo[4.4.0.0²,⁴]decan]-9'-ene-10'-carboxylate
1-hydroxy-6-methoxy-3-methyl-8-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}anthracene-9,10-dione
(2r,3r,4r,5r,6r)-5-hydroxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl (2z)-3-(4-hydroxyphenyl)prop-2-enoate
6-[(2s,3s,4r,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]-5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one
methyl 1-hydroxy-9,10-dioxo-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}anthracene-2-carboxylate
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)chromen-4-one
1,2-di-o-e-sinapoyl-β-glucopyranose
{"Ingredient_id": "HBIN000832","Ingredient_name": "1,2-di-o-e-sinapoyl-\u03b2-glucopyranose","Alias": "NA","Ingredient_formula": "C28H32O14","Ingredient_Smile": "COC1=CC(=CC(=C1O)OC)C=CC(=O)OC2C(C(C(OC2OC(=O)C=CC3=CC(=C(C(=C3)OC)O)OC)CO)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6508","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1,3-dihydroxy-2-carbomethoxy-9,10-anthra-quinone 3-o-β-primeveroside
{"Ingredient_id": "HBIN001178","Ingredient_name": "1,3-dihydroxy-2-carbomethoxy-9,10-anthra-quinone 3-o-\u03b2-primeveroside","Alias": "NA","Ingredient_formula": "C27H28O15","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5784","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1,6-di-o-sinapoylglucose
{"Ingredient_id": "HBIN001888","Ingredient_name": "1,6-di-o-sinapoylglucose","Alias": "NA","Ingredient_formula": "C28H32O14","Ingredient_Smile": "COC1=CC(=CC(=C1O)OC)C=CC(=O)OCC2C(C(C(C(O2)OC(=O)C=CC3=CC(=C(C(=C3)OC)O)OC)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6509","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
acacetin-7-O-β-D-rutinoside
{"Ingredient_id": "HBIN014307","Ingredient_name": "acacetin-7-O-\u03b2-D-rutinoside","Alias": "NA","Ingredient_formula": "C28H32O14","Ingredient_Smile": "CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)OC)O)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "39715","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
Acacetin- 7- rutinoside
{"Ingredient_id": "HBIN014310","Ingredient_name": "Acacetin- 7- rutinoside","Alias": "NA","Ingredient_formula": "C28H32O14","Ingredient_Smile": "CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=CC(=C4C(=C3)OC(=CC4=O)C5=CC=C(C=C5)OC)O)O)O)O)O)O)O","Ingredient_weight": "592.5 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "34811","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "44257888","DrugBank_id": "NA"}