Exact Mass: 592.2047
Exact Mass Matches: 592.2047
Found 469 metabolites which its exact mass value is equals to given mass value 592.2047
,
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
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.
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
2-O-alpha-L-Rhamnosyl-6-C-fucosyl-3-methoxyluteoiin
6)-glucoside
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
2'-O-alpha-L-Rhamnosyl-6-C-fucosyl-3-methoxyluteolin
Baicalein 6-methyl ether 7-glucosyl- (1->3) -rhamnoside
Isomargaritene
(3alpha,4beta,24s)-3,21-Disulfdte,Cholesta-5,25-diene-3,4,21,24-tetrol
7-hydroxy-4,8-dimethoxyisoflavone 7-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
11,17-dimethoxy-18-(7-methoxy-benzo[1,3]dioxole-5-carbonyloxy)-yohimbane-16-carboxylic acid methyl ester|Veneserpin
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
(2R,8E,11R,13S)-8-[(acetoxy)methyl]-5-hydroxy-4,14,15,15-tetramethyl-7-oxobicyclo[9.3.1]pentadeca-1(14),3,8-triene-2,3,10,13-tetrayl tetraacetate|(3E,8E)-2alpha,9,10beta,13alpha,20-pentaacetoxy-7beta-hydroxy-3,8-secotaxa-3,8,11-trien-5-one
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
6-alpha-L-rhamnosyl,8-O-acetylshanzhiside methyl ester
1beta,5alpha,6alpha,14-tetraacetoxy-9alpha-benzoyloxy-7beta H-eudesman-2beta,11-diol
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
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??,5??,7??,8??,15??-Pentaacetoxyjatropha-6(17),11E-dien-9,14-dione
8-O-methyl retusin 7-O-beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranoside|mucodianin F
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]
Ala Met Trp Trp
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His His His Tyr
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Gln Trp Glu Met
Gln Trp Met Glu
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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
8,8-Methylenebiscatechin
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$l^{6},2-benzoxathiazocin-5-yl]methyl]-1-methylurea
2-[(2R,4aS,12aS)-8-[(3,4-difluorophenyl)carbamoylamino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-(4-propan-2-ylphenyl)acetamide
(1R)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-(3-methylphenyl)sulfonyl-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
(1S)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-(3-methylphenyl)sulfonyl-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
4-fluoro-N-[[(4S,5R)-2-[(2S)-1-hydroxypropan-2-yl]-8-(2-methoxyphenyl)-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$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
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].
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
13-(acetyloxy)-7-(2,5-dihydroxy-4,5-dihydrofuran-3-yl)-1,8,12,17,17-pentamethyl-5,15-dioxo-3,6,16-trioxapentacyclo[9.9.0.0²,⁴.0²,⁸.0¹²,¹⁸]icosan-20-yl acetate
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
[(1s,2r,3e,7s,8e,10s,13r)-2,9,10,13-tetrakis(acetyloxy)-7-hydroxy-8,12,15,15-tetramethyl-5-oxobicyclo[9.3.1]pentadeca-3,8,11-trien-4-yl]methyl acetate
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
(1s,2s,3as,5s,11s,13s,13ar)-1,3a,11,13-tetrakis(acetyloxy)-2,5,8,8-tetramethyl-12-methylidene-4,9-dioxo-1h,3h,5h,10h,11h,13h,13ah-cyclopenta[12]annulen-2-yl acetate
(3as,5ar,6r,9r,9as,9bs)-5a-methyl-3-methylidene-2-oxo-9-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-octahydro-3ah-naphtho[1,2-b]furan-6-yl (2r)-2-hydroxy-3-(4-hydroxyphenyl)propanoate
methyl 1-(acetyloxy)-1-methyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2,3,3a,6,7,7a-hexahydroindene-4-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
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-{[(12r)-4-hydroxy-2-oxatricyclo[13.2.2.1³,⁷]icosa-1(17),3(20),4,6,15,18-hexaen-12-yl]oxy}oxane-3,4,5-triol
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
[2,9,10,13-tetrakis(acetyloxy)-7-hydroxy-8,12,15,15-tetramethyl-5-oxobicyclo[9.3.1]pentadeca-3,8,11-trien-4-yl]methyl acetate
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
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"}
1,6-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"}
aceroside iii
{"Ingredient_id": "HBIN014384","Ingredient_name": "aceroside iii","Alias": "NA","Ingredient_formula": "C30H40O12","Ingredient_Smile": "C1CCC2=CC(=C(C=C2)O)OC3=CC=C(CCC(C1)OC4C(C(C(C(O4)COC5C(C(CO5)(CO)O)O)O)O)O)C=C3","Ingredient_weight": "592.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "105","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "21637602","DrugBank_id": "NA"}