Exact Mass: 462.09174640000003
Exact Mass Matches: 462.09174640000003
Found 500 metabolites which its exact mass value is equals to given mass value 462.09174640000003,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Homoplantaginin
C22H22O11 (462.11620619999997)
Homoplantaginin is a glycoside and a member of flavonoids. Homoplantaginin is a natural product found in Scoparia dulcis, Eriocaulon buergerianum, and other organisms with data available. Homoplantaginin is a flavonoid from a traditional Chinese medicine Salvia plebeia with antiinflammatory and antioxidant properties. Homoplantaginin could inhibit TNF-α and IL-6 mRNA expression, IKKβ and NF-κB phosphorylation. Homoplantaginin is a flavonoid from a traditional Chinese medicine Salvia plebeia with antiinflammatory and antioxidant properties. Homoplantaginin could inhibit TNF-α and IL-6 mRNA expression, IKKβ and NF-κB phosphorylation.
Luteolin 7-glucuronide
Luteolin 7-glucuronide, also known as cyanidenon-7-O-B-D-glucuronate or luteolin 7-O-beta-D-glucuronopyranoside, is a member of the class of compounds known as flavonoid-7-o-glucuronides. Flavonoid-7-o-glucuronides are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid at the C7-position. Luteolin 7-glucuronide is slightly soluble (in water) and a moderately acidic compound (based on its pKa). Luteolin 7-glucuronide can be found in a number of food items such as globe artichoke, wild carrot, carrot, and lettuce, which makes luteolin 7-glucuronide a potential biomarker for the consumption of these food products. Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively. Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively.
Swertiajaponin
C22H22O11 (462.11620619999997)
Swertiajaponin is a natural product found in Carex fraseriana, Alliaria petiolata, and other organisms with data available. Swertiajaponin is found in green vegetables. Swertiajaponin is a constituent of leaves of Gnetum gnemon (bago)
Isoscoparin
C22H22O11 (462.11620619999997)
Isoscoparin is a C-glycosyl compound that consists of chrysoeriol substituted by a 1,5-anhydro-D-glucitol moiety at position 6. It has a role as a metabolite. It is a trihydroxyflavone, a monomethoxyflavone, a monosaccharide derivative and a C-glycosyl compound. It is functionally related to a 4,5,7-trihydroxy-3-methoxyflavone. It is a conjugate acid of an isoscoparin-7-olate. Isoscoparin is a natural product found in Gentiana orbicularis, Gentianopsis barbata, and other organisms with data available.
Cefamandole
Cefamandole is only found in individuals that have used or taken this drug. It is a broad-spectrum cephalosporin antibiotic. The clinically used form of cefamandole is the formate ester cefamandole nafate, a prodrug which is administered parenterally. Cefamandole is no longer available in the United States.Like all beta-lactam antibiotics, cefamandole binds to specific penicillin-binding proteins (PBPs) located inside the bacterial cell wall, causing the inhibition of the third and last stage of bacterial cell wall synthesis. Cell lysis is then mediated by bacterial cell wall autolytic enzymes such as autolysins; it is possible that cefamandole interferes with an autolysin inhibitor. J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DC - Second-generation cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
Shekanin
C22H22O11 (462.11620619999997)
Tectoridin is a isoflavone isolated from Maackia amurensis. Tectoridin is a phytoestrogen and activates estrogen and thyroid hormone receptors. Tectoridin exerts the estrogenic effects via ER-dependent genomic pathway and GPR30-dependent nongenomic pathway[1][2]. Tectoridin is a isoflavone isolated from Maackia amurensis. Tectoridin is a phytoestrogen and activates estrogen and thyroid hormone receptors. Tectoridin exerts the estrogenic effects via ER-dependent genomic pathway and GPR30-dependent nongenomic pathway[1][2].
Rimonabant
Rimonabant is an anorectic anti-obesity drug produced and marketed by Sanofi-Aventis. It is an inverse agonist for the cannabinoid receptor CB1. Its main avenue of effect is reduction in appetite. Rimonabant is the first selective CB1 receptor blocker to be approved for use anywhere in the world. Rimonabant is approved in 38 countries including the E.U., Mexico, and Brazil. It was rejected for approval for use in the United States. This decision was made after a U.S. advisory panel recommended the medicine not be approved because it may increase suicidal thinking and depression. A - Alimentary tract and metabolism > A08 - Antiobesity preparations, excl. diet products > A08A - Antiobesity preparations, excl. diet products D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D063385 - Cannabinoid Receptor Modulators D018377 - Neurotransmitter Agents > D063385 - Cannabinoid Receptor Modulators > D063387 - Cannabinoid Receptor Antagonists C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D019440 - Anti-Obesity Agents Same as: D05731
Luteolin
Luteolin 7-O-beta-D-glucosiduronic acid is a luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 7-position. It has a role as a metabolite. It is a trihydroxyflavone, a glycosyloxyflavone, a monosaccharide derivative and a luteolin O-glucuronoside. It is a conjugate acid of a luteolin 7-O-beta-D-glucosiduronate and a luteolin 7-O-beta-D-glucosiduronate(2-). Luteolin 7-glucuronide is a natural product found in Galeopsis tetrahit, Galeopsis ladanum, and other organisms with data available. A luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 7-position. Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively. Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively.
6-Cinnamoyl-1-galloylglucose
C22H22O11 (462.11620619999997)
6-Cinnamoyl-1-galloylglucose is found in green vegetables. 6-Cinnamoyl-1-galloylglucose is isolated from commercial rhubarb (Rheum species). Isolated from commercial rhubarb (Rheum subspecies). 6-Cinnamoyl-1-galloylglucose is found in green vegetables.
Kaempferol 3-glucuronide
Isolated from the leaves of Euphorbia lathyris, Euphorbia cyparissias, Anemone alpina and Phaseolus vulgaris (kidney bean) and many other plants [CCD]. Kaempferol 3-glucuronide is found in many foods, some of which are dill, fennel, strawberry, and green bean. Kaempferol 3-glucuronide is found in chicory. Kaempferol 3-glucuronide is isolated from the leaves of Euphorbia lathyris, Euphorbia cyparissias, Anemone alpina and Phaseolus vulgaris (kidney bean) and many other plants [CCD Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2]. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2].
Luteolin 7-glucuronide
Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively. Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively.
Diosmetin 7-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
Isolated from Galium subspecies, Chrysanthemum species and Cassia species [CCD]. Diosmetin 7-glucoside is found in cornmint, spearmint, and sweet marjoram. Diosmetin 7-O-beta-D-glucopyranoside is isolated from Galium species, Chrysanthemum sp. and Cassia sp. [CCD]. Diosmetin-7-O-β-D-glucopyranoside is a natural product isolated from the flowers of Chrysanthemum morifolium, with antioxidant activity[1][2]. Diosmetin-7-O-β-D-glucopyranoside is a natural product isolated from the flowers of Chrysanthemum morifolium, with antioxidant activity[1][2].
Scoparin
C22H22O11 (462.11620619999997)
6-[4-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
6-{[6,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
Tricin arabinoside
C22H22O11 (462.11620619999997)
Tricin arabinoside is found in cereals and cereal products. Tricin arabinoside is a constituent of the leaves of Setaria italica (foxtail millet). Constituent of the leaves of Setaria italica (foxtail millet). Tricin arabinoside is found in cereals and cereal products.
2-Cinnamoyl-1-galloyl-beta-D-glucopyranose
C22H22O11 (462.11620619999997)
2-Cinnamoyl-1-galloyl-beta-D-glucopyranose is found in garden rhubarb. 2-Cinnamoyl-1-galloyl-beta-D-glucopyranose is isolated from commercial rhubarbs (Rheum species). Isolated from commercial rhubarbs (Rheum subspecies). 2-Cinnamoyl-1-galloyl-beta-D-glucopyranose is found in green vegetables and garden rhubarb.
Kaempferide 7-glucoside
C22H22O11 (462.11620619999997)
Kaempferide 7-glucoside is found in fruits. Kaempferide 7-glucoside is isolated from wood of Prunus mume (Japanese apricot). Isolated from wood of Prunus mume (Japanese apricot). Kaempferide 7-glucoside is found in herbs and spices and fruits.
Pratensein 3'-glucoside
C22H22O11 (462.11620619999997)
Pratensein 3-glucoside is found in nuts. Pratensein 3-glucoside is a constituent of the skins of peanuts, Arachis hypogaea. Constituent of the skins of peanuts, Arachis hypogaea. Pratensein 3-glucoside is found in nuts.
6-{[2-(3,4-dihydroxyphenyl)-7-hydroxy-4-oxo-4H-chromen-5-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
6-beta-D-Glucopyranosyldiosmetin
C22H22O11 (462.11620619999997)
6-beta-D-Glucopyranosyldiosmetin is found in citrus. 6-beta-D-Glucopyranosyldiosmetin is isolated from lemon peel (Citrus limon), not found in oranges. Isolated from lemon peel (Citrus limon), not found in oranges
Isoswertiajaponin
C22H22O11 (462.11620619999997)
Isoswertiajaponin is found in green vegetables. Isoswertiajaponin is isolated from Gnetum gnemon (bago). Isolated from Gnetum gnemon (bago). 7-Methoxy orientin is found in nuts and green vegetables.
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-4H-chromen-4-one
C22H22O11 (462.11620619999997)
3-Methylellagic acid 8-rhamnoside
3-Methylellagic acid 8-rhamnoside is a constituent of Eucalyptus globulus (Tasmanian blue gum). Constituent of Eucalyptus globulus (Tasmanian blue gum)
Leptosin
C22H22O11 (462.11620619999997)
Leptosin is found in fruits. Leptosin is isolated from European cranberry (Vaccinium oxycoccus) fruits. Isolated from European cranberry (Vaccinium oxycoccus) fruits. Leptosin is found in fruits.
6-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-6-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
Oxazepam glucuronide
C21H19ClN2O8 (462.08298840000003)
Oxazepam glucuronide belongs to the family of Glucuronic Acid Derivatives. These are compounds containing a glucuronic acid moeity (or a derivative), which consists of a glucose moiety with the C6 carbon oxidized to a carboxylic acid.
Luteolin 3'-glucuronide
Cefapime
Cefatrizine
2-Ethoxy-3-[4-[2-[4-(trifluoromethylsulfonyloxy)phenyl]ethoxy]phenyl]propanoic acid
C20H21F3O7S (462.09600320000004)
5-Hydroxy-3-(4-hydroxyphenyl)-6-methoxy-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
C22H22O11 (462.11620619999997)
Scutellarein 7-glucuronide
Hispiduloside
C22H22O11 (462.11620619999997)
Hispiduloside 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. Hispiduloside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Hispiduloside can be found in rosemary and sweet marjoram, which makes hispiduloside a potential biomarker for the consumption of these food products.
luteolin 3-glucuronide
Luteolin 3-O-glucuronide is a luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 3-position. It has a role as a metabolite. It is a luteolin O-glucuronoside and a trihydroxyflavone. Luteolin 3-o-glucuronide is a natural product found in Salvia, Salvia officinalis, and other organisms with data available. See also: Rosemary (part of). A luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 3-position. Luteolin-3-O-beta-D-glucuronide is a luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 3'-position. Luteolin-3-O-beta-D-glucuronide is a luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 3'-position.
Scutellarin
Scutellarin is the glycosyloxyflavone which is the 7-O-glucuronide of scutellarein. It has a role as an antineoplastic agent and a proteasome inhibitor. It is a glycosyloxyflavone, a glucosiduronic acid, a trihydroxyflavone and a monosaccharide derivative. It is functionally related to a scutellarein. It is a conjugate acid of a scutellarin(1-). Scutellarin is a natural product found in Scoparia dulcis, Sempervivum ruthenicum, and other organisms with data available. Scutellarin, an active flavone isolated from Scutellaria baicalensis, can down-regulates the STAT3/Girdin/Akt signaling in HCC cells, and inhibits RANKL-mediated MAPK and NF-κB signaling pathway in osteoclasts. Scutellarin is active against HIV-1IIIB, HIV-1(74V) and HIV-1KM018 with EC50s of 26 μM, 253 μM and 136 μM, respectively. Scutellarin, an active flavone isolated from Scutellaria baicalensis, can down-regulates the STAT3/Girdin/Akt signaling in HCC cells, and inhibits RANKL-mediated MAPK and NF-κB signaling pathway in osteoclasts. Scutellarin is active against HIV-1IIIB, HIV-1(74V) and HIV-1KM018 with EC50s of 26 μM, 253 μM and 136 μM, respectively. Scutellarin, an active flavone isolated from Scutellaria baicalensis, can down-regulates the STAT3/Girdin/Akt signaling in HCC cells, and inhibits RANKL-mediated MAPK and NF-κB signaling pathway in osteoclasts. Scutellarin is active against HIV-1IIIB, HIV-1(74V) and HIV-1KM018 with EC50s of 26 μM, 253 μM and 136 μM, respectively.
Tectoridin
C22H22O11 (462.11620619999997)
Tectoridin is a glycosyloxyisoflavone that is tectorigenin substituted by a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It has a role as a plant metabolite. It is a hydroxyisoflavone, a methoxyisoflavone, a monosaccharide derivative and a 7-hydroxyisoflavones 7-O-beta-D-glucoside. It is functionally related to a tectorigenin. Tectoridin is a natural product found in Iris milesii, Iris tectorum, and other organisms with data available. A glycosyloxyisoflavone that is tectorigenin substituted by a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. A polyphenol metabolite detected in biological fluids [PhenolExplorer] Tectoridin is a isoflavone isolated from Maackia amurensis. Tectoridin is a phytoestrogen and activates estrogen and thyroid hormone receptors. Tectoridin exerts the estrogenic effects via ER-dependent genomic pathway and GPR30-dependent nongenomic pathway[1][2]. Tectoridin is a isoflavone isolated from Maackia amurensis. Tectoridin is a phytoestrogen and activates estrogen and thyroid hormone receptors. Tectoridin exerts the estrogenic effects via ER-dependent genomic pathway and GPR30-dependent nongenomic pathway[1][2].
Eridictiol
C22H22O11 (462.11620619999997)
Diosmetin 7-O-beta-D-glucopyranoside is a glycoside and a member of flavonoids. Diosmetin 7-O-beta-D-glucopyranoside is a natural product found in Chrysanthemum indicum, Mentha spicata, and other organisms with data available. Diosmetin-7-O-β-D-glucopyranoside is a natural product isolated from the flowers of Chrysanthemum morifolium, with antioxidant activity[1][2]. Diosmetin-7-O-β-D-glucopyranoside is a natural product isolated from the flowers of Chrysanthemum morifolium, with antioxidant activity[1][2].
Thermopsoside
C22H22O11 (462.11620619999997)
Chrysoeriol 7-galactoside 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. Chrysoeriol 7-galactoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Chrysoeriol 7-galactoside can be found in barley, which makes chrysoeriol 7-galactoside a potential biomarker for the consumption of this food product.
Hispidulin 4-glucoside
C22H22O11 (462.11620619999997)
Isorhamnetin 7-rhamnoside
C22H22O11 (462.11620619999997)
Scutellarein 7-methyl ether 6-galactoside
C22H22O11 (462.11620619999997)
Luteolin 7-methyl ether 5-glucoside
C22H22O11 (462.11620619999997)
Parkinsonin A
C22H22O11 (462.11620619999997)
Azaleatin 3-rhamnoside
C22H22O11 (462.11620619999997)
5,7,8,2-Tetrahydroxyflavone 7-glucuronide
Vogelin
C22H22O11 (462.11620619999997)
5,3,4-Trihydroxy-7-methoxy-4-phenylcoumarin 5-O-glucoside
C22H22O11 (462.11620619999997)
5,2,6-Trihydroxy-7-methoxyflavone 2-O-glucoside
C22H22O11 (462.11620619999997)
Scutellarein 5-glucuronide
Dalpanitin
C22H22O11 (462.11620619999997)
3-O-Methylorobol 7-O-glucoside
C22H22O11 (462.11620619999997)
Pratensein 7-O-glucoside
C22H22O11 (462.11620619999997)
Rhamnocitrin 3-galactoside
C22H22O11 (462.11620619999997)
3-mono-O-methylellagic acid 4-O-alpha-L-rhamnopyranoside
Tamarixetin 3-rhamnoside
C22H22O11 (462.11620619999997)
6-Methoxykaempferol 3-rhamnoside
C22H22O11 (462.11620619999997)
Luteolin 3-methyl ether 4-glucoside
C22H22O11 (462.11620619999997)
Rhamnetin 3-rhamnoside
C22H22O11 (462.11620619999997)
Kaempferol 5-methyl ether 3-galactoside
C22H22O11 (462.11620619999997)
Kaempferide 3-galactoside
C22H22O11 (462.11620619999997)
Luteolin 3-methyl ether 5-glucoside
C22H22O11 (462.11620619999997)
Rhamnocitrin 5-glucoside
C22H22O11 (462.11620619999997)
Diosmetin 3-glucoside
C22H22O11 (462.11620619999997)
Isorhamnetin 3-rhamnoside
C22H22O11 (462.11620619999997)
Isotectorigenin 7-O-glucoside
C22H22O11 (462.11620619999997)
Kaempferol 7-methyl ether 4-glucoside
C22H22O11 (462.11620619999997)
Keyakinin
C22H22O11 (462.11620619999997)
Luteolin 5-methyl ether 7-glucoside
C22H22O11 (462.11620619999997)
Quercetin 3-methyl ether 7-rhamnoside
C22H22O11 (462.11620619999997)
6-C-Methylkaempferol 3-glucoside
C22H22O11 (462.11620619999997)
8-C-beta-D-Glucopyranosyldiosmetin
C22H22O11 (462.11620619999997)
Takakin 8-O-beta-D-glucoside
C22H22O11 (462.11620619999997)
5,7,2-Trihydroxy-6-methoxyflavone 7-O-glucoside
C22H22O11 (462.11620619999997)
Luteorin 5-methyl ether 3-glucoside
C22H22O11 (462.11620619999997)
Tricin 4-apioside
C22H22O11 (462.11620619999997)
5,3,4-Trihydroxy-7-methoxyisoflavone 3-O-glucoside
C22H22O11 (462.11620619999997)
Ombuin 3-arabinofuranoside
C22H22O11 (462.11620619999997)
Kaempferol 5-glucuronide
3-O-Methylellagic acid 3-O-alpha-L-rhamnopyranoside
Luteolin-3-O-glucuronide
Luteolin-3-O-beta-D-glucuronide is a luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 3'-position. Luteolin-3-O-beta-D-glucuronide is a luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 3'-position.
Isoscoparin
C22H22O11 (462.11620619999997)
Isoscoparin is a C-glycosyl compound that consists of chrysoeriol substituted by a 1,5-anhydro-D-glucitol moiety at position 6. It has a role as a metabolite. It is a trihydroxyflavone, a monomethoxyflavone, a monosaccharide derivative and a C-glycosyl compound. It is functionally related to a 4,5,7-trihydroxy-3-methoxyflavone. It is a conjugate acid of an isoscoparin-7-olate. Isoscoparin is a natural product found in Gentiana orbicularis, Gentianopsis barbata, and other organisms with data available. A C-glycosyl compound that consists of chrysoeriol substituted by a 1,5-anhydro-D-glucitol moiety at position 6.
Scutellarein 7-methyl ether 6-glucoside
C22H22O11 (462.11620619999997)
Isokaempferide 7-glucoside
C22H22O11 (462.11620619999997)
Rhamnocitrin 3-glucoside
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one is a natural product found in Tamarix aphylla, Wikstroemia canescens, and other organisms with data available.
5,3,4-Trihydroxy-7-methoxy-4-phenylcoumarin 5-O-galactoside
C22H22O11 (462.11620619999997)
6-C-beta-D-Glucopyranosyldiosmetin
C22H22O11 (462.11620619999997)
Leucanthoside
C22H22O11 (462.11620619999997)
Scoparin
C22H22O11 (462.11620619999997)
Isoswertiajaponin
C22H22O11 (462.11620619999997)
Kaempferol 3-glucuronide
Acquisition and generation of the data is financially supported in part by CREST/JST. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2]. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2].
Leptosin
C22H22O11 (462.11620619999997)
Mumenin
C22H22O11 (462.11620619999997)
Setaricin
C22H22O11 (462.11620619999997)
5,8-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
C22H22O11 (462.11620619999997)
4-O-methylellagic acid 3-alpha-rhamnoside|4-O-Methylellagic acid 3-??-rhamnoside
5,4-Dihydroxy-7-methoxy-8-beta-D-glucopyranosyloxyflavone
C22H22O11 (462.11620619999997)
acacetin 6-C-beta-D-glucopyranoside|isocytisoside
C22H22O11 (462.11620619999997)
5-Me ether,2-O-beta-D-glucopyranoside-1,2,4,5-Tetrahydroxy-3-methylanthraquinone
C22H22O11 (462.11620619999997)
5,7,2-trihydroxy-8-methoxyflavone 2-O-beta-D-glucopyranoside|5,7,2-Trihydroxy-8-methoxyflavone 2-O-??-D-glucopyranoside
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(3,4,5-trihydroxyphenyl)-3-O-alpha-rhamnosyl-4H-benzopyran-4-one
C22H22O11 (462.11620619999997)
5,7,2-trihydroxy-8-methoxyflavone 7-O-beta-D-glucopyranoside|5,7,2-Trihydroxy-8-methoxyflavone 7-O-??-D-glucopyranoside|5,7,2-trihydroxy-8-methoxyflavone-7-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
kaempferol-3-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
6-demethoxy-4-methylcapillarisin-7-beta-glucoside|6-demethoxy-4-O-methylcapillarisin-7-O-beta-D-glucoside
C22H22O11 (462.11620619999997)
6-Me ether-8-Glucopyranosyl-4,5,6,7-tetrahydroxyflavone
C22H22O11 (462.11620619999997)
isorhamnetin-3-beta-glucopyranoside
C22H22O11 (462.11620619999997)
7-O-beta-D-Glucopyranoside-4,5,7-Trihydroxy-3-methoxyflavone
C22H22O11 (462.11620619999997)
Di-Ac-3鈥樎?Chloro-2鈥樎? 5-dihydroxy-3, 7, 8-trimethoxyflavone
C22H19ClO9 (462.07175540000003)
Isorhamnetin-3-??-L-rhamnofuranoside
C22H22O11 (462.11620619999997)
12R-hydroxy-bromosphaerol|12R-hydroxybromosphaerol
quercetin 3-O-(3-O-methyl-alpha-L-rhamnopyranoside)
C22H22O11 (462.11620619999997)
2,5,7-trihydroxy-6-methoxyflavone 2-O-beta-D-glucopyranoside|glutin
C22H22O11 (462.11620619999997)
1-O-(E)-cinnamoyl-4-galloyl-beta-D-glucopyranose
C22H22O11 (462.11620619999997)
tectoridin|tectorigenin-7-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
6-methoxykaempferol-3-O-beta-glucopyranoside
C22H22O11 (462.11620619999997)
isorhamnetin 5-O-alpha-L-rhamnoside
C22H22O11 (462.11620619999997)
(2R)-4,5-dihydroxyflavanone 7-O-beta-glucuronide methyl ester|prainianonide
C22H22O11 (462.11620619999997)
5,7,2-trihydroxy-4-methoxyisoflavone 7-O-beta-D-glucopyranoside|dehydroferreirin 7-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
curcucomoside A|rhamnazin 3-O-alpha-L-arabinopyranoside
C22H22O11 (462.11620619999997)
2-sinapoylpiscidic acid|cimicifugic acid J
C22H22O11 (462.11620619999997)
kaempferol 3-O-beta-D-glucuronopyranosylmethyl ester
C22H22O11 (462.11620619999997)
5?-hydroxy-4?-methoxyisoflavone-2?-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
3,4-di-O-methylellagic acid 3-O-beta-D-xylopyranoside
quercetin 3-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
8-Me ether,3-O-beta-D-glucopyranoside-1,3,5,8-Tetrahydroxy-2-methylanthraquinone
C22H22O11 (462.11620619999997)
2-hydroxymethyl-1-methoxy-3,6-dihydroxyanthraquinone 3-O-beta-glucopyranoside|putorinoside B
C22H22O11 (462.11620619999997)
3,3-di-O-methyl ellagic acid-4-O-beta-D-xylopyranoside
4-methoxyapigenin-6-C-beta-D-glucopyranoside|isocytisoside
C22H22O11 (462.11620619999997)
3,5,7,4-tetrahydroxy-6-methylflavonol-7-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
(2S)-7,2,-dihydroxy-5-methoxyflavanone 7-O-beta-D-glucuronopyranoside|(2S)-7,2-Dihydroxy-5-methoxyflavanone 7-O-??-D-glucuronopyranoside
C22H22O11 (462.11620619999997)
5,7,2,5-tetrahydroxyflavone 7-O-beta-D-glucuronopyranoside|5,7,2,5-Tetrahydroxyflavone 7-O-??-D-glucuronopyranoside
3-O-methylellagic acid 4-O-alpha-L-rhamnopyranoside
Yuanhuanin
C22H22O11 (462.11620619999997)
Yuanhuanin is a natural product found in Wikstroemia canescens and Daphne feddei with data available.
Ladanetin-6-O-β-D-glucopyranoside
C22H22O11 (462.11620619999997)
5-Hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)-4H-chromen-4-one is a natural product found in Pterogyne nitens, Dracocephalum tanguticum, and other organisms with data available.
Isoscutellarein 8-glucuronide
Isoscutellarein 8-glucuronide is a natural product found in Theobroma grandiflorum, Lavandula coronopifolia, and other organisms with data available. See also: Theobroma grandiflorum seed (part of).
Isorhamnetin 7-O-α-L-rhamnoside
C22H22O11 (462.11620619999997)
Isorhamnetin 7-O-alpha-L-rhamnoside is a natural product found in Barbarea vulgaris with data available.
Termopsoside
C22H22O11 (462.11620619999997)
Thermopsoside is a natural product found in Cleome amblyocarpa, Narthecium ossifragum, and other organisms with data available.
Kaempferol 3-O-β-D-glucuronide
Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2]. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2].
Pratensein 7-O-glucopyranoside
C22H22O11 (462.11620619999997)
Pratensein 7-O-glucopyranoside is a natural product found in Astragalus mongholicus, Ammopiptanthus mongolicus, and other organisms with data available.
2-Cinnamoyl-1-galloylglucose
C22H22O11 (462.11620619999997)
ACon1_002166
C22H22O11 (462.11620619999997)
Kaempferol-3-Glucuronide
Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2]. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2].
5,7-dihydroxy-6-methoxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-3-[4-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-methoxychromen-4-one
C22H22O11 (462.11620619999997)
5,8-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one
C22H22O11 (462.11620619999997)
6-[(6,8-dihydroxy-7-methoxy-3-methyl-1-oxo-3,4-dihydroisochromen-4-yl)oxy]-4,8-dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
C22H22O11 (462.11620619999997)
4-(3,4-dihydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one
C22H22O11 (462.11620619999997)
(2S,3S,4S,5R,6S)-6-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
(2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[(6,8-dihydroxy-7-methoxy-3-methyl-1-oxo-3,4-dihydroisochromen-4-yl)oxy]-4,8-dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
C22H22O11 (462.11620619999997)
kaempferol-3-o-glucuronide
Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2]. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2].
Kaempferol glucuronide
Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2]. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2].
Kaempferol 3-O-glucuronide
A kaempferol O-glucuronide that is kaempferol with a beta-D-glucosiduronic acid residue attached at the 3-position. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2]. Kaempferol 3-O-β-D-glucuronide (Kaempferol-3-glucuronide), one conjugated kaempferol metabolite, has anti-inflammatory effect. Kaempferol 3-O-β-D-glucuronide significantly inhibits various pro-inflammatory mediators like IL-1β, NO, PGE2, and LTB4. Kaempferol 3-O-β-D-glucuronide upregulates the secretion of anti-inflammatory cytokine IL-10[1][2].
Luteolin 7-O-glucuronide
Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively. Luteolin 7-O-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 17.63, 7.99, 11.42, 12.85, 0.03 μM for MMP-1, MMP-3, MMP-8, MMP-9, MMP-13, respectively.
C22H22O11_beta-D-Glucopyranose, 6-O-[(2E)-1-oxo-3-phenyl-2-propen-1-yl]-, 1-(3,4,5-trihydroxybenzoate)
C22H22O11 (462.11620619999997)
Cefatrizine
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DB - First-generation cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-phenylprop-2-enoyl]oxymethyl]oxan-2-yl] 3,4,5-trihydroxybenzoate
C22H22O11 (462.11620619999997)
5,7-dihydroxy-6-methoxy-2-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
C22H22O11 (462.11620619999997)
(2S,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[(6,8-dihydroxy-7-methoxy-3-methyl-1-oxo-3,4-dihydroisochromen-4-yl)oxy]-4,8-dihydroxy-7-methoxy-3-methyl-3,4-dihydroisochromen-1-one
C22H22O11 (462.11620619999997)
Flavone base + 3O, 1MeO, O-Hex
C22H22O11 (462.11620619999997)
Annotation level-3
Flavone base + 3O, 1MeO, C-Hex
C22H22O11 (462.11620619999997)
Annotation level-3
4-(3,4-dihydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one [IIN-based: Match]
C22H22O11 (462.11620619999997)
4-(3,4-dihydroxyphenyl)-7-methoxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one [IIN-based on: CCMSLIB00000847772]
C22H22O11 (462.11620619999997)
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-phenylprop-2-enoyl]oxymethyl]oxan-2-yl] 3,4,5-trihydroxybenzoate_major
C22H22O11 (462.11620619999997)
Luteolin 3-methyl ether 7-glucoside
C22H22O11 (462.11620619999997)
Luteolin 4-methyl ether 7-glucoside
C22H22O11 (462.11620619999997)
3-Methylellagic acid 8-rhamnoside
7-O-b-D-Glucopyranoside
C22H22O11 (462.11620619999997)
Diosmetin-7-O-β-D-glucopyranoside is a natural product isolated from the flowers of Chrysanthemum morifolium, with antioxidant activity[1][2]. Diosmetin-7-O-β-D-glucopyranoside is a natural product isolated from the flowers of Chrysanthemum morifolium, with antioxidant activity[1][2].
6-b-D-Glucopyranosyldiosmetin
C22H22O11 (462.11620619999997)
Pratensein 3'-glucoside
C22H22O11 (462.11620619999997)
2-Cinnamoyl-1-galloyl-beta-D-glucopyranose
C22H22O11 (462.11620619999997)
6-Cinnamoyl-1-galloylglucose
C22H22O11 (462.11620619999997)
5,8-Dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-4-oxo-4H-chromen-3-yl 6-deoxy-?-L-mannopyranoside
C22H22O11 (462.11620619999997)
di(propan-2-yl)-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane
C14H19F13Si (462.1048369999999)
2,2-dimethylpropane-1,3-diol,1,3-dioxo-2-benzofuran-5-carboxylic acid,terephthalic acid
C22H22O11 (462.11620619999997)
n-[(3-trimethoxysilyl)propyl]ethylenediamine triacetic acid trisodium salt
Eletriptan HBr
C22H27BrN2O2S (462.09765020000003)
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist Eletriptan hydrobromide (Eletriptan HBr) is a selective 5-HT1B and 5-HT1D receptor agonist with Ki of 0.92 nM and 3.14 nM, respectively.
2-(2,4-DIFLUOROPHENOXY)-5-(2-METHOXY-5-(5-METHYL-1,3,4-OXADIAZOL-2-YL)PHENYL)-6H-PYRIDO[1,2-B]PYRIDAZIN-6-ONE
5,8,4-Trihydroxy-7-methoxyflavone 8-O-glucoside
C22H22O11 (462.11620619999997)
Rintodestrant
C26H19FO5S (462.09371760000005)
C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C2116 - Selective Estrogen Receptor Down Regulator C274 - Antineoplastic Agent > C129818 - Antineoplastic Hormonal/Endocrine Agent > C481 - Antiestrogen C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist
[4-[(Z)-[3-(2-aminoethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-2-methoxyphenyl] 2,5-dimethylbenzenesulfonate
4-Chloro-6-(4-{4-[4-(methylsulfonyl)benzyl]piperazin-1-YL}-1H-pyrazol-5-YL)benzene-1,3-diol
C21H23ClN4O4S (462.11284680000006)
Rimonabant
A - Alimentary tract and metabolism > A08 - Antiobesity preparations, excl. diet products > A08A - Antiobesity preparations, excl. diet products D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D063385 - Cannabinoid Receptor Modulators D018377 - Neurotransmitter Agents > D063385 - Cannabinoid Receptor Modulators > D063387 - Cannabinoid Receptor Antagonists C78272 - Agent Affecting Nervous System > C28197 - Antianxiety Agent D019440 - Anti-Obesity Agents Same as: D05731
Breviscapin
Scutellarin, an active flavone isolated from Scutellaria baicalensis, can down-regulates the STAT3/Girdin/Akt signaling in HCC cells, and inhibits RANKL-mediated MAPK and NF-κB signaling pathway in osteoclasts. Scutellarin is active against HIV-1IIIB, HIV-1(74V) and HIV-1KM018 with EC50s of 26 μM, 253 μM and 136 μM, respectively. Scutellarin, an active flavone isolated from Scutellaria baicalensis, can down-regulates the STAT3/Girdin/Akt signaling in HCC cells, and inhibits RANKL-mediated MAPK and NF-κB signaling pathway in osteoclasts. Scutellarin is active against HIV-1IIIB, HIV-1(74V) and HIV-1KM018 with EC50s of 26 μM, 253 μM and 136 μM, respectively. Scutellarin, an active flavone isolated from Scutellaria baicalensis, can down-regulates the STAT3/Girdin/Akt signaling in HCC cells, and inhibits RANKL-mediated MAPK and NF-κB signaling pathway in osteoclasts. Scutellarin is active against HIV-1IIIB, HIV-1(74V) and HIV-1KM018 with EC50s of 26 μM, 253 μM and 136 μM, respectively.
Isorhamnetin7-O-alpha-L-rhamnoside
C22H22O11 (462.11620619999997)
4-(3,4-Dihydroxyphenyl)-5-beta-D-glucopyranosyloxy-7-methoxycoumarin
C22H22O11 (462.11620619999997)
luteolin 5-O-glucuronide
A luteolin glucosiduronic acid consisting of luteolin having a beta-D-glucosiduronic acid residue attached at the 5-position.
kaempferol 7-O-glucuronide
A kaempferol O-glucuronide that is kaempferol with a beta-D-glucosiduronic acid residue attached at the 7-position.
kaempferol 5-O-glucuronide
A kaempferol O-glucuronide that is kaempferol with a beta-D-glucosiduronic acid residue attached at the 5-position.
4,5,7-trihydroxy-3-methoxyflavone-7-O-beta-D-glucopyranoside
C22H22O11 (462.11620619999997)
A glycosyloxyflavone that is 4,5,7-trihydroxy-3-methoxyflavone attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It is isolated from the whole plant of Lepisorus contortus.
[3,4,5-trihydroxy-6-[[(Z)-3-phenylprop-2-enoyl]oxymethyl]oxan-2-yl] 3,4,5-trihydroxybenzoate
C22H22O11 (462.11620619999997)
7-(Methylthio)heptyl-glucosinolate
C15H28NO9S3- (462.09261380000004)
peonidin 3-O-beta-D-glucoside betaine
C22H22O11 (462.11620619999997)
An oxonium betaine obtained by deprotonation of the 5 position of peonidin 3-O-beta-D-glucoside. It is the major microspecies at pH 7.3.
7-(3,4-Dihydroxyphenyl)-4-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-11-one
3-(2-chlorophenyl)-6-[3-(cyclopropylmethoxy)-4-(difluoromethoxy)phenyl]-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
1-[4-[2-(4-Bromophenoxy)-1-oxoethyl]-1-piperazinyl]-2-(4-methoxyphenoxy)ethanone
N-[4-[(2,6-difluorophenyl)sulfonylamino]butyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide
C18H20F2N2O6S2 (462.07308040000004)
3-L-aspartyl-AMP
An L-aspartic acid derivative that is the ester obtained by formal condensation of the alpha-carboxy group of L-aspartic acid with the 3-hydroxy group of AMP.
N-[4-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylamino]-2-methoxyphenyl]-2-methylpropanamide
C22H27BrN2O4 (462.11540820000005)
4-methoxy-N-[2-[(4-nitrophenyl)methylthio]-4-oxo-3-quinazolinyl]benzamide
2-[(2,3,4-Trifluorophenyl)sulfonylamino]acetic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester
6-[1-oxo-2-[[4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]ethyl]-4H-1,4-benzoxazin-3-one
C23H18N4O3S2 (462.08202779999993)
peonidin 3-O-beta-D-galactoside betaine
C22H22O11 (462.11620619999997)
2-acetamido-2-deoxy-3-O-(6-O-sulfonato-beta-D-glucosyl)-beta-D-galactose
C14H24NO14S- (462.09174640000003)
(2S,3S,4S,5R)-6-[(7-Chloro-2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
C21H19ClN2O8 (462.08298840000003)
(2S)-2-[[2-amino-9-[(2R,4S,5R)-4-hydroxy-5-(phosphonooxymethyl)oxolan-2-yl]purin-6-yl]amino]butanedioic acid
4,4-Bis(methylphenylchlorosilyl)[1,1-biphenyl]
C26H24Cl2Si2 (462.07935239999995)
5-hydroxy-3-[4-hydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-7-methoxychromen-4-one
C22H22O11 (462.11620619999997)
Cefamandole
J - Antiinfectives for systemic use > J01 - Antibacterials for systemic use > J01D - Other beta-lactam antibacterials > J01DC - Second-generation cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams A cephalosporin compound having (R)-mandelamido and N-methylthiotetrazole side-groups. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic
MDM2-IN-1
C23H21Cl2FN2O3 (462.09131879999995)
MDM2-IN-1 (Compound 30) is a synthetic MDM2-p53 interaction (MDM2) inhibitor and contains the trans (D-)configuration[1].
RLX-33
C24H19ClN4O4 (462.10947640000006)
RLX-33 is a potent, selective and blood-brain barrier (BBB) penetrant relaxin family peptide 3 (RXFP3) antagonist, also blocks relaxin-3-induced ERK1/2 phosphorylation, with IC50 values of 2.36 μM for RXFP3, 7.82 and 13.86 μM for ERK1 and ERK2 phosphorylation, respectively. RLX-33 can block the stimulation of food intake induced by the RXFP3-selective agonist R3/I5 in rats. RLX-33 can be used for the research of metabolic syndrome[1].
6-hydroxy-7,14-dimethoxy-13-[(3,4,5-trihydroxyoxan-2-yl)oxy]-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
(1s,3s,3's,4s,4's,6's)-3',4,9-trihydroxy-4'-(methoxycarbonyl)-6'-methyl-5,10-dioxo-3,4-dihydrospiro[naphtho[2,3-c]pyran-1,2'-oxan]-3-ylacetic acid
C22H22O11 (462.11620619999997)
14-{[(2s,3r,4r,5s)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-7-hydroxy-6,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
(1s,3s,4bs,5r,8s,8as,10as)-8-bromo-10a-(bromomethyl)-1-isopropyl-5,8a-dimethyl-2,3,4b,6,7,8,9,10-octahydro-1h-phenanthrene-3,5-diol
5,7-dihydroxy-6-methoxy-2-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)chromen-4-one
C22H22O11 (462.11620619999997)
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-3-{[(2s,3r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(2r,3s,4r,5r,6s)-4,5-dihydroxy-2-(hydroxymethyl)-6-{[(2e)-3-phenylprop-2-enoyl]oxy}oxan-3-yl 3,4,5-trihydroxybenzoate
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]chromen-4-one
C22H22O11 (462.11620619999997)
7-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(2s,3s,4s,5r,6s)-3,4,5-trihydroxy-6-{[(2s)-2-(2-hydroxyphenyl)-5-methoxy-4-oxo-2,3-dihydro-1-benzopyran-7-yl]oxy}oxane-2-carboxylic acid
C22H22O11 (462.11620619999997)
6-[5-(5,7-dihydroxy-4-oxochromen-2-yl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]methoxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-7-methyl-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)chromen-4-one
C22H22O11 (462.11620619999997)
(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(3-phenylprop-2-enoyl)oxy]oxan-2-yl 3,4,5-trihydroxybenzoate
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methyl-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
3-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
C22H22O11 (462.11620619999997)
4-(3,4-dihydroxyphenyl)-7-methoxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-2-one
C22H22O11 (462.11620619999997)
(2s,3s,4s,5r,6s)-6-{[5,8-dihydroxy-2-(2-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
7-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[(2s,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-5-one
C22H22O11 (462.11620619999997)
2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl 3,4,5,6-tetrahydroxyoxane-2-carboxylate
2-(3,4-dihydroxyphenyl)-5-hydroxy-7-methoxy-3-{[(2s,3s,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-3-{[(2s,3r,4r,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(1r,3s,4'as,5's,7'r,8's,8'as)-3,5'-dibromo-2,2,4'a,8'-tetramethyl-6-methylidene-hexahydro-1'h-spiro[cyclohexane-1,2'-naphthalene]-7',8'-diol
5-hydroxy-3-(4-hydroxyphenyl)-8-methoxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
7,13-dihydroxy-6-methoxy-14-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-8-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(1s,3s,4s,4as,4bs,8s,8as,10as)-1-bromo-8a-(bromomethyl)-8-isopropyl-4,10a-dimethyl-2,3,4a,4b,7,8,9,10-octahydro-1h-phenanthrene-3,4-diol
5,7-dihydroxy-2-(4-methoxyphenyl)-3-{[(3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
2-(3,5-dimethoxy-4-oxidophenyl)-5,7-dihydroxy-3-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-1λ⁴-chromen-1-ylium
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3-{[(2s,3s,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-3-methoxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
2-bromo-4-[(4e)-5-(5-bromo-2,6,6-trimethyloxan-2-yl)penta-2,4-dien-2-yl]-1-methylcyclohexan-1-ol
(2r,3s)-2-[(3,4-dihydroxyphenyl)methyl]-3-{[3-(3,4-dimethoxyphenyl)prop-2-enoyl]oxy}-2-hydroxybutanedioic acid
C22H22O11 (462.11620619999997)
6-hydroxy-7,14-dimethoxy-13-{[(2r,3r,4r,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
3,5,7-trihydroxy-6-methoxy-2-(4-{[(2s,3s,4r,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)chromen-4-one
C22H22O11 (462.11620619999997)
4,12-bis(but-2-en-2-yl)-5,13-dichloro-14-hydroxy-6-methoxy-7,15-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one
2-bromo-4-[(3e)-4-(3-bromo-2,2-dimethyl-6-methylidenecyclohexyl)-2-hydroxybut-3-en-2-yl]-1-methylcyclohexan-1-ol
3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]chromen-4-one
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-[(2s,3s,4r,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
C22H22O11 (462.11620619999997)
1,4-dihydroxy-2-methoxy-3-methyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}anthracene-9,10-dione
C22H22O11 (462.11620619999997)
7-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-8-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(1s,3s)-3,5'-dibromo-2,2,4'a,8'-tetramethyl-6-methylidene-hexahydro-1'h-spiro[cyclohexane-1,2'-naphthalene]-7',8'-diol
13-hydroxy-6,14-dimethoxy-7-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
4,5-dihydroxy-2-(hydroxymethyl)-6-[(3-phenylprop-2-enoyl)oxy]oxan-3-yl 3,4,5-trihydroxybenzoate
C22H22O11 (462.11620619999997)
6-hydroxy-2-(hydroxymethyl)-1-methoxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}anthracene-9,10-dione
C22H22O11 (462.11620619999997)
6-hydroxy-7,14-dimethoxy-13-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
14-{[(2r,3s,4r,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-7-hydroxy-6,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
1,2,4,5-tetrahydroxy-3-methylanthraquinone; 5-me ether,2-o-beta-d-glucopyranoside
C22H22O11 (462.11620619999997)
{"Ingredient_id": "HBIN000628","Ingredient_name": "1,2,4,5-tetrahydroxy-3-methylanthraquinone; 5-me ether,2-o-beta-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C22H22O11","Ingredient_Smile": "NA","Ingredient_weight": "0","OB_score": "NA","CAS_id": "106428-34-6","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9608","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-7,2'-dihydroxy-5-methoxyflavanone7-o-β-d-glucuronopyranoside
C22H22O11 (462.11620619999997)
{"Ingredient_id": "HBIN006781","Ingredient_name": "(2s)-7,2'-dihydroxy-5-methoxyflavanone7-o-\u03b2-d-glucuronopyranoside","Alias": "NA","Ingredient_formula": "C22H22O11","Ingredient_Smile": "COC1=C2C(=O)CC(OC2=CC(=C1)OC3C(C(C(C(O3)C(=O)O)O)O)O)C4=CC=CC=C4O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5979","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-o-β-d-glucopyranosyl-5,9,4'-trihydroxy-8-methoxyflavone
C22H22O11 (462.11620619999997)
{"Ingredient_id": "HBIN009213","Ingredient_name": "3-o-\u03b2-d-glucopyranosyl-5,9,4'-trihydroxy-8-methoxyflavone","Alias": "NA","Ingredient_formula": "C22H22O11","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15635","TCMID_id": "8743","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-o-methylellagicacid3'-o-α-l-rhamnopyranoside
{"Ingredient_id": "HBIN009348","Ingredient_name": "3-o-methylellagicacid3'-o-\u03b1-l-rhamnopyranoside","Alias": "NA","Ingredient_formula": "C21H18O12","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14336","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-o-methylellagic acid 3'-o-alpha-rhamnopyranoside
{"Ingredient_id": "HBIN009349","Ingredient_name": "3-o-methylellagic acid 3'-o-alpha-rhamnopyranoside","Alias": "NA","Ingredient_formula": "C21H18O12","Ingredient_Smile": "CC1C(C(C(C(O1)OC2=C(C=C3C4=C2OC(=O)C5=CC(=C(C(=C54)OC3=O)OC)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31601","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-o-methylellagicacid4-o-α-l-rhamnopyranoside
{"Ingredient_id": "HBIN009351","Ingredient_name": "3-o-methylellagicacid4-o-\u03b1-l-rhamnopyranoside","Alias": "NA","Ingredient_formula": "C21H18O12","Ingredient_Smile": "CC1C(C(C(C(O1)OC2=C(C3=C4C(=C2)C(=O)OC5=C4C(=CC(=C5OC)O)C(=O)O3)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14337","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
3-o-methylellagicacid4'-o-α-l-rhamnopyranoside
{"Ingredient_id": "HBIN009352","Ingredient_name": "3-o-methylellagicacid4'-o-\u03b1-l-rhamnopyranoside","Alias": "NA","Ingredient_formula": "C21H18O12","Ingredient_Smile": "CC1C(C(C(C(O1)OC2=C(C3=C4C(=C2)C(=O)OC5=C4C(=CC(=C5OC)O)C(=O)O3)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14338","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-o-methylellagicacid 3'-α-rhamnoside
{"Ingredient_id": "HBIN010781","Ingredient_name": "4-o-methylellagicacid 3'-\u03b1-rhamnoside","Alias": "NA","Ingredient_formula": "C21H18O12","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14339","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5,6,4'-trihydroxyflavone-7-o-beta-d-galactonic acid
{"Ingredient_id": "HBIN011088","Ingredient_name": "5,6,4'-trihydroxyflavone-7-o-beta-d-galactonic acid","Alias": "5,6,4'-trihydroxyflavone-7-o-\u03b2-d-galactonicacid","Ingredient_formula": "C21H18O12","Ingredient_Smile": "C1=CC(=CC=C1C2=CC(=O)C3=C(C(=C(C=C3O2)OC4C(C(C(C(O4)C(=O)O)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "32121;21719","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5,7,2',5'-tetrahydroxyflavone7-o-β-d-glucuronopyranoside
{"Ingredient_id": "HBIN011165","Ingredient_name": "5,7,2',5'-tetrahydroxyflavone7-o-\u03b2-d-glucuronopyranoside","Alias": "NA","Ingredient_formula": "C21H18O12","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21099","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5,7,4'- trihydroxy- 6-methoxyflavone
C22H22O11 (462.11620619999997)
{"Ingredient_id": "HBIN011227","Ingredient_name": "5,7,4'- trihydroxy- 6-methoxyflavone","Alias": "NA","Ingredient_formula": "C22H22O11","Ingredient_Smile": "COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O)C4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "41530","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7α-l-rhamnosyl-6-methoxyluteolin
C22H22O11 (462.11620619999997)
{"Ingredient_id": "HBIN013047","Ingredient_name": "7\u03b1-l-rhamnosyl-6-methoxyluteolin","Alias": "NA","Ingredient_formula": "C22H22O11","Ingredient_Smile": "CC1C(C(C(C(O1)OC2=C(C(=C3C(=C2)OC(=CC3=O)C4=CC(=C(C=C4)O)O)O)OC)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18728","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(10r)-1,8,10-trihydroxy-3-methyl-9-oxo-10-[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-methoxyphenyl)-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(1r,3ar,5s,6ar)-6-bromo-5-{1-[(1r,3r,4s)-3-bromo-4-hydroxy-4-methylcyclohexyl]ethenyl}-1,4,4-trimethyl-hexahydropentalen-1-ol
2-(3,4-dihydroxyphenyl)-5-hydroxy-3-methoxy-7-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-6-methoxy-7-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(2s,3s,4s,5r,6s)-6-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-6-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
2'-(3,4-dihydroxyphenyl)-6'-[2-(3,4-dihydroxyphenyl)ethenyl]-5-methyl-2'h-spiro[furan-2,3'-furo[3,2-c]pyran]-3,4'-dione
5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
methyl 3,4,5-trihydroxy-6-{[5-hydroxy-2-(2-hydroxyphenyl)-4-oxo-2,3-dihydro-1-benzopyran-7-yl]oxy}oxane-2-carboxylate
C22H22O11 (462.11620619999997)
3-[(3,4-dihydroxy-5-methoxy-6-methyloxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
C22H22O11 (462.11620619999997)
2-(3,4-dihydroxyphenyl)-7-hydroxy-5-methoxy-8-[(2r,3r,4s,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
C22H22O11 (462.11620619999997)
6-{[5,8-dihydroxy-2-(2-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
(2s,3s,4s,5r)-6-{[2-(3,4-dihydroxyphenyl)-7-hydroxy-4-oxochromen-5-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
(6r,7r)-7-{[(2r)-1,2-dihydroxy-2-phenylethylidene]amino}-3-{[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]methyl}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-{[(2r,3r,4s,5r,6r)-3,4,5,6-tetrahydroxyoxan-2-yl]methoxy}chromen-4-one
C22H22O11 (462.11620619999997)
3,4,5-trihydroxy-6-{[2-(2-hydroxyphenyl)-5-methoxy-4-oxo-2,3-dihydro-1-benzopyran-7-yl]oxy}oxane-2-carboxylic acid
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-8-methoxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(2-hydroxyphenyl)-6-methoxy-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-methoxyphenyl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-8-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-8-yl 3,4,5,6-tetrahydroxyoxane-2-carboxylate
3,5,7-trihydroxy-2-(3-methoxy-4-{[(3s,5r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}phenyl)chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
6,13-dihydroxy-7-methoxy-14-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
6,7-dihydroxy-14-methoxy-13-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
5-hydroxy-2-(4-methoxyphenoxy)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5,7-dihydroxy-6-methoxy-3-(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-7-{[(2s,3s,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(2-hydroxy-6-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-7-methoxychromen-4-one
C22H22O11 (462.11620619999997)
{8,11-dihydroxy-2-[2-methyl-3-(prop-1-en-1-yl)oxiran-2-yl]-4,7,12-trioxo-1-oxatetraphen-5-yl}acetic acid
5,7-dihydroxy-3-(4-hydroxy-3-methoxyphenyl)-8-[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-methoxyphenoxy)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(2-hydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-7-methoxychromen-4-one
C22H22O11 (462.11620619999997)
6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
(1s,3ar,5s,6s,6ar)-6-bromo-5-{1-[(1r,3r,4s)-3-bromo-4-hydroxy-4-methylcyclohexyl]ethenyl}-1,4,4-trimethyl-hexahydropentalen-1-ol
5-hydroxy-7-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2-(3,4,5-trihydroxyphenyl)chromen-4-one
C22H22O11 (462.11620619999997)
(2s,3s,4s,5r,6s)-6-{[5,6-dihydroxy-2-(2-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
5-hydroxy-2-(2-hydroxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-7-methoxychromen-4-one
C22H22O11 (462.11620619999997)
(1s,3ar,5s,6ar)-6-bromo-5-{1-[(1r,3r,4s)-3-bromo-4-hydroxy-4-methylcyclohexyl]ethenyl}-1,4,4-trimethyl-hexahydropentalen-1-ol
3-[4,5-dihydroxy-2-(6-methyl-4-oxopyran-2-yl)phenyl]-6-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxypyran-2-one
(2r,11r)-7,15,26-trihydroxyheptacyclo[19.7.1.0²,¹¹.0²,²⁰.0³,⁸.0¹⁴,¹⁹.0²⁵,²⁹]nonacosa-1(29),3,5,7,14,16,18,20,22,25,27-undecaene-9,13,24-trione
5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3-[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one
C22H22O11 (462.11620619999997)
[(1s,7s,9s,10s,16r,18r,19r)-1,3,10,14,19-pentahydroxy-7,18-dimethyl-5,12-dioxo-8,17-dioxapentacyclo[14.2.2.0²,¹⁵.0⁴,¹³.0⁶,¹¹]icosa-2(15),3,6(11),13-tetraen-9-yl]acetic acid
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
6,13-dihydroxy-7-methoxy-14-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
5,7-dihydroxy-8-methoxy-2-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)chromen-4-one
C22H22O11 (462.11620619999997)
2-(3,4-dihydroxyphenyl)-7-methoxy-5-{[(2s,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
13-hydroxy-6,14-dimethoxy-7-[(3,4,5-trihydroxyoxan-2-yl)oxy]-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
(1r,3ar,5s,6s,6ar)-6-bromo-5-{1-[(1s,3s,4r)-3-bromo-4-hydroxy-4-methylcyclohexyl]ethenyl}-1,4,4-trimethyl-hexahydropentalen-1-ol
7-hydroxy-6,13-dimethoxy-14-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
8-bromo-10a-(bromomethyl)-1-isopropyl-5,8a-dimethyl-2,3,4b,6,7,8,9,10-octahydro-1h-phenanthrene-3,5-diol
4,6-dichloro-9-hydroxy-3,3,17-trimethyl-2,12-dioxapentacyclo[9.8.3.1¹⁰,¹⁴.0¹,⁶.0⁸,²¹]tricosa-8(21),9,11(22),14,17-pentaene-7,20-dione
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(2s,11s)-7,15,26-trihydroxyheptacyclo[19.7.1.0²,¹¹.0²,²⁰.0³,⁸.0¹⁴,¹⁹.0²⁵,²⁹]nonacosa-1(29),3,5,7,14,16,18,20,22,25,27-undecaene-9,13,24-trione
6,14-dihydroxy-7-methoxy-13-{[(2s,3r,4r,5r,6r)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
5,7-dihydroxy-2-(4-methoxy-3-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)chromen-4-one
C22H22O11 (462.11620619999997)
6-{[5,6-dihydroxy-2-(2-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
(2r,3r,4r,5s,6s)-6-{[2-(3,4-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
14-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-7-hydroxy-6,13-dimethoxy-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]chromen-4-one
C22H22O11 (462.11620619999997)
(2r,3r,4s,5s,6r)-2-{[3-(3,4-dihydroxybenzoyl)-8-hydroxy-1h-isochromen-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
C22H22O11 (462.11620619999997)
5-hydroxy-3-(4-hydroxy-3-methoxyphenyl)-7-{[(2s,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
6,14-dihydroxy-7-methoxy-13-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
7-hydroxy-2-(4-hydroxy-3-{[(2s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-5-methoxychromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-8-methoxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxyphenyl)-3-methoxy-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-{[(2s,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
6-hydroxy-7,14-dimethoxy-13-{[(2r,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4,6,8(16),11,13-hexaene-3,10-dione
5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-{[(3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}chromen-4-one
C22H22O11 (462.11620619999997)
(2s,3s,4s,5r,6s)-6-{[2-(2,5-dihydroxyphenyl)-5-hydroxy-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
2-bromo-4-[4-(3-bromo-2,2-dimethyl-6-methylidenecyclohexyl)-2-hydroxybut-3-en-2-yl]-1-methylcyclohexan-1-ol
(2r,3r,4r,5s,6r)-6-{[5,6-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
(2s,3s,4s,5r)-6-{[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxochromen-3-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
7-hydroxy-6,13-dimethoxy-14-[(3,4,5-trihydroxyoxan-2-yl)oxy]-2,9-dioxatetracyclo[6.6.2.0⁴,¹⁶.0¹¹,¹⁵]hexadeca-1(15),4(16),5,7,11,13-hexaene-3,10-dione
(6ar,9r,9as)-9-acetyl-5-bromo-3-[(1e,3e,5s)-3,5-dimethylhepta-1,3-dien-1-yl]-6a-methyl-1h,9h,9ah,9bh-furo[2,3-h]isochromene-6,8-dione
C23H27BrO5 (462.10417520000004)