Exact Mass: 446.1212912
Exact Mass Matches: 446.1212912
Found 500 metabolites which its exact mass value is equals to given mass value 446.1212912,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Swertisin
Swertisin is a flavone C-glycoside that is 7-O-methylapigenin in which the hydrogen at position 6 has been replaced by a beta-D-glucosyl residue. It has a role as a plant metabolite, an adenosine A1 receptor antagonist, an anti-inflammatory agent, an antioxidant and a hypoglycemic agent. It is a flavone C-glycoside, a monosaccharide derivative, a polyphenol, a monomethoxyflavone and a dihydroxyflavone. It is functionally related to an apigenin. Swertisin is a natural product found in Carex fraseriana, Gentiana orbicularis, and other organisms with data available. A flavone C-glycoside that is 7-O-methylapigenin in which the hydrogen at position 6 has been replaced by a beta-D-glucosyl residue. Swertisin, a C-glucosylflavone isolated from Iris tectorum, is known to have antidiabetic, anti-inflammatory and antioxidant effects. Swertisin is an adenosine A1 receptor antagonist[1][2].
Paederoside
Paederoside is a glycoside. Paederoside is a natural product found in Pseudomegoura nipponica, Paederia scandens, and other organisms with data available. Paederoside is a monoterpene S-methyl thiocarbonate isolated from Paederia pertomentosa. Paederoside shows a high anti-tumor promoting activity against the Epstein-Barr virus activation[1]. Paederoside is a monoterpene S-methyl thiocarbonate isolated from Paederia pertomentosa. Paederoside shows a high anti-tumor promoting activity against the Epstein-Barr virus activation[1].
Glucoobtusifolin
Obtusifolin 2-glucoside is an anthraquinone. Obtusifolin 2-glucoside is a natural product found in Senna obtusifolia and Senna tora with data available. Glucoobtusifolin is found in coffee and coffee products. Glucoobtusifolin is isolated from seeds of Cassia tora (charota
Glycitin
Glycitin is an isoflavone glycoside present in human diets containing soy. The transformation of glycitin by intestinal microflora produces glycitein, a compound found to scavenge intracellular reactive oxygen species. Diverse bacteria strains from human origin have specific activity (beta-glucosidase activity) in the metabolism of dietary flavonoids. Soy isoflavones are popular supplements based on their potential protection against cancer and their use as alternative hormone replacement therapy. Is one of the isoflavones present in ready-to-feed soy-based infant formula. (PMID: 17516245, 17157426, 17439230, 12607743). Present in soya foods; potential nutriceutical. Glycitin is found in many foods, some of which are soy milk, tofu, miso, and soy sauce. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens Glycitin is a natural isoflavone isolated from legumes; promotes the proliferation of bone marrow stromal cells and osteoblasts and suppresses bone turnover.Glycitin is antibacterial, antiviral and estrogenic. Glycitin is a natural isoflavone isolated from legumes; promotes the proliferation of bone marrow stromal cells and osteoblasts and suppresses bone turnover.Glycitin is antibacterial, antiviral and estrogenic.
Baicalin
Baicalin is a flavone, a type of flavonoid. It is found in several species in the genus Scutellaria, including Scutellaria lateriflora (blue skullcap). There are 10 mg/g baicalin in Scutellaria galericulata (common skullcap) leaves. Baicalin is the glucuronide of baicalein. It is a component of Chinese medicinal herb Huang-chin (Scutellaria baicalensis) and one of the chemical ingredients of Sho-Saiko-To, an herbal supplement. Acquisition and generation of the data is financially supported in part by CREST/JST. D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D000890 - Anti-Infective Agents D018501 - Antirheumatic Agents D004791 - Enzyme Inhibitors Baicalin, as a flavonoid glycoside, is an allosteric carnitine palmityl transferase 1 (CPT1) activator. Baicalin reduces the expression of NF-κB[1][2][3]. Baicalin, as a flavonoid glycoside, is an allosteric carnitine palmityl transferase 1 (CPT1) activator. Baicalin reduces the expression of NF-κB[1][2][3].
Sissotrin
Sissotrin is found in chickpea. Sissotrin is a constituent of Cicer arietinum (chickpea). Constituent of Cicer arietinum (chickpea). Biochanin A 7-glucoside is found in chickpea. Acquisition and generation of the data is financially supported in part by CREST/JST.
(-)-maackiain-3-O-glucoside
(-)-maackiain-3-o-glucoside, also known as trifolrhizin, is a member of the class of compounds known as pterocarpans. Pterocarpans are benzo-pyrano-furano-benzene compounds, containing the 6H-[1]benzofuro[3,2-c]chromene skeleton. They are derivatives of isoflavonoids (-)-maackiain-3-o-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). (-)-maackiain-3-o-glucoside can be found in a number of food items such as pepper (c. pubescens), loquat, nopal, and kiwi, which makes (-)-maackiain-3-o-glucoside a potential biomarker for the consumption of these food products. Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2]. Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2].
cephamycin C
One of three naturally occurring cephamycin antibiotics, differing from the A and B forms in its carbamoyloxymethyl substituent at C-3. 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 > D002513 - Cephamycins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
Physcion 8-glucoside
Physcion 8-glucoside is an anthraquinone. Physcion 8-glucoside is a natural product found in Rheum palmatum, Rheum australe, and Senna obtusifolia with data available.
Febantel
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Apigenin
Apigenin 7-glucuronide is a member of flavonoids and a glucosiduronic acid. Apigenin 7-glucuronide is a natural product found in Galeopsis tetrahit, Galeopsis ladanum, and other organisms with data available. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively.
Glucorhein
Glucorhein is found in green vegetables. Glucorhein is isolated from Rheum palmatum (Chinese rhubarb). Isolated from Rheum palmatum (Chinese rhubarb). Glucorhein is found in green vegetables. Rhein 8-Glucoside (Rhein 8-O-β-D-Glucopyranoside) is an anthraquinone glycoside that has been found in rhubarb. Purgative activity[1]. Rhein 8-Glucoside (Rhein 8-O-β-D-Glucopyranoside) is an anthraquinone glycoside that has been found in rhubarb. Purgative activity[1].
Rheochrysin
Rheochrysin is an anthraquinone. Rheochrysin is a natural product found in Selaginella delicatula, Rheum australe, and other organisms with data available. Rheochrysin is found in green vegetables. Rheochrysin occurs in root of Rheum sp Occurs in root of Rheum subspecies Rheochrysin is found in green vegetables. Physcion 8-O-β-D-glucopyranosideis an anthraquinone compound isolated from Rumex japonicus Houtt. Physcion 8-O-β-D-glucopyranoside exerts anti-inflammatory and anti-cancer properties, can be for common malignancy cancer research[1].
Trifolirhizin
Maackiain O-beta-D-galactopyranoside is found in herbs and spices. Maackiain O-beta-D-galactopyranoside is isolated from Trifolium pratense (red clover). Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2]. Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2].
Apigenin 7-glucuronide
Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively.
Calycosin 7-galactoside
Calycosin 7-galactoside is found in herbs and spices. Calycosin 7-galactoside is isolated from Trifolium pratense (red clover). Isolated from Trifolium pratense (red clover). Calycosin 7-galactoside is found in tea, herbs and spices, and pulses.
5,7-dihydroxy-2-(4-methoxyphenyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-one
Osmanthuside A
Osmanthuside C is found in herbs and spices. Osmanthuside C is isolated from Osmanthus fragrans (sweet osmanthus). Isolated from Osmanthus fragrans (sweet osmanthus). Osmanthuside C is found in herbs and spices.
6-{[2-(3,4-dihydroxyphenyl)-4-oxo-4H-chromen-7-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylic acid
Prunitrin
Prunitrin is found in herbs and spices. Prunitrin is isolated from Trifolium pratense (red clover). Isolated from Trifolium pratense (red clover). Prunitrin is found in tea and herbs and spices. Prunetrin (Trifoside) is a soflavonoid found in above-ground and below-ground organs of red clover[1].
Kaempferide 3-rhamnoside
Kaempferide 3-rhamnoside is found in alcoholic beverages. Kaempferide 3-rhamnoside is a constituent of the aerial parts of Agrimonia eupatoria (agrimony). Constituent of the aerial parts of Agrimonia eupatoria (agrimony). Kaempferide 3-rhamnoside is found in tea and alcoholic beverages.
2-(4-hydroxy-3-methoxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one
6-[(5,7-dihydroxy-4-oxo-2-phenyl-4H-chromen-6-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Mollicellin E
C22H19ClO8 (446.07684040000004)
Mollicellin E is produced by Chaetomium species and mutagenic mycotoxin. Production by Chaetomium subspecies and mutagenic mycotoxin.
5-hydroxy-2-(4-hydroxyphenyl)-7-methoxy-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4H-chromen-4-one
Lucuminic acid
C19H26O12 (446.14241960000004)
Lucuminic acid is found in fruits. Lucuminic acid is a constituent of Calocarpum sapota (marmalade plum) Constituent of Calocarpum sapota (marmalade plum). Lucuminic acid is found in fruits.
6-[4-(5,7-dihydroxy-4-oxo-4H-chromen-2-yl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
Genistein 7-O-glucuronide
Genistein 7-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
3,6,7-Trihydroxy-4'-methoxyflavone 7-rhamnoside
3,6,7-Trihydroxy-4-methoxyflavone 7-rhamnoside is found in cereals and cereal products. 3,6,7-Trihydroxy-4-methoxyflavone 7-rhamnoside is a constituent of the leaves of Setaria italica (Foxtail millet). Constituent of the leaves of Setaria italica (Foxtail millet). 3,6,7-Trihydroxy-4-methoxyflavone 7-rhamnoside is found in cereals and cereal products.
Gefitinib
C22H24ClFN4O3 (446.15208759999996)
Gefitinib (originally coded ZD1839) is a drug used in the treatment of certain types of cancer. Acting in a similar manner to erlotinib (marketed as Tarceva), gefitinib selectively targets the mutant proteins in malignant cells. It is marketed by AstraZeneca under the trade name Iressa. [Wikipedia] L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors > L01EB - Epidermal growth factor receptor (egfr) tyrosine kinase inhibitors C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163952 - EGFR-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors D000970 - Antineoplastic Agents
Physcionin
Physcionin is found in green vegetables. Physcionin is a constituent of root of Rheum species. Constituent of root of Rheum subspecies Physcionin is found in green vegetables. Physcion 8-O-β-D-glucopyranosideis an anthraquinone compound isolated from Rumex japonicus Houtt. Physcion 8-O-β-D-glucopyranoside exerts anti-inflammatory and anti-cancer properties, can be for common malignancy cancer research[1].
Genistein 4'-O-glucuronide
Genistein 4-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
Genistein 5-O-glucuronide
Genistein 5-O-glucuronide is a polyphenol metabolite detected in biological fluids (PMID: 20428313).
Apigenin 7-glucuronide
Apigenin 7-o-glucuronide 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. Apigenin 7-o-glucuronide is slightly soluble (in water) and a moderately acidic compound (based on its pKa). Apigenin 7-o-glucuronide can be found in globe artichoke, which makes apigenin 7-o-glucuronide a potential biomarker for the consumption of this food product. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively.
3 Pound feminine-Methoxy Puerarin
cephamycin C
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 > D002513 - Cephamycins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams
1-(4-Methanesulfonamidophenoxy)-3-(N-methyl-3,4-dichlorophenylethylamino)-2-propanol
D002317 - Cardiovascular Agents > D026902 - Potassium Channel Blockers D049990 - Membrane Transport Modulators
4,5-Diaminofluorescein diacetate
C24H18N2O7 (446.11139579999997)
Febantel
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Nesbuvir
C471 - Enzyme Inhibitor > C25995 - RNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
(6'-Acetyloxy-4,5-diamino-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl) acetate
C24H18N2O7 (446.11139579999997)
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-5-yl]oxyoxane-2-carboxylic acid
(2S,3S,4S,5R)-6-[4-(5,7-Dihydroxy-4-oxochromen-3-yl)phenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid
7-O-Methylapigenin 6-C-beta-D-glucopyranoside
Tilianin
Acacetin 7-glucoside
Acacetin 7-glucoside, also known as tilianin, 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-glucoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Acacetin 7-glucoside can be found in cornmint, which makes acacetin 7-glucoside a potential biomarker for the consumption of this food product. Tilianin is an active flavonoid glycoside found in many medical plants, with potential anti-hypertensive, myocardial-protective, anti-diabetic, anti-hyperlipidemic, anti-inflammatory and antioxidant effects[1][2][3]. Tilianin is an active flavonoid glycoside found in many medical plants, with potential anti-hypertensive, myocardial-protective, anti-diabetic, anti-hyperlipidemic, anti-inflammatory and antioxidant effects[1][2][3].
Monotropeoside
C19H26O12 (446.14241960000004)
Monotropeoside is a member of the class of compounds known as phenolic glycosides. Phenolic glycosides are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Monotropeoside is soluble (in water) and a very weakly acidic compound (based on its pKa). Monotropeoside can be found in bilberry, which makes monotropeoside a potential biomarker for the consumption of this food product.
Prunetinoside
Prunetinoside is a member of the class of compounds known as isoflavonoid o-glycosides. Isoflavonoid o-glycosides are o-glycosylated derivatives of isoflavonoids, which are natural products derived from 3-phenylchromen-4-one. Prunetinoside is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Prunetinoside can be found in sour cherry, which makes prunetinoside a potential biomarker for the consumption of this food product.
Physcion 8-glucoside
Physcion 8-glucoside is a member of the class of compounds known as anthraquinones. Anthraquinones are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone. Physcion 8-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Physcion 8-glucoside can be found in garden rhubarb, which makes physcion 8-glucoside a potential biomarker for the consumption of this food product.
Baicalin
Baicalin is the glycosyloxyflavone which is the 7-O-glucuronide of baicalein. It is an active ingredient of Chinese herbal medicine Scutellaria baicalensis. It has a role as a non-steroidal anti-inflammatory drug, an EC 3.4.21.26 (prolyl oligopeptidase) inhibitor, a prodrug, a plant metabolite, a ferroptosis inhibitor, a neuroprotective agent, an antineoplastic agent, a cardioprotective agent, an antiatherosclerotic agent, an antioxidant, an EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitor, an anticoronaviral agent and an antibacterial agent. It is a glucosiduronic acid, a glycosyloxyflavone, a dihydroxyflavone and a monosaccharide derivative. It is functionally related to a baicalein. It is a conjugate acid of a baicalin(1-). Baicalin is a natural product found in Scutellaria amoena, Thalictrum baicalense, and other organisms with data available. See also: Scutellaria baicalensis Root (part of). The glycosyloxyflavone which is the 7-O-glucuronide of baicalein. It is an active ingredient of Chinese herbal medicine Scutellaria baicalensis. D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D000890 - Anti-Infective Agents D018501 - Antirheumatic Agents D004791 - Enzyme Inhibitors Baicalin, as a flavonoid glycoside, is an allosteric carnitine palmityl transferase 1 (CPT1) activator. Baicalin reduces the expression of NF-κB[1][2][3]. Baicalin, as a flavonoid glycoside, is an allosteric carnitine palmityl transferase 1 (CPT1) activator. Baicalin reduces the expression of NF-κB[1][2][3].
Glycitin
Glycitin is a glycosyloxyisoflavone that is isoflavone substituted by a methoxy group at position 6, a hydroxy group at position 4 and a beta-D-glucopyranosyloxy group at position 7. It has a role as a plant metabolite. It is a methoxyisoflavone, a hydroxyisoflavone, a monosaccharide derivative and a 7-hydroxyisoflavones 7-O-beta-D-glucoside. Glycitin is a natural product found in Sorbus cuspidata, Ziziphus spina-christi, and other organisms with data available. A glycosyloxyisoflavone that is isoflavone substituted by a methoxy group at position 6, a hydroxy group at position 4 and a beta-D-glucopyranosyloxy group at position 7. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens Glycitin is a natural isoflavone isolated from legumes; promotes the proliferation of bone marrow stromal cells and osteoblasts and suppresses bone turnover.Glycitin is antibacterial, antiviral and estrogenic. Glycitin is a natural isoflavone isolated from legumes; promotes the proliferation of bone marrow stromal cells and osteoblasts and suppresses bone turnover.Glycitin is antibacterial, antiviral and estrogenic.
trifolrhizin
Trifolirhizin is a member of pterocarpans. Trifolirhizin is a natural product found in Sophora alopecuroides, Ononis arvensis, and other organisms with data available. Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2]. Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2].
Gaultherin
C19H26O12 (446.14241960000004)
Gaultherin is a glycoside. Gaultherin is a natural product found in Gaultheria procumbens, Monotropa hypopitys, and other organisms with data available. D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates Gaultherin, a natural salicylate derivative, is isolated from Gaultheria yunnanensis. Gaultherin is a non-steroidal anti-inflammatory drug (NSAID). Gaultherin has analgesic and anti-inflammatory effects and lack gastric ulcerogenic effect compared to Aspirin[1].
Daphylloside
C19H26O12 (446.14241960000004)
Daphylloside is a glycoside and an iridoid monoterpenoid. Daphylloside is a natural product found in Spermacoce alata, Escallonia myrtoidea, and other organisms with data available.
3-Methoxypuerarin
3-Methoxypuerarin is a natural product found in Pueraria montana var. lobata with data available. 3'-Methoxypuerarin (3'-MOP) is an isoflavone extracted from radix puerariae that shows neuron protection activity. 3'-Methoxypuerarin (3'-MOP) is an isoflavone extracted from radix puerariae that shows neuron protection activity.
Calycosin-7-O-β-D-glucoside
Calycosin-7-O-beta-D-glucoside is a glycosyloxyisoflavone that is calycosin substituted by a beta-D-glucopyranosyl residue at position at 7 via a glycosidic linkage. It is a hydroxyisoflavone, a monosaccharide derivative, a member of 4-methoxyisoflavones and a 7-hydroxyisoflavones 7-O-beta-D-glucoside. It is functionally related to a calycosin. Calycosin 7-O-glucoside is a natural product found in Astragalus mongholicus, Maackia amurensis, and other organisms with data available. See also: Astragalus propinquus root (part of). Calycosin-7-O-β-D-glucoside is an isoflavone isolated from Astragali Radix. Calycosin-7-O-β-D-glucoside has variety of biological activities, such as neuroprotective, cardioprotection, anti-inflammation, and antioxidative stress effects[1][2]. Calycosin-7-O-β-D-glucoside is an isoflavone isolated from Astragali Radix. Calycosin-7-O-β-D-glucoside has variety of biological activities, such as neuroprotective, cardioprotection, anti-inflammation, and antioxidative stress effects[1][2].
Tilianin
Tilianin is a natural product found in Tanacetum vulgare, Linaria kurdica, and other organisms with data available. Tilianin is an active flavonoid glycoside found in many medical plants, with potential anti-hypertensive, myocardial-protective, anti-diabetic, anti-hyperlipidemic, anti-inflammatory and antioxidant effects[1][2][3]. Tilianin is an active flavonoid glycoside found in many medical plants, with potential anti-hypertensive, myocardial-protective, anti-diabetic, anti-hyperlipidemic, anti-inflammatory and antioxidant effects[1][2][3].
4-methyloxy-Genistin
Calycosin 7-O-glucoside
Calycosin-7-O-β-D-glucoside is an isoflavone isolated from Astragali Radix. Calycosin-7-O-β-D-glucoside has variety of biological activities, such as neuroprotective, cardioprotection, anti-inflammation, and antioxidative stress effects[1][2]. Calycosin-7-O-β-D-glucoside is an isoflavone isolated from Astragali Radix. Calycosin-7-O-β-D-glucoside has variety of biological activities, such as neuroprotective, cardioprotection, anti-inflammation, and antioxidative stress effects[1][2].
5,4-Dihydroxy-7-methoxy-4-phenylcoumarin 5-O-galactoside
Norwogonin 7-glucuronide
Glychionide A is a flavonoside that can be found in the roots of Glychirriza glabra. Glychionide A promotes apoptosis and autophagy of PANC-1 pancreatic cancer cells. Glychionide A can be used for the research of cancer[1][2].
Isoswertisin
5,6-Dihydroxy-7-methoxyflavone 6-O-beta-D-glucopyranoside
Echioidinin 5-O-glucoside
Pueraria glycoside 3
3'-Methoxypuerarin (3'-MOP) is an isoflavone extracted from radix puerariae that shows neuron protection activity. 3'-Methoxypuerarin (3'-MOP) is an isoflavone extracted from radix puerariae that shows neuron protection activity.
Hispidulin 7-rhamnoside
5,8-Dihydroxy-3,7,2,3,4-pentamethoxyflavone 8-acetate
Trifolirhizin
Isolated from Trifolium pratense (red clover). Maackiain O-beta-D-galactopyranoside is found in tea and herbs and spices. relative retention time with respect to 9-anthracene Carboxylic Acid is 0.909 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.906 Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2]. Trifolirhizin is a pterocarpan flavonoid isolated from the roots of Sophora flavescens. Trifolirhizin possesses potent tyrosinase inhibitory activity with an IC50 of 506 μM[1]. Trifolirhizin exhibits potential anti-inflammatory and anticancer activities[2].
4-Methyl,2-P-[beta-D-xylopyranosyl-1-6-beta-D-glucopyranoside]-2,4-Dihydroxybenzaldehyde
C19H26O12 (446.14241960000004)
2-hydroxyformononetin beta-D-glucoside|2-hydroxyformononetin 7-O-glucoside
3-methoxy-4-[O-beta-D-apiofuranosyl-(1->6)-O-beta-D-glucopyranosyloxy]benzaldehyde|bretschneideroside A
C19H26O12 (446.14241960000004)
(E)-7-O-beta-D-glucopyranoside-5-hydroxy-3-(4-hydroxybenzylidene)chroman-4-one|4-demethyleucomin 7-O-beta-D-glucopyranoside
2H-1-Benzopyran-3,4-diol, 2-(3,4-dimethoxyphenyl)-3,4-dihydro-7,8-dimethoxy-, diacetate, [2R-(2.alpha.,3.alpha.,4.alpha.)]-
(2S,4R)-7,4-dihydroxy-6,8-dimethyl-4,2-oxidoflavan-5-O-beta-D-glucopyranoside|abacopterin F
7-(5-amino-5-carboxy-pentanoylamino)-3-carbamoyloxymethyl-7-methoxy-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-3-ene-2-carboxylic acid|Mono-Natrium-Salz
4-beta-D-Glucopyranosyloxy-5-hydroxy-9,10-dioxo-9,10-dihydro-anthracen-2-carbonsaeure|4-beta-D-glucopyranosyloxy-5-hydroxy-9,10-dioxo-9,10-dihydro-anthracene-2-carboxylic acid|4-O-beta-D-Glucopyranosyl-rhein
3-(alpha-methoxy-4-hydroxybenzylidene)-6-hydroxybenzofuran-2(3H)-one-7-C-beta-D-glucopyranoside|pteroisoauroside
9alpha,13alpha-dihydroxyisopropylidenylisatisine A
rhein-11-O-beta-D-glucoside|Rhein-acyl-beta-D-glucopyranosid
6-O-trans-p-coumaroyl-(4-hydroxybenzoyl)-beta-D-glucopyranoside
erythritol-1-O-(6-O-trans-caffeoyl)-beta-D-glucopyranoside
C19H26O12 (446.14241960000004)
Hexa-Ac-4-C-Methyl-myo-C-Methylinositol
C19H26O12 (446.14241960000004)
3,4-dihydroxy-6-methoxyflavone-7-O-alpha-L-rhamnopyranoside
8-Me ether,3-O-alpha-L-rhamnopyranoside-1,3,5,8-Tetrahydroxy-2-methylanthraquinone
benzoyl beta-D-glucopyranosyl-(1->6)-beta-D-glucopyranoside
C19H26O12 (446.14241960000004)
3,3,4,5,5,8-hexamethoxy-6,7-methylenedioxyflavone|Di-Me ether-3,5-Dihydroxy-3,4,5,8-tetramethoxy-6,7-methylenedioxyflavone
(1R*,3S*,4S*,5R*,8S*,9S*,12R*,13S*,14S*)-8,14-dibromo-5,9-dimethyl-13-(1-methylethyl)tetracyclo[10.2.1.0(3,12).0(4,9)]pentadecan-5-ol|(3S*)-3-bromo-1-deoxybromotetrasphaerol
6-methoxy-7-hydroxy-4-O-beta-D-glucosylisoflavone|glycitein 4-O-beta-D-glucoside|glycitein 4-O-beta-glucoside|glycitein-4-O-beta-D-glucoside
7,4-dihydroxy-5-methoxyflavone-6-C-beta-D-glucopyranoside
nepodin-8-O-beta-D-(60-O-trans-crotonoyl)glucopyranoside|rumexneposide A
cinnacasolide A|methyl 3-hydoxybenzoyl-3-O-beta-D-apiofuranosyl-(1->6)-beta-D-glucopyranoside
C19H26O12 (446.14241960000004)
dichotomine I|methyl 1-acetyl-8-(beta-D-glucopyranosyloxy)-9H-beta-carboline-3-carboxylate
C21H22N2O9 (446.13252420000003)
7-O-beta-glucopyranosyl demethoxymatteucinol|demethoxymatteucinol-7-O-beta-D-glucopyranoside|demethoxymatteuocinol 7-O-glucopyranoside
5,6,6-Trimethoxy-4,10-dihydroxy-11,12-dimethyl-4,5-(epoxymethanoxy)-2,2-butanobiphenyl-3-carboxylic acid
7-beta-D-glucopyranosyloxymethyl-9-methoxy-5H-dibenzo[a,c][7]annulene-3,10-diol|subavenoside C
7-methyl-luteolin 8-C-beta-(6-deoxyxylo-3-uloside)
1-(3,5-Dimethoxy-4-hydroxyphenyl)-6,8-dimethoxy-7-hydroxy-1,2-dihydronaphthalene-2,3-dicarboxylic acid
5-Me ether,8-O-alpha-L-rhamnopyranoside-1,3,5,8-Tetrahydroxy-2-methylanthraquinone
p-hydroxybenzoyl-beta-D-rutinoside
C19H26O12 (446.14241960000004)
1,3,9-trihydroxycoumestan-1-O-beta-glucopyranoside|hedysarimcoumestan C
(-)-15-methoxypodorhizol|(-)-5-methoxypodorhizol|5-Methoxypodorhizol
apigenin 7-O-glucuronide|Scutellarein-7-O-beta-D-Glucuronid (Scutellarin)
betabeta-Pyranose-benzyl glycoside-3-O-beta-D-Glucopyranuronosyl-D-galactose
C19H26O12 (446.14241960000004)
(1R,2R)-1-(3-methoxy-4,5-methylenedioxyphenyl)-2-methyl-3-oxobutyl 3,4,5-trimethoxybenzoate|tsangin B
3-(beta-D-glucopyranosyloxy)-7-hydroxy-4-methoxyisoflavone|3-[3-(beta-D-glucopyranosyloxy)-4-methoxyphenyl]-7-hydroxy-1H-1-benzopyran-4-one|caragiside B
4-Me ether-3-Glucopyranosyl-4,5,7-trihydroxyflavone
O-beta-D-Galactopyranosyl-(1->4)-O-beta-D-galactopyranosyl-(1->2)-L-erythritol
5,7-dihydroxy-2-(3,4-dihydroxyphenyl)-3-O-alpha-rhamnosyl-4H-1-benzopyran-4-one
4-O-(6-O-p-hydroxybenzoyl-beta-D-glucopyranosyl)-cis-p-coumaric acid
3-hydroxy-5,7-dimethoxyflavone 4-O-beta-D-apiofuranoside
(1S,2R)-2-methyl-3-oxo-1-(3,4,5-trimethoxyphenyl)butyl 3-methoxy-4,5-methylenedioxybenzoate|tsangin A
7-Me ether-8-Glucopyranosyl-4,5,7,-trihydroxyflavanone
3?-Methoxy-5?-hydroxy isoflavone-7-O-beta-D-glucoside
prunitrin
Prunetin 4-O-glucoside is a glycosyloxyisoflavone that is the 4-O-beta-D-glucoside of prunetin. It is a hydroxyisoflavone, a glycosyloxyisoflavone and a member of 7-methoxyisoflavones. It is functionally related to a prunetin. Prunetin 4-O-glucoside is a natural product found in Dalbergia sissoo, Styphnolobium japonicum, and other organisms with data available. Prunetrin (Trifoside) is a soflavonoid found in above-ground and below-ground organs of red clover[1].
Glychionide A
Glychionide A is a natural product found in Glycyrrhiza glabra with data available. See also: Glycyrrhiza Glabra (part of). Glychionide A is a flavonoside that can be found in the roots of Glychirriza glabra. Glychionide A promotes apoptosis and autophagy of PANC-1 pancreatic cancer cells. Glychionide A can be used for the research of cancer[1][2].
sissotrin
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.909 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.907 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.906
2-[2-(4-Methyl-2-oxo-2H-chromen-7-yloxy)-acetyl]-1,2,3,4-tetrahydro-beta-carbolin-3-ylcarboxylic acid methyl ester
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid
(2S,3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
5-hydroxy-8-methoxy-2-phenyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
3-(4-hydroxyphenyl)-7-methoxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
4-(3-acetyl-2,6-dihydroxyphenyl)-2-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid
C19H26O12 (446.14241960000004)
3-(4-hydroxyphenyl)-5-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
N-(7,8-dimethoxy-2-oxochromen-3-yl)-4a,5,8-trihydroxy-N-methyl-4,5,8,8a-tetrahydro-1,2-benzoxazine-3-carboxamide
C21H22N2O9 (446.13252420000003)
Apigenin 7-O-glucuronide
Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively.
C19H26O12_4-Acetyl-2-hydroxyphenyl 2-O-beta-D-fructofuranosyl-beta-D-xylopyranoside
C19H26O12 (446.14241960000004)
C19H26O12_beta-D-Fructofuranosyl 6-O-benzoyl-alpha-D-glucopyranoside
C19H26O12 (446.14241960000004)
C19H26O12_Methyl 2-{[6-O-(beta-D-xylopyranosyl)-beta-D-glucopyranosyl]oxy}benzoate
C19H26O12 (446.14241960000004)
C19H26O12_Cyclopenta[c]pyran-4-carboxylic acid, 7-[(acetyloxy)methyl]-1-(beta-D-glucopyranosyloxy)-1,4a,5,7a-tetrahydro-5-hydroxy-, methyl ester, (1S,4aS,5S,7aS)
C19H26O12 (446.14241960000004)
Paederoside
Paederoside is a monoterpene S-methyl thiocarbonate isolated from Paederia pertomentosa. Paederoside shows a high anti-tumor promoting activity against the Epstein-Barr virus activation[1]. Paederoside is a monoterpene S-methyl thiocarbonate isolated from Paederia pertomentosa. Paederoside shows a high anti-tumor promoting activity against the Epstein-Barr virus activation[1].
7-O-beta-glucopyranosyl-4-hydroxy-5-methoxyisoflavone
3-(4-hydroxyphenyl)-7-methoxy-5-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Trichodermamide C
C21H22N2O9 (446.13252420000003)
CONFIDENCE isolated standard
4-(3-acetyl-2,6-dihydroxyphenyl)-2-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid [IIN-based: Match]
C19H26O12 (446.14241960000004)
N-(7,8-dimethoxy-2-oxochromen-3-yl)-4a,5,8-trihydroxy-N-methyl-4,5,8,8a-tetrahydro-1,2-benzoxazine-3-carboxamide [IIN-based: Match]
C21H22N2O9 (446.13252420000003)
N-(7,8-dimethoxy-2-oxochromen-3-yl)-4a,5,8-trihydroxy-N-methyl-4,5,8,8a-tetrahydro-1,2-benzoxazine-3-carboxamide [IIN-based on: CCMSLIB00000848485]
C21H22N2O9 (446.13252420000003)
1,2-Bis(p-(2-hydroxyethoxycarbonyl)benzoyloxy)ethane
The sample was injected by direct infusion.; This record was created by the financial support of MEXT/JSPS KAKENHI Grant Number 19HP8024 to the Mass Spectrometry Society of Japan.
Cys Gly His Met
Cys Gly Met His
Cys His Gly Met
Cys His Met Gly
Cys His Ser Thr
C16H26N6O7S (446.15836060000004)
Cys His Thr Ser
C16H26N6O7S (446.15836060000004)
Cys Met Gly His
Cys Met His Gly
Cys Met Pro Pro
Cys Asn Asn Pro
C16H26N6O7S (446.15836060000004)
Cys Asn Pro Asn
C16H26N6O7S (446.15836060000004)
Cys Pro Met Pro
Cys Pro Asn Asn
C16H26N6O7S (446.15836060000004)
Cys Pro Pro Met
Cys Ser His Thr
C16H26N6O7S (446.15836060000004)
Cys Ser Thr His
C16H26N6O7S (446.15836060000004)
Cys Thr His Ser
C16H26N6O7S (446.15836060000004)
Cys Thr Ser His
C16H26N6O7S (446.15836060000004)
Asp Asp Pro Thr
C17H26N4O10 (446.16488560000005)
Asp Asp Thr Pro
C17H26N4O10 (446.16488560000005)
Asp Glu Pro Ser
C17H26N4O10 (446.16488560000005)
Asp Glu Ser Pro
C17H26N4O10 (446.16488560000005)
Asp Pro Asp Thr
C17H26N4O10 (446.16488560000005)
Asp Pro Glu Ser
C17H26N4O10 (446.16488560000005)
Asp Pro Ser Glu
C17H26N4O10 (446.16488560000005)
Asp Pro Thr Asp
C17H26N4O10 (446.16488560000005)
Asp Ser Glu Pro
C17H26N4O10 (446.16488560000005)
Asp Ser Pro Glu
C17H26N4O10 (446.16488560000005)
Asp Thr Asp Pro
C17H26N4O10 (446.16488560000005)
Asp Thr Pro Asp
C17H26N4O10 (446.16488560000005)
Glu Asp Pro Ser
C17H26N4O10 (446.16488560000005)
Glu Asp Ser Pro
C17H26N4O10 (446.16488560000005)
Glu Pro Asp Ser
C17H26N4O10 (446.16488560000005)
Glu Pro Ser Asp
C17H26N4O10 (446.16488560000005)
Glu Ser Asp Pro
C17H26N4O10 (446.16488560000005)
Glu Ser Pro Asp
C17H26N4O10 (446.16488560000005)
Gly Cys His Met
Gly Cys Met His
Gly His Cys Met
Gly His Met Cys
Gly Met Cys His
Gly Met His Cys
His Cys Gly Met
His Cys Met Gly
His Cys Ser Thr
C16H26N6O7S (446.15836060000004)
His Cys Thr Ser
C16H26N6O7S (446.15836060000004)
His Gly Cys Met
His Gly Met Cys
His Met Cys Gly
His Met Gly Cys
His Ser Cys Thr
C16H26N6O7S (446.15836060000004)
His Ser Thr Cys
C16H26N6O7S (446.15836060000004)
His Thr Cys Ser
C16H26N6O7S (446.15836060000004)
His Thr Ser Cys
C16H26N6O7S (446.15836060000004)
Met Cys Gly His
Met Cys His Gly
Met Cys Pro Pro
Met Gly Cys His
Met Gly His Cys
Met His Cys Gly
Met His Gly Cys
Met Pro Cys Pro
Met Pro Pro Cys
Asn Cys Asn Pro
C16H26N6O7S (446.15836060000004)
Asn Cys Pro Asn
C16H26N6O7S (446.15836060000004)
Asn Asn Cys Pro
C16H26N6O7S (446.15836060000004)
Asn Asn Pro Cys
C16H26N6O7S (446.15836060000004)
Asn Pro Cys Asn
C16H26N6O7S (446.15836060000004)
Asn Pro Asn Cys
C16H26N6O7S (446.15836060000004)
Pro Cys Met Pro
Pro Cys Asn Asn
C16H26N6O7S (446.15836060000004)
Pro Cys Pro Met
Pro Asp Asp Thr
C17H26N4O10 (446.16488560000005)
Pro Asp Glu Ser
C17H26N4O10 (446.16488560000005)
Pro Asp Ser Glu
C17H26N4O10 (446.16488560000005)
Pro Asp Thr Asp
C17H26N4O10 (446.16488560000005)
Pro Glu Asp Ser
C17H26N4O10 (446.16488560000005)
Pro Glu Ser Asp
C17H26N4O10 (446.16488560000005)
Pro Met Cys Pro
Pro Met Pro Cys
Pro Asn Cys Asn
C16H26N6O7S (446.15836060000004)
Pro Asn Asn Cys
C16H26N6O7S (446.15836060000004)
Pro Pro Cys Met
Pro Pro Met Cys
Pro Ser Asp Glu
C17H26N4O10 (446.16488560000005)
Pro Ser Glu Asp
C17H26N4O10 (446.16488560000005)
Pro Thr Asp Asp
C17H26N4O10 (446.16488560000005)
Ser Cys His Thr
C16H26N6O7S (446.15836060000004)
Ser Cys Thr His
C16H26N6O7S (446.15836060000004)
Ser Asp Glu Pro
C17H26N4O10 (446.16488560000005)
Ser Asp Pro Glu
C17H26N4O10 (446.16488560000005)
Ser Glu Asp Pro
C17H26N4O10 (446.16488560000005)
Ser Glu Pro Asp
C17H26N4O10 (446.16488560000005)
Ser His Cys Thr
C16H26N6O7S (446.15836060000004)
Ser His Thr Cys
C16H26N6O7S (446.15836060000004)
Ser Pro Asp Glu
C17H26N4O10 (446.16488560000005)
Ser Pro Glu Asp
C17H26N4O10 (446.16488560000005)
Ser Thr Cys His
C16H26N6O7S (446.15836060000004)
Ser Thr His Cys
C16H26N6O7S (446.15836060000004)
Thr Cys His Ser
C16H26N6O7S (446.15836060000004)
Thr Cys Ser His
C16H26N6O7S (446.15836060000004)
Thr Asp Asp Pro
C17H26N4O10 (446.16488560000005)
Thr Asp Pro Asp
C17H26N4O10 (446.16488560000005)
Thr His Cys Ser
C16H26N6O7S (446.15836060000004)
Thr His Ser Cys
C16H26N6O7S (446.15836060000004)
Thr Pro Asp Asp
C17H26N4O10 (446.16488560000005)
Thr Ser Cys His
C16H26N6O7S (446.15836060000004)
Thr Ser His Cys
C16H26N6O7S (446.15836060000004)
2-ETHOXYCARBONYL-5,7-DIHYDROXY-8,3,4,5-TETRAMETHOXYISOFLAVONE
Gefitinib
C22H24ClFN4O3 (446.15208759999996)
L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents > L01E - Protein kinase inhibitors > L01EB - Epidermal growth factor receptor (egfr) tyrosine kinase inhibitors C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163952 - EGFR-targeting Agent C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors D000970 - Antineoplastic Agents
Apigenin 7-glucuronide
Apigenin 7-glucuronide 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. Apigenin 7-glucuronide is slightly soluble (in water) and a moderately acidic compound (based on its pKa). Apigenin 7-glucuronide can be found in common sage and dill, which makes apigenin 7-glucuronide a potential biomarker for the consumption of these food products. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively. Apigenin-7-glucuronide could inhibit Matrix Metalloproteinases (MMP) activities, with IC50s of 12.87, 22.39, 17.52, 0.27 μM for MMP-3, MMP-8, MMP-9, MMP-13, respectively.
DAF-2 diacetate
C24H18N2O7 (446.11139579999997)
Glucorein
Rhein 8-Glucoside (Rhein 8-O-β-D-Glucopyranoside) is an anthraquinone glycoside that has been found in rhubarb. Purgative activity[1]. Rhein 8-Glucoside (Rhein 8-O-β-D-Glucopyranoside) is an anthraquinone glycoside that has been found in rhubarb. Purgative activity[1].
Mollicellin E
C22H19ClO8 (446.07684040000004)
A member of the class of depsidones that is 11H-dibenzo[b,e][1,4]dioxepine substituted by a chloro group at position 2, hydroxy groups at positions 3 and 9, a methoxy group at position 8, methyl groups at positions 1 and 6, a 3-methylbut-2-enoyl group at position 7, an oxo group at position 11 and a formyl group at position 4. Isolated from Chaetomium brasiliense, it exhibits antimalarial and cytotoxic activities.
Lucuminic acid
C19H26O12 (446.14241960000004)
Osmanthuside A
Calycosin 7-galactoside
Physcionin
Physcion 8-O-β-D-glucopyranosideis an anthraquinone compound isolated from Rumex japonicus Houtt. Physcion 8-O-β-D-glucopyranoside exerts anti-inflammatory and anti-cancer properties, can be for common malignancy cancer research[1].
Genistein 4'-O-glucuronide
Genistein 5-O-glucuronide
Genistein 7-O-glucuronide
1,3,5-TRI-O-BENZOYL-2-DEOXY-2-FLUORO-α-D-ARABINOFURANOSE
Phosphonium,[[4-(methoxycarbonyl)phenyl]methyl]triphenyl-, chloride (1:1)
1-N,4-N-bis(3-chlorophenyl)-3,6-diethyl-1,2,4,5-tetrazine-1,4-dicarboxamide
3-(2-oxy-ethyl)-2-[3-(3-(2-oxy-ethyl)-2-benzothiazolinylidene)-2-methyl-1-propenyl)] benzothiazolium chloride
hydroxyzine hydrochloride
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist D003879 - Dermatologic Agents > D000982 - Antipruritics Hydroxyzine dihydrochloride, a benzodiazepine antihistamine agent, acts as a orally active histamine?H1-receptor and serotonin antagonist. Hydroxyzine dihydrochloride has anxiolytic effect and can be used forthe research of generalised anxiety disorder[1][2].
2-[4-(4-Chlorobenzoyl)phenoxy]-2-methylpropanoic acid 1,1-dimethyl-2-(1-methylethoxy)-2-oxoethyl ester
C24H27ClO6 (446.14960720000005)
ethyl 1-(2,4-difluorophenyl)-6-fluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylate
C22H21F3N4O3 (446.15656720000004)
ethyl 1-(2,4-difluorophenyl)-6-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-1,8-naphthyridine-3-carboxylate
C22H21F3N4O3 (446.15656720000004)
3-ETHYL-5-[(E,2E)-1-PHENYL-4-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-INDOL-2-YLIDENE)-2-BUTENYLIDENE]-2-THIOXO-1,3-THIAZOLIDIN-4-ONE
6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
tributyl-[5-(1,3-dioxolan-2-yl)thiophen-2-yl]stannane
methyl-2-deoxy-3,5-di-o-p-nitrobenzoyl-d-ribofuranoside
C20H18N2O10 (446.09614079999994)
Cloprostenol Sodium
C22H28ClNaO6 (446.14720180000006)
D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D012102 - Reproductive Control Agents > D008186 - Luteolytic Agents
2-(2-methylpropoxy)ethyl 2-(2-cyanoethylamino)-5-[(5-nitro-1,3-thiazol-2-yl)diazenyl]benzoate
benzene-1,3-dicarboxylic acid,furan-2,5-dione,2-(2-hydroxyethoxy)ethanol,propane-1,2-diol
C19H26O12 (446.14241960000004)
GW791343
GW791343 dihydrochloride is a potent human P2X7 receptor negative allosteric modulator (exhibits species-specific activity), produces a non-competitive antagonist effect on human P2X7 receptor, with a pIC50 of 6.9-7.2. GW791343 dihydrochloride can enhance ATP rhythm. GW791343 dihydrochloride can be used in study of neurological disease[1][2].
3-Deschloro-4-Desfluoro-4-Chloro-3-Fluoro Gefitinib
C22H24ClFN4O3 (446.15208759999996)
POLYPHENYL ETHER (5 RINGS) OS-124, STAT. PHASE FOR GC
N-[4-[(7-Chloro-2,3,4,5-tetrahydro-5-oxo-1H-1-benzazepin-1-yl)carbonyl]-3-methylphenyl]-2-methylbenzamide
Phosphonium,[(2-methylphenyl)methyl]triphenyl-, bromide
Brilanestrant
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
Fluclorolone
C21H25Cl2FO5 (446.10629919999997)
D - Dermatologicals > D07 - Corticosteroids, dermatological preparations > D07A - Corticosteroids, plain > D07AC - Corticosteroids, potent (group iii)
Solabegron Hydrochloride
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists
Acacetin-7-O-beta-D-galactopyranoside
A glycosyloxyflavone that is the 7-O-beta-D-galactopyranosyl derivative of acacetin. It is isolated from the flowering heads of Chrysanthemum morifolium and has been found to possess potent anti-HIV activity.
N-(7,8-Dimethoxy-2-oxochromen-3-YL)-4A,5,8-trihydroxy-N-methyl-4,5,8,8A-tetrahydro-1,2-benzoxazine-3-carboxamide
C21H22N2O9 (446.13252420000003)
(S)-2-Chloro-N-(1-(2-(2-Hydroxyethylamino)-2-Oxoethyl)-2-Oxo-1,2,3,4-Tetrahydroquinolin-3-Yl)-6h-Thieno[2,3-B]pyrrole-5-Carboxamide
C20H19ClN4O4S (446.0815484000001)
Nesbuvir
C471 - Enzyme Inhibitor > C25995 - RNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
Rheochrysin
Physcion 8-O-β-D-glucopyranosideis an anthraquinone compound isolated from Rumex japonicus Houtt. Physcion 8-O-β-D-glucopyranoside exerts anti-inflammatory and anti-cancer properties, can be for common malignancy cancer research[1].
4,5-dihydroxy-9,10-dioxo-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid
120163-18-0
methyl 4-[5-[(1,3-dioxoisoindol-2-yl)methyl]uran-2-yl]-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
3,4,5-Trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxane-2-carboxylic acid
3-(4-Hydroxyphenyl)-7-methoxy-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
3-(4-hydroxyphenyl)-5-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
(2S)-2-[[4-[[(6S)-2,4-dioxo-5,6,7,8-tetrahydro-1H-pteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid
2-[2-[[(2S)-2-azaniumyl-2-carboxylatoethyl]amino]-2-oxoethyl]-4-[2-[(4-carboxylato-4-oxobutanoyl)amino]ethylamino]-2-hydroxy-4-oxobutanoate
C16H22N4O11-2 (446.12850219999996)
4,5-Diaminofluorescein diacetate
C24H18N2O7 (446.11139579999997)
D004396 - Coloring Agents > D005456 - Fluorescent Dyes > D005452 - Fluoresceins D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-[7-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-5-yl]oxyoxane-2-carboxylic acid
4-Hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-7-(4-hydroxyphenyl)-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-11-one
2-[2-[4-[(4-Chlorophenyl)-phenylmethyl]piperazin-1-yl]ethoxy]ethanol;hydron;dichloride
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D003879 - Dermatologic Agents > D000982 - Antipruritics
6-[3-(cyclopropylmethoxy)-4-(difluoromethoxy)phenyl]-3-(2-fluorophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
3-L-valyl-AMP
An L-valyl ester obtained by formal condensation of the carboxy group of L-valine with the 3-hydroxy group of AMP.
4-chloro-N-(1-propyl-2-benzimidazolyl)-3-(1-pyrrolidinylsulfonyl)benzamide
C21H23ClN4O3S (446.11793180000006)
2-[4-[(E)-3-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]prop-2-enoyl]phenoxy]acetic acid
1-methylsulfonyl-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)-2,3-dihydroindole-5-sulfonamide
5-(3,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
4-[2-Nitro-5-[4-(phenylmethyl)sulfonyl-1-piperazinyl]phenyl]morpholine
C21H26N4O5S (446.16238260000006)
1-[4-[4-[[1-(4-Chlorophenyl)sulfonylcyclopropyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone
C22H23ClN2O4S (446.10669880000006)
2-[3-(3,4-Dimethoxyphenyl)-2,4-dioxo-1-quinazolinyl]acetic acid (phenylmethyl) ester
2-[(4-Chloro-3-nitrophenyl)-oxomethyl]benzoic acid [2-[di(propan-2-yl)amino]-2-oxoethyl] ester
ethyl 6-amino-5-cyano-2-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylmethyl]-4-phenyl-4H-pyran-3-carboxylate
C24H22N4O3S (446.14125420000005)
N-[5-[2-(2,5-dimethoxyanilino)-4-thiazolyl]-4-methyl-2-thiazolyl]-2-methylpentanamide
5-[(2-{[(3S)-5-{[(2S)-2-azaniumyl-2-carboxylatoethyl]amino}-3-carboxylato-3-hydroxy-5-oxopentanoyl]amino}ethyl)amino]-2,5-dioxopentanoate
C16H22N4O11-2 (446.12850219999996)
[(Z)-[Amino-(4-nitrophenyl)methylidene]amino] 1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carboxylate
C19H18N4O7S (446.08961580000005)
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N-[(1E)-1-(4-methylphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
[(1S,2aR,8bR)-1-(hydroxymethyl)-4-[(3-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-fluorophenyl)methanone
[(1R,2aR,8bR)-1-(hydroxymethyl)-4-[(3-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-fluorophenyl)methanone
(2R)-2-[(4S,5S)-8-[2-(2-fluorophenyl)ethynyl]-4-methyl-5-(methylaminomethyl)-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-2-yl]-1-propanol
C23H27FN2O4S (446.16754740000005)
2-[(1S,3S,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
2-[(1S,3R,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
2-[(1S,3S,4aR,9aS)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
[(1R,2aS,8bS)-1-(hydroxymethyl)-4-[(3-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-fluorophenyl)methanone
[(1S,2aS,8bS)-1-(hydroxymethyl)-4-[(3-methoxyphenyl)-oxomethyl]-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-2-yl]-(4-fluorophenyl)methanone
2-[(1R,3R,4aR,9aS)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
2-[(1R,3S,4aR,9aS)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
2-[(1R,3R,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
2-[(1R,3S,4aS,9aR)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
2-[(1S,3R,4aR,9aS)-6-(benzenesulfonamido)-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]-N,N-dimethylacetamide
C22H26N2O6S (446.15114960000005)
7,8-dimethoxy-2-phenyl-5-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy-2,3-dihydrochromen-4-one
6-[(2S,3S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-oxooxan-2-yl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
methyl (3R)-2-{[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-2,3,4,9-tetrahydro-1H-beta-carboline-3-carboxylate
(3S,4S,5R,6S)-6-(5,6-dihydroxy-4-oxo-2-phenylchromen-7-yl)oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
4-(3-Acetyl-2,6-dihydroxyphenyl)-2-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid
C19H26O12 (446.14241960000004)
[2-Hydroxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropyl] heptanoate
[1-Acetyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] butanoate
[3-[Hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-2-propanoyloxypropyl] propanoate
gluco-obtusifolin
Obtusifolin 2-glucoside is an anthraquinone. Obtusifolin 2-glucoside is a natural product found in Senna obtusifolia and Senna tora with data available.
1-(4-Methanesulfonamidophenoxy)-3-(N-methyl-3,4-dichlorophenylethylamino)-2-propanol
D002317 - Cardiovascular Agents > D026902 - Potassium Channel Blockers D049990 - Membrane Transport Modulators
staphyloferrin B(2-)
C16H22N4O11 (446.12850219999996)
A tricarboxylic acid dianion obtained by deprotonation of the three carboxy groups and protonation of the amino group of staphyloferrin B; major species at pH 7.3.
Biochanin a 7-O-beta-D-glucoside
A glycosyloxyisoflavone that is biochanin A attached to a beta-D-glucopyranosyl residue at position 7 via glycosidic linkage.
OGT-IN-2
C23H27ClN2O3S (446.1430822000001)
OGT-IN-2 (compound 4) is a potent O-GlcNAc transferase (OGT) inhibitor, with IC50 values of 30 and 53 μM for sOGT and ncOGT, respectively[1].