Exact Mass: 317.9953482
Exact Mass Matches: 317.9953482
Found 184 metabolites which its exact mass value is equals to given mass value 317.9953482,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Gossypetin
Gossypetin is a hexahydroxyflavone having the hydroxy groups placed at the 3-, 3-, 4-, 5- 7- and 8-positions. It has a role as a plant metabolite. It is a 7-hydroxyflavonol and a hexahydroxyflavone. It is a conjugate acid of a gossypetin-3-olate and a gossypetin(1-). Gossypetin is a natural product found in Sedum brevifolium, Rhododendron stenophyllum, and other organisms with data available. See also: Primula veris flower (part of); Larrea tridentata whole (part of). A hexahydroxyflavone having the hydroxy groups placed at the 3-, 3-, 4-, 5- 7- and 8-positions.
Myricetin
Myricetin, also known as cannabiscetin or myricetol, belongs to the class of organic compounds known as flavonols. Flavonols are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position. Thus, myricetin is considered to be a flavonoid lipid molecule. A hexahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 3, 4, 5, 5 and 7. Myricetin is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Myricetin is found, on average, in the highest concentration within a few different foods, such as common walnuts, carobs, and fennels and in a lower concentration in welsh onions, yellow bell peppers, and jutes. Myricetin has also been detected, but not quantified in several different foods, such as napa cabbages, sesames, mixed nuts, lichee, and garden cress. Myricetin is a hexahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 3, 4, 5, 5 and 7. It has been isolated from the leaves of Myrica rubra and other plants. It has a role as a cyclooxygenase 1 inhibitor, an antineoplastic agent, an antioxidant, a plant metabolite, a food component, a hypoglycemic agent and a geroprotector. It is a hexahydroxyflavone and a 7-hydroxyflavonol. It is a conjugate acid of a myricetin(1-). Myricetin is a natural product found in Ficus auriculata, Visnea mocanera, and other organisms with data available. Myricetin is a metabolite found in or produced by Saccharomyces cerevisiae. See also: Quercetin (related). Flavanol found in a wide variety of foodstuffs especially in red table wine, bee pollen, bilberries, blueberries, bog whortleberries, broad beans, Chinese bajberry, corn poppy leaves, cranberries, crowberries, blackcurrants, dock leaves, fennel, grapes, parsley, perilla, rutabaga, dill weed and tea (green and black). Glycosides are also widely distributed. Potential nutriceutical showing anti-HIV activity A hexahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 3, 4, 5, 5 and 7. It has been isolated from the leaves of Myrica rubra and other plants. COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS [Raw Data] CB066_Myricetin_pos_30eV_CB000028.txt [Raw Data] CB066_Myricetin_pos_20eV_CB000028.txt [Raw Data] CB066_Myricetin_pos_40eV_CB000028.txt [Raw Data] CB066_Myricetin_pos_50eV_CB000028.txt [Raw Data] CB066_Myricetin_pos_10eV_CB000028.txt [Raw Data] CB066_Myricetin_neg_10eV_000019.txt [Raw Data] CB066_Myricetin_neg_40eV_000019.txt [Raw Data] CB066_Myricetin_neg_50eV_000019.txt [Raw Data] CB066_Myricetin_neg_20eV_000019.txt [Raw Data] CB066_Myricetin_neg_30eV_000019.txt Myricetin is a common plant-derived flavonoid with a wide range of activities including strong anti-oxidant, anticancer, antidiabetic and anti-inflammatory activities. Myricetin is a common plant-derived flavonoid with a wide range of activities including strong anti-oxidant, anticancer, antidiabetic and anti-inflammatory activities.
3-deoxy-D-manno-octulosonate 8-phosphate
3-deoxy-d-manno-octulosonate 8-phosphate is a member of the class of compounds known as monosaccharide phosphates. Monosaccharide phosphates are monosaccharides comprising a phosphated group linked to the carbohydrate unit. 3-deoxy-d-manno-octulosonate 8-phosphate is soluble (in water) and a moderately acidic compound (based on its pKa). 3-deoxy-d-manno-octulosonate 8-phosphate can be found in a number of food items such as green zucchini, okra, nopal, and grape, which makes 3-deoxy-d-manno-octulosonate 8-phosphate a potential biomarker for the consumption of these food products.
8-O-4'-Diferulic acid
D010575 - Pesticides > D007306 - Insecticides D016573 - Agrochemicals
quercetagetin
D004791 - Enzyme Inhibitors Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties. Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties.
Mitotane
C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C2355 - Anti-Adrenal L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents D000970 - Antineoplastic Agents
3,3',4',5,5',8-Hexahydroxyflavone
3,3,4,5,5,8-Hexahydroxyflavone is found in coffee and coffee products. 3,3,4,5,5,8-Hexahydroxyflavone is isolated from Cassia tora (charota). Isolated from Cassia tora (charota). 3,3,4,5,5,8-Hexahydroxyflavone is found in coffee and coffee products, herbs and spices, and pulses.
Mitotane
Mitotane is only found in individuals that have used or taken this drug. It is a derivative of the insecticide dichlorodiphenyldichloroethane that specifically inhibits cells of the adrenal cortex and their production of hormones. It is used to treat adrenocortical tumors and causes CNS damage, but no bone marrow depression. [PubChem]Its biochemical mechanism of action is unknown, although data are available to suggest that the drug modifies the peripheral metabolism of steroids as well as directly suppressing the adrenal cortex. C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist > C2355 - Anti-Adrenal L - Antineoplastic and immunomodulating agents > L01 - Antineoplastic agents D000970 - Antineoplastic Agents
(2R,3R,4S,5R)-2-(5,6-Dichlorobenzimidazol-1-yl)-5-(hydroxymethyl)oxolane-3,4-diol
C12H12Cl2N2O4 (318.01740920000003)
3,4',5,6,7,8-Hexahydroxyflavone
3,4,5,6,7,8-hexahydroxyflavone is a member of the class of compounds known as flavonols. Flavonols are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position. 3,4,5,6,7,8-hexahydroxyflavone is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 3,4,5,6,7,8-hexahydroxyflavone can be found in almond, which makes 3,4,5,6,7,8-hexahydroxyflavone a potential biomarker for the consumption of this food product.
(5E)-2-amino-5-[(6-bromo-1H-indol-3-yl)methylidene]-3-methylimidazol-4-one
C13H11BrN4O (318.01161759999997)
(E)-3-(8-carboxy-3,4,6-trihydroxy-5-oxo-5H-benzocyclohepten-1-yl)-2-propenoic acid|crocipodin
3-(3,3-Dichloro-2-hydroxypropyl)-6-methoxy-8-hydroxy-1H-2-benzopyran-1-one
3,4,6,8-Tetrahydroxy-9-oxo-9H-xanthene-1-carboxylic acid methyl ester
1-Methyl-2-amino-5-(6-bromo-1H-indole-3-ylmethylene)-2-imidazoline-4-one
C13H11BrN4O (318.01161759999997)
2-Acetyl-3,4,7-trihydroxy-6-methoxy-naphtho[2,3-b]furan-5,8-chinon|2-acetyl-3,4,7-trihydroxy-6-methoxy-naphtho[2,3-b]furan-5,8-quinone
4H,6H-Benzo(1,2-b:4,5-c)dipyran-8-carboxylic acid, 5-hydroxy-9-methoxy-2-methyl-4,6-dioxo-
8-Chloro-11-hydroxy-1-methoxycarbonyl-9-methylxanthone
Quercetagetin
Quercetagetin is a hexahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 5, 6, 7, 3 and 4 respectively. It has a role as an antioxidant, an antiviral agent and a plant metabolite. It is a member of flavonols and a hexahydroxyflavone. It is functionally related to a quercetin. Quercetagetin is a natural product found in Calanticaria bicolor, Tagetes subulata, and other organisms with data available. See also: Chaste tree fruit (part of). A hexahydroxyflavone that is flavone substituted by hydroxy groups at positions 3, 5, 6, 7, 3 and 4 respectively. D004791 - Enzyme Inhibitors Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties. Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties.
Myricetin
COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS relative retention time with respect to 9-anthracene Carboxylic Acid is 0.783 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.784 Myricetin is a common plant-derived flavonoid with a wide range of activities including strong anti-oxidant, anticancer, antidiabetic and anti-inflammatory activities. Myricetin is a common plant-derived flavonoid with a wide range of activities including strong anti-oxidant, anticancer, antidiabetic and anti-inflammatory activities.
5,6-Dichlorobenzimidazole riboside
C12H12Cl2N2O4 (318.01740920000003)
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.751 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.745 5,6-Dichlorobenzimidazole riboside (DRB) is a nucleoside analog that inhibits several carboxyl-terminal domain kinases, including casein kinase II and cell cycle-dependent kinases (CDK). 5, 6-dichlorobenzimidazole riboside has antitumor activity. 5, 6-dichlorobenzimidazole riboside can induce apoptosis[1][2][3][4][5][6][7].
3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)chromen-4-one
DRB
C12H12Cl2N2O4 (318.01740920000003)
5,6-Dichlorobenzimidazole riboside (DRB) is a nucleoside analog that inhibits several carboxyl-terminal domain kinases, including casein kinase II and cell cycle-dependent kinases (CDK). 5, 6-dichlorobenzimidazole riboside has antitumor activity. 5, 6-dichlorobenzimidazole riboside can induce apoptosis[1][2][3][4][5][6][7].
2-(5-Bromo-2,3-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
C12H14BBrF2O2 (318.02382179999995)
(CYANO-PHENYL-METHYL)-CARBAMICACIDTERT-BUTYLESTER
C12H14Cl2Zr (317.95195839999997)
DIETHYL 1-(2-BROMO-ETHYL)-1H-PYRAZOLE-3,5-DICARBOXYLIC ACID
N-(5-Iodo-4-methyl-pyridin-2-yl)-2,2-dimethyl-propionamide
C11H15IN2O (318.02290899999997)
Bis(2,2,2-trifluoroethyl) (methoxycarbonylmethyl)phosphonate
C7H9F6O5P (318.00917860000004)
4-Chlorodiazepam
D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D003292 - Convulsants D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D009676 - Noxae > D000963 - Antimetabolites
2-chloro-4-[(3-chloro-4-isocyanato-phenyl)methyl]-1-isocyanato-benzene
C15H8Cl2N2O2 (317.99628079999997)
5,5-Dichloro-2,2-dihydroxydiphenyl sulfone
C12H8Cl2O4S (317.95203480000004)
3-(4-chlorophenyl)sulfanyl-2-methyl-4-nitro-1H-indole
1H-Indene-1,3(2H)-dione, 2-[(3,5-dichloro-4-hydroxyphenyl)methylene]-
C16H8Cl2O3 (317.98504779999996)
N-(2,6-DICHLORO-4-PYRIDYL)-N-[5-(METHYLTHIO)-4H-1,2,4-TRIAZOL-3-YL]UREA
N-(5-IODO-3-METHYL-PYRIDIN-2-YL)-2,2-DIMETHYL-PROPIONAMIDE
C11H15IN2O (318.02290899999997)
2-(2-Bromo-3,5-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
C12H14BBrF2O2 (318.02382179999995)
Bis(methylcyclopentadienyl)zirconium dichloride
C12H14Cl2Zr (317.95195839999997)
2-(4-nitrophenoxy)-3-chloro-5-trifluoromethyl pyridine
ETHYL 1-(3-CHLOROPHENYL)-5-(TRIFLUOROMETHYL)-1H-PYRAZOLE-4-CARBOXYLATE
tert-butyl N-(5-bromo-4-cyclopropyl-1,3-thiazol-2-yl)carbamate
2-[2-[4-(trifluoromethoxy)anilino]-1,3-thiazol-4-yl]acetic acid
Ethyl 1-(4-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole-4-carboxylate
4-amino-N-[4-(trifluoromethyl)pyrimidin-2-yl]benzenesulfonamide
4-(BENZO[B]THIOPHENE-3-SULFONYL)-PIPERAZINE HYDROCHLORIDE
2-(2,6-dichloroanilino)pyridine-3-sulfonic acid
C11H8Cl2N2O3S (317.96326780000004)
4-BROMO-1,2-DIMETHYL-5-(QUINOXALIN-6-YL)-1H-PYRAZOL-3(2H)-ONE
C13H11BrN4O (318.01161759999997)
N-(5-IODO-6-METHYL-PYRIDIN-2-YL)-2,2-DIMETHYL-PROPIONAMIDE
C11H15IN2O (318.02290899999997)
Diethyl [(5-chloro-1-benzothiophen-3-yl)methyl]phosphonate
C13H16ClO3PS (318.02462660000003)
5-[amino(methyl)amino]-4-chloro-2-(3,5-dichlorophenyl)pyridazin-3-one
1-(5-Bromo-2-hydroxyphenyl)-3-phenyl-1,3-propanedione
methyl 4-tert-butyl-3-iodobenzoate
C12H15IO2 (318.01167599999997)
Thiazolidine, 2-(4-methoxy-3-nitrophenyl)-3-(methylsulfonyl)- (9CI)
4-(4-(thiophen-2-yl)thiazol-2-ylamino)-2-hydroxybenzoic acid
2-CHLORO-N-[4-(MORPHOLINE-4-SULFONYL)-PHENYL]-ACETAMIDE
5-(2-(BROMOMETHYL)PHENYL)-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE
2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO]-PYRIDINE-3-SULFONIC ACID
tert-Butyl 2-bromo-6,7-dihydrothiazolo[5,4-c]pyridine-5(4H)-carboxylate
1,2-Diaminonaphtahlene-5,7-disulfonic acid
C10H10N2O6S2 (317.99802800000003)
3-(4-bromophenyl)-5-(4-fluorophenyl)-1,2,4-oxadiazole
3-(4-Bromophenyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
3-(2-Bromophenyl)-5-(2-fluorophenyl)-1,2,4-oxadiazole
ethyl (2Z,4Z)-5-chloro-2-(chloromethyl)-5-(3-chlorophenyl)penta-2,4-dienoate
4-CHLORO-2-(2,4-DICHLOROPHENYL)-5-(1-METHYLHYDRAZINO)-2,3-DIHYDROPYRIDAZIN-3-ONE
Ethyl 5-(4-chlorophenyl)-2-(trifluoromethyl)-3-furoate
C14H10ClF3O3 (318.02705360000004)
2-(4-ethyl-3-iodophenyl)-2-Methylpropanoic acid
C12H15IO2 (318.01167599999997)
Dichlororibofuranosylbenzimidazole
C12H12Cl2N2O4 (318.01740920000003)
D004791 - Enzyme Inhibitors > D019384 - Nucleic Acid Synthesis Inhibitors 5,6-Dichlorobenzimidazole riboside (DRB) is a nucleoside analog that inhibits several carboxyl-terminal domain kinases, including casein kinase II and cell cycle-dependent kinases (CDK). 5, 6-dichlorobenzimidazole riboside has antitumor activity. 5, 6-dichlorobenzimidazole riboside can induce apoptosis[1][2][3][4][5][6][7].
3-Chloro-1-(3,4-dichlorophenyl)-4-(dimethylamino)pyrrole-2,5-dione
2-Acetyl-3,4,8-trihydroxy-7-methoxybenzo[f][1]benzofuran-5,6-dione
1-((4-Nitrophenyl)sulfonyl)-1H-benzimidazol-2-amine
N-[(4-chlorobenzyl)oxy]-N-thieno[2,3-d]pyrimidin-4-yliminoformamide
1-[(2-Amino-4-chloro-5-methylphenyl)sulfonyl]-L-proline
90-18-6
D004791 - Enzyme Inhibitors Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties. Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties.
quercetagetin
2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4h-chromen-4-one, also known as 6-hydroxyquercetin or 3,3,4,5,6,7-hexahydroxyflavone, is a member of the class of compounds known as flavonols. Flavonols are compounds that contain a flavone (2-phenyl-1-benzopyran-4-one) backbone carrying a hydroxyl group at the 3-position. Thus, 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4h-chromen-4-one is considered to be a flavonoid lipid molecule. 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4h-chromen-4-one is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4h-chromen-4-one can be synthesized from quercetin. 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4h-chromen-4-one is also a parent compound for other transformation products, including but not limited to, axillarin, eupatin, and patuletin. 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4h-chromen-4-one is a bitter tasting compound found in sweet orange, which makes 2-(3,4-dihydroxyphenyl)-3,5,6,7-tetrahydroxy-4h-chromen-4-one a potential biomarker for the consumption of this food product. Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties. Quercetagetin (6-Hydroxyquercetin) is a flavonoid[1]. Quercetagetin is a moderately potent and selective, cell-permeable pim-1 kinase inhibitor (IC50, 0.34 μM)[2]. Anti-inflammatory and anticancer properties.
3-deoxy-8-O-phosphono-alpha-D-manno-oct-2-ulopyranosonic acid
5,6,6-Trihydroxy-5-methoxy[biphenyl]-3,3-dicarboxylate
(2R,4R,5R)-2-(5,6-dichloro-1-benzimidazolyl)-5-(hydroxymethyl)oxolane-3,4-diol
C12H12Cl2N2O4 (318.01740920000003)
1-(2-Chlorophenyl)-3-(2-oxo-1,3-dihydrobenzimidazol-5-yl)thiourea
4-chloro-N-(3,4,5-trimethoxyphenyl)-5-dithiazolimine
N-(4-chlorophenyl)-2-(3-oxo-1,2-benzothiazol-2-yl)acetamide
N-(5-chloro-2-methoxyphenyl)-5-pyridin-4-yl-1,3,4-thiadiazol-2-amine
2-[[2-(3-Nitrophenyl)-2-oxoethyl]thio]-3-pyridinecarboxylic acid
(3E)-3-(Carbamothioylhydrazinylidene)-N-(3,4-dichlorophenyl)butanamide
3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid 5-phosphate
3-deoxy-alpha-D-manno-oct-2-ulopyranosonic acid 4-phosphate
3-(4-chlorobenzenesulfonyl)oxymethyl-5,5-dimethyldihydro-2(3H)-furanone
(3S,4R)-2-(5,6-dichloro-1-benzimidazolyl)-5-(hydroxymethyl)oxolane-3,4-diol
C12H12Cl2N2O4 (318.01740920000003)
2-(2,4-Dihydroxyphenyl)-3,5,6,7-tetrahydroxychromen-4-one
8-phospho-3-deoxy-D-manno-oct-2-ulosonic acid
A ketoaldonic acid phosphate consisting of 3-deoxy-D-manno-oct-2-ulosonic acid having a phospho group at the 8-position.
DDD
A chlorophenylethane that is 2,2-bis(p-chlorophenyl)ethane substituted by two chloro groups at position 1. It is a metabolite of the organochlorine insecticide, DDT.