Exact Mass: 302.11139579999997
Exact Mass Matches: 302.11139579999997
Found 500 metabolites which its exact mass value is equals to given mass value 302.11139579999997,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Haematoxylin
An organic heterotetracyclic compound 7,11b-dihydroindeno[2,1-c]chromene carrying five hydroxy substituents at positions 3, 4, 6a, 9 and 10. The most important and most used dye in histology, histochemistry, histopathology and in cytology. Hematoxylin appears as white to yellowish crystals that redden on exposure to light. (NTP, 1992) (+)-haematoxylin is a haematoxylin. It is an enantiomer of a (-)-haematoxylin. Hematoxylin is a natural product found in Haematoxylum brasiletto and Haematoxylum campechianum with data available. A dye obtained from the heartwood of logwood (Haematoxylon campechianum Linn., Leguminosae) used as a stain in microscopy and in the manufacture of ink. D004396 - Coloring Agents
Hesperetin
Hesperetin, also known as prestwick_908 or YSO2, belongs to the class of organic compounds known as 4-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C4 atom of the flavonoid backbone. Thus, hesperetin is considered to be a flavonoid lipid molecule. Hesperetin also seems to upregulate the LDL receptor. Hesperetin, in the form of its glycoside , is the predominant flavonoid in lemons and oranges. Hesperetin is a drug which is used for lowering cholesterol and, possibly, otherwise favorably affecting lipids. In vitro research also suggests the possibility that hesperetin might have some anticancer effects and that it might have some anti-aromatase activity. Hesperetin is a very hydrophobic molecule, practically insoluble in water, and relatively neutral. Hesperetin is a bitter tasting compound. Hesperetin is found, on average, in the highest concentration within a few different foods, such as limes, persian limes, and sweet oranges and in a lower concentration in pummelo, welsh onions, and lemons. Hesperetin has also been detected, but not quantified, in several different foods, such as yellow bell peppers, carrots, rapinis, hazelnuts, and beers. Hesperetin is a biomarker for the consumption of citrus fruits. Hesperetin reduces or inhibits the activity of acyl-coenzyme A:cholesterol acyltransferase genes (ACAT1 and ACAT2) and it reduces microsomal triglyceride transfer protein (MTP) activity. Hesperetin is a trihydroxyflavanone having the three hydroxy gropus located at the 3-, 5- and 7-positions and an additional methoxy substituent at the 4-position. It has a role as an antioxidant, an antineoplastic agent and a plant metabolite. It is a monomethoxyflavanone, a trihydroxyflavanone, a member of 3-hydroxyflavanones and a member of 4-methoxyflavanones. It is a conjugate acid of a hesperetin(1-). Hesperetin belongs to the flavanone class of flavonoids. Hesperetin, in the form of its glycoside [hesperidin], is the predominant flavonoid in lemons and oranges. Hesperetin is a natural product found in Brassica oleracea var. sabauda, Dalbergia parviflora, and other organisms with data available. Isolated from Mentha (peppermint) and numerous Citrussubspecies, with lemons, tangerines and oranges being especially good sources. Nutriceutical with anti-cancer props. Glycosides also widely distributed A trihydroxyflavanone having the three hydroxy gropus located at the 3-, 5- and 7-positions and an additional methoxy substituent at the 4-position. Acquisition and generation of the data is financially supported in part by CREST/JST. [Raw Data] CB046_Hesperetin_pos_40eV_CB000021.txt [Raw Data] CB046_Hesperetin_pos_50eV_CB000021.txt [Raw Data] CB046_Hesperetin_pos_30eV_CB000021.txt [Raw Data] CB046_Hesperetin_pos_20eV_CB000021.txt [Raw Data] CB046_Hesperetin_pos_10eV_CB000021.txt [Raw Data] CB046_Hesperetin_neg_20eV_000014.txt [Raw Data] CB046_Hesperetin_neg_10eV_000014.txt [Raw Data] CB046_Hesperetin_neg_40eV_000014.txt [Raw Data] CB046_Hesperetin_neg_50eV_000014.txt [Raw Data] CB046_Hesperetin_neg_30eV_000014.txt Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity. Hesperetin regulates apoptosis. Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity. Hesperetin regulates apoptosis.
Homoeriodictyol
Homoeriodictyol is a trihydroxyflavanone that consists of 3-methoxyflavanone in which the three hydroxy substituents are located at positions 4, 5, and 7. It has a role as a metabolite and a flavouring agent. It is a monomethoxyflavanone, a trihydroxyflavanone, a member of 3-methoxyflavanones and a member of 4-hydroxyflavanones. It is functionally related to an eriodictyol. Homoeriodictyol is a natural product found in Smilax corbularia, Limonium aureum, and other organisms with data available. Homoeriodictyol is a flavonoid metabolite of Eriocitrin in plasma and urine. Eriocitrin is a strong antioxidant agent[1]. Homoeriodictyol is a flavonoid metabolite of Eriocitrin in plasma and urine. Eriocitrin is a strong antioxidant agent[1].
Cumyluron
Precursor ion, [M-H]-, is a 37Cl-isotopolog ion.; 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. 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. The sample was injected by direct infusion.; Precursor ion, [M-H]-, is a 37Cl-isotopolog ion.; This record was created by the financial support of MEXT/JSPS KAKENHI Grant Number 19HP8024 to the Mass Spectrometry Society of Japan.
Odoratol
A member of the class of dihydrochalcones that is dihydrochalcone substituted by a hydroxy group at position 2, methoxy groups at positions 4 and 4 and a hydroxy group at position alpha- to the ketonic group.
Nanafrocin
A pyranonaphthoquinone antibiotic from strain OS-3966 of Streptomyces rosa var. notoensis. C254 - Anti-Infective Agent > C514 - Antifungal Agent C254 - Anti-Infective Agent > C258 - Antibiotic
Ferreirin
Isolated from Cajanus cajan (pigeon pea). Ferreirin is found in pigeon pea and pulses. Ferreirin is found in pigeon pea. Ferreirin is isolated from Cajanus cajan (pigeon pea
Lotisoflavan
A hydroxyisoflavan that is isoflavan substituted by hydroxy groups at positions 2 and 4 and methoxy groups at positions 5 and 7 respectively.
(R)-3',7-Dihydroxy-2',4'-dimethoxyisoflavan
(±)-3,7-Dihydroxy-2,4-dimethoxyisoflavan is found in common bean. (±)-3,7-Dihydroxy-2,4-dimethoxyisoflavan is isolated from Astragalus gummifer (tragacanth Isolated from Astragalus gummifer (tragacanth). (±)-3,7-Dihydroxy-2,4-dimethoxyisoflavan is found in common bean, yellow wax bean, and green bean.
Bicozamycin
C12H18N2O7 (302.11139579999997)
D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents D005765 - Gastrointestinal Agents > D000930 - Antidiarrheals C784 - Protein Synthesis Inhibitor D004791 - Enzyme Inhibitors
Benzo[a]pyrene-7,8-dihydrodiol-9,10-oxide
Benzo[a]pyrene-7,8-dihydrodiol-9,10-oxide, also known as BPDE or benzo(a)Pyrene diol epoxide, is classified as a member of the Pyrenes. Pyrenes are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system. Benzo[a]pyrene-7,8-dihydrodiol-9,10-oxide is considered to be practically insoluble (in water) and relatively neutral. It is a carcinogenic metabolite of benzo[a]pyrene (BaP) which forms adducts with DNA and proteins and is hydrolysed to BPDE tetrols. It is used as a marker for BaP exposure (a surrogate marker for PAHs). D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens
Nicofetamide
C20H18N2O (302.14190579999996)
A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders > A03AC - Synthetic antispasmodics, amides with tertiary amines
Dibenzo[a,l]pyrene
This compound belongs to the family of Benzopyrenes. These are organic compounds containing a benzene fused to a pyrene(benzo[def]phenanthrene) ring system. D009676 - Noxae > D002273 - Carcinogens
Terizidone
J - Antiinfectives for systemic use > J04 - Antimycobacterials > J04A - Drugs for treatment of tuberculosis C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent D000890 - Anti-Infective Agents > D023303 - Oxazolidinones
Isomucronulatol
Isomucronulatol is an ether and a member of flavonoids. Isomucronulatol is a natural product found in Gliricidia sepium, Wisteria brachybotrys, and other organisms with data available. Isolated from Glycyrrhiza glabra (licorice). Isomucronulatol is found in many foods, some of which are tea, yellow wax bean, green bean, and common bean. Isomucronulatol is found in common bean. Isomucronulatol is isolated from Glycyrrhiza glabra (licorice). Isomucronulatol is a flavonoid isolated from the roots of A. membranaceus. Isomucronulatol exhibits inhibitory effects on LPS-stimulated production IL-12 p40 in vitro and has potential anti-inflammatory effect[1]. Isomucronulatol is a flavonoid isolated from the roots of A. membranaceus. Isomucronulatol exhibits inhibitory effects on LPS-stimulated production IL-12 p40 in vitro and has potential anti-inflammatory effect[1].
5,7,3'-Trihydroxy-4'-methoxyflavanone
5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one is an ether and a member of flavonoids. 5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one is a natural product found in Allium caeruleum, Allium caesium, and other organisms with data available. The S-form is It is isolated from Brickellia vernicosa, Persica vulgaris (preferred genus name Prunus), Citrus and Mentha species [CCD (Rac)-Hesperetin is the racemate of Hesperetin. Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity. Hesperetin induces apoptosis via p38 MAPK activation. (Rac)-Hesperetin is the racemate of Hesperetin. Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity. Hesperetin induces apoptosis via p38 MAPK activation. Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity. Hesperetin regulates apoptosis. Hesperetin is a natural flavanone, and acts as a potent and broad-spectrum inhibitor against human UGT activity. Hesperetin regulates apoptosis.
3,3',4,4'-Tetrahydroxy-2-methoxychalcone
3,3,4,4-Tetrahydroxy-2-methoxychalcone is found in herbs and spices. 3,3,4,4-Tetrahydroxy-2-methoxychalcone is a constituent of licorice (Glycyrrhiza sp.) Constituent of licorice (Glycyrrhiza species). 3,3,4,4-Tetrahydroxy-2-methoxychalcone is found in tea and herbs and spices. 3,3,4,4-Tetrahydroxy-2-methoxychalcone is a member of chalcones.
4'-Methoxy-2',3,7-trihydroxyisoflavanone
4-Methoxy-2,3,7-trihydroxyisoflavanone is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
Folerogenin
Folerogenin is found in root vegetables. Folerogenin is isolated from licorice (Glycyrrhiza glabra) leaves Nadolol is a nonselective beta-adrenergic receptor antagonist with a long half-life, and is structurally similar to propranolol. Clinical pharmacology studies have demonstrated beta-blocking activity by showing (1) reduction in heart rate and cardiac output at rest and on exercise, (2) reduction of systolic and diastolic blood pressure at rest and on exercise, (3) inhibition of isoproterenol-induced tachycardia, and (4) reduction of reflex orthostatic tachycardia. Nadolol has no intrinsic sympathomimetic activity and, unlike some other beta-adrenergic blocking agents, nadolol has little direct myocardial depressant activity and does not have an anesthetic-like membrane-stabilizing action. Isolated from licorice (Glycyrrhiza glabra) leaves. Folerogenin is found in root vegetables.
Isoferreirin
Constituent of Dolichos biflorus (papadi). Isoferreirin is found in scarlet bean, lima bean, and fruits. Isoferreirin is found in fruits. Isoferreirin is a constituent of Dolichos biflorus (papadi)
Blumeatin
Blumeatin is found in tea. Blumeatin is a constituent of Blumea balsamifera (sambong). Constituent of Blumea balsamifera (sambong). Blumeatin is found in tea.
4',5,7-Trihydroxy-3-methoxyflavanone
4,5,7-Trihydroxy-3-methoxyflavanone is found in european plum. 4,5,7-Trihydroxy-3-methoxyflavanone is a constituent of Prunus domestica (plum). Constituent of Prunus domestica (plum). Aromadendrin 3-methyl ether is found in fruits and european plum.
5,7,8-trihydroxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
2,3',6-Trihydroxy-4'-methoxybenzylcoumaranone
2,3,6-Trihydroxy-4-methoxybenzylcoumaranone is isolated from quebracho. Isolated from quebracho
Divanillin
Divanillin is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
(±)-Sphaerosin
Isolated from Lablab niger (hyacinth bean). (±)-Sphaerosin is found in many foods, some of which are hyacinth bean, yellow wax bean, pulses, and common bean. (±)-Sphaerosin is found in common bean. (±)-Sphaerosin is isolated from Lablab niger (hyacinth bean).
5,7-dihydroxy-3-(4-hydroxy-3-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
2',7-Dihydroxy-4',6-dimethoxyisoflavan
2,7-Dihydroxy-4,6-dimethoxyisoflavan is found in pulses. 2,7-Dihydroxy-4,6-dimethoxyisoflavan is isolated from cultures of Fusarium solani growing on Pisum sativum (pea). Isolated from cultures of Fusarium solani growing on Pisum sativum (pea). 2,7-Dihydroxy-4,6-dimethoxyisoflavan is found in pulses and common pea.
14-methoxy-8,17-dioxatetracyclo[8.7.0.0(2),.0(1)(1),(1)]heptadeca-2(7),3,5,11(16),12,14-hexaene-5,6,15-triol
9-(4-Hydroxyphenyl)-2-methoxy-1H-phenalen-1-one
9-(4-Hydroxyphenyl)-2-methoxy-1H-phenalen-1-one is found in fruits. 9-(4-Hydroxyphenyl)-2-methoxy-1H-phenalen-1-one is a constituent of Musa acuminata (dwarf banana) Constituent of Musa acuminata (dwarf banana). 9-(4-Hydroxyphenyl)-2-methoxy-1H-phenalen-1-one is found in fruits.
5,7-dihydroxy-2-(3-hydroxy-5-methoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
3,5,7-trihydroxy-8-methoxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one
5,7-dihydroxy-3-(4-hydroxyphenyl)-6-methoxy-3,4-dihydro-2H-1-benzopyran-4-one
2-Hydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one
2-Hydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one is found in fruits. 2-Hydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one is a constituent of the rhizomes of Musa acuminata (dwarf banana). Constituent of the rhizomes of Musa acuminata (dwarf banana). 2-Hydroxy-4-(4-methoxyphenyl)-1H-phenalen-1-one is found in fruits.
Porric acid A
Porric acid A is found in onion-family vegetables. Porric acid A is a constituent of the bulbs of Allium porrum (leeks)
Phenylalanylhistidine
Phenylalanylhistidine is a dipeptide composed of phenylalanine and histidine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Histidylphenylalanine
Histidylphenylalanine is a dipeptide composed of histidine and phenylalanine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Garcinia lactone dibutyl ester
Garcinia lactone dibutyl ester is found in fruits. Garcinia lactone dibutyl ester is a constituent of the fruit of Garcinia atroviridis (gelugor). Constituent of the fruit of Garcinia atroviridis (gelugor). Garcinia lactone dibutyl ester is found in fruits.
3'-Hydroxy-3,4,5,4'-tetramethoxystilbene
3-Hydroxy-3,4,5,4-tetramethoxystilbene is a polyphenol metabolite detected in biological fluids (PMID: 20428313). A polyphenol metabolite detected in biological fluids [PhenolExplorer]
(-)-Haematoxylin
D004396 - Coloring Agents
Cambendazole
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AD - Enzymes D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Homoeriodictyol
Homoeriodictyol is a member of the class of compounds known as 3-o-methylated flavonoids. 3-o-methylated flavonoids are flavonoids with methoxy groups attached to the C3 atom of the flavonoid backbone. Homoeriodictyol is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Homoeriodictyol can be found in coriander, which makes homoeriodictyol a potential biomarker for the consumption of this food product. Homoeriodictyol (3`-methoxy-4`,5,7-trihydroxyflavanone) is one of the 4 flavanones identified by Symrise in this plant eliciting taste-modifying property: homoeriodictyol sodium salt, eriodictyol and sterubin. Homoeriodictyol Sodium salt elicited the most potent bitter-masking activity by reducing from 10 to 40\\\\% the bitterness of salicin, amarogentin, paracetamol and quinine. However no bitter-masking activity was detected with bitter linoleic acid emulsions. According to Symrises scientists homoeriodictyol sodium salt seems to be a taste-modifier with large potential in food applications and pharmaceuticals . Homoeriodictyol is a flavonoid metabolite of Eriocitrin in plasma and urine. Eriocitrin is a strong antioxidant agent[1]. Homoeriodictyol is a flavonoid metabolite of Eriocitrin in plasma and urine. Eriocitrin is a strong antioxidant agent[1].
Terizidone
J - Antiinfectives for systemic use > J04 - Antimycobacterials > J04A - Drugs for treatment of tuberculosis C254 - Anti-Infective Agent > C52588 - Antibacterial Agent > C280 - Antitubercular Agent D000890 - Anti-Infective Agents > D023303 - Oxazolidinones
Aromadendrin 7-methyl ether
Aromadendrin 7-methyl ether, also known as 7-methoxy-aromadendrin, is a member of the class of compounds known as 7-o-methylated flavonoids. 7-o-methylated flavonoids are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone. Aromadendrin 7-methyl ether is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Aromadendrin 7-methyl ether can be found in sweet cherry, which makes aromadendrin 7-methyl ether a potential biomarker for the consumption of this food product.
indole-3-acetyl-glutamate
Indole-3-acetyl-glutamate is also known as iaa-glu or N-(indol-3-ylacetyl)glutamic acid(2-). Indole-3-acetyl-glutamate is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Indole-3-acetyl-glutamate can be found in a number of food items such as broccoli, cornmint, banana, and rapini, which makes indole-3-acetyl-glutamate a potential biomarker for the consumption of these food products.
indole-3-acetyl-glutamine
Indole-3-acetyl-glutamine, also known as n(2)-(1h-indol-3-ylacetyl)glutaminate or iaa-gln, belongs to glutamine and derivatives class of compounds. Those are compounds containing glutamine or a derivative thereof resulting from reaction of glutamine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. Indole-3-acetyl-glutamine is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Indole-3-acetyl-glutamine can be found in a number of food items such as yellow wax bean, rapini, borage, and fireweed, which makes indole-3-acetyl-glutamine a potential biomarker for the consumption of these food products.
1,11b-Dihydro-11b-hydroxymaackiain
13-Hydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,17-tetraen-16-one is a natural product found in Ononis viscosa with data available.
Gutenbergin
4,7-Dihydorxy-2,3,6-trimethoxy-9,10-dihydrophenanthrene
2,7-Dihydroxy-3,4,6-trimethoxy-9,10-dihydrophenanthrene
6,7-Dihydroxy-2,3,4-trimethoxy-9,10-dihydrophenanthrene
2-Formyl-5-(4-methoxybenzoyloxy)-3-methyl-2-cyclopentene-1-acetaldehyde
3,6-Dihydroxy-2,4,7-trimethoxy-9,10-Dihydropenanthrene
2,6-Dihydroxy-1,5,7-trimethoxy-9,10-dihydrophenanthrene
2,7-Dihydroxy-1,3,5-trimethoxy-9,10-dihydrophenanthrene
4-Hydroxy-3,3-dimethoxy-4,5-methylenedioxybibenzyl
5,6-Dihydroxy-1,3,4-trimethoxy-9,10-dihydrophenanthrene
2,6-Dihydroxy-3,4,7-trimethoxy-9,10-dihydrophenanthrene
Irazunolide
2,4-Dihydroxy-4,6-dimethoxydihydrochalcone
4,2,6-Trihydroxy-4-methoxy-3-methyldihydrochalcone
4,4-Dihydroxy-2,6-dimethoxydihydrochalcone
4,4-Dihydroxy-2,6-dimethoxydihydrochalcone is a natural product found in Soymida febrifuga and Dracaena cochinchinensis with data available.
2-Isopropenyl-4-methylanthra[2,3-b]furan-5,10-dione
Isomucronulatol
Isomucronulatol is a flavonoid isolated from the roots of A. membranaceus. Isomucronulatol exhibits inhibitory effects on LPS-stimulated production IL-12 p40 in vitro and has potential anti-inflammatory effect[1]. Isomucronulatol is a flavonoid isolated from the roots of A. membranaceus. Isomucronulatol exhibits inhibitory effects on LPS-stimulated production IL-12 p40 in vitro and has potential anti-inflammatory effect[1].
2-Hydroxy-4-(4-methoxyphenyl)-6-phenylnicotinonitrile
2-[4-(2-aminophenyl)sulfanylbut-2-enylsulfanyl]aniline
4-[formyl(6-methoxyquinolin-8-yl)amino]pentanoic acid
1-(2,4-dihydroxyphenyl)-3-(2-methoxy-4,5-methylenedioxyphenyl)-propane|2-Me,4,5-methylene ether-1-(2,4-Dihydroxyphenyl)-3-(2,4,5-trihydroxyphenyl)propane
3-[4-methyl-5-(3-methyl-5-oxo-4-vinyl-1,5-dihydro-pyrrol-2-ylidenemethyl)-2-oxo-2,3-dihydro-pyrrol-3-yl]-propionic acid|3-[4-Methyl-5-(3-methyl-5-oxo-4-vinyl-1,5-dihydro-pyrrol-2-ylidenmethyl)-2-oxo-2,3-dihydro-pyrrol-3-yl]-propionsaeure
3,8,9-trihydroxy-6-methoxy-3,7-dimethyl-2,4-dihydroanthracen-1-one
2-hydroxy-4beta-methyl-4alpha-(beta-D-glucopyranoside)-2,5-cyclohexadien-1-one
(2alpha,3beta,5alpha)-2-(acetyloxy)-9-methoxy-5-(methoxycarbonyl)-2,3-dimethylheptano-5-lactone|rel-(2R,4R,5S)-2-(acetyloxy)tetrahydro-2-(1-methoxyethyl)-4,5-dimethyl-6-oxo-2H-pyran-2-carboxylic acid methyl ester
(2E)-cyclopent-2-en-1-ylidene((3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)acetic acid|edulilic acid
phoyunbene A|trans-3,3-dihydroxy-2,4,5-trimethoxystilbene
(2R,3S,4S)-2,3-trans-3,4-cis-7,4-dimethoxy-3,4-flavandiol|4.7-Dimethoxy-2.3-trans-flavan-3.4-cis-diol
3-Deoxy-4-O-methylsappanol
3-Deoxy-4-O-methylsappanol is a natural product found in Biancaea decapetala and Biancaea sappan with data available.
3,6,7-trimethoxy-9,10-dihydrophenanthrene-2,5-diol
9,10-Dihydro-3,4,6-trimethoxy-2,7-phenanthrenediol
2-methylphloroglucinol-O-beta-D-glucopyranoside|eucalmainoside A
3,9-dimethoxypterocarpan-6a-ol|6a-hydroxy-3,9-dimethoxypterocarpan
[3-formyl-4-methyl-2-(2-oxoethyl)cyclopent-3-en-1-yl] 4-methoxybenzoate
phoyunbene B|trans-3,4-dihydroxy-2,3,5-trimethoxystilbene
2-(4-Hydroxyphenyl)-4-(3,4-dihydroxyphenyl)tetrahydro-2H-pyran-5-ol
(1RS,2RS,3SR,4RS)-3,4,7-Tri-Ac-1-(Hydroxymethy)-5-cyclohexene-1,2,3,4-tetrol
9,10-Dihydro-2,4,7-trimethoxy-3,6-phenanthrenediol
Salirepin
Salirepin is a glycoside. Salirepin is a natural product found in Itoa orientalis and Idesia polycarpa with data available.
2,4-dihydroxy-6-methylphenyl beta-D-glucopyranoside|6-O-degalloylmyrsinoside A|myrsinoside B
4-hydroxymethyl-2-methyl-3-furanylcarbonyl alpha-L-rhamnopyranoside
1,5,7-trimethoxy-9,10-dihydrophenanthrene-2,6-diol
9,10-dihydro-2,7-dihydroxy-1,3,5-trimethoxyphenanthrene
(2R,3R,4S,5S)-2,4-bis(4-hydroxyphenyl)-3,5-dihydroxy-tetrahydropyran|taxodascendin
1,2,3,4-tetrahydro-3alpha-hydroxy-5,6-dimethoxy-2beta-methylanthracene-9,10-dione|psiconnatanone B
Griffithane D
A member of the class of 1,4-benzoquinones that is 1,4-benzoquinone which has been substituted by a methoxy group at position 5 and a 3-(4-hydroxy-3-methoxyphenyl)propyl group at position 2. It has been isolated from the stems of Combretum griffithii and has been shown to exhibit anticancer activity.
2,3,3-Trimethyl-6-methoxy-7-hydroxy-9-methyl-2,3-dihydronaphtho[1,2-b]furan-4,5-dione
2-hydroxy-3,3-dimethoxy-4,5-methylenedioxybibenzyl|gastrochilin
3-hydroxy-2,5-dimethylphenyl 2,4-dihydroxy-3,6-dimethylbenzoate
(2S)-6,4-dihydroxy-7,3-dimethoxyflavan|griffinoid B
(1S,5S,8S)-5-hydroxy-8-(3-hydroxy-4-methoxyphenyl)-1-methylbicyclo[3.3.1]non-3-ene-2,9-dione|tazettone B
(2S)-3,4-dihydroxy-6,7-dimethoxyflavan|griffinoid C
rel-(5R,6S,7R)-5,6,7,8-tetrahydro-5,6,7-trihydroxy-2-(2-phenylethyl)-4H-1-benzopyran-4-one
2,5-dihydroxy-3,4,6-trimethoxy-9,10-dihydrophenanthrene
3,3-dimethoxy-4,5-methylenedioxy-4-hydroxybibenzyl
6-sec-butyl-3-(4-hydroxy-benzoyl)-5-methoxy-1H-pyrazin-2-one|Septorin
9,10-dihydro-5,6,8-trimethoxy-3,4-phenanthrenediol
7,8,8a,9-tetrahydro-8-h ydroxy-5-(hydroxymethyl)-2-methoxy-8a-methyl-1 ,4-anthracenedione
3-[4-methyl-5-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-pyrrol-2-ylidenemethyl)-2-oxo-2,3-dihydro-pyrrol-3-yl]-propionic acid|3-[4-Methyl-5-(4-methyl-5-oxo-3-vinyl-1,5-dihydro-pyrrol-2-ylidenmethyl)-2-oxo-2,3-dihydro-pyrrol-3-yl]-propionsaeure
9,10-Dihydro-3,4,7-trimethoxy-2,6-phenanthrenediol
2,3-dihydro-5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-6-methoxy-3-methylbenzofuran
8,9-dimethoxy-7-methyl-10,11-dihydrodibenzo[b,f]oxepine-1,6-diol
2,3,6-trimethoxy-9,10-dihydrophenanthrene-4,5-diol
BAUHINOXEPIN F
A dibenzooxepine that is 10,11-dihydrodibenzo[b,f]oxepine substituted by methoxy groups at positions 6 and 9, methyl group at position 7 and hydroxy groups at positions 1 and 8 respectively. It is isolated from the root extract of Bauhinia purpurea and exhibits antimalarial, antimycobacterial, antifungal, anti-inflammatory and cytotoxic activities.
3,4,5-Trimethyl-4-hydroxy-7,8-dimethoxynaphtho[2,3-b]furan-9(4H)-one
3,4,5-Trimethyl-5-hydroxy-7,9-dimethoxynaphtho[2,3-b]furan-8(5H)-one
(R)-Isomucronulatol
(R)-Isomucronulatol is a natural product found in Astragalus mongholicus, Oxytropis falcata, and other organisms with data available.
2-methylidene-3-(6-oxalooxyhexyl)butanedioic acid
3-[(2,6-dihydroxy-3,4-dimethylphenyl)methyl]-2,4-dihydroxy-6-methylbenzaldehyde
1-(2,4-dihydroxyphenyl)-2-(3,5-dimethoxyphenyl)propan-1-one
PRI_303.1340_15.8
CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1612
1-(2,4-dihydroxyphenyl)-2-(3,5-dimethoxyphenyl)propan-1-one
3-[(2,6-dihydroxy-3,4-dimethylphenyl)methyl]-2,4-dihydroxy-6-methylbenzaldehyde
2-(3-hydroxy-5-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
3-[(2,6-dihydroxy-3,4-dimethylphenyl)methyl]-2,4-dihydroxy-6-methylbenzaldehyde [IIN-based: Match]
2-(3-hydroxy-5-methoxyphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol_major
1-(2,4-dihydroxyphenyl)-2-(3,5-dimethoxyphenyl)propan-1-one_major
Phe-his
A dipeptide composed of L-phenylalanine and L-histidine joined by a peptide linkage.
3'-Hydroxy-3,4,5,4'-tetramethoxystilbene
1-(2,4-Dihydroxyphenyl)-2-(3,5-dimethoxyphenyl)-1-propanone
Mucronulatol
A methoxyisoflavan that is (S)-isoflavan substituted by methoxy groups at positions 2 and 4 and hydroxy groups at positions 7 and 3 respectively.
(4R,4aS,7aR,12bS)-4a-hydroxy-9-methoxy-1,2,3,4,5,6,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinoline-7-one
Florantyrone
C78276 - Agent Affecting Digestive System or Metabolism > C66913 - Cholagogues or Choleretic Agents
N-(2-CHLORO-4-METHYLPYRIDIN-3-YL)-2-(CYCLOPROPYLAMINO)NICOTINAMIDE
1-[2-AMINO-1-(4-TRIFLUOROMETHYL-PHENYL)-ETHYL]-PYRROLIDINE-3-CARBOXYLICACID
C14H17F3N2O2 (302.12420579999997)
2-O-(2-Methoxyethyl)uridine
C12H18N2O7 (302.11139579999997)
2'-O-(2-Methoxyethyl)-uridine is a synthetic oligonucleotide conversed from uridine. 2'-O-(2-Methoxyethyl)-uridine has the potential for chemotherapeutic agents development[1].
1-Benzyl-2-(difluoro(phenoxy)Methyl)-4,5-dihydro-1H-imidazole
C17H16F2N2O (302.12306299999995)
methanesulfonic acid,4-phenylmethoxycyclohexan-1-ol
C14H22O5S (302.11878820000004)
N-[(2,5-dihydroxyphenyl)-(3-nitrophenyl)methyl]acetamide
4,4,5,5-TETRAMETHYL-2-[2-(2,2,2-TRIFLUORO-ETHOXY)-PHENYL]-[1,3,2]DIOXABOROLANE
C14H18BF3O3 (302.13010240000006)
3-o-acetyl-1,2:5,6-di-o-isopropylidene-alpha-d-glucofuranose
3-(2-HYDROXY-ETHOXYMETHYL)-2,5,9-TRIMETHYL-FURO[3,2-G]CHROMEN-7-ONE
6-(4-Methoxyphenyl)-3-(pyridin-3-yl)pyrazolo[1,5-a]pyrimidine
1-(4-AMINO-3-METHOXYPHENYL)-1-ETHANONE
C20H18N2O (302.14190579999996)
4,4,5,5-Tetramethyl-2-(3-methyl-5-(trifluoromethoxy)-phenyl)-1,3,2-dioxaborolane
C14H18BF3O3 (302.13010240000006)
4-(trifluoromethoxy)benzylboronic acid pinacol ester
C14H18BF3O3 (302.13010240000006)
1-ETHYNYL-4-((4-(PHENYLETHYNYL)PHENYL)ETHYNYL)BENZENE
2-(4-METHOXY-2-(TRIFLUOROMETHYL)PHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE
C14H18BF3O3 (302.13010240000006)
2-Chloro-1-(8-methyl-1,2,3a,4,5,6-hexahydro-pyrazino[3,2,1-jk]carbazol-3-yl)-ethanone
2-[(CHLOROACETYL)AMINO]-N-(3-METHYLPHENYL)BENZAMIDE
[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-benzofuran-6-yl] acetate
(S)-2-[(4-Chlorophenyl)(4-piperidinyloxy)methyl]pyridine
2-(4-Hydroxy-6-methylnicotinamido)-2-(4-hydroxyphenyl)acetic acid
1H-Indole-1-carboxylic acid, 3-(1-cyano-1-methylethyl)-5-fluoro-, 1,1-dimethylethyl ester
1-decyl-3-methylimidazol-3-ium,bromide
C14H27BrN2 (302.13574819999997)
[R-(R*,S*)]-(-)-N-(1-PHENYLETHYL)-1-AZABICYCLO[2.2.2]OCTAN-3-AMINE DIHYDROCHLORIDE
C15H24Cl2N2 (302.13164439999997)
[(Diphenylmethyl)sulfinyl]acetic Acid Ethyl Ester
C17H18O3S (302.09765980000003)
1-propiophenone tosylhydrazone 97
C16H18N2O2S (302.10889280000004)
2-[(4-Chlorophenyl)(4-piperidinyloxy)methyl]pyridine
furan-2,5-dione,methyl 2-methylprop-2-enoate,styrene
Safinamide
N - Nervous system > N04 - Anti-parkinson drugs > N04B - Dopaminergic agents > N04BD - Monoamine oxidase b inhibitors C471 - Enzyme Inhibitor > C667 - Monoamine Oxidase Inhibitor
(S)-5-AMINO-2-(((BENZYLOXY)CARBONYL)AMINO)PENTANOIC ACID HYDROCHLORIDE
4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)benzoic acid
C14H17F3N2O2 (302.12420579999997)
1,3,4-Oxadiazole,2-(4-methoxyphenyl)-5-(2-naphthalenyl)-
8-benzyl-2,8-diazaspiro[4.5]decane
C15H24Cl2N2 (302.13164439999997)
tert-butyl 3-(trifluoromethyl)-5,6,7,8-tetrahydro-1,6-naphthyridine-6-carboxylate
C14H17F3N2O2 (302.12420579999997)
1H-Benzimidazole,5-[5-[[(tetrahydro-2-furanyl)methyl]thio]-1,3,4-oxadiazol-2-yl]-(9CI)
ethyl (E)-3-(3-nitrophenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate
Benzyl2-chloro-2-[2-(4-methylphenyl)hydrazono]acetate
proxicromil
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent
3-BENZYL-N-HYDROXY-1-ISOPROPYL-2,4-DIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXIMIDAMIDE
1-Butyl-2,3-Dimethylimidazolium Trifluoromethanesulfonate
C10H17F3N2O3S (302.09119280000004)
1-butyl-3-methylimidazolium trifluoromethanesulfonate
C10H17F3N2O3S (302.09119280000004)
(3R,5R)-benzyl 3-amino-5-(trifluoromethyl)piperidine-1-carboxylate
C14H17F3N2O2 (302.12420579999997)
1-pentyl-3-methylimidazolium trifluoromethanesulfonate
C10H17F3N2O3S (302.09119280000004)
(2S,5S)-3-Methyl-2-phenyl-5-(phenylMethyl)-4-IMidazolidinone hydrochloride
4,4,5,5-TETRAMETHYL-2-[3-(2,2,2-TRIFLUORO-ETHOXY)-PHENYL]-[1,3,2]DIOXABOROLANE
C14H18BF3O3 (302.13010240000006)
1-[4-(2-Chloroethoxy)phenyl]-2-ethyl-2-phenylethanone
1(2H)-NAPHTHALENONE,4-(3,4-DICHLOROPHENYL)-3,4-DIHYDRO-,OXIME
Phenol,4-[2-[4-(2-phenyldiazenyl)phenyl]diazenyl]-
N2-(1H-Indol-5-yl)-6-(pyridin-4-yl)pyrazine-2,3-diamine
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor
6-((4R)-4-Methyl-1,1-dioxo-1,2,6-thiadiazinan-2-yl)isoquinoline-1-carbonitrile
4-[(6-Phenyl[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methyl]phenol
Flurbiprofen sodium
C15H16FNaO4 (302.09302679999996)
D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C471 - Enzyme Inhibitor > C29577 - Carbonic Anhydrase Inhibitor D002491 - Central Nervous System Agents > D000700 - Analgesics C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors
Propanamide, 2-[[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]amino]-
Phoyunbene B
A stilbenoid that is trans-stilbene substituted by hydroxy groups at positions 3 and 4 and methoxy groups at positions 2, 3 and 5. Isolated from Pholidota yunnanensis, it exhibits inhibitory effects on production of nitric oxide.
(2S,3S)-2-(3-hydroxy-4-methoxyphenyl)-6-methoxy-3-methyl-2,3-dihydro-1-benzofuran-5-ol
1-(3,5-dimethylphenyl)-3-(1H-1,2,4-triazol-5-ylthio)pyrrolidine-2,5-dione
methyl 5-[(4-tert-butylbenzoyl)amino]-2H-1,2,4-triazole-3-carboxylate
sequirin C
A norlignan that is a derivative of agatharesinol in which the aromatic ring B has an additional hydroxy substituent ortho to the one present in the parent compound.
Pterolinus G
A member of the class of hydroquinones that is benzene-1,4-diol substituted by a methoxy group at position 5 and a prop-en-1-yl group at position 2 which in turn is substituted by a 3-hydroxy-4-methoxyphenyl group at position 1. It has been isolated from Pterocarpus santalinus.
4-(dimethylamino)benzaldehyde N-(2-furylmethyl)thiosemicarbazone
C15H18N4OS (302.12012580000004)
2-chloro-N-[4-(N-propan-2-ylanilino)phenyl]acetamide
6-Methyl-5-phenyl-2-(phenylthio)-3-pyridinecarbonitrile
2-{[(E)-(4-methoxyphenyl)methylidene]amino}-5-phenyl-3-furonitrile
4-(4-Hydroxy-3-isopropylphenylthio)-2-isopropylphenol
N,N-Diphenylpyrazolo[1,5-A][1,3,5]triazine-2,4-diamine
2-((3,5-Dimethoxy-4-hydroxyphenyl)azo)benzoic acid
2-(4-Carcoxy-5-isopropylthiazolyl)benzopiperidine
C16H18N2O2S (302.10889280000004)
4-amino-1-tert-butyl-3-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-2-ium
Cambendazol
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AD - Enzymes D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Glucopyranoside, 4-hydroxy-2-methoxyphenyl, beta-D-(8CI); 4-Hydroxy-2-methoxyphenyl beta-D-glucopyranoside
2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-3-phenylpropanoic acid
4-[[(1S)-7-hydroxy-6-methoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-1-yl]methyl]benzene-1,2-diol
Phoyunbene A
A stilbenoid that is trans-stilbene substituted by hydroxy groups at positions 3 and 3 and methoxy groups at positions 2, 4 and 5. Isolated from Pholidota yunnanensis, it exhibits inhibitory effects on production of nitric oxide.
(2R)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]propanamide
N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)pyrazine-2-carboxamide
Hydroxysugiresinol
A norlignan that is a derivative of sugiresinol in which the aromatic ring B has an additional hydroxy substituent.
N-(3-fluorobenzylidene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide
5-(4-Methoxyphenyl)-7-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine
N-(2-fluorobenzylidene)-4,5,6,7-tetrahydro-1-benzothiophene-3-carbohydrazide
(3S,4R)-4 hydroxy-6,3 dimethoxyisoflavan-4-ol
A methoxyisoflavan that is (S)-isoflavan substituted by methoxy groups at positions 6 and 3 and hydroxy groups at positions 4 and 4. It has been isolated from Taxus yunnanensis and exhibits inhibitory activity against CYP3A4.
6-(3-furanyl)-N-(3-pyridinylmethyl)-4-quinazolinamine
1-[4-(4-Aminophenyl)-2-thiazolyl]-4-piperidinecarboxamide
C15H18N4OS (302.12012580000004)
5-(3-indolylidene)-N-(1-methoxypropan-2-yl)-4H-1,3,4-thiadiazin-2-amine
C15H18N4OS (302.12012580000004)
N-[5-[(4-methylphenyl)methyl]-2-thiazolyl]-2-oxolanecarboxamide
C16H18N2O2S (302.10889280000004)
N-[2-methoxy-4-[(2-methyl-1-oxopropyl)amino]phenyl]-2-furancarboxamide
(S,S,S)-nicotianamine monoanion
C12H20N3O6- (302.13520400000004)
The tricarboxylic acid monoanion that is the conjugate base of (S,S,S)-nicotianamine, resulting from deprotonation of the central carboxy group and zwitterion formation of the other two. One of two major microspecies at physiological pH.
2-[(3,4,8-Trimethyl-2-oxo-1-benzopyran-7-yl)oxy]acetic acid prop-2-enyl ester
2-[[2-(3-Methyl-1-oxo-2-isoquinolinyl)-1-oxoethyl]amino]acetic acid ethyl ester
2-Hydroxybenzoic acid [2-[[(1-methyl-2-pyrrolyl)-oxomethyl]amino]-2-oxoethyl] ester
(4E)-4-(dimethylaminomethylidene)-2-(4-nitrophenyl)-5-propylpyrazol-3-one
2-methyl-N-[1-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)ethyl]benzamide
C15H18N4OS (302.12012580000004)
N-(7-methyl-2,5-dioxo-4,4a,6,10b-tetrahydro-3H-pyrano[3,2-c]quinolin-3-yl)propanamide
3-hex-1-ynyl-5H-indazolo[2,3-a][3,1]benzoxazine
C20H18N2O (302.14190579999996)
1-methyl-N-(2-naphthalenyl)-5-benzotriazolecarboxamide
5-(tert-butyl)-2-methyl-N-(4-nitrophenyl)-3-furamide
3-Chloro-N-[(E)-2,3-dihydro-1,4-benzodioxin-6-ylmethylideneamino]-4-methylaniline
3-Methoxy-4-[(4-nitrophenyl)methoxy]benzaldehyde oxime
(allyl 7-azido-3,7-dideoxy-beta-L-gulo-oct-2-ulopyranosid)onate
C11H16N3O7- (302.09882059999995)
5-Hydroxy-8-(2-hydroxypropan-2-yl)-4-prop-2-enyl-8,9-dihydrouro[2,3-h]chromen-2-one
[1-[(4-Chlorophenyl)methyl]-2-hydroxy-5-methylindol-3-yl]-oxidoazanium
2-(4-ethyl-3-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-chromene-4,7-diol
4-methoxy-2-[2-[5-methoxy-2-(oxidoamino)phenyl]ethyl]-N-oxidoaniline
N-Acetylglycylglycylglycylglycine methyl ester
C11H18N4O6 (302.12262880000003)
3,4-Diethynyl-1,1-dimethyl-2,5-bis(trimethylsilyl)-1-silacyclopenta-2,5-diene
N-(1,2-Diphenylethyl)nicotinamide
C20H18N2O (302.14190579999996)
A - Alimentary tract and metabolism > A03 - Drugs for functional gastrointestinal disorders > A03A - Drugs for functional gastrointestinal disorders > A03AC - Synthetic antispasmodics, amides with tertiary amines
Benzo(a)pyrene diol epoxide
D009676 - Noxae > D002273 - Carcinogens D009676 - Noxae > D009153 - Mutagens
4-hydroxy-2-methoxyphenyl 1-O-beta-D-glucopyranoside
A monosaccharide derivative that consists of 2-methoxybenzene-1,4-diol attached to a beta-D-glucopyranosyl residue at position 1 via a glycosidic linkage. It is isolated from Acacia mearnsii.
Phe-His zwitterion
A dipeptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Phe-His. Major species at pH 7.3.
N-(indole-3-acetyl)glutamate(2-)
A dicarboxylic acid dianion obtained by deprotonation of the carboxy groups of N-(indole-3-acetyl)glutamic acid.
N-(indol-3-ylacetyl)glutaminate
A monocarboxylic acid anion that is the conjugate base of N-(indol-3-ylacetyl)glutamine, obtained by deprotonation of the carboxy group; major species at pH 7.3.
SB-200646A
SB-200646A is the first selective 5-HT2B/2C over 5-HT2A receptor antagonist with pKi values of 7.5, 6.9 and 5.2 for 5-HT2B, 5-HT2C and 5-HT2A, respectively. SB-200646A is orally active and has electrophysiological and anxiolytic properties in vivo[1][2].