Exact Mass: 230.1114
Exact Mass Matches: 230.1114
Found 500 metabolites which its exact mass value is equals to given mass value 230.1114,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
(R)-Kawain
Kawain is a member of 2-pyranones and an aromatic ether. Kavain is a natural product found in Piper methysticum, Alnus sieboldiana, and Piper majusculum with data available. See also: Piper methysticum root (part of). (R)-Kawain is found in beverages. (R)-Kawain is found in the roots of kava (Piper methysticum). FDA advises against use of kava in food due to potential risk of severe liver damage (2002). Found in the roots of kava (Piper methysticum). FDA advises against use of kava in food due to potential risk of severe liver damage (2002) D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D002491 - Central Nervous System Agents > D000927 - Anticonvulsants (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. Kavain is a class of kavalactone isolated from Piper methysticum, which has anxiolytic properties in animals and humans. Kavain positively modulated γ-Aminobutyric acid type A (GABAA) receptor[1]. Kavain is a class of kavalactone isolated from Piper methysticum, which has anxiolytic properties in animals and humans. Kavain positively modulated γ-Aminobutyric acid type A (GABAA) receptor[1]. Kavain is a class of kavalactone isolated from Piper methysticum, which has anxiolytic properties in animals and humans. Kavain positively modulated γ-Aminobutyric acid type A (GABAA) receptor[1].
demethylsuberosin
Demethylsuberosin, also known as 7-hydroxy-6-prenylcoumarin or 7-hydroxy-6-prenyl-1-benzopyran-2-one, is a member of the class of compounds known as 7-hydroxycoumarins. 7-hydroxycoumarins are coumarins that contain one or more hydroxyl groups attached to the C7 position the coumarin skeleton. Demethylsuberosin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Demethylsuberosin can be found in a number of food items such as rice, apple, black radish, and cloudberry, which makes demethylsuberosin a potential biomarker for the consumption of these food products. 7-demethylsuberosin is a hydroxycoumarin that is 7-hydroxycoumarin which is substituted at position 6 by a 3-methylbut-2-en-1-yl group. A natural product found in Citropsis articulata. It has a role as a plant metabolite. Demethylsuberosin is a natural product found in Prangos tschimganica, Limonia acidissima, and other organisms with data available. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Demethylsuberosin (7-Demethylsuberosin) is a coumarin compound isolated from Angelica gigas Nakai, and has anti-inflammatory activity[1]. Demethylsuberosin (7-Demethylsuberosin) is a coumarin compound isolated from Angelica gigas Nakai, and has anti-inflammatory activity[1].
Osthenol
Osthenol is a hydroxycoumarin that is umbelliferone in which the hydrogen at position 8 has been replaced by a prenyl group. It has a role as a plant metabolite and an antifungal agent. It is functionally related to an umbelliferone. Osthenol is a natural product found in Zanthoxylum beecheyanum, Prangos tschimganica, and other organisms with data available. Isolated from seeds of Apium graveolens. Osthenol is found in many foods, some of which are green vegetables, wild celery, fennel, and angelica. A hydroxycoumarin that is umbelliferone in which the hydrogen at position 8 has been replaced by a prenyl group. Osthenol is found in angelica. Osthenol is isolated from seeds of Apium graveolens. Osthenol (Ostenol), a prenylated coumarin isolated from the dried roots of Angelica pubescens, is selective, reversible, and competitive human monoamine oxidase-A (hMAO-A) inhibitor (Ki=0.26 μM). Osthenol potently inhibits recombinant hMAO-A with an IC50 of 0.74 μM and shows a high selectivity index for hMAO-A versus hMAO-B[1]. Osthenol (Ostenol), a prenylated coumarin isolated from the dried roots of Angelica pubescens, is selective, reversible, and competitive human monoamine oxidase-A (hMAO-A) inhibitor (Ki=0.26 μM). Osthenol potently inhibits recombinant hMAO-A with an IC50 of 0.74 μM and shows a high selectivity index for hMAO-A versus hMAO-B[1].
Naproxen
Naproxen (INN) is a non-steroidal anti-inflammatory drug (NSAID) commonly used for the reduction of mild to moderate pain, fever, inflammation and stiffness caused by conditions such as osteoarthritis, rheumatoid arthritis, psoriatic arthritis, gout, ankylosing spondylitis, injury (like fractures), menstrual cramps, tendonitis, bursitis, and the treatment of primary dysmenorrhea. Naproxen and naproxen sodium are marketed under various trade names including: Aleve, Anaprox, Naprogesic, Naprosyn, Naprelan; Naproxen is a non-steroidal anti-inflammatory drug (NSAID) commonly used for the reduction of mild to moderate pain, fever, inflammation and stiffness caused by conditions such as osteoarthritis, rheumatoid arthritis, psoriatic arthritis, gout, ankylosing spondylitis, injury (like fractures), menstrual cramps, tendonitis, bursitis, and the treatment of primary dysmenorrhea. Naproxen and naproxen sodium are marketed under various trade names including: Aleve, Anaprox, Naprogesic, Naprosyn, Naprelan. Naproxen was first marketed as the prescription drug Naprosyn in 1976 and naproxen sodium was first marketed under the trade name Anaprox in 1980. It remains a prescription-only drug in much of the world. The U.S. Food and Drug Administration (FDA) approved the use of naproxen sodium as an over-the-counter (OTC) drug in 1991, where OTC preparations are sold under the trade name Aleve. In Australia, small packets of lower-strength preparations of naproxen sodium are Schedule 2 Pharmacy Medicines; Naproxen is a member of the 2-arylpropionic acid (profen) family of NSAIDs. It is an odorless, white to off-white crystalline substance. It is lipid-soluble, practically insoluble in water with a low pH (below pH 4), while freely soluble in water at 6 pH and above. Naproxen has a melting point of 153 degree centigrade. Naproxen (INN) is a non-steroidal anti-inflammatory drug (NSAID) commonly used for the reduction of mild to moderate pain, fever, inflammation and stiffness caused by conditions such as osteoarthritis, rheumatoid arthritis, psoriatic arthritis, gout, ankylosing spondylitis, injury (like fractures), menstrual cramps, tendonitis, bursitis, and the treatment of primary dysmenorrhea. Naproxen and naproxen sodium are marketed under various trade names including: Aleve, Anaprox, Naprogesic, Naprosyn, Naprelan; Naproxen is a non-steroidal anti-inflammatory drug (NSAID) commonly used for the reduction of mild to moderate pain, fever, inflammation and stiffness caused by conditions such as osteoarthritis, rheumatoid arthritis, psoriatic arthritis, gout, ankylosing spondylitis, injury (like fractures), menstrual cramps, tendonitis, bursitis, and the treatment of primary dysmenorrhea. Naproxen and naproxen sodium are marketed under various trade names including: Aleve, Anaprox, Naprogesic, Naprosyn, Naprelan. M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain > M02AA - Antiinflammatory preparations, non-steroids for topical use M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AE - Propionic acid derivatives G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CC - Antiinflammatory products for vaginal administration D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D018501 - Antirheumatic Agents > D006074 - Gout Suppressants C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor D000893 - Anti-Inflammatory Agents KEIO_ID N018; [MS2] KO009075 D004791 - Enzyme Inhibitors KEIO_ID N018 Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
trimethyl-[(2S)-1-oxidanyl-1-oxidanylidene-3-(2-sulfanylidene-1,3-dihydroimidazol-4-yl)propan-2-yl]azanium
Dihydroresveratrol
A polyphenol metabolite detected in biological fluids [PhenolExplorer] Dihydroresveratrol, a potent phytoestrogen, is a hormone receptor modulator. Dihydroresveratrol exhibits proliferative effects in androgen-independent prostate and breast cancer cells at picomolar and nanomolar concentrations[1]. Dihydroresveratrol, a potent phytoestrogen, is a hormone receptor modulator. Dihydroresveratrol exhibits proliferative effects in androgen-independent prostate and breast cancer cells at picomolar and nanomolar concentrations[1].
Aucaparin
Aucuparin, also known as 3,5-dimethoxy-(1,1-biphenyl)-4-ol or 2,6-dimethoxy-4-phenylphenol, belongs to biphenyls and derivatives class of compounds. Those are organic compounds containing to benzene rings linked together by a C-C bond. Aucuparin is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Aucuparin can be found in loquat and rowanberry, which makes aucuparin a potential biomarker for the consumption of these food products.
Demethylbatatasin IV
Demethylbatatasin IV is found in root vegetables. Demethylbatatasin IV is isolated from Dioscorea alata (greater yam), Dioscorea bulbifera (air potato) and Dioscorea rotundata (white guinea yam) infected with Botryodiplodia theobromae. Isolated from Dioscorea alata (greater yam), Dioscorea bulbifera (air potato) and Dioscorea rotundata (white guinea yam) infected with Botryodiplodia theobromae. Demethylbatatasin IV is found in root vegetables.
Dihydro-resveratrol
Dihydroresveratrol is a stilbenol that is 1,1-ethane-1,2-diyldibenzene with hydroxy groups at positions 1, 3 and 4. It has a role as a xenobiotic metabolite and a plant metabolite. Dihydroresveratrol is a natural product found in Blasia pusilla, Dioscorea dumetorum, and other organisms with data available. A stilbenol that is 1,1-ethane-1,2-diyldibenzene with hydroxy groups at positions 1, 3 and 4. Dihydroresveratrol, a potent phytoestrogen, is a hormone receptor modulator. Dihydroresveratrol exhibits proliferative effects in androgen-independent prostate and breast cancer cells at picomolar and nanomolar concentrations[1]. Dihydroresveratrol, a potent phytoestrogen, is a hormone receptor modulator. Dihydroresveratrol exhibits proliferative effects in androgen-independent prostate and breast cancer cells at picomolar and nanomolar concentrations[1].
Pondaplin
Pondaplin is found in alcoholic beverages. Pondaplin is a constituent of the leaves of Annona glabra (pond apple). Constituent of the leaves of Annona glabra (pond apple). Pondaplin is found in alcoholic beverages and fruits.
(1xi,3xi)-1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid
(1xi,3xi)-1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid is found in alcoholic beverages. (1xi,3xi)-1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid is widespread in many foodstuffs especially fruit juices, jams and fermented foods or beverages including beer and soy sauce. Also present in the toxic fly agaric mushroom (Amanita muscaria). (1xi,3xi)-1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid is formed by Pictet-Spengler condensation between acetaldehyde and L-tryptophan in nature or during food processing. Widespread in many foodstuffs especially fruit juices, jams and fermented foods or beverages including beer and soy sauceand is) also present in the toxic fly agaric mushroom (Amanita muscaria). Formed by Pictet-Spengler condensation between acetaldehyde and L-tryptophan in nature or during food processing. (1xi,3xi)-1,2,3,4-Tetrahydro-1-methyl-beta-carboline-3-carboxylic acid is found in many foods, some of which are alcoholic beverages, herbs and spices, fruits, and mushrooms.
Hydroxyprolyl-Valine
Hydroxyprolyl-Valine is a dipeptide composed of hydroxyproline and valine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Valylhydroxyproline
Valylhydroxyproline is a dipeptide composed of valine and hydroxyproline. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Dicyclohexyl disulfide
Dicyclohexyl disulfide is a flavouring ingredient. Flavouring ingredient
cyclic Melatonin
cyclic Melatonin is a metabolite of melatonin. Melatonin Listen/ˌmɛləˈtoʊnɪn/, also known chemically as N-acetyl-5-methoxytryptamine, is a naturally occurring compound found in animals, plants, and microbes. In animals, circulating levels of the hormone melatonin vary in a daily cycle, thereby allowing the entrainment of the circadian rhythms of several biological functions. (Wikipedia)
(1E)-1-{[(Diaminomethylidene)amino]imino}-2,3-dihydro-1H-indene-4-carboximidamide
1-[3-(Trifluoromethyl)phenyl]piperazine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists
(1R,4S,4aS,7S,7aS)-7-hydroxyl-4-hydroxymethyl-7-methyl-1-methoxyl-1,4,4a,7a-tetrahydrocyclopenta[e]-pyran-3-one
10-Methyl-11H-benzo[a]fluoren|10-methyl-11H-benzo[a]fluorene|10-Methyl-benzofluoren|10-Methylbenzofluoren|10-Methylchrysofluoren|8-Methyl-2,3-benzfluoren
Ethanone, 1-(1-hydroxy-8-methoxy-3-methyl-2-naphthalenyl)-
2beta-(2,4-hexadiynoyl)-1,6-dioxaspiro<4.5>deca-3-ene|2beta-(2,4-hexadiynoyl)-1,6-dioxaspiro[4.5]deca-3-ene
(2beta,4beta)-2-ethyl-5-hydroxy-5-(methoxycarbonyl)-4,5-dimethylpentano-4-lactone|rel-(2R,4R)-4-ethyltetrahydro-alpha-hydroxy-alpha,2-dimethyl-5-oxofuran-2-acetic acid methyl ester
2-[(Z)-2,4-hexadiynylidene]-7-hydroxymethyl-1,6-dioxaspiro[4.4]non-3-ene|dendrazawayne B
4alpha-(3-methyl-4-formyloxy-hexyl)-3alpha-methyl-2-oxetanone
1-methyl-1,2,3,4-tetrahydro-beta-carboline-3-carboxylic acid
3,4-Dihydro-2,3-trimethylenequinazoline-4-acetic acid
(+/-)-1,2,3,9-tetrahydro-5-methoxypyrrolo<2,1-b>quinazoline-3-ol|(+/-)-1,2,3,9-tetrahydro-5-methoxypyrrolo[2,1-b]quinazoline-3-ol
(2S,3S,6S,8R,11S)-3,11-dihydroxy-2,8-dimethyl-1,7-dioxaspiro[5,5]undecan-4-one|(2S,3S,6S,8R,11S)-3,11-dihydroxy-2,8-dimethyl-1,7-dioxaspiro[5.5]undecan-4-one|dinemasone A
(-)-cobactin T|3-hydroxy-N-(1-hydroxy-2-oxo-azepan-3-yl)-butyramide|Cobactin S|Cobactin S, Cobactin H|Cobactin T
3,5-dihydroxy-2-methoxy-8-methylnon-6-ene 1,4-lactone
3-hydroxy-2,5-dimethoxybiphenyl
A natural product found in Rhaphiolepis indica var. tashiroi.
7-Prenyloxycoumarin
7-Prenyloxycoumarin (7-O-Prenylumbelliferone) is a secondary metabolite from the endophytic fungus of Annulohypoxylon ilanense[1]. 7-Prenyloxycoumarin (7-O-Prenylumbelliferone) is a secondary metabolite from the endophytic fungus of Annulohypoxylon ilanense[1].
lenoremycin
7-Prenyloxycoumarin is a natural product found in Coleonema album, Haplopappus multifolius, and other organisms with data available. 7-Prenyloxycoumarin (7-O-Prenylumbelliferone) is a secondary metabolite from the endophytic fungus of Annulohypoxylon ilanense[1]. 7-Prenyloxycoumarin (7-O-Prenylumbelliferone) is a secondary metabolite from the endophytic fungus of Annulohypoxylon ilanense[1].
Dihydroseselin
N-(3-Trifluoromethylphenyl)piperazine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists CONFIDENCE standard compound; EAWAG_UCHEM_ID 2819
Naproxen
M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain > M02AA - Antiinflammatory preparations, non-steroids for topical use M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AE - Propionic acid derivatives G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CC - Antiinflammatory products for vaginal administration D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D018501 - Antirheumatic Agents > D006074 - Gout Suppressants C471 - Enzyme Inhibitor > C1323 - Cyclooxygenase Inhibitor D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 2651 CONFIDENCE standard compound; INTERNAL_ID 8544 CONFIDENCE standard compound; INTERNAL_ID 4066
2-(1,2-dihydroxypentyl)-4-methoxy-2,3-dihydropyran-6-one
(2S)-2-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one
7-hydroxy-8-(3-methylbut-2-enyl)chromen-2-one
2-(6-hydroxyhexyl)-3-methylidenebutanedioic acid
Ostenol
Osthenol (Ostenol), a prenylated coumarin isolated from the dried roots of Angelica pubescens, is selective, reversible, and competitive human monoamine oxidase-A (hMAO-A) inhibitor (Ki=0.26 μM). Osthenol potently inhibits recombinant hMAO-A with an IC50 of 0.74 μM and shows a high selectivity index for hMAO-A versus hMAO-B[1]. Osthenol (Ostenol), a prenylated coumarin isolated from the dried roots of Angelica pubescens, is selective, reversible, and competitive human monoamine oxidase-A (hMAO-A) inhibitor (Ki=0.26 μM). Osthenol potently inhibits recombinant hMAO-A with an IC50 of 0.74 μM and shows a high selectivity index for hMAO-A versus hMAO-B[1].
C11H18O5_(4S,5S,10R)-4-Hydroxy-5-methoxy-10-methyl-2,7-oxecanedione
Kavain
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D002491 - Central Nervous System Agents > D000927 - Anticonvulsants Kawain is a member of 2-pyranones and an aromatic ether. Kavain is a natural product found in Piper methysticum, Alnus sieboldiana, and Piper majusculum with data available. See also: Piper methysticum root (part of). (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. (+)-Kavain, a main kavalactone extracted from Piper methysticum, has anticonvulsive properties, attenuating vascular smooth muscle contraction through interactions with voltage-dependent Na+ and Ca2+ channels[1]. (+)-Kavain is shown to bind at the α4β2δ GABAA receptor and potentiate GABA efficacy[2]. (+)-Kavain is used as a treatment for inflammatory diseases, its anti-inflammatory action has been widely studied[4]. Kavain is a class of kavalactone isolated from Piper methysticum, which has anxiolytic properties in animals and humans. Kavain positively modulated γ-Aminobutyric acid type A (GABAA) receptor[1]. Kavain is a class of kavalactone isolated from Piper methysticum, which has anxiolytic properties in animals and humans. Kavain positively modulated γ-Aminobutyric acid type A (GABAA) receptor[1]. Kavain is a class of kavalactone isolated from Piper methysticum, which has anxiolytic properties in animals and humans. Kavain positively modulated γ-Aminobutyric acid type A (GABAA) receptor[1].
(2S)-2-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one
(2S)-2-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one [IIN-based on: CCMSLIB00000847200]
2-(1,2-dihydroxypentyl)-4-methoxy-2,3-dihydropyran-6-one [IIN-based on: CCMSLIB00000845022]
2-(1,2-dihydroxypentyl)-4-methoxy-2,3-dihydropyran-6-one [IIN-based: Match]
(2S)-2-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one [IIN-based: Match]
(2S)-2-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one [IIN-based on: CCMSLIB00000847202]
2-(6-hydroxyhexyl)-3-methylidenebutanedioic acid_major
(2S)-2-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxy-2,3-dihydropyran-6-one_major
3,4-dihydro-2,2-dimethyl-pyrano[3,2-c][2]benzopyran-6(2H)-one
1-methyl-1H,2H,3H,4H,9H-pyrido[3,4-b]indole-3-carboxylic acid
3-THIOCARBAMOYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
(2S,4R)-4-amino-1-(tert-butoxycarbonyl)pyrrolidine-2-carboxy
4-trans-Phenylcyclohexane-(1R,2-cis)-dicarboxylic anhydride
3-HYDROXY-8,9,10,11-TETRAHYDRO-7H-CYCLOHEPTACCHROMEN-6-ONE
(S)-2-THIOCARBAMOYL-PYRROLIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
3-(4-METHOXYPHENYL)-4,5,6,7-TETRAHYDROISOXAZOLO[4,5-C]PYRIDINE
1,2:3,4-DI-O-ISOPROPYLIDENE-BETA-D-ARABINOPYRANOSE
2-Hydroxy-3-(3-Methyl-2-Butenyl)-4H-Pyrido[1,2-alpha]Pyrimidin-4-One
2-(3,5-DIMETHYL-1-PHENYL-1H-PYRAZOL-4-YL)ACETIC ACID
1-{[(2-Methyl-2-propanyl)oxy]carbonyl}-2-piperazinecarboxylic acid
methyl 2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-4-carboxylate
(3R,4R)-4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-3-carboxylic acid
5-METHYL-2-PHENYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
(2S,4S)-4-Amino-1,2-pyrrolidinedicarboxylic acid 1-(tert-butyl) ester
(2R,4R)-4-Amino-1,2-pyrrolidinedicarboxylic acid 1-(tert-butyl) ester
3-Amino-1-(tert-butoxycarbonyl)pyrrolidine-3-carboxylic acid
5-Isopropyl-1-phenyl-1H-pyrazole-4-carboxylic acid
metomidate
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
3-Hydroxycyclopentane-1,1-dicarboxylic acid diethyl ester
Benzaldehyde, 3-ethoxy-4-(4-methyl-1H-imidazol-1-yl)
Benzaldehyde, 4-(4-ethyl-1H-imidazol-1-yl)-3-methoxy
1H-Imidazole-1-carboxylicacid,(3,4-dimethylphenyl)methylester(9CI)
(3S,4R)-4-Amino-1-(tert-butoxycarbonyl)pyrrolidine-3-carboxylic acid
1-(3,4-DIMETHYLPHENYL)-3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOLE-4-CARBALDEHYDE
2-(PIPERIDIN-4-YL)-5-(PYRIDIN-4-YL)-1,3,4-OXADIAZOLE
p-Terphenyl
Formed by thermal treatment of proline and glucose mixtures
trimethyl(1-trimethylsilyloxybuta-1,3-dienoxy)silane
2-n-Butyl-1,3-diaza-spiro[4,4]non-1-en-4-one hydrochloride
ethenol,ethenyl acetate,methyl 2-methylprop-2-enoate
3-cyano-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine
2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLINE-1-CARBOXYLIC ACID METHYL ESTER
5-BENZYL-TETRAHYDROPYRROLO[3,4-C]PYRROLE-1,3(2H,3AH)-DIONE
2,3,4,9-TETRAHYDRO-1H-B-CARBOLINE-3-CARBOXYLICACIDMETHYLESTER
4-AMINO-1-(TERT-BUTOXYCARBONYL)PYRROLIDINE-3-CARBOXYLIC ACID
6-(methoxymethyl)-2-(3-methylphenyl)pyrimidin-4-ol
1-CYANOMETHYLENE-6,7-DIMETHOXY-1,2,3,4-TETRAHYDROISOQUINOLINE
3-methyl-5-phenyl-1h-pyrazole-4-carboxylic acid ethyl ester
2H-1-Benzopyran-2-one,4,8-dimethyl-7-(2-propen-1-yloxy)-
2,2,2,2-Tetramethyldihydrospiro[1,3-dioxolane-4,6-furo[2,3-d][ 1,3]dioxole]
4-[4-(2-hydroxy-ethyl)-piperazin-1-yl]-4-oxo-butyric acid
Sardomozide
D000970 - Antineoplastic Agents D004791 - Enzyme Inhibitors
4-(tert-Butoxycarbonyl)piperazine-2-carboxylic acid
5-Acetyl-6-methyl-4-phenyl-3,4-dihydro-1H-pyrimidin-2-one
(r)-2-thiocarbamoyl-pyrrolidine-1-carboxylic acid tert-butyl ester
1-Pyrrolidinecarboxylicacid, 2-cyano-, phenylmethyl ester, (2S)-
(4S)-2,2-Dimethyl-5β-[(4R)-2,2-dimethyl-1,3-dioxolane-4β-yl]-1,3-dioxolane-4α-carbaldehyde
1-(PHENYL)-5-ISOPROPYL-1H-PYRAZOLE-3-CARBOXYLIC ACID
1-Benzyl-3,5-dimethyl-1H-pyrazole-4-carboxylic acid
2-amino-1-[5-amino-1-(phenylmethyl)-1h-imidazol-4-yl] ethanone
4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)picolinonitrile
1,2:3,4-BIS-O-(1-METHYLETHYLIDENE)-BETA-L-ARABINOPYRANOSE
(2S)-1-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrolidine-2-carboxylic acid
Ethyl 8-hydroxy-1,4-dioxaspiro[4.5]decane-8-carboxylate
2-[5-(4-Piperidinyl)-1,2,4-oxadiazol-3-yl]pyridine
2,5-DIMETHYL-1-(PYRIDIN-4-YLMETHYL)-1H-PYRROLE-3-CARBOXYLIC ACID
N-(2,5-DIMETHYL-1H-PYRROL-1-YL)-4-HYDROXYBENZAMIDE
(1S,3S)-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
Poly(Methyl vinyl ether-alt-Maleic acid Monobutyl ester) solution
(2R,4R,5R)-2-ALLYLOXYMETHYL-4-DIMETHOXYMETHYL-3,6-DIOXA-BICYCLO[3.1.0]HEXANE
3-(T-BUTOXYCARBONYL)AMINOPYRROLIDINE-3-CARBOXYLIC ACID
cis-5-Benzyltetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
trimethyl(3-trimethylsilyloxybuta-1,3-dien-2-yloxy)silane
1H-Pyrido[3,4-b]indole-1-carboxylicacid, 2,3,4,9-tetrahydro-1-methyl-
4-cyano-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)pyridine
2-[(dimethylamino)methylene]-3-(4-methoxyphenyl)-3-oxo-propanenitrile
(2R,4S)-1-BOC-4-AMINO-PYRROLIDINE-2-CARBOXYLIC ACID
1-(3-Fluorophenyl)homopiperazine monohydrochloride
Fipamezole
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist
L-Ergothionine hydrochloride
D020011 - Protective Agents > D000975 - Antioxidants
ethyl (E)-2-cyano-4-(1-methylpyridin-4-ylidene)but-2-enoate
2-(p-tolyl)tetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,3aH)-dione
58436-28-5
Dihydroresveratrol, a potent phytoestrogen, is a hormone receptor modulator. Dihydroresveratrol exhibits proliferative effects in androgen-independent prostate and breast cancer cells at picomolar and nanomolar concentrations[1]. Dihydroresveratrol, a potent phytoestrogen, is a hormone receptor modulator. Dihydroresveratrol exhibits proliferative effects in androgen-independent prostate and breast cancer cells at picomolar and nanomolar concentrations[1].
2-[4-(4-Hydroxyphenoxy)phenyl]ethylazanium
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Bis-(4-hydroxybenzyl)ether
An ether in which the oxygen atom is linked to two 4-hydroxybenzyl groups. It is isolated from the tubers of Gastrodia elata and acts as a platelet aggregation inhibitor.
N-(2-cyano-1-cyclopentenyl)-1-ethyl-3-pyrazolecarboxamide
(2S)-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-3-ium-4-yl)-2-(trimethylazaniumyl)propanoate
2H,5H-Pyrano(3,2-C)(1)benzopyran-5-one, 3,4-dihydro-2,2-dimethyl-
1,2-Dimethyl-8-nitro-5,6-dihydro-4H-pyrrolo[3,2,1-ij]quinoline
3-(5-Oxooxolan-2-yl)propanoic acid, TMS derivative
1-(Trimethylsiloxy)-1,2-dihydro-1,2-methanonaphthalene
Demethylsuberosin
7-demethylsuberosin is a hydroxycoumarin that is 7-hydroxycoumarin which is substituted at position 6 by a 3-methylbut-2-en-1-yl group. A natural product found in Citropsis articulata. It has a role as a plant metabolite. Demethylsuberosin is a natural product found in Prangos tschimganica, Limonia acidissima, and other organisms with data available. A hydroxycoumarin that is 7-hydroxycoumarin which is substituted at position 6 by a 3-methylbut-2-en-1-yl group. A natural product found in Citropsis articulata. D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins Demethylsuberosin (7-Demethylsuberosin) is a coumarin compound isolated from Angelica gigas Nakai, and has anti-inflammatory activity[1]. Demethylsuberosin (7-Demethylsuberosin) is a coumarin compound isolated from Angelica gigas Nakai, and has anti-inflammatory activity[1].
Tetrahydroharman-3-carboxylic acid
(R)-Kawain
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014151 - Anti-Anxiety Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D002491 - Central Nervous System Agents > D000927 - Anticonvulsants
3,3,5-Trihydroxybibenzyl
A diphenylethane that is 1,2-dihydrostilbene substituted by hydroxy groups at positions 3, 3 and 5.
6-(1,2-Dihydroxypentyl)-4-methoxy-5,6-dihydropyran-2-one
ergothioneine(1+)
An alpha-amino-acid cation obtained by protonation of the imidazole ring of ergothioneine. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Methyldopa (hydrate)
Methyldopa hydrate (L-(-)-α-Methyldopa hydrate), a potent antihyoertensive agent, is an alpha-adrenergic agonist (selective for α2-adrenergic receptors). Methyldopa hydrate is a proagent and is metabolized (α-Methylepinephrine) in the central nervous system[1][2].
(2r)-2-[(5s)-5-hydroxyhexyl]-3-methylidenebutanedioic acid
4-(hydroxymethyl)-2-[(4-hydroxyphenyl)methyl]phenol
(2e,5s,7s)-2-(hexa-2,4-diyn-1-ylidene)-7-methoxy-1,6-dioxaspiro[4.4]non-3-ene
2-(hexa-2,4-diyn-1-ylidene)-7-methoxy-1,6-dioxaspiro[4.4]non-3-ene
8a-methyl-3-methylidene-3ah,4h,9h,9ah-naphtho[2,3-b]furan-2,6-dione
(1s,4r,5s,7s,7as)-5-hydroxy-7-(hydroxymethyl)-1-methoxy-4-methyl-hexahydro-1h-cyclopenta[c]pyran-3-one
(1r,11r)-7-hydroxy-11-(prop-1-en-2-yl)-2-oxatricyclo[6.3.1.0⁴,¹²]dodeca-4(12),5,7-trien-3-one
8-hydroxy-3-isopropyl-7-methylnaphthalene-1,2-dione
3-methoxy-3-(5-methoxy-4,5-dimethyloxolan-3-yl)prop-2-enoic acid
(8r)-4,8,12-trimethyl-2,6-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),4,9(13),10-tetraen-3-one
(1r,3s)-1-methyl-1h,2h,3h,4h,9h-pyrido[3,4-b]indole-3-carboxylic acid
(4s,5s,10r)-4-hydroxy-5-methoxy-10-methyloxecane-2,7-dione
(5r,8r)-2-(hexa-2,4-diyn-1-ylidene)-1,6-dioxaspiro[4.5]dec-3-en-8-ol
(3s,8as)-1-hydroxy-3-phenyl-3h,6h,7h,8h,8ah-pyrrolo[1,2-a]pyrazin-4-one
(1r,2s,4z,5s)-4-(hexa-2,4-diyn-1-ylidene)-3,6-dioxaspiro[bicyclo[3.1.0]hexane-2,2'-oxane]
1-methyl-1, 2, 3, 4-tetrahydro-β-carboline-3-carboxylic acid
{"Ingredient_id": "HBIN002718","Ingredient_name": "1-methyl-1, 2, 3, 4-tetrahydro-\u03b2-carboline-3-carboxylic acid","Alias": "NA","Ingredient_formula": "C13H14N2O2","Ingredient_Smile": "CC1C2=C(CC(N1)C(=O)O)C3=CC=CC=C3N2","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40645","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1r,4r,4 as,7s,7 as)-7-hydroxyl-4-hydroxy-methyl-7-methyl-1-methoxyl-1,4,4a,7a-tetrahy drocyclopenta[e]-pyran-3-one
{"Ingredient_id": "HBIN003124","Ingredient_name": "(1r,4r,4 as,7s,7 as)-7-hydroxyl-4-hydroxy-methyl-7-methyl-1-methoxyl-1,4,4a,7a-tetrahy drocyclopenta[e]-pyran-3-one","Alias": "NA","Ingredient_formula": "C11H18O5","Ingredient_Smile": "CC1(CCC2C1C(OC(=O)C2CO)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10320","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1r,4s,4 as,7s,7 as)-7-hydroxyl-4-hydroxy-methyl-7-methyl-1-methoxyl-1,4,4a,7a-tetrahy drocyclopenta[ e]-pyran-3-one
{"Ingredient_id": "HBIN003136","Ingredient_name": "(1r,4s,4 as,7s,7 as)-7-hydroxyl-4-hydroxy-methyl-7-methyl-1-methoxyl-1,4,4a,7a-tetrahy drocyclopenta[ e]-pyran-3-one","Alias": "NA","Ingredient_formula": "C11H18O5","Ingredient_Smile": "CC1(CCC2C1C(OC(=O)C2CO)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10321","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1s,4r,4 as,7s,7 as)-7-hydroxyl-4-hydroxy-methyl-7-methyl-1-methoxyl-1,4,4a,7a-tetrahy drocyclopenta[ e]-pyran-3-one
{"Ingredient_id": "HBIN003280","Ingredient_name": "(1s,4r,4 as,7s,7 as)-7-hydroxyl-4-hydroxy-methyl-7-methyl-1-methoxyl-1,4,4a,7a-tetrahy drocyclopenta[ e]-pyran-3-one","Alias": "NA","Ingredient_formula": "C11H18O5","Ingredient_Smile": "CC1(CCC2C1C(OC(=O)C2CO)OC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10322","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-(2,4-hexadiynylidene)-3,4-epoxy-1,6-dioxaspiro[4.5] decane
{"Ingredient_id": "HBIN003660","Ingredient_name": "2-(2,4-hexadiynylidene)-3,4-epoxy-1,6-dioxaspiro[4.5] decane","Alias": "NA","Ingredient_formula": "C14H14O3","Ingredient_Smile": "NA","Ingredient_weight": "230.263","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9080","PubChem_id": "NA","DrugBank_id": "NA"}
4-[(4-hydroxyphenyl)methoxy]benzenemethanol
{"Ingredient_id": "HBIN009963","Ingredient_name": "4-[(4-hydroxyphenyl)methoxy]benzenemethanol","Alias": "NA","Ingredient_formula": "C14H14O3","Ingredient_Smile": "C1=CC(=CC=C1CO)OCC2=CC=C(C=C2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10626","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-hydroxy-5-methoxy-10-methyl-oxecane-2,7-dione a
{"Ingredient_id": "HBIN010496","Ingredient_name": "4-hydroxy-5-methoxy-10-methyl-oxecane-2,7-dione a","Alias": "NA","Ingredient_formula": "C11H18O5","Ingredient_Smile": "CC1CCC(=O)CC(C(CC(=O)O1)O)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10425","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
4-Methoxycephalospolide G
{"Ingredient_id": "HBIN010632","Ingredient_name": "4-Methoxycephalospolide G","Alias": "NA","Ingredient_formula": "C11H18O5","Ingredient_Smile": "CC1CCC(=O)CC(C(CC(=O)O1)O)OC","Ingredient_weight": "230.26 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10426","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11253214","DrugBank_id": "NA"}
