Exact Mass: 326.176071
Exact Mass Matches: 326.176071
Found 500 metabolites which its exact mass value is equals to given mass value 326.176071
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Ajmaline
Ajmaline, also known as (+)-ajmaline, is a member of the class of compounds known as ajmaline-sarpagine alkaloids. Ajmaline-sarpagine alkaloids are organic compounds containing either of the ajmalan, sarpagan skeleton, or derivative thereof. The Sarpagine (Akuammidine) group, based on the sarpagan nucleus, arises from bond formation between C-16 and C-5 of the corynantheine precursor. Ajmaline alkaloids are based on a 17,19-secoyohimban skeleton (oxayohimban) which is invariably present as an ether. Ajmaline is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Ajmaline can be synthesized from ajmalan. Ajmaline is also a parent compound for other transformation products, including but not limited to, vinorine, norajmaline, and 17-O-acetylajmaline. Ajmaline can be found in a number of food items such as soursop, jews ear, small-leaf linden, and soft-necked garlic, which makes ajmaline a potential biomarker for the consumption of these food products. Ajmaline can be found primarily in blood and urine. Ajmaline is a drug which is used for use as an antiarrhythmic agent. The compound was first isolated by Salimuzzaman Siddiqui in 1931 from the roots of Rauvolfia serpentina. He named it ajmaline, after Hakim Ajmal Khan, one of the most illustrious practitioners of Unani medicine in South Asia. Ajmaline can be found in most species of the Rauvolfia genus as well as Catharanthus roseus. In addition to Southeast Asia, Rauvolfia species have also been found in tropical regions of India, Africa, South America, and some oceanic islands. Other indole alkaloids found in Rauvolfia include reserpine, ajmalicine, serpentine, corynanthine, and yohimbine. While 86 alkaloids have been discovered throughout Rauvolfia vomitoria, ajmaline is mainly isolated from the stem bark and roots of the plant . The class I antiarrhythmic agents interfere with the sodium channel. A class IA agent lengthens the action potential (right shift) which brings about improvement in abnormal heart rhythms. This drug in particular has a high affinity for the Nav 1.5 sodium channel (DrugBank). An alkaloid found in the root of Rauwolfia serpentina, among other plant sources. It is a class Ia antiarrhythmic agent that apparently acts by changing the shape and threshold of cardiac action potentials. Ajmaline produces potent sodium channel blocking effects and a very short half-life which makes it a very useful drug for acute intravenous treatments. The drug has been very popular in some countries for the treatment of atrial fibrillation in patients with the Wolff Parkinson White syndrome and in well tolerated monomorphic ventricular tachycardias. It has also been used for many years as a drug to challenge the conduction system of the heart in cases of bundle branch block and syncope. In these cases, abnormal prolongation of the HV interval has been taken as a proof for infrahisian conduction defects tributary for permanent pacemaker implantation. D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D049990 - Membrane Transport Modulators Ajmaline (Cardiorythmine) is a sodium channel blocking, class 1A anti-arrhythmic agent. Ajmaline blocks HERG currents with an IC50 of 1 μM in HEK cells and 42.3 μM in Xenopus oocytes. Ajmaline can be used for the research of the ventricular tachyarrhythmia[1][2]. Ajmaline (Cardiorythmine) is a sodium channel blocking, class 1A anti-arrhythmic agent. Ajmaline blocks HERG currents with an IC50 of 1 μM in HEK cells and 42.3 μM in Xenopus oocytes. Ajmaline can be used for the research of the ventricular tachyarrhythmia[1][2].
Hydroquinidine
Same as: D08048 C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents relative retention time with respect to 9-anthracene Carboxylic Acid is 0.751 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.749 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.745 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.742 Hydroquinidine (Dihydroquinidine) is a derivative of Quinidine (an antiarrhythmic agent). Hydroquinidine prolongs the QT interval and has antiarrhythmic efficacy[1][2][3]. Hydroquinidine (Dihydroquinidine) is a derivative of Quinidine (an antiarrhythmic agent). Hydroquinidine prolongs the QT interval and has antiarrhythmic efficacy[1][2][3].
Docebenone
D004791 - Enzyme Inhibitors > D016859 - Lipoxygenase Inhibitors C471 - Enzyme Inhibitor > C1322 - Lipooxygenase Inhibitor Docebenone (AA 861) is a potent, selective and orally active 5-LO (5-lipoxygenase) inhibitor.
LICARIN A
(-)-Licarin A is a natural product found in Magnolia dodecapetala, Magnolia kachirachirai, and other organisms with data available. Dehydrodiisoeugenol is a natural product found in Myristica fragrans with data available. Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2]. Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2]. Licarin A ((+)-Licarin A), a neolignan, significantly and dose-dependently reduces TNF-α production (IC50=12.6 μM) in dinitrophenyl-human serum albumin (DNP-HSA)-stimulated RBL-2H3 cells. Anti-allergic effects. Licarin A reduces TNF-α and PGD2 production, and COX-2 expression[1]. Licarin A ((+)-Licarin A), a neolignan, significantly and dose-dependently reduces TNF-α production (IC50=12.6 μM) in dinitrophenyl-human serum albumin (DNP-HSA)-stimulated RBL-2H3 cells. Anti-allergic effects. Licarin A reduces TNF-α and PGD2 production, and COX-2 expression[1].
Tortuosamine
5,6,7,8-Tetrahydroquinoline in whith the hydrogens at position 6 are substituted by a 3-azabutyl group and a 3,4-dimethoxyphenyl group. (S configuration). It is found in the herb kanna (Sceletium tortuosum).
Moxestrol
G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CB - Synthetic estrogens, plain D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D004965 - Estrogen Antagonists C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones ATC code: G03CB04
Acitretin
D - Dermatologicals > D05 - Antipsoriatics > D05B - Antipsoriatics for systemic use > D05BB - Retinoids for treatment of psoriasis C274 - Antineoplastic Agent > C2122 - Cell Differentiating Agent > C1934 - Differentiation Inducer C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C804 - Retinoic Acid Agent C308 - Immunotherapeutic Agent > C129820 - Antineoplastic Immunomodulating Agent D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids D003879 - Dermatologic Agents > D007641 - Keratolytic Agents
Acepromazine
Acepromazine is only found in individuals that have used or taken this drug. It is one of the phenothiazine derivative psychotropic drugs, used little in humans, however frequently in animals as a sedative and antiemetic.Acepromazine acts as an antagonist (blocking agent) on different postsysnaptic receptors -on dopaminergic-receptors (subtypes D1, D2, D3 and D4 - different antipsychotic properties on productive and unproductive symptoms), on serotonergic-receptors (5-HT1 and 5-HT2, with anxiolytic, antidepressive and antiaggressive properties as well as an attenuation of extrapypramidal side-effects, but also leading to weight gain, fall in blood pressure, sedation and ejaculation difficulties), on histaminergic-receptors (H1-receptors, sedation, antiemesis, vertigo, fall in blood pressure and weight gain), alpha1/alpha2-receptors (antisympathomimetic properties, lowering of blood pressure, reflex tachycardia, vertigo, sedation, hypersalivation and incontinence as well as sexual dysfunction, but may also attenuate pseudoparkinsonism - controversial) and finally on muscarinic (cholinergic) M1/M2-receptors (causing anticholinergic symptoms like dry mouth, blurred vision, obstipation, difficulty/inability to urinate, sinus tachycardia, ECG-changes and loss of memory, but the anticholinergic action may attenuate extrapyramidal side-effects). N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics > N05AA - Phenothiazines with aliphatic side-chain D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C66883 - Dopamine Antagonist
4-Dodecylbenzenesulfonic Acid
4-Dodecylbenzenesulfonic Acid is a sodium dodecylbenzenesulfonate, a series of organic compounds with the formula C12H25C6H4SO3Na. It is a colourless salt with useful properties as a surfactant. It is usually produced as a mixture of related sulfonates. It is a major component of laundry detergent. (Wikipedia)
Aceprometazine
Aceprometazine (INN) is a prescription drug with neuroleptic and anti-histamine properties. It is not widely prescribed. It may be used in combination with meprobamate for the treatment of sleep disorders. This combination is available in France under the trade name Mepronizine. [Wikipedia] D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent
Heptaethylene glycol
Heptaethylene glycol belongs to the class of organic compounds known as polyethylene glycols. These are oligomers or polymers of ethylene oxide, with the general formula (C2H4O)n (with n>=3).
5,5-Diisopropyl-2,2'-dimethylbiphenyl-3,3',4,4'-tetrone
5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone is found in herbs and spices. 5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone is a constituent of the leaves of thyme Thymus vulgaris. Shows antioxidant activity. Constituent of the leaves of thyme Thymus vulgaris. Shows antioxidant activity. 5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone is found in herbs and spices.
Gingerenone C
Constituent of Zingiber officinale (ginger). Gingerenone C is found in herbs and spices and ginger. Gingerenone C is found in ginger. Gingerenone C is a constituent of Zingiber officinale (ginger)
1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione
1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione is found in herbs and spices. 1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione is from Alpinia officinarum (lesser galangal). From Alpinia officinarum (lesser galangal). 1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione is found in herbs and spices.
Alkaloid AQC2
C19H22N2O3 (326.16303419999997)
Alkaloid AQC2 is an alkaloid AQC2 is an alkaloid from cell cultures of Aspidosperma quebracho-blanco (quebracho)
(+)-Galeon
(-)-Galeon is found in herbs and spices. (-)-Galeon is a constituent of Myrica gale (bog myrtle)
Isoacitretin
Isoacitretin is an oral retinoid effective in the treatment of psoriasis. It is the major metabolite of etretinate with the advantage of a much shorter half-life when compared with etretinate (Pubchem). An oral retinoid effective in the treatment of psoriasis. It is the major metabolite of etretinate with the advantage of a much shorter half-life when compared with etretinate. -- Pubchem [HMDB] D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids D003879 - Dermatologic Agents > D007641 - Keratolytic Agents
Acitretin
Acitretin is only found in individuals that have used or taken this drug. It is an oral retinoid effective in the treatment of psoriasis. It is the major metabolite of etretinate with the advantage of a much shorter half-life when compared with etretinate (PubChem). The mechanism of action of acitretin is unknown, however it is believed to work by targeting specific receptors (retinoid receptors such as RXR and RAR) in the skin which help normalize the growth cycle of skin cells. An oral retinoid effective in the treatment of psoriasis. It is the major metabolite of etretinate with the advantage of a much shorter half-life when compared with etretinate. -- Pubchem [HMDB] D - Dermatologicals > D05 - Antipsoriatics > D05B - Antipsoriatics for systemic use > D05BB - Retinoids for treatment of psoriasis C274 - Antineoplastic Agent > C2122 - Cell Differentiating Agent > C1934 - Differentiation Inducer C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C804 - Retinoic Acid Agent C308 - Immunotherapeutic Agent > C129820 - Antineoplastic Immunomodulating Agent D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids D003879 - Dermatologic Agents > D007641 - Keratolytic Agents
2-Dodecylbenzenesulfonic acid
The Na salt is likely to be a minor component of sodium laurybenzenesulfonate used as a detergent in food processing. See
1,2-Dihydrodehydroguaiaretic acid
1,2-Dihydrodehydroguaiaretic acid is found in herbs and spices. 1,2-Dihydrodehydroguaiaretic acid is a constituent of Myristica fragrans (nutmeg). Constituent of Myristica fragrans (nutmeg). 1,2-Dihydrodehydroguaiaretic acid is found in herbs and spices.
(17R)-17-Ethynyl-11-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
hydroquinidine
M - Musculo-skeletal system > M09 - Other drugs for disorders of the musculo-skeletal system > M09A - Other drugs for disorders of the musculo-skeletal system > M09AA - Quinine and derivatives C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents Hydroquinine is a cinchona alkaloid, can be used in the preparation of its derivatives such as C9 epihydroquinine, 9-acetoxy-10,11-dihydroquinine and 10,11-dihydroquinine monohydrochloride[1].
Aritmina
D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D049990 - Membrane Transport Modulators
Buparvaquone
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
Dehydrodiisoeugenol
Gelsenicine
C19H22N2O3 (326.16303419999997)
Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2]. Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2].
Hydrodolasetron
C19H22N2O3 (326.16303419999997)
2-(12-Hydroxydodec-1-en-5,10-diynyl)-3,5,6-trimethylbenzene-1,4-diol
Nipradilol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
Poncitrin
Poncitrin is a member of the class of compounds known as linear pyranocoumarins. Linear pyranocoumarins are organic compounds containing a pyran (or a hydrogenated derivative) linearly fused to a coumarin moiety. Poncitrin is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Poncitrin can be found in sweet orange, which makes poncitrin a potential biomarker for the consumption of this food product.
Calcium octanoate
It is used in foods as a binder, emulsifier and anticaking agent
Dihydroquinine
M - Musculo-skeletal system > M09 - Other drugs for disorders of the musculo-skeletal system > M09A - Other drugs for disorders of the musculo-skeletal system > M09AA - Quinine and derivatives C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents Hydroquinine is a cinchona alkaloid. Hydroquinidine (Dihydroquinidine) is a derivative of Quinidine (an antiarrhythmic agent). Hydroquinidine prolongs the QT interval and has antiarrhythmic efficacy[1][2][3]. Hydroquinidine (Dihydroquinidine) is a derivative of Quinidine (an antiarrhythmic agent). Hydroquinidine prolongs the QT interval and has antiarrhythmic efficacy[1][2][3]. Hydroquinine is a cinchona alkaloid, can be used in the preparation of its derivatives such as C9 epihydroquinine, 9-acetoxy-10,11-dihydroquinine and 10,11-dihydroquinine monohydrochloride[1].
Humantenmine
C19H22N2O3 (326.16303419999997)
Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2]. Humantenmine, a newalkaloid isolated from Gelsemium elegan Banth in China, has the potential for pain and rheumatic arthritis treatment[1][2].
Dehydrodiisoeugenol
Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2]. Dehydrodiisoeugenol is isolated from Myristica fragrans Houtt, shows anti-inflammatory and anti-bacterial actions[1]. Dehydrodiisoeugenol inhibits LPS- stimulated NF-κB activation and cyclooxygenase (COX)-2 gene expression in murine macrophages[2].
2-Carboxy-3,5-dihydroxy-4-(3-methyl-2-butenyl)bibenzyl
Acutifolin A
Broussinol
Octabenzone
CONFIDENCE standard compound; INTERNAL_ID 434; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9853; ORIGINAL_PRECURSOR_SCAN_NO 9852 CONFIDENCE standard compound; INTERNAL_ID 434; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 11562; ORIGINAL_PRECURSOR_SCAN_NO 11560 CONFIDENCE standard compound; INTERNAL_ID 434; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9908; ORIGINAL_PRECURSOR_SCAN_NO 9907 CONFIDENCE standard compound; INTERNAL_ID 434; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9929; ORIGINAL_PRECURSOR_SCAN_NO 9928 CONFIDENCE standard compound; INTERNAL_ID 434; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9896; ORIGINAL_PRECURSOR_SCAN_NO 9894 CONFIDENCE standard compound; INTERNAL_ID 434; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9937; ORIGINAL_PRECURSOR_SCAN_NO 9936
Buparvaquone
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent
6,7-Didehydro-(20S)-20-Hydroxy-3-oxopregn-4-en-18-oic acid
4-[(2R,3R)-2,3-dihydro-7-methoxy-3-methyl-5-(prop-2-enyl)benzofuran-2-yl]-2-methoxyphenol|isodihydrocarinatidin
(3S,5R)-3-Hydroxy-5-ethoxy-1-(4-hydroxyphenyl)-7-phenyl-6E-heptene
3-Methyl-2-pentenoyl-5,6-Secofuranoeremophila-1(10),2,4-trien-6-ol
3alpha-Acetoxy-7-hydroxy-5beta-(2-methylbutyryloxy) carvotanacetone
Triptonolide
A tetracyclic diterpenoid with formula C20H22O4, originally isolated from Tripterygium wilfordii.
2-Phenyl-4--6-methyl-7(?)-hydroxy-2,3-dihydro-1,4-benzoxazin-3-on|2-Phenyl-4--6-methyl-7-hydroxy-2,3-dihydro-1,4-benzoxazin-3-on|4-(2-dimethylamino-ethyl)-7-hydroxy-6-methyl-2-phenyl-4H-benzo[1,4]oxazin-3-one
C19H22N2O3 (326.16303419999997)
11alpha-hydroxy-18,20-oxido-3-oxo-pregna-1,4,17(20)-triene|pubadysone
16-epiaffinine|17-hydroxy-19,20-dihydro-vobasan-3-one|Dihydroaffinin
9,10-Dihydro-4-(1-ethoxyethyl)-1,8-dimethyl-2-methoxyphenanthrene-7-ol
Rac-(2S,3S)-5-allyl-6-hydroxy-2-(3,4-dimethoxyphenyl)-3-methyl-2,3-dihydrobenzofuran
7-(4-hydroxy-3-methoxyphenyl)-1-phenyl-3,5-heptadione|7-(4-hydroxy-3methoxyphenyl)-1-phenyl-3,5-heptadione
(4E,6R)-6-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenylhept-4-en-3-one|alpinoid B
8-[(2E)-3,7-dimethylocta-2,6-dienyl]-2,7-dihydroxynaphthalene-1,4-dione
(Z)-10-hydroxy-N(alpha)-demethyl-19,20-dehydroraumacline
C19H22N2O3 (326.16303419999997)
1,7,8,12b-tetrahydro-2,2,4-trimethyl-2h-benzo[6,7]cyclohepta[1,2,3-de][1]benzopyran-5,10,11-triol
1,3-dihydroxy-3-methyl-3-methyl-3-prenyl-2,3-dihydronaphto[1,2-b]oxepin-4(1H)-one|aggregatin D
1-(4-hydroxyphenyl)-7-(4-hydroxy-3-methoxyphenyl)-4-hepten-3-one
(9S)-3(?),9-Dihydroxy-1H-cinchonan-2-on|(9S)-3(?),9-dihydroxy-1H-cinchonan-2-one
C19H22N2O3 (326.16303419999997)
3-Geranyl-4-hydroxy-5-cumarincarbaldehyd|Piloselloidal
4-[(2S)-3,4-dihydro-7-hydroxy-8-(3-methyl-2-buten-1-yl)-2H-1-benzopyran-2-yl]-1,3-benzenediol|Anticancer Flavonoid PMV70P691-013|morusyunnansin F
(3S)-Methoxy-1,7-bis(4-hydroxyphenyl)-6E-hepten-5-one
(7alpha,8beta)-4,4-dihydroxy-3,3-dimethoxy-6,7-cyclolign-7-ene|(7R,8S)-4,5-dihydroxy-8,8-dimethyl-3,4-dimethoxy-2,7-cyclolignan-7-ene
4-[(E,3S)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-(4-hydroxyphenyl)prop-1-enyl]phenol
kibalaurifenone|pregn-3,5-diene-7-one-18,20-lactone
3-Ethyl-11-hydroxy-1,3-ethano-1,3-propanospiro[1H-indole-2(3H),2-piperidine]-9,10-dione
C19H22N2O3 (326.16303419999997)
2,4,5-trihydroxy-3-methoxy-4-(gamma,gamma-dimethylallyl)stilbene|artolacuchin
6beta-acetoxy-7beta,8beta-dihydroxy-11alphaH-eremophilan-(12,8alpha)-olide
(E)-4-(3-methyl-2-buten-1-yl)-3,3,5-trihydroxy-4-methoxystilbene
3,5,3-trihydroxy-4-methoxy-5-isopent-2-enylstilbene|MIP
(E)-3-(3-methyl-2-butenyloxy)-4,5-dihydroxy-3-methoxystilbene|E-1-[5-hydroxy-3-(3-methylbut-2-enyloxy)phenyl]-2-[4-hydroxy-3-methoxyphenyl]ethene
(E)-2-(3-methyl-2-buten-1-yl)-3,4,5-trihydroxy-3-methoxystilbene
3-Ethyl-3-hydroxy-1,3-ethano-1,3-propanospiro[1H-indole-2(3H),2-piperidine]-9,10-dione
C19H22N2O3 (326.16303419999997)
4,4-diallyl-5,5-dimethoxy-[1,1-biphenyl]-2,2-diol|biseugenol A
3-Ethyl-5-hydroxy-1,3-ethano-1,3-propanospiro[1H-indole-2(3H),2-piperidine]-9,10-dione
C19H22N2O3 (326.16303419999997)
2,10-Di-Me ether-2,3,4,10-Tetrahydroxy-1(5)-guaien-12,6-olide|3beta,4beta-dihydroxy-2alpha,10alpha-dimethoxy-11alphaH-guaia-1(5)-en-12,6beta-olide
5-hydroxy-2,8,8-trimethyl-6-(3-methyl-but-2-enyl)-8H-pyrano[2,3-f]chromen-4-one|6-(3,3-dimethylallyl)alloptaeroxylin|6-(3-methylbut-2-enyl)allopteroxylin
1-(3-Methyl-2-butenyl)-2-(4-hydroxyphenyl)-5-hydroxybicyclo[3.3.1]nona-6-ene-8,9-dione
Beninin|beninine|ent-6beta,21-epoxy-17-methoxy-aspidospermidine
1,11-di-3-furanyl-4,8-dimethyl-2,6,8-undecatrien-4-ol
8-hydroxy-2-(6-phenylhexyl)-5,6,7,8-tetrahydrochromone
2H,8H-Benzo[1,2-b:5,4-b]dipyran-2-one, 5-methoxy-8,8-dimethyl-10-(3-methyl-2-butenyl)-
10-Methoxygeissoschizol|Me ether-10-Hydroxygeissoschizol
10-(4-hydroxy-4-methylpent-2-enoyl)-13-isopropyl-5-methyl-[1,2]naphthoquinone|8-[(2E)-4-hydroxy-4-methyl-1-oxopent-2-en-1-yl]-7-methyl-3-(1-methylethyl)naphthalen-1,2-dione|prionoid E
7-(3,7-dimethylocta-2,5,7-trienyloxy)-8-methoxycoumarin|schinitrienin
(3R)-3,5-dihydroxy-4-methoxy-3,4-oxo-1,7-diphenyl-1-heptene
2-<4(?)-Hydroxyphenyl>-4--6-methyl-2,3-dihydro-1,4-benzoxazin-3-on|4-(2-dimethylamino-ethyl)-2-(4-hydroxy-phenyl)-6-methyl-4H-benzo[1,4]oxazin-3-one
C19H22N2O3 (326.16303419999997)
11-methoxy-coryn-18-en-17-ol|2-(10-methoxy-3-vinyl-1,2,3,4,6,7,12,12b-octahydro-indolo[2,3-a]quinolizin-2-yl)-ethanol
17,19-epoxy-11-methoxy-18-nor-cur-19-en-17-ol
C19H22N2O3 (326.16303419999997)
2-Phenyl-4--6-hydroxymethyl-2,3-dihydro-1,4-benzoxazin-3-on|4-(2-dimethylamino-ethyl)-6-hydroxymethyl-2-phenyl-4H-benzo[1,4]oxazin-3-one
C19H22N2O3 (326.16303419999997)
5-Methoxy-7-(4-hydroxyphenyl)-1-phenyl-3-heptanone
Phenol, 2-methoxy-6-(2-methoxy-4-(2-propenyl)phenoxy)-4-(2-propenyl)-
Kazinol U
4-(7-Hydroxy-3,4-dihydro-2H-chromen-2-yl)-3-(3-methylbut-2-enyl)benzene-1,2-diol is a natural product found in Broussonetia papyrifera with data available.
Ajmaline
A monoterpenoid indole alkaloid that consists of ajmalan substituted at positions 17 and 21 by hydroxy groups. Annotation level-1 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.572 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.566 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.567 Ajmaline is a natural product found in Rauvolfia yunnanensis, Rauvolfia balansae, and other organisms with data available. An alkaloid found in the root of RAUWOLFIA SERPENTINA, among other plant sources. It is a class 1-A antiarrhythmic agent that apparently acts by changing the shape and threshold of cardiac action potentials. C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D049990 - Membrane Transport Modulators Ajmaline (Cardiorythmine) is a sodium channel blocking, class 1A anti-arrhythmic agent. Ajmaline blocks HERG currents with an IC50 of 1 μM in HEK cells and 42.3 μM in Xenopus oocytes. Ajmaline can be used for the research of the ventricular tachyarrhythmia[1][2]. Ajmaline (Cardiorythmine) is a sodium channel blocking, class 1A anti-arrhythmic agent. Ajmaline blocks HERG currents with an IC50 of 1 μM in HEK cells and 42.3 μM in Xenopus oocytes. Ajmaline can be used for the research of the ventricular tachyarrhythmia[1][2].
2-O-Methylbroussonin C
4-(3-(4-Hydroxy-2-methoxyphenyl)propyl)-2-(3-methylbut-2-en-1-yl)phenol is a natural product found in Broussonetia papyrifera with data available.
dimoxystrobin
C19H22N2O3 (326.16303419999997)
CONFIDENCE standard compound; INTERNAL_ID 2597 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3598
ACEPROMAZINE
N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics > N05AA - Phenothiazines with aliphatic side-chain D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C66883 - Dopamine Antagonist
[5-acetyloxy-3-(hydroxymethyl)-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] 3-methylbutanoate
1-[2,4-dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)propan-1-one
4-[(3S)-7-hydroxy-8-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-3-yl]benzene-1,3-diol
4-amino-2-hydroxy-5-[[1-hydroxy-1-(5-oxo-6-bicyclo[4.1.0]hept-3-enyl)propan-2-yl]amino]-5-oxopentanoic acid
Dodecylbenzenesulfonic acid
CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8762
NPE_327.1704_12.2
C19H22N2O3 (326.16303419999997)
CONFIDENCE Tentative identification: most likely structure (Level 3); INTERNAL_ID 1102
C20H22O4_2-Methoxy-4-{(2S,3R)-7-methoxy-3-methyl-5-[(1E)-1-propen-1-yl]-2,3-dihydro-1-benzofuran-2-yl}phenol
C20H26N2O2_(17R,21alpha)-Ajmalan-17,21-diol
C20H26N2O2_Ajmalan-17,21-diol, (17R,21alpha)
dihydroquinine
M - Musculo-skeletal system > M09 - Other drugs for disorders of the musculo-skeletal system > M09A - Other drugs for disorders of the musculo-skeletal system > M09AA - Quinine and derivatives D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents Hydroquinine is a cinchona alkaloid, can be used in the preparation of its derivatives such as C9 epihydroquinine, 9-acetoxy-10,11-dihydroquinine and 10,11-dihydroquinine monohydrochloride[1].
[5-acetyloxy-3-(hydroxymethyl)-2-oxo-6-propan-2-ylcyclohex-3-en-1-yl] 3-methylbutanoate
4-amino-2-hydroxy-5-[[1-hydroxy-1-(5-oxo-6-bicyclo[4.1.0]hept-3-enyl)propan-2-yl]amino]-5-oxopentanoic acid
Aceprometazine
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent
Etymemazine
C20H26N2S (326.18165960000005)
C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
N-Methylisothebainium
Origin: Plant; SubCategory_DNP: Isoquinoline alkaloids, Morphine alkaloids, Thebaine alkaloids
Ajmalin
Origin: Plant; Formula(Parent): C20H26N2O2; Bottle Name:Ajmaline; PRIME Parent Name:Ajmaline; PRIME in-house No.:V0319; SubCategory_DNP: Monoterpenoid indole alkaloids, Ajmaline alkaloids, Indole alkaloids Ajmaline (Cardiorythmine) is a sodium channel blocking, class 1A anti-arrhythmic agent. Ajmaline blocks HERG currents with an IC50 of 1 μM in HEK cells and 42.3 μM in Xenopus oocytes. Ajmaline can be used for the research of the ventricular tachyarrhythmia[1][2]. Ajmaline (Cardiorythmine) is a sodium channel blocking, class 1A anti-arrhythmic agent. Ajmaline blocks HERG currents with an IC50 of 1 μM in HEK cells and 42.3 μM in Xenopus oocytes. Ajmaline can be used for the research of the ventricular tachyarrhythmia[1][2].
4-amino-2-hydroxy-5-[[1-hydroxy-1-(5-oxo-6-bicyclo[4.1.0]hept-3-enyl)propan-2-yl]amino]-5-oxopentanoic acid_major
4-amino-2-hydroxy-5-[[1-hydroxy-1-(5-oxo-6-bicyclo[4.1.0]hept-3-enyl)propan-2-yl]amino]-5-oxopentanoic acid_95.8\\%
Gly Gly Pro Pro
Gly Pro Gly Pro
Gly Pro Pro Gly
Pro Gly Gly Pro
Pro Gly Pro Gly
Pro Pro Gly Gly
Hydroquinine
Hydroquinine is a cinchona alkaloid, can be used in the preparation of its derivatives such as C9 epihydroquinine, 9-acetoxy-10,11-dihydroquinine and 10,11-dihydroquinine monohydrochloride[1].
2,6-Methano-2H-quinolizine(MDL 74156)
C19H22N2O3 (326.16303419999997)
1H-Indole-3-carboxylic acid, octahydro-3-hydroxy-2,6-methano-2H-quinolizin-8-yl ester, N-oxide
C19H22N2O3 (326.16303419999997)
Soriatane
D - Dermatologicals > D05 - Antipsoriatics > D05B - Antipsoriatics for systemic use > D05BB - Retinoids for treatment of psoriasis C274 - Antineoplastic Agent > C2122 - Cell Differentiating Agent > C1934 - Differentiation Inducer C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C804 - Retinoic Acid Agent C308 - Immunotherapeutic Agent > C129820 - Antineoplastic Immunomodulating Agent D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids D003879 - Dermatologic Agents > D007641 - Keratolytic Agents
Isoacitretin
D020011 - Protective Agents > D000975 - Antioxidants > D002338 - Carotenoids D003879 - Dermatologic Agents > D007641 - Keratolytic Agents
Acetylpromazine
N - Nervous system > N05 - Psycholeptics > N05A - Antipsychotics > N05AA - Phenothiazines with aliphatic side-chain D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018492 - Dopamine Antagonists D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C66883 - Dopamine Antagonist
LABSA
A member of the class dodecylbenzenesulfonic acids that is benzenesulfonic acid in which the hydrogen at position 2 of the phenyl ring is substituted by a dodecyl group. D013501 - Surface-Active Agents D000890 - Anti-Infective Agents D004202 - Disinfectants
(+)-galeon
1-(4-Hydroxy-3-methoxyphenyl)-7-phenyl-3,5-heptanedione
Alkaloid AQC2
C19H22N2O3 (326.16303419999997)
5,5-Diisopropyl-2,2'-dimethylbiphenyl-3,3',4,4'-tetrone
5-Acetoxy-3-(hydroxymethyl)-6-isopropyl-2-oxo-3-cyclohexen-1-yl 3-methylbutanoate
4-Allyl-2-[1-(1,3-benzodioxol-5-yl)-2-propanyl]-6-methoxyphenol
AA-861
D004791 - Enzyme Inhibitors > D016859 - Lipoxygenase Inhibitors C471 - Enzyme Inhibitor > C1322 - Lipooxygenase Inhibitor Docebenone (AA 861) is a potent, selective and orally active 5-LO (5-lipoxygenase) inhibitor.
Peficitinib
L - Antineoplastic and immunomodulating agents > L04 - Immunosuppressants > L04A - Immunosuppressants > L04AA - Selective immunosuppressants C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor D007155 - Immunologic Factors > D007166 - Immunosuppressive Agents D004791 - Enzyme Inhibitors
1-[2-AMINO-1-(3-PHENOXY-PHENYL)-ETHYL]-PYRROLIDINE-3-CARBOXYLICACID
C19H22N2O3 (326.16303419999997)
1-{2-(Cyclopropylmethoxy)-6-[(4-methoxybenzyl)oxy]phenyl}ethanone
N-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YL)PROPANE-2-SULFONAMIDE
[2-[1,1-Dimethyl-2-[(1-oxoallyl)oxy]ethyl]-5-ethyl-1,3-dioxan-5-yl]methyl acrylate
4-BENZYLAMINO-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER-HCl
C17H27ClN2O2 (326.17609519999996)
1H-Pyrrolo[2,3-b]pyridine, 1-[(1,1-dimethylethyl)dimethylsilyl]-5-(3-fluorophenyl)-
C19H23FN2Si (326.16144499999996)
ethyl prop-2-enoate,N-(hydroxymethyl)prop-2-enamide,prop-2-enenitrile,prop-2-enoic acid
1-(((TERT-BUTYLDIPHENYLSILYL)OXY)METHYL)CYCLOPROPANOL
3-Fluorophenyl 4-trans-ethylcyclohexylbenzoate
C21H23FO2 (326.16819899999996)
10-(a-diethylaminopropionyl)-phenothiazi ne hydrochloride (as-139
Glycine,N,N-1,2-ethanediylbis[N-(carboxymethyl)-, ammonium salt (1:2)
Bumadizone
C19H22N2O3 (326.16303419999997)
M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents
2-(Boc-Amino)thiazole-5-boronic acid pinacol ester
[2-[(8S,9R,10S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
(2S,3aS,7aS)-1-{N-[(methyloxy)carbonyl]-L-valyl}octahydro-1H-indole-2-carboxylic acid
(1R,4R)-[4-(6-Chloro-pyriMidin-4-ylaMino)-cyclohexyl]-carbaMic acid tert-butyl ester
2-ETHYL-4-(4-METHYLPIPERAZIN-1-YL)-10H-BENZO[B]THIENO[2,3-E][1,4]DIAZEPINE
2-Amino-3-benzyloxypyridine-5-boronic acid pinacol ester
C18H23BN2O3 (326.18016380000006)
Epsiprantel
C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent
Agatharesinol acetonide
A natural product found in Metasequoia glyptostroboides.
4-([2-(1H-INDOL-3-YL)-ETHYLAMINO]-METHYL)-2,6-DIMETHOXY-PHENOL
C19H22N2O3 (326.16303419999997)
tert-Butyl 3-(benzylamino)piperidine-1-carboxylate hydrochloride
C17H27ClN2O2 (326.17609519999996)
6-(cyclohexylsulfanyl)-1-(ethoxymethyl)-5-(1-methylethyl)pyrimidine-2,4(1H,3H)-dione
Triptophenolide methyl ether
A tetracyclic diterpenoid with formula C21H26O3, originally isolated from Tripterygium wilfordii.
(3bR,9bS)-6-hydroxy-9b-methyl-7-(propan-2-yl)-3,3b,4,9b,10,11-hexahydrophenanthro[1,2-c]furan-1,5-dione
Benzeneacetamide, 2-((2,5-dimethylphenoxy)methyl)-alpha-(methoxyimino)-N-methyl-
C19H22N2O3 (326.16303419999997)
(2-Hydroxy-3-phosphonooxypropyl) decanoate
C13H27O7P (326.14943220000004)
Methacrylic acid 2-hydroxy-3-(4-anilinoanilino)propyl ester
C19H22N2O3 (326.16303419999997)
5,5-Diethoxy-4-hydroxy-2-oxopentylphosphonic acid diethyl ester
C13H27O7P (326.14943220000004)
1-(2-(2-Methyl-5-pyridyl)ethyl)-3-phenyl-2-methylindole
VALTORCITABINE
C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
(3,3-Dimethylpiperidin-1-yl)(6-(3-fluoro-4-methylphenyl)pyridin-2-yl)methanone
C20H23FN2O (326.17943199999996)
(3aS,4R,9bR)-4-(4-hydroxyphenyl)-6-(methoxymethyl)-1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen-8-ol
(3r,4s)-1-(3,4-Dimethoxyphenyl)-3-(3-Methylphenyl)piperidin-4-Amine
2,6-Dimethyl-1-(3-[3-methyl-5-isoxazolyl]-propanyl)-4-[2-methyl-4-isoxazolyl]-phenol
C19H22N2O3 (326.16303419999997)
Nipradilol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
(5AR,6S,8S,10S,11S,11as,12ar,13R)-5-methyl-5a,6,8,9,10,11,11a,12-octahydro-5H-6,10:11,12a-dimethanoindolo[3,2-b]quinolizine-8,13-diol
(S)-[(2R,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methanol
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BA - Antiarrhythmics, class ia D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
Lysine acetylsalicylate
D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors D000893 - Anti-Inflammatory Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D012459 - Salicylates D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D002491 - Central Nervous System Agents > D000700 - Analgesics D004791 - Enzyme Inhibitors
4-DODECYLBENZENESULFONIC ACID
Surfactant for use in washing or lye peeling of fruit and vegetables and poultry scald solutions
4-Amino-2-hydroxy-5-[[1-hydroxy-1-(2-oxo-1-bicyclo[4.1.0]hept-3-enyl)propan-2-yl]amino]-5-oxopentanoic acid
4-{Methyl[3-phenyl-3-(pyridin-2-yl)propyl]amino}-4-oxobutanoic acid
C19H22N2O3 (326.16303419999997)
1-hydroxy-2,11-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium
(9R,10S,12S,13S,14R,16S,18R)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
4-[(5-hydroxyadamantan-2-yl)amino]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
2-(12-Hydroxydodec-1-en-5,10-diynyl)-3,5,6-trimethylbenzene-1,4-diol
[3-carboxy-2-[(3E,5E,7E)-8-carboxyocta-3,5,7-trienoyl]oxypropyl]-trimethylazanium
C16H24NO6+ (326.16035439999996)
[3-carboxy-2-[(2E,4E,7E)-8-carboxyocta-2,4,7-trienoyl]oxypropyl]-trimethylazanium
C16H24NO6+ (326.16035439999996)
3-[2-(4-methyl-2-propan-2-ylphenoxy)ethyl]-1H-benzimidazole-2-thione
1-{(E)-amino[(4-methylquinazolin-2-yl)amino]methylidene}-3-cyclohexylurea
nor-6,7-secoangustilobine A, (rel)-
C19H22N2O3 (326.16303419999997)
A natural product found in Alstonia spatulata.
[4-(2-Hydroxyethyl)-1-piperazinyl]-(4-phenylphenyl)methanethione
(1R,9R,13S,14R,16S)-13-Ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
4-[[4-(2,5-Dimethylphenyl)-1-piperazinyl]methyl]-2-methoxyphenol
4-(4-methoxyphenyl)-N-[(E)-(2-methoxyphenyl)methylidene]butanehydrazide
C19H22N2O3 (326.16303419999997)
3-(4-Acetylphenyl)-1-(phenylmethyl)-1-propylthiourea
1-Decanoyl-sn-glycero-3-phosphate
C13H27O7P (326.14943220000004)
A 1-acyl-sn-glycerol 3-phosphate in which the 1-acyl substituent is specified as decanoyl.
N-[2-(1-cyclohexenyl)ethyl]-3-(1,3-dioxo-2-isoindolyl)propanamide
C19H22N2O3 (326.16303419999997)
8-Methoxy-5-methyl-3-[2-(1-pyrrolidinyl)ethyl]-4-pyrimido[5,4-b]indolone
N-(4-acetamidophenyl)-2-(5-methyl-4,5,6,7-tetrahydroindazol-2-yl)acetamide
(1S)-1-[(1R,15R,17R,18R)-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-17-yl]ethanol
N-[(3-methylphenyl)methyl]-6-(3-pyridinyl)-4-quinazolinamine
4-(4-morpholinyl)-N-phenyl-6-(1-pyrrolidinyl)-1,3,5-triazin-2-amine
6-(3-methylphenyl)-N-(3-pyridinylmethyl)-4-quinazolinamine
1-[2,4-Dihydroxy-3-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)propan-1-one
N-[(2S,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
N-[(2S,3R,6S)-2-(hydroxymethyl)-6-(2-oxo-2-piperidin-1-ylethyl)-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
N-[(2R,3R,6S)-2-(hydroxymethyl)-6-(2-oxo-2-piperidin-1-ylethyl)-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
[(1R,2aS,8bS)-1-(hydroxymethyl)-2-methyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-fluorophenyl)methanone
(6R,7S,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
N-[(2R,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(1-piperidinyl)ethyl]-3,6-dihydro-2H-pyran-3-yl]-2-methoxyacetamide
[(1S,2aR,8bR)-1-(hydroxymethyl)-2-methyl-1,2a,3,8b-tetrahydroazeto[2,3-c]quinolin-4-yl]-(4-fluorophenyl)methanone
(6S,7S,8S)-7-[4-(2-fluorophenyl)phenyl]-8-(hydroxymethyl)-1,4-diazabicyclo[4.2.0]octan-2-one
1-(4-Fluorophenyl)-3-(4-methyl-1-piperazinyl)-2-phenyl-1-propanone
C20H23FN2O (326.17943199999996)
(1R,9R,12R,13S,14R,16S)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
2-(5-amino-4-cyano-1H-imidazol-1-yl)-5-(4-methylpiperazin-1-yl)benzoic acid
(1R,9R,10S,12R,13S,14R,16S)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
(1R,9R,10S,12S,13S,14R,16S,18R)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
(1R,13S,14R,16S)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
(2S,3S)-2-Benzyloxy-4-(tert-butyldimethylsilyloxy)butan-1,3-diol
1,2-Diethyl-1,2-dimethyl-1,2-di(p-tolyl)disilane
C20H30Si2 (326.18859399999997)
(12R,14R,16S,18S)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol
5,5-Diisopropyl-2,2-dimethylbiphenyl-3,3,4,4-tetrone
1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)-(4E)-4-hepten-3-one
A diarylheptanoid that is (4E)-4-hepten-3-one substituted by a 4-hydroxy-3-methoxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7 respectively. It has been isolated from the rhizomes of Curcuma kwangsiensis.
1-(4-hydroxy-3-methoxyphenyl)-7-phenylheptane-3,5-dione
(R)-[(2S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxy-4-quinolinyl)methanol
Crocetin(2-)
A dicarboxylic acid dianion resulting from the removal of a proton from both of the carboxy groups of crocetin. The major species at pH 7.3.
2-Deamino-2-hydroxyneamine(3+)
An organic cation obtained by protonation of the three amino groups of 2-deamino-2-hydroxyneamine; major species at pH 7.3.
(9r)-17,19-dioxatetracyclo[12.6.1.1²,⁶.0¹⁶,²⁰]docosa-1(21),2(22),3,5,14,16(20)-hexaene-3,9-diol
7-methoxy-11,11-dimethyl-5h,10h,10ah-benzo[b]fluorene-4b,5,9-triol
8-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-2,7-dihydroxynaphthalene-1,4-dione
6-methoxy-3-(6-methoxy-3,4-dihydro-2h-1-benzopyran-3-yl)-3,4-dihydro-2h-1-benzopyran
3-ethyl-11-hydroxy-5-oxa-8,18-diazapentacyclo[9.7.1.1³,⁸.0⁴,⁶.0¹²,¹⁷]icosa-1(18),12,14,16-tetraen-19-one
C19H22N2O3 (326.16303419999997)
4-{6,7-dimethyl-2h,5h,6h,7h,8h-naphtho[2,3-d][1,3]dioxol-5-yl}-2-methoxyphenol
6-[7-hydroxy-4-methyl-3-(propan-2-ylidene)heptyl]naphthalene-1,4-dione
5-methyl-4-{2-[(3z,5r)-5-(2-methylprop-1-en-1-yl)oxolan-3-ylidene]ethoxy}chromen-2-one
(12r,19s)-12-ethyl-9,19-dihydroxy-8,16-diazatetracyclo[10.6.1.0²,⁷.0¹⁶,¹⁹]nonadeca-1(18),2,4,6,8-pentaen-17-one
C19H22N2O3 (326.16303419999997)
10-hydroxy-2-isopropyl-3-methoxy-8,8-dimethyl-7h-phenanthrene-1,9-dione
methyl (4s,4ar,11bs)-4,7,11b-trimethyl-1h,2h,3h,4ah,5h,6h-phenanthro[3,2-b]furan-4-carboxylate
7-ethyl-3,8,9-trihydroxy-2,4,4,6-tetramethylanthracen-1-one
8-methoxy-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5,7,9,16-tetraen-14-ol
C19H22N2O3 (326.16303419999997)
(4e,6r)-6-hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-phenylhept-4-en-3-one
(2's,4ar,5'r,6'r,7r)-9'-hydroxy-5',7-dimethyl-4a,5,6,7-tetrahydro-11'-azaspiro[cyclopenta[c]pyridine-4,8'-tricyclo[5.2.2.0²,⁶]undecan]-10'-ene-1'-carbaldehyde
(1r)-13,16,16-trimethyl-15-oxatetracyclo[8.7.1.0²,⁷.0¹⁴,¹⁸]octadeca-2,4,6,10,12,14(18)-hexaene-5,6,12-triol
(6z,9z)-10-[(1r,3r,4r,6r,7s)-6-chloro-3-ethyl-2-oxabicyclo[2.2.1]heptan-7-yl]deca-6,9-dienoic acid
[(1s,12s,13r,16s,17s,18r)-16,20-dimethyl-15-oxa-3,20-diazapentacyclo[10.7.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]icosa-2(10),4,6,8-tetraen-17-yl]methanol
4-[(3s)-3-[(4s)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-(4-hydroxyphenyl)prop-1-en-1-yl]phenol
10-{6-chloro-3-ethyl-2-oxabicyclo[2.2.1]heptan-7-yl}deca-6,9-dienoic acid
(1r,12r,13s,16s,18r)-20,20-dimethyl-10,19-diazapentacyclo[14.2.2.0³,¹¹.0⁴,⁹.0¹³,¹⁸]icosa-3(11),4,6,8-tetraene-12,13-diol
(3as,3br,9bs,11as)-3b,11a-dimethyl-1-oxo-2h,3h,3ah,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl acetate
5-[(1r)-1-ethoxyethyl]-7-methoxy-1,8-dimethyl-9,10-dihydrophenanthren-2-ol
(2r,3s,4r,5r,6s)-2-{[(2r,3r,4r)-2,6-dihydroxy-4-methoxyhexan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(1s)-1-[(1r,15s,17s,18r)-7-methoxy-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8-tetraen-17-yl]ethanol
(6r,7s,8s)-8-(2h-1,3-benzodioxol-5-yl)-3-methoxy-6,7-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
(3ar,3bs,9ar,9br,11r,11as)-1-acetyl-11-hydroxy-9a,11a-dimethyl-3h,3ah,3bh,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-one
4-[(3s)-7-hydroxy-3,4-dihydro-2h-1-benzopyran-3-yl]-6-(2-methylbut-3-en-2-yl)benzene-1,3-diol
(1s,2s,9s,11r,12r,13s)-11-hydroxy-6,13-dimethyl-7-oxapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-5,14,17-trien-16-one
(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-yl (2e,6z)-deca-2,6-dien-4-ynoate
2-(4-methoxyphenyl)-6-[2-(4-methoxyphenyl)ethyl]oxane
2-[(2r,3z,12bs)-3-ethylidene-9-methoxy-1h,2h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizin-2-yl]ethanol
4-(7-hydroxy-3,4-dihydro-2h-1-benzopyran-2-yl)-3-(3-methylbut-2-en-1-yl)benzene-1,2-diol
(1s,12as,13r,14r,15ar)-14-chloro-1-ethyl-13-hydroxy-1h,4h,5h,6h,7h,10h,12ah,13h,14h,15h,15ah-cyclopenta[c]oxacyclotetradecan-3-one
(4br,5r,9ar,10as)-5,9a-dihydroxy-7-methoxy-11,11-dimethyl-4bh,5h,10h,10ah-cyclohexa[b]fluoren-9-one
3-hydroxy-5-[(1z)-3-hydroxy-4-methylpenta-1,3-dien-1-yl]-2-isopropyl-6-methylnaphthalene-1,4-dione
19,21-dioxa-2,12-diazaheptacyclo[10.9.1.1¹⁶,²⁰.0¹,⁹.0²,¹⁸.0³,⁸.0¹⁶,²²]tricosa-3,5,7-trien-9-ol
C19H22N2O3 (326.16303419999997)
(2s,3s)-2-(3,4-dimethoxyphenyl)-3-methyl-5-(prop-2-en-1-yl)-2,3-dihydro-1-benzofuran-6-ol
(1s,9s,13r,14r,16r)-13-ethyl-8-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6-triene-14,18-diol
(3e,7z)-1,11-bis(furan-3-yl)-4,8-dimethylundeca-3,7-dien-6-one
(1s)-13,16,16-trimethyl-15-oxatetracyclo[8.7.1.0²,⁷.0¹⁴,¹⁸]octadeca-2,4,6,10,12,14(18)-hexaene-4,5,12-triol
1-[(1r,12r,13r,14s)-13-(hydroxymethyl)-3,16-dimethyl-3,16-diazatetracyclo[10.3.1.0²,¹⁰.0⁴,⁹]hexadeca-2(10),4,6,8-tetraen-14-yl]propan-2-one
2-[(2r,3z,12bs)-3-ethylidene-8-methoxy-1h,2h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizin-2-yl]ethanol
12-ethyl-10-hydroxy-8,16-diazapentacyclo[10.6.1.0¹,⁹.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6-triene-8-carbaldehyde
3-[3-(7-butyl-6-hydroxy-4-methyl-6,7-dihydro-1,5,2,3-dioxadiazepin-2-yl)-3-oxopropyl]-5h-furan-2-one
(1r,3as,3br,5r,9bs,11as)-1-ethynyl-7-methoxy-11a-methyl-2h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthrene-1,5-diol
2-[(2r,3e,12bs)-3-ethylidene-9-methoxy-1h,2h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizin-2-yl]ethanol
4-[(2r)-7-hydroxy-3,4-dihydro-2h-1-benzopyran-2-yl]-3-(3-methylbut-2-en-1-yl)benzene-1,2-diol
4-[(3s,5r,6e)-5-ethoxy-3-hydroxy-7-phenylhept-6-en-1-yl]phenol
6,7,13-trihydroxy-4,11,11-trimethyl-12-oxatricyclo[6.3.2.0¹,⁹]tridec-4-en-2-yl acetate
3b,11a-dimethyl-1-oxo-2h,3h,3ah,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl acetate
15-ethyl-4-hydroxy-17-oxa-1,11-diazapentacyclo[13.4.1.0⁴,¹².0⁵,¹⁰.0¹⁶,¹⁸]icosa-5,7,9,11-tetraen-13-one
C19H22N2O3 (326.16303419999997)