Exact Mass: 296.1736
Exact Mass Matches: 296.1736
Found 500 metabolites which its exact mass value is equals to given mass value 296.1736
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Crocetindial
Crocetin dialdehyde is an apo carotenoid diterpenoid compound arising from oxidative degradation of the beta,beta-carotene skeleton at the 8- and 8-positions. It is an enal, a dialdehyde and an apo carotenoid diterpenoid. Crocetin dialdehyde is a natural product found in Plectranthus barbatus with data available.
Exemestane
Exemestane is an oral steroidal aromatase inhibitor used in the adjuvant treatment of hormonally-responsive (also called hormone-receptor-positive, estrogen-responsive) breast cancer in postmenopausal women. It acts as a false substrate for the aromatase enzyme, and is processed to an intermediate that binds irreversibly to the active site of the enzyme causing its inactivation. L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02B - Hormone antagonists and related agents > L02BG - Aromatase inhibitors D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D065088 - Steroid Synthesis Inhibitors D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D004965 - Estrogen Antagonists C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor D004791 - Enzyme Inhibitors > D065088 - Steroid Synthesis Inhibitors > D047072 - Aromatase Inhibitors C274 - Antineoplastic Agent > C129818 - Antineoplastic Hormonal/Endocrine Agent > C481 - Antiestrogen C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C1740 - Aromatase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist CONFIDENCE standard compound; EAWAG_UCHEM_ID 661 D000970 - Antineoplastic Agents
17a-Ethynylestradiol
Ethinyl estradiol. A semisynthetic alkylated estradiol with a 17-alpha-ethinyl substitution. It has high estrogenic potency when administered orally, and is often used as the estrogenic component in oral contraceptives. -- Pubchem; estradiol (17-beta estradiol) (also oestradiol) is a sex hormone. Labelled the "female" hormone but also present in males it represents the major estrogen in humans. Critical for sexual functioning, estradiol also supports bone growth. -- Wikipedia; One of the fascinating twists to mammalian sexual differentiation is that estradiol is one of the two active metabolites of testosterone in males (the other being dihydrotestosterone). estradiol cannot be transferred readily from the circulation into the brain. Since fetuses of both sexes are exposed to similarly high levels of maternal estradiol, it can play little role in prenatal sexual differentiation. However, testosterone enters the central nervous system more freely and significant amounts are aromatized to estradiol within the brain of most male mammals, including humans. There is now much evidence that the programming of adult male sexual behavior in "lower mammals," (such as mounting rather than lordosis behavior), is largely dependent on estradiol produced in the central nervous system during prenatal life and early infancy from testosterone. We do not yet know whether this process plays a minimal or significant part in human sexual behaviors. -- Wikipedia; A synthetic form of estradiol, called ethinyl estradiol is a major component of hormonal contraceptive devices. Combined oral contraceptives contain ethinyl estradiol and a progestin, which both contribute to the inhibition of GnRH, LH, and FSH. The inhibition of these hormones accounts for the ability of combined oral contraceptives or birth control pills to prevent ovulation and thus prevent pregnancy. Other types of hormonal birth control contain only progestins and no ethinyl estradiol. -- Wikipedia. A synthetic form of estradiol, called ethinyl estradiol is a major component of hormonal contraceptive devices. 17alpha-ethynylestradiol is found in many foods, some of which are common walnut, ginkgo nuts, allspice, and papaya. G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CA - Natural and semisynthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Ethinylestradiol (Ethynyl estradiol) is a biologically active estrogen. Ethinylestradiol is a click chemistry reagent, itcontains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups. Ethinylestradiol (Ethynyl estradiol) is a biologically active estrogen. Ethinylestradiol is a click chemistry reagent, itcontains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
3-Methoxy-D-homoestra-1,3,5(10),8,14-pentaen-17abeta-ol
Cinchonamine
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.690 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.686 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.679 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.682
Palonosetron
Palonosetron (INN, trade name Aloxi) is a 5-HT3 antagonist used in the prevention and treatment of chemotherapy-induced nausea and vomiting (CINV). It is the most effective of the 5-HT3 antagonists in controlling delayed CINV nausea and vomiting that appear more than 24 hours after the first dose of a course of chemotherapy and is the only drug of its class approved for this use by the U.S. Food and Drug Administration. As of 2008, it is the most recent 5-HT3 antagonist to enter clinical use. [wikipedia]
Hydrocinchonine
Hydrocinchonine is found in fruits. Hydrocinchonine is an alkaloid from Olea europae
Methyl dihydrophaseate
Methyl dihydrophaseate is found in pulses. Methyl dihydrophaseate is isolated from French beans. Isolated from French beans. Methyl dihydrophaseate is found in pulses.
3,8-Dihydroxy-6-methoxy-7(11)-eremophilen-12,8-olide
3,8-Dihydroxy-6-methoxy-7(11)-eremophilen-12,8-olide is found in green vegetables. 3,8-Dihydroxy-6-methoxy-7(11)-eremophilen-12,8-olide is a constituent of Petasites japonicus (sweet coltsfoot). Constituent of Petasites japonicus (sweet coltsfoot). 3b,8a-Dihydroxy-6b-methoxy-7(11)-eremophilen-12,8-olide is found in green vegetables.
5-Methoxy-1,7-diphenyl-3-heptanone
5-Methoxy-1,7-diphenyl-3-heptanone is found in herbs and spices. 5-Methoxy-1,7-diphenyl-3-heptanone is a constituent of rhizomes of Alpinia officinarum (lesser galangal). Constituent of rhizomes of Alpinia officinarum (lesser galangal). 5-Methoxy-1,7-diphenyl-3-heptanone is found in herbs and spices.
Panaxydol chlorohydrin
Panaxydol chlorohydrin is found in tea. Panaxydol chlorohydrin is isolated from Korean ginseng root. Isolated from Korean ginseng root. Panaxydol chlorohydrin is found in tea.
2-hydroxyimipramine
2-hydroxyimipramine is a metabolite of imipramine. Imipramine (sold as Antideprin, Deprimin, Deprinol, Depsol, Depsonil, Dynaprin, Eupramin, Imipramil, Irmin, Janimine, Melipramin, Surplix, Tofranil), also known as melipramine, is an antidepressant medication, a tricyclic antidepressant of the dibenzazepine group. Imipramine is mainly used in the treatment of major depression and enuresis (inability to control urination). It has also been evaluated for use in panic disorder. (Wikipedia)
17-alpha-ethinyl estradiol
17-alpha-ethinyl estradiol is a metabolite of mestranol. Mestranol is the 3-methyl ether of ethinylestradiol. It was the estrogen used in many of the first oral contraceptives. It is a biologically inactive prodrug of ethinylestradiol to which it is demethylated in the liver with a conversion efficiency of 70\\% (50 µg of mestranol is pharmacokinetically bioequivalent to 35 µg of ethinylestradiol). (Wikipedia)
(1S,17R)-17-Ethyl-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraen-7-ol
(2-Methoxy-benzyl)-(2-phenyl-piperidin-3-yl)-amine
17beta-Ethinylestradiol
2-Hydroxydesmethyltrimipramine
Batelapine
C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent
3-Piperidinamine, N-((2-methoxyphenyl)methyl)-2-phenyl-, (2R,3R)-
Imipraminoxide
N - Nervous system > N06 - Psychoanaleptics > N06A - Antidepressants > N06AA - Non-selective monoamine reuptake inhibitors C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent
Palonosetron, (3R)-
Dihydrocinchonine
Dihydrocinchonine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Dihydrocinchonine can be found in olive, which makes dihydrocinchonine a potential biomarker for the consumption of this food product.
crocetin dialdehyde
Crocetin dialdehyde is a member of the class of compounds known as acyclic diterpenoids. Acyclic diterpenoids are diterpenoids (compounds made of four consecutive isoprene units) that do not contain a cycle. Crocetin dialdehyde is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Crocetin dialdehyde can be found in a number of food items such as purple laver, sweet bay, rowanberry, and yellow wax bean, which makes crocetin dialdehyde a potential biomarker for the consumption of these food products.
dehydrokahweol
3-Hydroxy-5-methoxy-2-(3-methyl-2-butenyl)bibenzyl
7,8,9,10,11,11a-Hexahydro-11a-hydroxy-6-methyl-10-methylene-2-(1-methylethyl)-1H-cycloocta[de]naphthalene-1-one
3beta-Hydroxy-5alpha-Hydroperoxycostic acid methyl ester
5-Hydroxy-3-methoxy-2-(3-methyl-2-butenyl)bibenzyl
4-Hydroxy-3-methoxy-4-(3-methyl-2-butenyl)bibenzyl
[4S-(4alpha,4aalpha,5alpha,8aalpha,9aalpha)]-4a,5,6,7,8,8a,9,9a-Octahydro-4,8a-dihydroxy-9a-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one
3-Hydroxy-4-methoxy-4-(3-methyl-2-butenyl)bibenzyl
Propizepine
C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent
6S-acetyl-4R,5R-dimethyl-1R(10S)-epoxy-2R-hydroxy-7R-acetoxydecahydronaphthalene
1beta,10alpha-epoxy-4-methoxy-8-hydroxyglechomanolide
rugosic acid A methyl ester|rugosid acid A methyl ester
8a-Ethyl-7,8,8a,9,10,11,12a,13-octahydroindolizino[8,1-ef][1]benzoazonine-6(5H)-one
7alpha,10alpha-dihydroxy-1beta-methoxyeremophil-11(13)-en-12,8beta-olide
1,8,11,13-cleistanthatetraen-3,7-dione|<5S,10S>-cleistantha-8,11,13-triene-3,7-dione|[5S,10S]-cleistantha-8,11,13-triene-3,7-dione
5-acetyloxy-3,9a-dihydroxy-9a-homomegastigma-6,7-dien-9-one
Saprothoquinone
Saprothoquinone is a natural product found in Salvia hypargeia, Salvia montbretii, and Salvia prionitis with data available.
4beta,10beta-dihydroxy-1alpha-methoxy-5alpha,11alphaH-guaia-2-en-12,6alpha-olide
Me ester -(4alpha,6alpha,11xi)-4,6-Dihydroxy-9-oxo-7-eudesmen-12-oic acid
1-(4-methoxyphenyl)-7-(4-hydroxyphenyl)-(E)-hept-2-ene
8beta,10beta-dihydroxy-6beta-methoxyeremophil-7(11)-en-12,8alpha-olide|8beta,10beta-dihydroxy-6beta-methoxyleremophilenolide|8??,10??-Dihydroxy-6??-methoxyeremophil-7(11)-en-12,8??-olide
1beta,10beta-epoxy-7beta-hydroxy-8alpha-methoxyeremophil-11alphaH-12,8beta-olide
(1R*, 1aS*, 4R*, 7R*, 7aS*, 7b*, 5Z)-4,4a,7-trihydroxyaromadendr-5-en-8-oic acid methyl ester
10alpha,13-dihydroxy-1beta-methoxyeremophil-7(11)-en-12,8beta-olide
4,10-dihydroxy-8-methoxyguai-7(11)-en-8,12-olide|8-O-methylzedoarolide B
(4aR,5S,8R,8aS,9aS)-4a,5,6,7,8,8a,9,9a-octahydro-8,8a-dihydroxy-9a-methoxy-3,4a,5-trimethylnaphtho[2,3-b]furan-2(4H)-one|1beta,10beta-dihydroxy-8beta-methoxyeremophil-7(11)-en-12,8alpha-olide
(1R,4aS,5R,8aR)-1,2,3,4,4a,5,8,8a-octahydro-5-hydroxy-5-(hydroxymethyl)-1,4a,6-trimethyl-8-oxonaphthalene-1-carboxylic acid methyl ester|loxocalyxins B
12, 13-Dihydro, Ac-(3E, 6S, 7S, 9Z, 12Z)-7-Chloro-3, 9, 12-pentadecatrien-1-yn-6-ol
4beta,5beta-epoxy-3beta-hydroxy-10alpha-methoxy-11alphaH-guaia-1-en-12,6beta-olide
4-(3-Methyl-2-butenyl)-5-(2-phenylethyl)-3-methoxyphenol
Andragine|Andrangine|ent-6alpha,7alpha-epoxy-22-nor-vallesamidine
1,2-dehydrogeissoschizoline
An indole alkaloid that is the 1,2-dehydro derivative of geissoschizoline. Isolated from Geissospermum sericeum, it exhibits antiplasmodial activity.
trans-(2S)-2-<1-(4-methoxyphenyl)prop-2-yl>anethol|trans-(2S)-2-[1-(4-methoxyphenyl)prop-2-yl]anethol
1,5xi-Dimethyl-3xi-(3-methyl-[2]furyl)-5xi-[trans-2-(3-methyl-[2]furyl)-vinyl]-cyclohexen|1,5xi-dimethyl-3xi-(3-methyl-[2]furyl)-5xi-[trans-2-(3-methyl-[2]furyl)-vinyl]-cyclohexene|Diclansenan A+B|Diclausenan|diclausenan A, B
(2S)-1-[2,6-dimethoxy-4-(prop-2-enyl)phenoxy]-3-methylbutane-2,3-diol|lenisin A
19-hydroxy-18(4->3)abeo-abieta-3,8,11,13-tetraen-18-oic acid
1beta,3beta,6alpha-trihydroxycostic acid methyl ester
methyl 1beta,2beta,6alpha-trihydroxy-5alpha,7alphaH-eudesma-4(15),11(13)-dien-12-oate
2-(3,7,11-trimethyldodeca-2,6,10-trienylthio)acetic acid
Exemestane
L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02B - Hormone antagonists and related agents > L02BG - Aromatase inhibitors D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D065088 - Steroid Synthesis Inhibitors D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists > D004965 - Estrogen Antagonists C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor D004791 - Enzyme Inhibitors > D065088 - Steroid Synthesis Inhibitors > D047072 - Aromatase Inhibitors C274 - Antineoplastic Agent > C129818 - Antineoplastic Hormonal/Endocrine Agent > C481 - Antiestrogen C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C1740 - Aromatase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor C147908 - Hormone Therapy Agent > C547 - Hormone Antagonist D000970 - Antineoplastic Agents CONFIDENCE standard compound; INTERNAL_ID 2242 CONFIDENCE standard compound; INTERNAL_ID 8738
Ethynyl estradiol
G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03C - Estrogens > G03CA - Natural and semisynthetic estrogens, plain L - Antineoplastic and immunomodulating agents > L02 - Endocrine therapy > L02A - Hormones and related agents > L02AA - Estrogens D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D004967 - Estrogens C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Disclaimer: While authors make an effort to ensure that the content of this record is accurate, the authors make no representations or warranties in relation to the accuracy or completeness of the record. This record do not reflect any viewpoints of the affiliation and organization to which the authors belong. CONFIDENCE standard compound; EAWAG_UCHEM_ID 3065 EAWAG_UCHEM_ID 3065; CONFIDENCE standard compound Ethinylestradiol (Ethynyl estradiol) is a biologically active estrogen. Ethinylestradiol is a click chemistry reagent, itcontains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups. Ethinylestradiol (Ethynyl estradiol) is a biologically active estrogen. Ethinylestradiol is a click chemistry reagent, itcontains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
Hydrocinchonine
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.680 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.675 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.674
Oxymetazoline hydrochloride
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D019141 - Respiratory System Agents > D014663 - Nasal Decongestants D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
3-methoxy-2-(3-methylbut-2-enyl)-5-(2-phenylethyl)phenol
(E)-4-hydroxy-4-[4-hydroxy-2-[(E)-6-oxohept-1-enyl]cyclopentyl]but-2-enoic acid
C16H24O5_2-Naphthaleneacetic acid, 1,2,3,4,4a,5,8,8a-octahydro-1,8-dihydroxy-alpha,4a,8-trimethyl-5-oxo-, methyl ester
C16H24O5_4-Hydroxy-5-methoxy-4-[2-methyl-3-(3-methyl-2-buten-1-yl)-2-oxiranyl]-1-oxaspiro[2.5]octan-6-one
C16H24O5_Cyclohexaneacetic acid, 4-ethenyl-2,6-dihydroxy-3-[1-(hydroxymethyl)ethenyl]-4-methyl-alpha-methylene-, methyl ester
Palonosetron
A - Alimentary tract and metabolism > A04 - Antiemetics and antinauseants > A04A - Antiemetics and antinauseants > A04AA - Serotonin (5ht3) antagonists C78272 - Agent Affecting Nervous System > C66885 - Serotonin Antagonist > C94726 - 5-HT3 Receptor Antagonist D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents C78272 - Agent Affecting Nervous System > C267 - Antiemetic Agent D005765 - Gastrointestinal Agents > D000932 - Antiemetics D002491 - Central Nervous System Agents
methyl 2-[4-ethenyl-2,6-dihydroxy-3-(3-hydroxyprop-1-en-2-yl)-4-methylcyclohexyl]prop-2-enoate
Na-Desacetylisoretuline
Origin: Plant; SubCategory_DNP: Monoterpenoid indole alkaloids, Bisindole alkaloids, Indole alkaloids
Methyl dihydrophaseate
3,8-Dihydroxy-6-methoxy-7(11)-eremophilen-12,8-olide
Methyl 2-[2,6-dihydroxy-3-(3-hydroxy-1-propen-2-yl)-4-methyl-4-vinylcyclohexyl]acrylate
dimevamide
C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent
1-O-tert-butyl 4-O-ethyl 4-(cyanomethyl)piperidine-1,4-dicarboxylate
1-O-tert-butyl 3-O-ethyl 3-(cyanomethyl)piperidine-1,3-dicarboxylate
3,5-di-tert-butyl-4-hydroxybenzenepropanoyl chloride
1-methyl-1-phenyl-N,N-bis(trimethylsilyl)-Silanediamine
TERT-BUTYLN-[2-AMINO-2-(3,4-DIMETHOXYPHENYL)ETHYL]CARBAMATE
[2-amino-2-(2,4-dimethoxy-phenyl)-ethyl]-carbamic acid tert-butyl ester
[R-(R*,R*)]-2-(1-Azabicyclo[2.2.2]oct-3-yl)-2,3,3a,4,5,6-hexahydro-1H-benz[de]isoquinolin-1-one
1-Benzyl-4-phenylamino-4-(hydroxymethyl)piperidine
Phosphonium,tributyl(carboxymethyl)-, chloride (1:1)
3-[3,3-dimethylbutan-2-yloxy(methyl)phosphoryl]oxy-2,2-dimethylbutane
4-[4-(cyclopentylamino)-2-methylpyrimidin-5-yl]benzamide
Ropinirole hydrochloride
D002491 - Central Nervous System Agents > D018726 - Anti-Dyskinesia Agents > D000978 - Antiparkinson Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018491 - Dopamine Agonists C78272 - Agent Affecting Nervous System > C38149 - Antiparkinsonian Agent Ropinirole (SKF 101468) hydrochloride is an orally active, potent D3/D2 receptor agonist with a Ki of 29 nM for D2 receptor. Ropinirole hydrochloride has pEC50s of 7.4, 8.4 and 6.8 for hD2, hD3 and hD4 receptors, respectively. Ropinirole hydrochloride has no affinity for the D1 receptors. Ropinirole hydrochloride has the potential for Parkinson's disease[1][2].
buta-1,3-diene,2-methylprop-2-enamide,prop-2-enenitrile,styrene
l-Glutamic acid, N-coco acyl derivs., compds. with triethanolamine (1:1)
1H-Benz[de]isoquinolin-1-one, 2-(3R)-1-azabicyclo[2.2.2]oct-3-yl-2,3,3a,4,5,6-hexahydro-, (3aR)-
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents D005765 - Gastrointestinal Agents > D000932 - Antiemetics D002491 - Central Nervous System Agents
(4As,12as)-8-methoxy-12a-methyl-3,4,4a,5,6,11,12,12a-octahydrochrysen-1(2h)-one
Imipraminoxide
N - Nervous system > N06 - Psychoanaleptics > N06A - Antidepressants > N06AA - Non-selective monoamine reuptake inhibitors C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent
methyl 2-(1,8-dihydroxy-4a,8-dimethyl-5-oxo-2,3,4,8a-tetrahydro-1H-naphthalen-2-yl)propanoate
(2-Methoxy-benzyl)-(2-phenyl-piperidin-3-yl)-amine
3-Piperidinamine, N-((2-methoxyphenyl)methyl)-2-phenyl-, (2R,3R)-
[(1R,4R,12S,13S,16S)-12-methyl-8-oxapentacyclo[14.2.1.01,13.04,12.05,9]nonadeca-5(9),6,10,17-tetraen-17-yl]methanol
[3-carboxy-2-[(2E,4E,7E)-nona-2,4,7-trienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(2E,4E,6E)-nona-2,4,6-trienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(3E,5E,7E)-nona-3,5,7-trienoyl]oxypropyl]-trimethylazanium
N-[(2-methoxyphenyl)methyl]-4-(1-piperidinyl)aniline
(13S,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
Noribogaine
An organic heteropentacyclic compound that is ibogamine in which the indole hydrogen para to the indole nitrogen has been replaced by a hydroxy group. It is the primary (and long-lived) metabolite of ibogaine, the psychoactive indole alkaloid found in the African rainforest shrub Tabernanthe iboga.
(8R,9S,13S,14R,17R)-17-ethynyl-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene-3,17-diol
2-[(2R,3R,12bS)-3-ethenyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]ethanol
N-(1-propyl-3-pyrazolo[3,4-b]quinolinyl)butanamide
N-cyclohexyl-2-(5-methyl-2-furanyl)-3-imidazo[1,2-a]pyrimidinamine
2-[2-[(2S)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-1H-indol-3-yl]ethanol
N-[(2S,3S,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)oxan-3-yl]-2-fluorobenzamide
cyclobutyl-[(1S,5R)-7-[4-[(E)-prop-1-enyl]phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]methanone
N-[(2R,3R,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-2-fluorobenzamide
(E)-4-hydroxy-4-[4-hydroxy-2-[(E)-6-oxohept-1-enyl]cyclopentyl]but-2-enoic acid
N-allyl-1-phenyl-2,3,4,5-tetrahydro-3-benzazepinium-7,8-diol(1+)
(8R,9R,10R,13R,14S)-10,13-dimethyl-6-methylidene-7,8,9,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,17-dione
2,6-Dimethyl-5-ethoxy-3-methoxy-(6R)-((2R)-2-methylbutyryloxy)-2,4-cyclohexadien-1-one
(1s)-1-hydroxy-3-isopropyl-8-methyl-13-methylidenetricyclo[7.5.1.0⁵,¹⁵]pentadeca-3,5(15),6,8-tetraen-2-one
(8r,9s,10r)-10-chloroheptadec-16-en-4,6-diyne-8,9-diol
3-{3-[(acetyloxy)methyl]-6-isopropylcyclohex-2-en-1-yl}-2-(hydroxymethyl)prop-2-enoic acid
2-{3-ethenyl-1h,2h,3h,4h,6h,7h,12h,12bh-indolo[2,3-a]quinolizin-2-yl}ethanol
(1r,6r,9s,10s)-6,10-dihydroxy-15-methyl-8,16-dioxatricyclo[7.7.1.0²,⁷]heptadec-2(7)-en-3-one
(3r,7r,8s)-7-ethyl-5-methyl-5,12-diazatetracyclo[9.7.0.0³,⁸.0¹³,¹⁸]octadeca-1(11),13,15,17-tetraen-10-one
(1s)-1-[(1r,15s,17s,18r)-3,13-diazapentacyclo[13.3.1.0²,¹⁰.0⁴,⁹.0¹³,¹⁸]nonadeca-2(10),4,6,8-tetraen-17-yl]ethanol
(1s,2r,5r,6s,9r,10s,12s,13s)-12-hydroxy-9-methoxy-5,9,13-trimethyl-3,14-dioxatetracyclo[8.4.0.0¹,¹³.0²,⁶]tetradecan-4-one
8-ethyl-1,1,4a,7-tetramethyl-10,10a-dihydrophenanthrene-2,9-dione
(10s)-6,6,10-trimethyl-12-oxatetracyclo[9.7.0.0²,⁷.0¹³,¹⁸]octadeca-1(11),2(7),13,15,17-pentaen-16-ol
(3s,9r,10s)-10-chloroheptadec-1-en-4,6-diyne-3,9-diol
6-hydroxy-2-(1-hydroxy-6-oxoheptyl)-2,3,4,6,7,8-hexahydro-1-benzopyran-5-one
(2r,3r,5r,7s)-2-hydroxy-5-(2-hydroxypropan-2-yl)-11,11-dimethyl-4,10-dioxatricyclo[7.4.0.0³,⁷]tridec-1(9)-en-13-one
6-heptyl-4,5-dihydroxy-5-methyl-2-methylidene-4h,6h-furo[2,3-b]pyran-3-one
(1s,3s,6r,7s,8s,11s)-7-hydroxy-5-(hydroxymethyl)-11-isopropyl-3-methoxy-6-methyl-9-oxatricyclo[6.2.1.0²,⁶]undec-4-en-10-one
(4s,4as,5s,8as,9as)-8a,9a-dihydroxy-4-methoxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-2-one
12-hydroxy-14-methoxy-1,9-dimethyl-4-methylidene-6,13-dioxatricyclo[8.4.0.0³,⁷]tetradecan-5-one
3-hydroxy-4-[(2r)-6-hydroxy-2-methoxy-6-methylheptan-2-yl]benzoic acid
(1s,5r,8r,9r)-8-hydroxy-4-(2-methoxypropan-2-yl)-10-oxatricyclo[7.2.1.0¹,⁵]dodec-3-ene-8-carboxylic acid
7-hydroxy-5-(2-hydroxypropan-2-yl)-11,11-dimethyl-4,10-dioxatricyclo[7.4.0.0³,⁷]tridec-1(9)-en-13-one
(15r,17r)-15-ethyl-1,11-diazapentacyclo[9.6.2.0²,⁷.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-2,4,6,8(18)-tetraen-17-ol
(1s)-3-[(3r,4r)-3-ethenylpiperidin-4-yl]-1-(quinolin-4-yl)propan-1-ol
3,3'-dimethyl-8'-methylidene-5'-(prop-1-en-2-yl)-5',6',7',8'a-tetrahydro-4'ah-spiro[cyclopentane-1,1'-naphthalen]-3-ene-2,2'-dione
2-isopropyl-6-methyl-5-(4-methylpent-4-en-1-yl)naphthalene-1,4-dione
methyl 2-(8a-hydroperoxy-1-hydroxy-4a-methyl-8-methylidene-hexahydro-1h-naphthalen-2-yl)prop-2-enoate
(1s,9r,16r,18s,21s)-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-trien-18-ol
(2s,6s)-6-hydroxy-2-[(1s)-1-hydroxy-6-oxoheptyl]-2,3,4,6,7,8-hexahydro-1-benzopyran-5-one
methyl (1r,2r,5r,7s,10s)-10-hydroxy-2-isopropyl-5-methyl-11,12-dioxatricyclo[5.3.2.0¹,⁵]dodec-8-ene-8-carboxylate
methyl 2-[(1r,2r,3r,4s,6s)-4-ethenyl-2,6-dihydroxy-3-(3-hydroxyprop-1-en-2-yl)-4-methylcyclohexyl]prop-2-enoate
(4r,5r,6r)-6-heptyl-4,5-dihydroxy-5-methyl-2-methylidene-4h,6h-furo[2,3-b]pyran-3-one
(1r,3s,6r,7s,9s,10r,13s)-7-hydroxy-3-methoxy-6,9,10-trimethyl-4,14-dioxatetracyclo[7.5.0.0¹,¹³.0³,⁷]tetradecan-5-one
19-epi-heyneanine
{"Ingredient_id": "HBIN002182","Ingredient_name": "19-epi-heyneanine","Alias": "19-epi-heyneanine","Ingredient_formula": "C19H24N2O","Ingredient_Smile": "CC(C1CC2CC3C1N(C2)CCC4=C3NC5=CC=CC=C45)O","Ingredient_weight": "296.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "33080","TCMSP_id": "NA","TCM_ID_id": "19374","PubChem_id": "44566759","DrugBank_id": "NA"}
7-o-methylpseudomajucin
{"Ingredient_id": "HBIN013419","Ingredient_name": "7-o-methylpseudomajucin","Alias": "NA","Ingredient_formula": "C16H24O5","Ingredient_Smile": "CC1C(CC23C1(CC(=O)O2)CC4(C(C3(CO4)C)C)OC)O","Ingredient_weight": "296.36 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14696","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11781435","DrugBank_id": "NA"}
8β,10β-dihydroxy-6β-methoxyeremophil-7(11)-en-12,8α-olide
{"Ingredient_id": "HBIN013648","Ingredient_name": "8\u03b2,10\u03b2-dihydroxy-6\u03b2-methoxyeremophil-7(11)-en-12,8\u03b1-olide","Alias": "NA","Ingredient_formula": "C16H24O5","Ingredient_Smile": "CC1CCCC2(C1(C(C3=C(C(=O)OC3(C2)O)C)OC)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5976","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}