Exact Mass: 370.2018
Exact Mass Matches: 370.2018
Found 500 metabolites which its exact mass value is equals to given mass value 370.2018
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
spiromesifen
(3S,7E,9S)-9-Hydroxy-4,7-megastigmadien-3-one 9-glucoside
(3S,7E,9S)-9-Hydroxy-4,7-megastigmadien-3-one 9-glucoside is found in fruits. (3S,7E,9S)-9-Hydroxy-4,7-megastigmadien-3-one 9-glucoside is a constituent of raspberry (Rubus idaeus) and leaves of sage (Salvia officinalis). Isolated from raspberry (Rubus idaeus) and the leaves of Dalmatian sage (Salvia officinalis). 3-Oxo-alpha-ionol 9-glucoside is found in herbs and spices, fruits, and red raspberry.
Octaethylene glycol
Octaethylene glycol, also known as 3,6,9,12,15,18,21-heptaoxatricosane-1,23-diol, is classified as a member of the polyethylene glycols. Polyethylene glycols are oligomers or polymers of ethylene oxide, with the general formula (C2H4O)n (with n>=3). Octaethylene glycol is considered to be practically insoluble (in water) and relatively neutral. (ChemoSummarizer)
Androsterone sulfate
Androsterone sulfate (Andros-S) is the most abundant 5-alpha-reduced androgen metabolite in serum (PMID: 8380602). Androsterone sulfate is clinically recognized as one of the major androgen metabolites found in urine. It is a cognate substrate for human dehydroepiandrosterone sulfotransferase, which catalyzes the transfer of the sulfonate group from 3-phosphoadenosine-5-phosphosulfate to dehydroepiandrosterone (DHEA) (PMID: 14573603). Androsterone sulfate has been identified in the human placenta (PMID: 32033212). Serum dehydroepiandrosterone-sulfate is a classic marker for adrenarche and, subsequently, for the individual hormonal milieu. (PMID 10599744) Dehydroepiandrosterone sulfate is an endogenously produced sex steroid that has been hypothesized to have anti aging effects. (PMID 16960027) It also has been inversely associated with development of atherosclerosis. (PMID 8956025) [HMDB] D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
5-Megastigmen-7-yne-3,9-diol 9-glucoside
5-Megastigmen-7-yne-3,9-diol 9-glucoside is found in alcoholic beverages. 5-Megastigmen-7-yne-3,9-diol 9-glucoside is a constituent of Riesling wine and Rose petals. Constituent of Riesling wine and Rose petals. 5-Megastigmen-7-yne-3,9-diol 9-glucoside is found in alcoholic beverages.
5a-Dihydrotestosterone sulfate
5a-Dihydrotestosterone sulfate is a sulfate derivative of 5a-Dihydrotestosterone produced through phase II metabolism. 5a-dihydrotestosterone (DHT) is a steroid similar to testosterone and androstenedione, that belongs to a class called androgens. DHT is a C19 steroid and possesses androgenic activity. Androgen production takes place mainly in the Leydig cells of the testes. Androgens circulate in the blood bound to proteins, especially sex hormone binding globulin (SHBG) and albumin. A trace amount of these steroids circulate in the unbound form in the blood and are referred to as the free fractions. DHT has at least three times the binding affinity for SHBG than testosterone. About 70\\% of DHT is derived from peripheral conversion of testosterone in males, while most of the DHT is derived from androstenedione in females. (http://www.biosupply.co.uk/doc.php?id=2296) [HMDB] 5a-Dihydrotestosterone sulfate is a sulfate derivative of 5a-Dihydrotestosterone produced through phase II metabolism. 5a-dihydrotestosterone (DHT) is a steroid similar to testosterone and androstenedione, that belongs to a class called androgens. DHT is a C19 steroid and possesses androgenic activity. Androgen production takes place mainly in the Leydig cells of the testes. Androgens circulate in the blood bound to proteins, especially sex hormone binding globulin (SHBG) and albumin. A trace amount of these steroids circulate in the unbound form in the blood and are referred to as the free fractions. DHT has at least three times the binding affinity for SHBG than testosterone. About 70\\% of DHT is derived from peripheral conversion of testosterone in males, while most of the DHT is derived from androstenedione in females.
Etiocholanolone sulfate
Etiocholanolone sulfate is urinary sulfate metabolite of etiocholanolone which is one of the steroid hormone. A human metabolite taken as a putative food compound of mammalian origin [HMDB]
5-Megastigmen-7-yne-3,9-diol 3-glucoside
5-Megastigmen-7-yne-3,9-diol 3-glucoside is found in alcoholic beverages. 5-Megastigmen-7-yne-3,9-diol 3-glucoside is a constituent of Riesling wine. Constituent of Riesling wine. 5-Megastigmen-7-yne-3,9-diol 3-glucoside is found in alcoholic beverages.
Lorcainide
Cardiac dysrhythmia is a heart rate disorder that manifests as an altered cardiac rhythm. It results from either abnormal pacemaker activity or a disturbance in impulse propagation, or both. Arrhythmias can be caused by various conditions including ischemia, hypoxia, pH disruptions, B adrenergic activation, drug interactions or the presence of diseased tissue. These events can trigger the development of ectopic pacemaker in the heart, which emit abnormal impulses at random times during the cardiac cycle. An arrhythmia can present itself as either bradycardia or tachycardia. Untreated arrhythmias may progress to atrial fibrillation or ventricular fibrillation. Treatment is aimed at normalizing cardiac rhythm by altering ion flow across the membrane. Antiarrhythmic agents can reduce arrhythmia related symptoms such as palpitations or syncope; however, they often have a narrow therapeutic index and can also be proarrhythmic. Lorcainide (Lorcainide hydrochloride) is a Class 1c antiarrhythmic agent that is used to help restore normal heart rhythm and conduction in patients with premature ventricular contractions, ventricular tachycardiac and Wolff-Parkinson-White syndrome. Lorcainide was developed by Janssen Pharmaceutica (Belgium) in 1968 under the commercial name Remivox and is designated by code numbers R-15889 or Ro 13-1042/001. It has a half-life of 8.9 +- 2.3 hrs which may be prolonged to 66 hrs in people with cardiac disease. Wolff-Parkinson-White syndrome (WPW) is a pre-excitation syndrome in which individuals are predisposed to supraventricular tachyarrhythmias (rapid and irregular heart beats). People with this condition have an extra or accessory atrioventricular conduction pathway that causes re-entry tachycardia. WPW is characterized by a short PR interval (<0.12 second) and a prolonged, slurred QRS complex (>0.12 seconds). C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BC - Antiarrhythmics, class ic C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
Epiandrosterone sulfate
Epiandrosterone sulfate, also known as (3beta,5alpha)-17-oxoandrostan-3-yl hydrogen sulfate or epiandrosterone sulphuric acid, is a member of the class of compounds known as sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. Epiandrosterone sulfate is practically insoluble (in water) and an extremely strong acidic compound (based on its pKa). Epiandrosterone sulfate can be synthesized from 5alpha-androstane and synthesized into epiandrosterone. Epiandrosterone sulfate can be found in blood and feces. D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
4-Androsten-3beta,17beta-diol 3-sulfate
4-Androsten-3beta,17beta-diol 3-sulfate, also known as androstenediol 3-sulfate, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 4-Androsten-3beta,17beta-diol monosulfate was found to be significantly (Bonferroni) associated with rheumatoid arthritis (PMID: 28831053).
4-Androsten-3beta,17beta-diol 17-sulfate
4-Androsten-3beta,17beta-diol 17-sulfate, also known as androstenediol 17-sulfate, is classified as a member of the sulfated steroids. Sulfated steroids are sterol lipids containing a sulfate group attached to the steroid skeleton. 4-Androsten-3beta,17beta-diol monosulfate was found to be significantly (Bonferroni) associated with rheumatoid arthritis (PMID: 28831053).
11-Hydroxyyohimbine
Androstenediol 3-sulfate
N-Desethyl Sunitinib
Nomegestrol acetate
Ocfentanil
C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist
Samidorphan
[(3S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] hydrogen sulfate
[4beta(2R,3R)]-Trichotheca-9,12-dien-4-ol, 5-(3-methyloxiranyl)-2,4-pentadienoate
Humantenirine
14-(4-Hydroxy-3-methoxybenzoyloxy)dauc-4,8-diene
(6R,9S)-3-oxo-alpha-ionol-beta-D-glucopyranoside
(6R,9R)-3-Oxo-alpha-ionyl-9-O-beta-glucopyranoside
N(4)-Demethyl-12-methoxyalstogustine
A natural product found in Alstonia spatulata.
2-(4,8-dimethylnona-3,7-dienyl)-8-hydroxy-2-methyl-2H-chromene-6-carboxylic acid methyl ester|2-(4,8-Dimethylnona-3,7-dienyl)-8-hydroxy-2-methyl-2H-chromene-6-carboxylic methyl ester
3-hydroxy-16-hydroxymethyl-22-nor-vobasan-17-oic acid methyl ester|Voacarpin
(3beta,5beta,8beta,14beta)-8,14-Epoxy-3-hydroxycarda-16,20(22)-dienolide
(19R)-19,20-epoxy-11-methoxy-1-methyl-(2beta,20alphaH)-1,2,19,20-tetrahydro-akuammilan-17-oic acid|11-methoxy-quaternoxine|Caberin|caberine
1-(5-geranyloxy-7-hydroxy-2,2-dimethyl-2H-chromen-8-yl)ethanone
coronaridine hydroxyindolenine|heyneanine hydroxyindolenine
(3E)-4-[(4R)-4-(beta-D-glucopyranosyloxy)-2,6,6-trimethyl-cyclohex-1-enyl]but-3-en-2-one|(3E)-4-[(4R)-4-(beta-D-glucopyranosyloxy)-2,6,6-trimethylcyclohex-1-enyl]but-3-en-2-one|3-hydroxymegastigmasta-5,7-dien-9-one-3-O-beta-D-glucopyranoside|3beta-D-glucopyranosyloxy-beta-ionone
(9R)-4-oxo-beta-ionol beta-D-glucopyranoside|4-Oxo-beta-ionol beta-D-glucopyranoside
20-hydroxy-12-methoxy-ibogamine-18-carboxylic acid methyl ester|Voacristin
3,4-dihydro-5-hydroxy-2,7-dimethyl-8-(3-methyl-2-butenyl)-2-(4-methyl-1,3-pentadienyl)-2H-1-benzopyrane-6-carboxylic acid|3,4-dihydro-5-hydroxy-2,7-dimethyl-8-(3-methyl-2-butenyl)-2-(4-methyl-1,3-pentadienyl)-2H-1-benzopyran-6-carboxylic acid
lehualide F
A member of the class of 2-pyranones that is 2H-pyran-2-one substituted by a methoxy group at position 3, a hydroxy group at position 4, a methyl group at position 5 and a (2E)-3-methyl-9-phenylnon-2-en-1-yl group at position 6. Isolated from the marine sponge of the genus Plakortis, it exhibits cytotoxicity against human promyeloid leukemic HL-60 cells.
(6Z)-[9-O-(beta-D-glucopyranosyl)] butylidene-1,5,5-trimethyl-4-cyclohexen-3-one
10-hydroxyisositsirikine|methyl (2R)-2-[(2R,3E,12bS)-3-ethylidene-1,2,3,4,6,7,12,12b-octahydro-9-hydroxyindolo[2,3-a]quinolizin-2-yl]-3-hydroxypropanoate
1-(hydroxymethyl)-3-(2-hydroxypropan-2-yl)-2-(5-methoxy-9H-beta-carbolin-1-yl)cyclopentanol
2,6-dihydroxy-2-<3,7,11-trimethyl-2(E),6(E),10-dodecatrien-1-yl>-3(2H)-benzofuranone
(2Z,4E)-2-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)pent-4-en-1-ol|morinol I
1-(2,4-dihydroxyphenyl)-3,7,11-trimethyl-3-vinyl-6(E),10-dodecadiene-1,9-dione
1-acetyl-19,21-epoxy-aspidospermidine-16,17-diol|Aspidofendlerin, N-Acetyl-16,17-dihydroxy-aspidoalbidin|Aspidofendlerine
8-hydroxy-5-methyl-7-(3-methylbut-2-enyl)-9-(3-methyl-1-oxobutyl)-4,5-dihydropyrano[4,3,2-de]chromen-2-one
1,2,9,10-tetramethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium
18β-Hydroxy-3-epi-α-yohimbine
18-Beta-hydroxy-3-epi-alpha-yohimbine is a natural product found in Rauvolfia serpentina with data available.
2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde
2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde
2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde [IIN-based on: CCMSLIB00000846934]
2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde [IIN-based: Match]
Octaethylene glycol
CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 11 INTERNAL_ID 11; CONFIDENCE Reference Standard (Level 1)
2,4-dihydroxy-6-methyl-3-[(2E,4E)-3-methyl-5-[(1R,2R,6R)-1,2,6-trimethyl-3-oxocyclohexyl]penta-2,4-dienyl]benzaldehyde_major
Ala Ala Ile Pro
Ala Ala Leu Pro
Ala Ala Pro Ile
Ala Ala Pro Leu
Ala Ile Ala Pro
Ala Ile Pro Ala
Ala Leu Ala Pro
Ala Leu Pro Ala
Ala Pro Ala Ile
Ala Pro Ala Leu
Ala Pro Ile Ala
Ala Pro Leu Ala
Ala Pro Pro Ser
Ala Pro Ser Pro
Ala Ser Pro Pro
Gly Pro Pro Thr
Gly Pro Thr Pro
Gly Pro Val Val
Gly Thr Pro Pro
Gly Val Pro Val
Gly Val Val Pro
Ile Ala Ala Pro
Ile Ala Pro Ala
Ile Pro Ala Ala
Leu Ala Ala Pro
Leu Ala Pro Ala
Leu Pro Ala Ala
Pro Ala Ala Ile
Pro Ala Ala Leu
Pro Ala Ile Ala
Pro Ala Leu Ala
Pro Ala Pro Ser
Pro Ala Ser Pro
Pro Gly Pro Thr
Pro Gly Thr Pro
Pro Gly Val Val
Pro Ile Ala Ala
Pro Leu Ala Ala
Pro Pro Ala Ser
Pro Pro Gly Thr
Pro Pro Ser Ala
Pro Pro Thr Gly
Pro Ser Ala Pro
Pro Ser Pro Ala
Pro Thr Gly Pro
Pro Thr Pro Gly
Pro Val Gly Val
Pro Val Val Gly
Ser Ala Pro Pro
Ser Pro Ala Pro
Ser Pro Pro Ala
Thr Gly Pro Pro
Thr Pro Gly Pro
Thr Pro Pro Gly
Val Gly Pro Val
Val Gly Val Pro
Val Pro Gly Val
Val Pro Val Gly
Val Val Gly Pro
Val Val Pro Gly
Androsterone sulfate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones A steroid sulfate that is the 3-sulfate of androsterone.
17-phenyl trinor-13,14-dihydro Prostaglandin A2
5-Megastigmen-7-yne-3,9-diol 9-glucoside
N-Lauryl-N-myristyl-beta-alanine
(3S,7E,9S)-9-Hydroxy-4,7-megastigmadien-3-one 9-glucoside
Lorcainide
C - Cardiovascular system > C01 - Cardiac therapy > C01B - Antiarrhythmics, class i and iii > C01BC - Antiarrhythmics, class ic C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents
Aplidic acid A
Etiocholanolone sulfate
Canangalia E
Canangalia F
(3-BOC-AMINO-PIPERIDIN-1-YL)-NAPHTHALEN-2-YL-ACETICACID
Oxypendyl
C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent C78272 - Agent Affecting Nervous System > C267 - Antiemetic Agent
1-Piperazinamine,4-(diphenylmethyl)-N-[(6-methyl-2-pyridinyl)methylene]-
(3AR,4S,5R,6AS)-4-(((TERT-BUTYLDIMETHYLSILYL)OXY)METHYL)-5-((TETRAHYDRO-2H-PYRAN-2-YL)OXY)HEXAHYDRO-2H-CYCLOPENTA[B]FURAN-2-ONE
5-(t-Butyldimethylsiloxy)-2,3-difluorophenylboronic
Urea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-phenyl-N-(phenylmethyl)- (9CI)
4-[CARBOXY-(2-CHLORO-PHENYL)-METHYL]-PIPERAZINE-1-CARBOXYLICACIDTERT-BUTYLESTERHYDROCHLORIDE
butane-1,4-diol,2-ethyl-2-(hydroxymethyl)propane-1,3-diol,hexanedioic acid
N,N-bis[(1R)-2-hydroxy-1-phenylethyl]-2,2-dimethylpropanediamide
butane-1,3-diol,2-ethyl-2-(hydroxymethyl)propane-1,3-diol,hexanedioic acid
3,6-BIS[(1,1-DIMETHYLETHYL)-9H-FLUOREN-9-YL]CHLORODIMETHYL-SILANE
(S)-TERT-BUTYL 3-(4-AMINOPHENYL)-2-(((BENZYLOXY)CARBONYL)AMINO)PROPANOATE
2-(4-boc-piperazinyl)-2-(2-naphthalenyl)acetic acid
Nomegestrol acetate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone
ethyl 4-[3-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]anilino]benzoate
6-[(2-hydroxyethyl)amino]-4-methyl-2-[[3-(2-phenoxyethoxy)propyl]amino]nicotinonitrile
Thiourea, N-[2-(1H-benzimidazol-2-yl)ethyl]-N-cyclohexyl-N-cyclopentyl- (9CI)
N-(2-Fluoro-5-methylphenyl)-N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea
TERT-BUTYL 4-(6-(2-ACETYL-1H-PYRROL-1-YL)PYRIDIN-2-YL)PIPERAZINE-1-CARBOXYLATE
sn-Glycerol 3-phosphate biscyclohexylammonium salt
1,1,1,1-Tetramethyl-4,4-(methylene-di-p-phenylene)disemicarbazide
Samidorphan
D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C681 - Opiate Antagonist
Branebrutinib
C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C163774 - BTK-targeting Agent D004791 - Enzyme Inhibitors > D047428 - Protein Kinase Inhibitors
7-Cyclopentyl-5-(4-phenoxyphenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine
1-(Phenylmethyl)-4-(4-phenyl-1-piperazinyl)pyrazolo[3,4-d]pyrimidine
[(3S,8R,9S,10S,13S,14S)-10,13-Dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] hydrogen sulfate
Samidorphan
[3-Carboxy-2-(9-carboxy-3,4-dimethylidenenonanoyl)oxypropyl]-trimethylazanium
[3-carboxy-2-[(2E,10E)-11-carboxyundeca-2,10-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(7E,9E)-11-carboxyundeca-7,9-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(5E,9E)-11-carboxyundeca-5,9-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(3E,10E)-11-carboxyundeca-3,10-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(5E,8E)-11-carboxyundeca-5,8-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(6E,8E)-11-carboxyundeca-6,8-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(7E,10E)-11-carboxyundeca-7,10-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(5E,10E)-11-carboxyundeca-5,10-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(4E,9E)-11-carboxyundeca-4,9-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(2E,6E)-11-carboxyundeca-2,6-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(6E,9E)-11-carboxyundeca-6,9-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(4E,8E)-11-carboxyundeca-4,8-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(4E,10E)-11-carboxyundeca-4,10-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(3E,9E)-11-carboxyundeca-3,9-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(5E,7E)-11-carboxyundeca-5,7-dienoyl]oxypropyl]-trimethylazanium
[3-carboxy-2-[(8E,10E)-11-carboxyundeca-8,10-dienoyl]oxypropyl]-trimethylazanium
(6aS)-1,2,9,10-tetramethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium
6-(9-Purine-6,8-diolyl)-2beta-suberosanone
A natural product found in Subergorgia suberosa.
6-[(2-fluorophenyl)methyl]-5-methyl-N-(3-methylbutyl)-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide
Ala-Leu-Ala-Pro
A tetrapeptide composed of L-alanine, L-leucine, L-alanine, and L-proline joined in sequence by peptide linkages.
2-[2-fluoro-5-(4-methyl-1-piperazinyl)-4-nitrophenyl]-3,4-dihydro-1H-isoquinoline
5-[1-[4-(Diethylamino)anilino]propylidene]-1-prop-2-enyl-1,3-diazinane-2,4,6-trione
1,2-Dihydroacenaphthylen-5-yl-[1-[(6-methyl-2-pyridinyl)methyl]-3-piperidinyl]methanone
4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-N-(2,6-dimethylphenyl)benzamide
1-cyclohexyl-3-(12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazolin-2-yl)thiourea
4-[7-(4-Methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]morpholine
4-[7-(3-Methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]morpholine
1-(4-ethylphenyl)-2-methyl-N-(3-pyridinylmethyl)-5-benzimidazolecarboxamide
N-(2-ethoxyphenyl)-4-(4-morpholinyl)-6-(1-pyrrolidinyl)-1,3,5-triazin-2-amine
2-(3-chloro-4-fluorophenoxy)-N-[(3S)-1-(3,3-dimethylbutyl)-3-piperidinyl]acetamide
Cyclopropyl-[4-(2,7-dimethyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-piperazinyl]methanone
N-[(2R,3R,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide
N-[(2R,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide
N-[(2S,3S,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide
N-[(2R,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide
N-[(2R,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide
[(1R,5S)-7-[4-(2-methylphenyl)phenyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-(2-pyrazinyl)methanone
N-[(2S,3R,6R)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide
N-[(2S,3S,6S)-6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-(hydroxymethyl)-3,6-dihydro-2H-pyran-3-yl]cyclopropanecarboxamide
(6R,7S,8S)-8-(hydroxymethyl)-4-(2-methoxy-1-oxoethyl)-7-[4-(3-methylbut-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one
(3E)-4-(2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)but-3-en-2-yl beta-D-glucopyranoside
[(3R,8R,9S,10R,13S,14S,17R)-3-hydroxy-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl] hydrogen sulfate
2-[[(2R)-3-heptanoyloxy-2-hydroxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[[(2R)-2-heptanoyloxy-3-hydroxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
2-[(3-Heptanoyloxy-2-hydroxypropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazanium
5alpha-Dihydrotestosterone sulfate
A 3-oxo-5alpha-steroid that is 5alpha-dihydrotestosterone in which the hydroxy hydrogen at position 17 has been replaced by a sulfo group.
Epiandrosterone sulfate
D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones A steroid sulfate that is the 3-sulfate of epiandrosterone.
8,12-dihydroxy-11-chloro-5Z,9Z,14Z,17Z-eicosatetraenoic acid
8,12-dihydroxy-9-chloro-5Z,10Z,14Z,17Z-eicosatetraenoic acid
(S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+)
A aporphine alkaloid that is the quaternary ammonium ion obtained by methylation of the tertiary amino group of (S)-glaucine.
BI-167107
BI-167107 is a high affinity, full agonist that binds to the β2 adrenergic receptor (β2AR) with a dissociation constant Kd of 84 pM[1].
(1'r,3s,4's,7'e,8's,9's)-7'-ethylidene-1,6-dimethoxy-11'-oxa-5'-azaspiro[indole-3,2'-tricyclo[6.3.1.0⁴,⁹]dodecan]-2-one
4-(2,6,6-trimethyl-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-1-en-1-yl)but-3-en-2-one
2-hydroxy-1-{14-hydroxy-16-methyl-15-oxa-1,11-diazahexacyclo[15.3.1.0⁴,¹².0⁴,²⁰.0⁵,¹⁰.0¹³,¹⁸]henicosa-5,7,9-trien-11-yl}ethanone
methyl 2-hydroxy-1'-methyl-1',3',4',4'a,5',5'a,7',8',10',10'a-decahydrospiro[indole-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate
(3e)-4-[(4r)-2,6,6-trimethyl-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-1-en-1-yl]but-3-en-2-one
methyl (1s,15s,18r,19s,20r)-7,18-dihydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate
methyl 2-hydroxy-1'-methyl-1',3',4',4'a,5',6',8',9',10'a,10'b-decahydrospiro[indole-3,10'-pyrano[4,3-g]indolizine]-4'-carboxylate
methyl 17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-triene-18-carboxylate
methyl 17,18-dihydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate
(1s,9s,12r,13s,14s)-3-hydroxy-5,9,13-trimethyl-13-(4-methylpent-3-en-1-yl)-8-oxatetracyclo[7.4.1.0²,⁷.0¹²,¹⁴]tetradeca-2(7),3,5-triene-4-carboxylic acid
1-(5-{[(2e)-3,7-dimethylocta-2,6-dien-1-yl]oxy}-7-hydroxy-2,2-dimethylchromen-8-yl)ethanone
methyl (1s,9r,16s,17s,18r,21r)-17,18-dihydroxy-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7-triene-18-carboxylate
methyl 12-(1-hydroxyethyl)-6-methoxy-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,9-tetraene-10-carboxylate
(6ar,8r,9ar)-3-[(5s)-3,5-dimethylhepta-1,3-dien-1-yl]-8-methoxy-6a,8-dimethyl-9h,9ah-furo[2,3-h]isochromen-6-one
(15s,17s,19s)-15-ethyl-17-hydroxy-17-(methoxycarbonyl)-1,11-diazapentacyclo[9.6.2.0²,⁷.0⁸,¹⁸.0¹⁵,¹⁹]nonadeca-2,4,6,8(18)-tetraen-11-ium-11-olate
(3e)-4-[(1r,4r)-2,6,6-trimethyl-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-yl]but-3-en-2-one
methyl (1r,15s,17r,18r,19s,20r)-17,18-dihydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate
(1r,3r,8s,10s,11s)-4-ethylidene-8-[4-methoxy-2-(methoxyamino)phenyl]-13-oxa-6-azatetracyclo[6.5.0.0³,¹¹.0⁶,¹⁰]tridecan-7-one
(2z)-2-[(3s,6'r,7's,8'as)-6'-ethyl-2-hydroxy-3',5',6',7',8',8'a-hexahydro-2'h-spiro[indole-3,1'-indolizin]-7'-yl]-3-methoxyprop-2-enoic acid
methyl (1s,15r,16r,19r,20s)-16-hydroxy-16-methyl-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraene-19-carboxylate
(1s,15r,18s,19r,20r)-18-hydroxy-19-(methoxycarbonyl)-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-2(10),4,6,8-tetraen-13-ium-13-olate
11-hydroxyhumantenine
{"Ingredient_id": "HBIN000446","Ingredient_name": "11-hydroxyhumantenine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC=C1CN(C2CC3(C4CC1C2CO4)C5=C(C=C(C=C5)O)N(C3=O)OC)C","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10167","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "102004537","DrugBank_id": "NA"}
15-hydroxyhumamtenine
{"Ingredient_id": "HBIN001688","Ingredient_name": "15-hydroxyhumamtenine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC=C1CN(C2CC3(C4CC1(C2CO4)O)C5=CC=CC=C5N(C3=O)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31201","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
15-hydroxyhumantenine
{"Ingredient_id": "HBIN001689","Ingredient_name": "15-hydroxyhumantenine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC=C1CN(C2CC3(C4CC1(C2CO4)O)C5=CC=CC=C5N(C3=O)OC)C","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10168","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101606434","DrugBank_id": "NA"}
19-(r)-hydroxydihydrogelsevirine
{"Ingredient_id": "HBIN002215","Ingredient_name": "19-(r)-hydroxydihydrogelsevirine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC(C12CN(C3C1C4(C5CC2C3CO5)C6=CC=CC=C6N(C4=O)OC)C)O","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10000","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101601180","DrugBank_id": "NA"}
19-(s)-hydroxydihydrogelsevirine
{"Ingredient_id": "HBIN002221","Ingredient_name": "19-(s)-hydroxydihydrogelsevirine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC(C12CN(C3C1C4(C5CC2C3CO5)C6=CC=CC=C6N(C4=O)OC)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10001","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-(4',8'-dimethylnona-3',7'-dienyl)-8-hydroxy-2-methyl-2h-chromene-6-carboxylicmethylester
{"Ingredient_id": "HBIN004271","Ingredient_name": "2-(4',8'-dimethylnona-3',7'-dienyl)-8-hydroxy-2-methyl-2h-chromene-6-carboxylicmethylester","Alias": "NA","Ingredient_formula": "C23H30O4","Ingredient_Smile": "CC(=CCCC(=CCCC1(C=CC2=CC(=CC(=C2O1)O)C(=O)OC)C)C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6378","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(6s,9r)-deoxyroseoside
{"Ingredient_id": "HBIN012811","Ingredient_name": "(6s,9r)-deoxyroseoside","Alias": "NA","Ingredient_formula": "C19H30O7","Ingredient_Smile": "CC1=CC(=O)CC(C1C=CC(C)OC2C(C(C(C(O2)CO)O)O)O)(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5209","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
amsosinine
{"Ingredient_id": "HBIN015914","Ingredient_name": "amsosinine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC1(C2CN3CCC4=C(C3CC2C(CO1)C(=O)OC)NC5=CC=CC=C45)O","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1089","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "5318152","DrugBank_id": "NA"}
aspidodasycarpine
{"Ingredient_id": "HBIN017152","Ingredient_name": "aspidodasycarpine","Alias": "NA","Ingredient_formula": "C21H26N2O4","Ingredient_Smile": "CC=C1CNC2CC1C(C34C2(NC5=CC=CC=C53)OCC4)(CO)C(=O)OC","Ingredient_weight": "370.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1901","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "118701741","DrugBank_id": "NA"}