Exact Mass: 217.0981836
Exact Mass Matches: 217.0981836
Found 500 metabolites which its exact mass value is equals to given mass value 217.0981836,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Captopril
Captopril is a potent, competitive inhibitor of angiotensin-converting enzyme (ACE), the enzyme responsible for the conversion of angiotensin I (ATI) to angiotensin II (ATII). ATII regulates blood pressure and is a key component of the renin-angiotensin-aldosterone system (RAAS). Captopril may be used in the treatment of hypertension. C - Cardiovascular system > C09 - Agents acting on the renin-angiotensin system > C09A - Ace inhibitors, plain > C09AA - Ace inhibitors, plain D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C247 - ACE Inhibitor D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Glutethimide
Glutethimide is only found in individuals that have used or taken this drug. It is a hypnotic and sedative. Its use has been largely superseded by other drugs. [PubChem]Glutethimide seems to be a GABA agonist which helps induced sedation. It also induces CYP 2D6. When taken with codeine, it enables the body to convert higher amounts of the codeine (higher than the average 5 - 10\\%) to morphine. The general sedative effect also adds to the power of the combination. D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CE - Piperidinedione derivatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
pymetrozine
C10H11N5O (217.09635559999998)
CONFIDENCE standard compound; EAWAG_UCHEM_ID 2947 CONFIDENCE standard compound; INTERNAL_ID 257; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2674; ORIGINAL_PRECURSOR_SCAN_NO 2673 CONFIDENCE standard compound; INTERNAL_ID 257; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2682; ORIGINAL_PRECURSOR_SCAN_NO 2681 CONFIDENCE standard compound; INTERNAL_ID 257; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2679; ORIGINAL_PRECURSOR_SCAN_NO 2677 CONFIDENCE standard compound; INTERNAL_ID 257; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2664; ORIGINAL_PRECURSOR_SCAN_NO 2662 CONFIDENCE standard compound; INTERNAL_ID 257; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 2667; ORIGINAL_PRECURSOR_SCAN_NO 2665
N-acetylcitrulline
N-alpha-Acetyl-L-citrulline, also known as N-acetylcitrulline, is an N-acetylated metabolite of citrulline that is part of the arginine biosynthetic pathway. Arginine biosynthesis is notable for its complexity and variability at the genetic level, and by its connection with several other pathways, such as pyrimidine and polyamine biosynthesis, and certain degradative pathways. The initial steps of the arginine biosynthetic pathways proceed via N-acetylated intermediates. The presumed reason for this is that the acetylation prevents the spontaneous cyclization of glutamate derivatives, which leads to proline biosynthesis. N-acetyl-L-ornithine can be transcarbamylated directly by the enzyme acetylornithine transcarbamylase, resulting in N-acetyl-L-citrulline. The enzyme acetylornithine deacetylase can accept N-acetyl-L-citrulline as a substrate and can deacetylate it into citrulline. N-alpha-Acetyl-L-citrulline is found in cases of deficiency of the urea cycle enzyme argininosuccinate synthase (EC 6.3.4.5) that leads to increased concentrations of citrulline and N-acetylcitrulline in the urine (PMID: 14633929). N-acetyl-l-citrulline, also known as (S)-2-acetamido-5-ureidopentanoic acid, is a member of the class of compounds known as N-acyl-l-alpha-amino acids. N-acyl-l-alpha-amino acids are n-acylated alpha amino acids which have the L-configuration of the alpha-carbon atom. N-acetyl-l-citrulline is slightly soluble (in water) and a weakly acidic compound (based on its pKa). N-acetyl-l-citrulline can be found in a number of food items such as macadamia nut, persian lime, broccoli, and annual wild rice, which makes N-acetyl-l-citrulline a potential biomarker for the consumption of these food products.
Securinine
Securinine is a member of indolizines. Securinine is a natural product found in Flueggea suffruticosa, Flueggea virosa, and other organisms with data available. See also: Phyllanthus amarus top (part of). relative retention time with respect to 9-anthracene Carboxylic Acid is 0.053 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.052 (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. Allosecurinine (Phyllochrysine) is a Securinega alkaloid isolated from Phyllanthus glaucus [1].
(R)-3-(indol-3-yl)-2-oxobutyric acid
The (R)-enantiomer of 3-(indol-3-yl)-2-oxobutyric acid.
1-Aminopyrene
1-aminopyrene belongs to the family of Pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system.
N-Desmethylaminopyrine
C12H15N3O (217.12150599999998)
N-Desmethylaminopyrine is a metabolite of Aminophenazone. N-desmethylaminopyrine belongs to the family of Anilides. These are organic compounds derived from oxoacids RkE(=O)l(OH)m by replacing an OH group by the NHPh group or derivative formed by ring substitution.
1-Isothiocyanato-8-(methylthio)octane
1-Isothiocyanato-8-(methylthio)octane is found in brassicas. 1-Isothiocyanato-8-(methylthio)octane is a flavour component of Japanese horseradish (Wasabia japonica). Flavour component of Japanese horseradish (Wasabia japonica). 1-Isothiocyanato-8-(methylthio)octane is found in brassicas.
Glutaminylalanine
Glutaminylalanine is a dipeptide composed of glutamine and alanine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.
Alanylglutamine
Alanylglutamine is a dipeptide composed of alanine and glutamine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. B - Blood and blood forming organs > B05 - Blood substitutes and perfusion solutions > B05X - I.v. solution additives > B05XB - Amino acids L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1]. L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1].
Alanyl-Gamma-glutamate
Alanyl-Gamma-glutamate is a dipeptide composed of alanine and gamma-glutamate. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
N-desisopropylpropranolol
N-desisopropylpropranolol is a metabolite of propranolol. Propranolol is a sympatholytic non-selective beta blocker. Sympatholytics are used to treat hypertension, anxiety and panic. It was the first successful beta blocker developed. Propranolol is available in generic form as propranolol hydrochloride, as well as an AstraZeneca and Wyeth product under the brand names Inderal, Inderal LA, Avlocardyl, Deralin, Dociton, Inderalici, InnoPran XL, Sumial, Anaprilinum, Bedranol SR. (Wikipedia)
3-[(2-Oxoacetyl)oxy]-4-(trimethylazaniumyl)butanoate
3-[(2-oxoacetyl)oxy]-4-(trimethylazaniumyl)butanoate is an acylcarnitine. More specifically, it is an 2-oxoacetic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. 3-[(2-oxoacetyl)oxy]-4-(trimethylazaniumyl)butanoate is therefore classified as a short chain AC. As a short-chain acylcarnitine 3-[(2-oxoacetyl)oxy]-4-(trimethylazaniumyl)butanoate is a member of the most abundant group of carnitines in the body, comprising more than 50\\% of all acylcarnitines quantified in tissues and biofluids (PMID: 31920980). Some short-chain carnitines have been studied as supplements or treatments for a number of diseases, including neurological disorders and inborn errors of metabolism. Carnitine acetyltransferase (CrAT, EC:2.3.1.7) is responsible for the synthesis of all short-chain and short branched-chain acylcarnitines (PMID: 23485643). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].
1-(D-3-Mercapto-2-methyl-1-oxopropyl)-L-proline
Benzeneacetonitrile, alpha-((((dimethylamino)carbonyl)oxy)imino)-C145
2-(2-Aminopropanylamino)-4-carbamoylbutyric acid
Propionic acid, 2-methyl-2-((piperidinomethyl)thio)-
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018680 - Cholinergic Antagonists D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents
4-Ethoxymethylene-2-phenyl-2-oxazolin-5-one
D007155 - Immunologic Factors
Mivazerol
C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists
Pymetrozine
C10H11N5O (217.09635559999998)
N-[(2R)-4-(Hydroxymethyl)-3-oxo-1-sulfanylhex-4-en-2-yl]acetamide
7-Methoxy-1,6-dimethyl-5,8-dihydroisoquinoline-5,8-dione
bruceolline L
An indole alkaloid that is 1H-indole substituted by a (2R)-2-hydroxy-3-methylbutanoyl group at position 3. It has been isolated from the ethanol extract of the stems of Brucea mollis.
(Z)-6-(4-hydroxy-3-methylbut-2-en-1-yl)indolin-2-one
5-(3-Amidinoureido)-2-aminovaleric acid
C7H15N5O3 (217.11748400000002)
Securinin
Virosecurinine is a member of indolizines. Virosecurinine is a natural product found in Flueggea suffruticosa and Phyllanthus niruri with data available. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. (-)-Securinine is plant-derived alkaloid and also a GABAA receptor antagonist. Allosecurinine (Phyllochrysine) is a Securinega alkaloid isolated from Phyllanthus glaucus [1].
Captopril
C - Cardiovascular system > C09 - Agents acting on the renin-angiotensin system > C09A - Ace inhibitors, plain > C09AA - Ace inhibitors, plain D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C247 - ACE Inhibitor D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS Annotation level-1 CONFIDENCE standard compound; INTERNAL_ID 2721 CONFIDENCE standard compound; INTERNAL_ID 8619
C13H15NO2_(5S)-5-Acetyl-1-benzyl-2-pyrrolidinone
Acetylcitrulline
MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; WMQMIOYQXNRROC-LURJTMIESA-N_STSL_0245_Acetylcitrulline_1000fmol_190413_S2_LC02MS02_076; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. MS2 deconvoluted using CorrDec from all ion fragmentation data, MetaboLights identifier MTBLS1040; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I.
4-(2-Keto-1-benzimidazolinyl)piperidine
C12H15N3O (217.12150599999998)
N-Desmethylaminopyrine
C12H15N3O (217.12150599999998)
Ala-GLN
A dipeptide formed from L-alanyl and L-glutamine residues.
5-amino-1-(4-methylphenyl)pyrazole-4-carboxylic acid
1H-1,2,3-Triazole-4-carboxylicacid,5-ethyl-1-phenyl-(9CI)
3,4-Dihydro-1(2H)-pyridinecarboxylic Acid Phenylmethyl Ester
1,6-Dimethyl-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid
7,9-dioxo-8-azaspiro[4.5]decane-6,10-dicarbonitrile
methyl 4-methyl-1-oxo-2H-isoquinoline-3-carboxylate
METHYL 1-BENZYL-2,5-DIHYDRO-1H-PYRROLE-3-CARBOXYLATE
tert-Butyl 3-fluoro-4-oxopiperidine-1-carboxylate
C10H16FNO3 (217.11141579999997)
4-(1-Methoxy-2-(methylamino)ethyl)phenol hydrochloride
Fenimide
C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent
1-(4-isocyanatophenyl)-4-methylpiperazine
C12H15N3O (217.12150599999998)
Ethyl 3-exo-aminobicyclo[2.2.1]hept-5-ene-2-exo-carboxylate hydrochloride
3-ETHYL-4-OXO-3,4-DIHYDRO-PHTHALAZINE-1-CARBOXYLIC ACID AMIDE
4-Isoxazolecarboxaldehyde,3-(4-methoxyphenyl)-5-methyl-(9CI)
3-[2-(trifluoromethyl)phenoxy]azetidine
C10H10F3NO (217.07144459999998)
3-Benzyl-3-azabicyclo[3.1.0]hexane-1-carboxylic acid
METHYL 1-CYCLOPROPYL-1H-BENZO[D][1,2,3]TRIAZOLE-5-CARBOXYLATE
(R)-5-OXO-1-((R)-1-PHENYLETHYL)PYRROLIDINE-3-CARBALDEHYDE
1-(2-(DIMETHYLAMINO)PHENYL)-2,2,2-TRIFLUOROETHANONE
C10H10F3NO (217.07144459999998)
METHYL 2-METHYL-4-OXO-1,4-DIHYDROQUINOLINE-6-CARBOXYLATE
(Z)-4-(4-METHOXYBENZYLIDENE)-2-METHYLOXAZOL-5(4H)-ONE
4-(2-METHYL-2-PHENYLHYDRAZINYL)-5,6-DIHYDROPYRIDIN-2(1H)-ONE
C12H15N3O (217.12150599999998)
1-(TETRAHYDRO-2H-PYRAN-2-YL)-1H-INDAZOL-6-AMINE
C12H15N3O (217.12150599999998)
4-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-3-(4-METHYLPHENYL)-
1,4-Dihydro-1,2-dimethyl-4-oxo -3-quilinecarboxylic acid
1-[(tert-butoxy)carbonyl]-3-hydroxyazetidine-3-carboxylic acid
4-(4-Methoxy-2-methylphenyl)-5-methyl-1H-pyrazol-3-amine
C12H15N3O (217.12150599999998)
1-(2-DIBENZYLAMINO-4-METHYL-THIAZOL-5-YL)-3-(2,5-DIHYDRO-2-DIBENZYLIMMONIUM-4-METHYL-THIAZOL-5-YLIDENE)-2-OXO-CYCLOBUTEN-4-OLATE
(S)-7-(TRIFLUOROMETHYL)CHROMAN-4-AMINE
C10H10F3NO (217.07144459999998)
5-Methoxy-6-(trifluoroMethyl)indoline
C10H10F3NO (217.07144459999998)
7-(trifluoromethyl)chroman-4-amine
C10H10F3NO (217.07144459999998)
N,N-Dimethyl-4-(trifluoromethyl)benzamide
C10H10F3NO (217.07144459999998)
2-(1-methylidene-3-oxoisoindol-2-yl)propanoic acid
2-CYANO-3-(PYRIDIN-2-YLAMINO)-ACRYLIC ACID ETHYL ESTER
Piroximone
D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors D004791 - Enzyme Inhibitors > D010726 - Phosphodiesterase Inhibitors C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor D020011 - Protective Agents > D002316 - Cardiotonic Agents D002317 - Cardiovascular Agents
1,3,5-TRIAZINE-2,4-DIAMINE, 6-(2-METHOXYPHENYL)-
C10H11N5O (217.09635559999998)
2-(1-METHYL-1H-INDOL-3-YL)-2-OXOACETIC ACID METHYL ESTER
Methyl 2-(3-(pyridin-2-yl)-1H-pyrazol-1-yl)acetate
(R)-7-(TRIFLUOROMETHYL)CHROMAN-4-AMINE
C10H10F3NO (217.07144459999998)
5-(Pyridin-3-yl)-1H-pyrazole-3-carboxylic acid ethyl ester
5-hex-1-ynylpyridine-3-carbohydrazide
C12H15N3O (217.12150599999998)
ethyl 3-endo-aminobicyclo[2.2.1]hept-5-ene-2-endo-carboxylate hydrochloride
N-(4-TRIFLUOROMETHYLPHENYL)PROPIONAMIDE
C10H10F3NO (217.07144459999998)
5,8-DIMETHYL-4-HYDROXYQUINOLINE-3-CARBOXYLIC ACID
(3s-cis)-7a-methyl-3-phenyltetrahydropyrrolo[2,1-b]oxazol-5(6h)-one
(S)-2-AMINO-3-(BENZYLOXY)PROPAN-1-OL HYDROCHLORIDE
6-methyl-2-(propylamino)-1H-quinazolin-4-one
C12H15N3O (217.12150599999998)
1-(4-(DIMETHYLAMINO)PHENYL)-2,2,2-TRIFLUOROETHANONE
C10H10F3NO (217.07144459999998)
2-[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]ethanol
1-(3-(DIMETHYLAMINO)PHENYL)-2,2,2-TRIFLUOROETHANONE
C10H10F3NO (217.07144459999998)
2-(1-Methyl-2-oxopropyl)-1H-isoindole-1,3-(2H)-dione
2,4(1H,3H)-Pyrimidinedione, 6-amino-1-(phenylmethyl)-
4-Quinolinecarboxylicacid, 1,2-dihydro-2-oxo-, ethyl ester
(R)-8-(TRIFLUOROMETHYL)CHROMAN-4-AMINE
C10H10F3NO (217.07144459999998)
5-(3-aminophenyl)furan-2-carboxylic acid methyl ester
Efortil
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents D020011 - Protective Agents > D002316 - Cardiotonic Agents Etilefrine hydrochloride is an orally active α adrenergic agonist. Etilefrine hydrochloride is also an AMPK activator. Etilefrine hydrochloride can be used for the research of postural hypotension[1][2][3][4]. Etilefrine hydrochloride is an orally active α adrenergic agonist. Etilefrine hydrochloride is also an AMPK activator. Etilefrine hydrochloride can be used for the research of postural hypotension[1][2][3][4].
5-(4-tert-butylphenyl)-1,3,4-oxadiazol-2-amine
C12H15N3O (217.12150599999998)
1-(6-methylpyridin-2-yl)imidazole-4-carbohydrazide
C10H11N5O (217.09635559999998)
1-(2-FLUORO-BENZOYLAMINO)-CYCLOHEPTANECARBOXYLICACID
3-[4-(trifluoromethyl)phenoxy]azetidine
C10H10F3NO (217.07144459999998)
Spiro[cyclohexane-1,3(1H)-furo[3,4-c]pyridine]-1,4-dione
1-BENZYL-5-METHYL-1H-[1,2,3]TRIAZOLE-4-CARBOXYLIC ACID
4-(4-METHOXYPHENYL)TETRAHYDRO-2H-PYRAN-4-CARBONITRILE
1-(2,3-Dimethoxyphenyl)-N-methylmethanamine hydrochloride
(R)-2-AMINO-3-(BENZYLOXY)PROPAN-1-OL HYDROCHLORIDE
1H-1,2,3-Triazole-5-carboxylicacid,4-ethyl-1-phenyl-(9CI)
5-METHYL-2-PHENYL-2H-1,2,3-TRIAZOLE-4-CARBOHYDRAZIDE
C10H11N5O (217.09635559999998)
METHYL 5-METHYL-2-PHENYL-2H-1,2,3-TRIAZOLE-4-CARBOXYLATE
3-Benzyl-3-azabicyclo[3.1.0]hexane-6-carboxylic acid
5-(2-AMINO-PHENYL)-FURAN-2-CARBOXYLIC ACID METHYL ESTER
2-(5-cyclopentyl-1,2,4-oxadiazol-3-yl)ethanamine(SALTDATA: HCl)
1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid(SALTDATA: FREE)
2,2,2-TRIFLUORO-N-[(R)-ALPHA-METHYLBENZYL]ACETAMIDE
C10H10F3NO (217.07144459999998)
2-N-(4-methoxyphenyl)-1,3,5-triazine-2,4-diamine
C10H11N5O (217.09635559999998)
1,6,8-TRIMETHYL-1,2,3,6-TETRAHYDRODIPYRAZOLO[3,4-B:3,4-D]PYRIDIN-3-ONE
C10H11N5O (217.09635559999998)
1,2,3,4,7,8,9,10-OCTAHYDROBENZO[C]CINNOLIN-1-ONE OXIME
C12H15N3O (217.12150599999998)
3-METHYL-5-PHENYL-ISOXAZOLE-4-CARBOXYLIC ACID METHYL ESTER
5-amino-1-phenylpyrazole-4-carbohydrazide
C10H11N5O (217.09635559999998)
Pyrimido[1,2-a]benzimidazole, 7-ethoxy-1,2,3,4-tetrahydro- (9CI)
C12H15N3O (217.12150599999998)
(S)-8-(TRIFLUOROMETHYL)CHROMAN-4-AMINE
C10H10F3NO (217.07144459999998)
3-(METHYLTHIO)-1-PYRROLIDINECARBOXYLIC ACID,1,1-DIMETHYLETHYL ESTER
Ethyl 2-amino-5-methyl-4-phenylthiophene-3-carboxylate
1H-1,2,3-Triazole-4-carboxamide,5-amino-1-(phenylmethyl)-
C10H11N5O (217.09635559999998)
1-(TETRAHYDRO-2H-PYRAN-2-YL)-1H-INDAZOL-5-AMINE
C12H15N3O (217.12150599999998)
methyl 4-methyl-2-phenyl-1,3-oxazole-5-carboxylate
4-amino-2-spirocyclohexyl-2h-benzimidazol-1-oxide
C12H15N3O (217.12150599999998)
n,n-dimethyl-3-(trifluoromethyl)benzamide
C10H10F3NO (217.07144459999998)
Carbamic acid, (2-ethynylphenyl)-, 1,1-dimethylethyl ester (9CI)
(S)-2-(tert-butoxycarbonyl)isoxazolidine-3-carboxylic acid
2-(4-Hydroxy-cyclohexylaMino)-nicotInonitrile
C12H15N3O (217.12150599999998)
1-Azabicyclo[2.2.2]oct-2-ene-3-carboxylic acid ethyl ester hydrochloride
2,2,2-TRIFLUORO-N-[(S)-ALPHA-METHYLBENZYL]ACETAMIDE
C10H10F3NO (217.07144459999998)
4-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-3-PHENYL-, METHYL ESTER
1H-Spiro[piperidine-4,2-quinazolin]-4(3H)-one
C12H15N3O (217.12150599999998)
1H-Spiro[piperidine-4,4-quinazolin]-2(3H)-one
C12H15N3O (217.12150599999998)
1-(2-CHLOROPHENYL)-N-(1-METHYLPROPYL)-ISOQUINOLINE-3-CARBOXAMIDE
6-(4-Methoxyphenyl)-1,3,5-triazine-2,4-diamine
C10H11N5O (217.09635559999998)
3-Isoquinolinecarboxylicacid,1-ethyl-3,4-dihydro-3-methyl-(9CI)
Isoxazole, 3-ethoxy-4-methyl-5-(phenylmethyl)- (9CI)
(3r-cis)-7a-methyl-3-phenyltetrahydropyrrolo[2,1-b]oxazol-5(6h)-one
1-((2,3-DIHYDROBENZO[B][1,4]DIOXIN-2-YL)METHYL)HYDRAZINE
(3-Cyclohexyl-1,2,4-oxadiazol-5-yl)methylamine hydrochloride
1-(4-Methoxybenzyl)-3-methyl-1H-pyrazol-5-amine
C12H15N3O (217.12150599999998)
Epicaptopril
D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents
4-ethoxymethylene-2-phenyl-2-oxazolin-5-one
D007155 - Immunologic Factors
(3Z)-3-[(4-methylphenyl)hydrazinylidene]piperidin-2-one
C12H15N3O (217.12150599999998)
1-(3-Mercapto-2-methyl-propionyl)-pyrrolidine-2-carboxylic acid
N-alpha-Acetylcitrulline
N-a-Acetylcitrulline is an N-acetylated metabolite of citrulline that is part of the arginine biosynthetic pathway. Arginine biosynthesis is notable for its complexity and variability at the genetic level, and by its connection with several other pathways, such as pyrimidine and polyamine biosynthesis, and certain degradative pathways. The initial steps of the arginine biosynthetic pathways proceed via N-acetylated intermediates. The presumed reason for this is that the acetylation prevents the spontaneous cyclization of glutamate derivatives, which leads to proline biosynthesis. N-acetyl-L-ornithine can be transcarbamylated directly by the enzyme acetylornithine transcarbamylase, resulting in N-acetyl-L-citrulline. The enzyme acetylornithine deacetylase can accept N-acetyl-L-citrulline as a substrate, and can deacetylate it into citrulline. N-a-Acetylcitrulline is found in cases of deficiency of the urea cycle enzyme argininosuccinate synthase (EC 6.3.4.5) that leads to increased concentrations of citrulline and N-acetylcitrulline in the urine. (PMID: 14633929) [HMDB]
(2S)-5-amino-2-{[(2S)-2-azaniumylpropanoyl]amino}-5-oxopentanoate
(2S)-2-azaniumyl-5-{[(1S)-1-carboxylatoethyl]amino}-5-oxopentanoate
C8H13N2O5- (217.08244280000002)
COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
[(Z)-[cyano(phenyl)methylidene]amino] N,N-dimethylcarbamate
3-[(2-Oxoacetyl)oxy]-4-(trimethylazaniumyl)butanoate
N-[(2R)-4-(Hydroxymethyl)-3-oxo-1-sulfanylhex-4-en-2-yl]acetamide
(2R,8S)-14-Oxa-7-azatetracyclo[6.6.1.01,11.02,7]pentadeca-9,11-dien-13-one
(E)-3-[[(2R)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]prop-2-enoic acid
4-methyl-N-(2-methyl-5-tetrazolyl)benzamide
C10H11N5O (217.09635559999998)
2-Cyclopentyl-5-(prop-2-enylamino)-4-oxazolecarbonitrile
C12H15N3O (217.12150599999998)
(3Z)-3-[(2-methylphenyl)hydrazinylidene]piperidin-2-one
C12H15N3O (217.12150599999998)
2-[(4-Hydroxy-2-methylphenyl)iminomethyl]cyclopentan-1-one
Methyl 2-methyl-5-phenyl-1-pyrroline-4-carboxylate (4,5-cis)
Methyl 3-methyl-5-phenyl-1-pyrroline-4-carboxylate (3,4-trans-4,5-cis)
Methyl 3-methyl-2-phenyl-1-pyrroline-3-carboxylate
glutethimide
D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D006993 - Hypnotics and Sedatives N - Nervous system > N05 - Psycholeptics > N05C - Hypnotics and sedatives > N05CE - Piperidinedione derivatives C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
H-Ala-Gln-OH
B - Blood and blood forming organs > B05 - Blood substitutes and perfusion solutions > B05X - I.v. solution additives > B05XB - Amino acids L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1]. L-Alanyl-L-glutamine, a glutamine dipeptide, is benefit for the antioxidant system, attenuating inflammation, and may modulate the heat shock protein (HSP) response in catabolic situations[1].
Ala-Gln zwitterion
A peptide zwitterion obtained by transfer of a proton from the carboxy to the amino terminus of Ala-Gln.
4-(methylamino)antipyrine
C12H15N3O (217.12150599999998)
A member of the class of pyrazoles that is antipyrine substituted at C-4 by a methylamino group. It is a metabolite of aminopyrine and of metamizole.
Ala-Ala-Gly
A tripeptide composed of two L-alanine units and a glycine joined by peptide linkages.
gamma-Glu-Ala(1-)
C8H13N2O5 (217.08244280000002)
A peptide anion that is the conjugate base of gamma-Glu-Ala, obtained by removal of protons from the two carboxy groups as well as protonation of the amino group; major species at pH 7.3.
8-(methylthio)octylisothiocyanate
An isothiocyanate that is octane in which two of the terminal methyl hydrogens at positions 1 and 8 have been replaced by isothiocyanato and methylsulfanyl groups.
(2s)-2-{[(2s)-2-amino-1-hydroxypropylidene]amino}-4-(c-hydroxycarbonimidoyl)butanoic acid
(1r,2r,8r)-14-oxa-7-azatetracyclo[6.6.1.0¹,¹¹.0²,⁷]pentadeca-9,11-dien-13-one
6-(4-hydroxy-2,5-dihydro-1,3-thiazol-2-yl)hexanoic acid
4-ethoxycarbonyl-2-quinolinone
{"Ingredient_id": "HBIN010377","Ingredient_name": "4-ethoxycarbonyl-2-quinolinone","Alias": "NA","Ingredient_formula": "C12H11NO3","Ingredient_Smile": "CCOC(=O)C1=CC(=O)NC2=CC=CC=C21","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15322","TCMID_id": "7397","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
n-[(1s,2s,5r,6r)-2,5,6-trihydroxy-4-(hydroxymethyl)cyclohex-3-en-1-yl]ethanimidic acid
(1r,2s,8r)-14-oxa-7-azatetracyclo[6.6.1.0¹,¹¹.0²,⁷]pentadeca-9,11-dien-13-one
(2e)-3-{[(2r)-1,2,4-trihydroxy-3,3-dimethylbutylidene]amino}prop-2-enoic acid
14-oxa-7-azatetracyclo[6.6.1.0¹,¹¹.0²,⁷]pentadeca-9,11-dien-13-one
(1s,2s)-14-oxa-7-azatetracyclo[6.6.1.0¹,¹¹.0²,⁷]pentadeca-9,11-dien-13-one
{[(2r,4r)-2-carboxy-4,5-dihydroxy-3,4-dihydropyrrol-2-yl]methyl}trimethylazanium
(1s,2s,8s)-14-oxa-7-azatetracyclo[6.6.1.0¹,¹¹.0²,⁷]pentadeca-9,11-dien-13-one
6-[(2s)-4-hydroxy-2,5-dihydro-1,3-thiazol-2-yl]hexanoic acid
(7e,9r)-7-ethylidene-9-hydroxy-5ah,6h,8h,8ah,9h-cyclopenta[f]indolizin-5-one
(1r,2s,8s)-14-oxa-7-azatetracyclo[6.6.1.0¹,¹¹.0²,⁷]pentadeca-9,11-dien-13-one
[(2e)-2-[(6-aminopurin-9-yl)methylidene]cyclopropyl]methanol
C10H11N5O (217.09635559999998)
3-[(1,2,4-trihydroxy-3,3-dimethylbutylidene)amino]prop-2-enoic acid
6-hydroxy-7-methyl-4-(methylamino)naphthalene-1,2-dione
{[(2s)-2-{[(2s)-2-amino-1-hydroxypropylidene]amino}-1-hydroxypropylidene]amino}acetic acid
ethyl({4-methoxy-1h,1'h-[2,2'-bipyrrol]-5-yl}methylidene)amine
C12H15N3O (217.12150599999998)