Exact Mass: 209.1052
Exact Mass Matches: 209.1052
Found 500 metabolites which its exact mass value is equals to given mass value 209.1052,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Propoxur
CONFIDENCE standard compound; INTERNAL_ID 365; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7950; ORIGINAL_PRECURSOR_SCAN_NO 7947 CONFIDENCE standard compound; INTERNAL_ID 365; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7933; ORIGINAL_PRECURSOR_SCAN_NO 7930 CONFIDENCE standard compound; INTERNAL_ID 365; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7922; ORIGINAL_PRECURSOR_SCAN_NO 7920 CONFIDENCE standard compound; INTERNAL_ID 365; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7940; ORIGINAL_PRECURSOR_SCAN_NO 7937 CONFIDENCE standard compound; INTERNAL_ID 365; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7982; ORIGINAL_PRECURSOR_SCAN_NO 7979 CONFIDENCE standard compound; INTERNAL_ID 365; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7967; ORIGINAL_PRECURSOR_SCAN_NO 7964 D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals
Proflavine
Proflavine is only found in individuals that have used or taken this drug. It is a topical antiseptic used mainly in wound dressings. [PubChem]Proflavine acts by interchelating DNA (intercalation), thereby disrupting DNA synthesis and leading to high levels of mutation in the copied DNA strands. This prevents bacterial reproduction. C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D000890 - Anti-Infective Agents
4-Acetamido-2-amino-6-nitrotoluene
This compound belongs to the family of Nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.
2-Hydroxyiminostilbene
2-Hydroxyiminostilbene is a metabolite of carbamazepine. Carbamazepine (CBZ) is an anticonvulsant and mood-stabilizing drug used primarily in the treatment of epilepsy and bipolar disorder, as well as trigeminal neuralgia. (Wikipedia)
4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol
4-(methylnitrosamino)-1-(3-pyridyl)-1-butanol belongs to the family of Pyridines and Derivatives. These are compounds containing a pyridine ring, which is a six-member aromatic heterocycle which consists of one nitrogen atom and five carbon atoms.
Talipexole
D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents > D018491 - Dopamine Agonists C78272 - Agent Affecting Nervous System > C66884 - Dopamine Agonist
Minoxidil
C - Cardiovascular system > C02 - Antihypertensives > C02D - Arteriolar smooth muscle, agents acting on > C02DC - Pyrimidine derivatives C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D - Dermatologicals KEIO_ID M035; [MS2] KO009058 KEIO_ID M035
Minoxidil
Minoxidil is only found in individuals that have used or taken this drug. It is a potent direct-acting peripheral vasodilator (vasodilator agents) that reduces peripheral resistance and produces a fall in blood pressure. (From Martindale, The Extra Pharmacopoeia, 30th ed, p371)Minoxidil is thought to promote the survival of human dermal papillary cells (DPCs) or hair cells by activating both extracellular signal-regulated kinase (ERK) and Akt and by preventing cell death by increasing the ratio of BCl-2/Bax. Minoxidil may stimulate the growth of human hairs by prolonging anagen through these proliferative and anti-apoptotic effects on DPCs. Minoxidil, when used as a vasodilator, acts by opening adenosine triphosphate-sensitive potassium channels in vascular smooth muscle cells. This vasodilation may also improve the viability of hair cells or hair follicles. C - Cardiovascular system > C02 - Antihypertensives > C02D - Arteriolar smooth muscle, agents acting on > C02DC - Pyrimidine derivatives C78274 - Agent Affecting Cardiovascular System > C270 - Antihypertensive Agent C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents D - Dermatologicals
10-Methylacridone
10-Methylacridone is found in citrus. 10-Methylacridone is a constituent of the roots of Citrus deliciosa (Italian tangerine). Constituent of the roots of Citrus deliciosa (Italian tangerine). 10-Methylacridone is found in citrus.
3-Methyl-9H-carbazole-9-carboxaldehyde
3-Methyl-9H-carbazole-9-carboxaldehyde is found in herbs and spices. 3-Methyl-9H-carbazole-9-carboxaldehyde is an alkaloid from the roots of Murraya koenigii (curryleaf tree). Alkaloid from the roots of Murraya koenigii (curryleaf tree). 3-Methyl-9H-carbazole-9-carboxaldehyde is found in herbs and spices.
2,5-Dimethoxy-4-methylamphetamine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D006213 - Hallucinogens
2',3'-Didehydro-2',3'-dideoxycytidine
4-(Methylnitrosoamino)-4-(3-pyridyl)-1-butanol
D009676 - Noxae > D002273 - Carcinogens
Bamethan
C - Cardiovascular system > C04 - Peripheral vasodilators > C04A - Peripheral vasodilators > C04AA - 2-amino-1-phenylethanol derivatives C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents
2-[Bis-(2-hydroxy-ethyl)-amino]-2-hydroxymethyl-propane-1,3-diol
Desciclovir
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
3[N-Morpholino]propane sulfonic acid
COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
N-Hydroxy-N'-(4-hydroxy-4-pyridin-3-ylbutyl)methanimidamide
(+)-7-iso-jasmonate
(+)-7-iso-jasmonate is a member of the class of compounds known as jasmonic acids. Jasmonic acids are lipids containing or derived from a jasmonic acid, with a structure characterized by the presence of an alkene chain linked to a 2-(3-oxocyclopentyl)acetic acid moiety (+)-7-iso-jasmonate is practically insoluble (in water) and a weakly acidic compound (based on its pKa). (+)-7-iso-jasmonate can be found in a number of food items such as tarragon, celery leaves, sweet marjoram, and rape, which makes (+)-7-iso-jasmonate a potential biomarker for the consumption of these food products.
6-(4-methyl-2-oxopentyl)-4-hydroxy-2-pyrone
6-(4-methyl-2-oxopentyl)-4-hydroxy-2-pyrone is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). 6-(4-methyl-2-oxopentyl)-4-hydroxy-2-pyrone can be found in a number of food items such as rye, chestnut, potato, and feijoa, which makes 6-(4-methyl-2-oxopentyl)-4-hydroxy-2-pyrone a potential biomarker for the consumption of these food products.
2,5-Dimethoxy-4-methylamphetamine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017366 - Serotonin Receptor Agonists D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D006213 - Hallucinogens
8-Dimethylamino-7-methyl-3,7-dihydro-purin-2,6-dion|8-dimethylamino-7-methyl-3,7-dihydro-purine-2,6-dione
3c-methyl-(4ar,10at,10bc)-decahydro-pyrano[2,3-g]indolizin-1-one|Elaeokanin D|Elaeokanine D
5-Acetamino-furfurol-acetylhydrazon|5-Acetaminofurfurol-acetylhydrazon
N,N-dihydroxydihomomethionine
An N,N-dihydroxy-alpha-amino acid having a 5-thiahexyl substituent at the 2-position.
propoxur
D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals
1,1,2-Trimethyl-1H-benzo[e]indole
CONFIDENCE standard compound; INTERNAL_ID 598; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9026; ORIGINAL_PRECURSOR_SCAN_NO 9021 CONFIDENCE standard compound; INTERNAL_ID 598; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9060; ORIGINAL_PRECURSOR_SCAN_NO 9058 CONFIDENCE standard compound; INTERNAL_ID 598; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9080; ORIGINAL_PRECURSOR_SCAN_NO 9076 CONFIDENCE standard compound; INTERNAL_ID 598; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9122; ORIGINAL_PRECURSOR_SCAN_NO 9120 CONFIDENCE standard compound; INTERNAL_ID 598; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9117; ORIGINAL_PRECURSOR_SCAN_NO 9115 CONFIDENCE standard compound; INTERNAL_ID 598; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9137; ORIGINAL_PRECURSOR_SCAN_NO 9135
((3S,4R)-4-(4-Fluorophenyl)piperidin-3-yl)methanol
Thiourea, N-(1-methylethyl)-N-(5-methyl-2-pyridinyl)- (9CI)
Ethanone,1-(3,4-dihydroxyphenyl)-2-[(1-methylethyl)amino]-
2-METHOXY-N-[1-(3-OXOCYCLOHEX-1-ENYL)VINYL]ACETAMIDE
3-AMINO-3-(4-HYDROXY-3,5-DIMETHYL-PHENYL)-PROPIONIC ACID
Carbamic acid,N-(3-hydroxyphenyl)-, 1,1-dimethylethyl ester
Pyrimidine, 4-ethoxy-5-nitro-6-(1E)-1-propenyl- (9CI)
1H-Furo[3,2-c]pyrazole-5-carboxylicacid,3-amino-,propylester(9CI)
(1H,1H,2H,2H-PERFLUORO-N-HEXYL)METHYLDICHLORO-SILANE
1H-Imidazole-1-carboxylicacid,1-methyl-3-piperidinylester(9CI)
tert-Butyl N-(2-amino-2-iminoethyl)carbamate,hydrochloride
1-Pyrrolidineacetamide, N-(5-methyl-3-isoxazolyl)-
(2-Hydroxy-ethyl)-Methyl-carbamic acid benzyl ester
2-AMINO-6-FLUORO-1,2,3,4-TETRAHYDRO-NAPHTHALENE-2-CARBOXYLIC ACID
4-(4-methylphenyl)-1,2,3,6-tetrahydropyridine hydrochloride
Ethyl 4-oxo-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine-2-carboxylate
Tetraethylammonium bromide
D002317 - Cardiovascular Agents > D026902 - Potassium Channel Blockers D049990 - Membrane Transport Modulators
1-Azabicyclo[2.2.2]octane-3,3-diol,2-(hydroxymethyl)-, hydrochloride (1:1)
3-Pyridazinecarboxylic acid, 6-(butylamino)-, methyl ester
4,6-Dihydropyrrolo[3,4-c]pyrazole-5(1H)-carboxylic acid tert-butyl ester
2-[2-(4-METHYL-PIPERAZIN-1-YL)-ETHOXY]-BENZALDEHYDE
N-ethyl-N-propan-2-ylpropan-2-amine,sulfur trioxide
[2-(4-HYDROXY-PHENYL)-ETHYL]-CARBAMIC ACID ETHYL ESTER
1-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-1,2,3-triazole
tert-Butyl 4,6-dihydropyrrolo[3,4-c]pyrazole-5(2H)-carboxylate
(NE)-N-[(3-methoxy-4-propan-2-yloxyphenyl)methylidene]hydroxylamine
4,5-DIHYDROSPIRO[PIPERIDINE-4,7-THIENO[2,3-C]PYRAN]
3-(3-AMINOPYRIDIN-4-YLAMINO)PROPIONIC ACID ETHYL ESTER
Bis-tris methane
D019995 - Laboratory Chemicals > D002021 - Buffers COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
5-methyl-4-pyrrolidin-1-ylmethyl-furan-2-carboxylic acid
2-(5-(2-METHYL-1,3-DIOXOLAN-2-YL)-2-PYRIDYL]ETHANOL
Tolonidine
C - Cardiovascular system > C02 - Antihypertensives > C02A - Antiadrenergic agents, centrally acting > C02AC - Imidazoline receptor agonists C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist
2-methylidene-1-azabicyclo[2.2.2]octan-3-one,hydrate,hydrochloride
9-d-(2,3-dihydroxypropyl)adenine
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents
1-METHYL-5-(PYRROLIDIN-1-YLMETHYL)-1H-PYRAZOLE-3-CARBOXYLIC ACID
Benzoic acid, 3-amino-4-ethoxy-, ethyl ester (9CI)
1H-Pyrrole-3-carboxylicacid, 5-acetyl-2,4-dimethyl-, ethyl ester
1-METHYL-3-(PYRROLIDIN-1-YLMETHYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID
(3S,4R)-4-(4-FLUOROPHENYL)PYRROLIDINE-3-CARBOXYLIC ACID
3-amino-3-(4-methoxy-3-methylphenyl)propanoic acid
TRANS-4-(4-FLUOROPHENYL)3-HYDROXYMETHYL)-PIPERIDINE
Ethyl 5-Hydroxypiperidine-3-carboxylate Hydrochloride
1-(5-Chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-N,N-dimethylmethanamin e
methyl 6-methyl-5-propan-2-yloxypyridine-2-carboxylate
5-(1H-Pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-3-carbonitrile
1-Propanone, 2-amino-1-(2,5-dimethoxyphenyl)-, hydrochloride
2-(Diethylamino)-6-methyl-4-pyrimidinecarboxylic acid
3-(N-Methylpentylamino)Propionic Acid Hydrochloride
(S)-METHYL (1-HYDROXY-3-PHENYLPROPAN-2-YL)CARBAMATE
4-Ethoxy-N,N,N-trimethyl-4-oxo-1-butanaminium chloride
0MPTP hydrochloride
MPTP hydrochloride is a brain penetrant dopamine neurotoxin. MPTP hydrochloride can be used to induces Parkinson’s Disease model. MPTP hydrochloride, a precusor of MPP+, induces apoptosis[1][2][3]. MPTP hydrochloride has been verified by MCE with professional biological experiments.
1,3-DIMETHYL-5-MORPHOLINO-1H-PYRAZOLE-4-CARBALDEHYDE
Carbamic acid, (2-amino-4-pyridinyl)-, 1,1-dimethylethyl ester (9CI)
4-((cyclopropylaMino)Methyl)-3-fluorophenylboronic acid
Pyrrolidinium, 1-ethyl-1-methyl-, methanesulfonate
ETHYL 7-METHYL-5,6,7,8-TETRAHYDROIMIDAZO[1,2-A]PYRAZINE-2-CARBOXYLATE
ethyl 2-methoxy-4,6-dimethylpyridine-3-carboxylate
methyl 4-acetyl-1,2,5-trimethylpyrrole-3-carboxylate
1H-1,2,3-Triazolo[4,5-d]pyrimidine-5,7(4H,6H)-dione,4,6-diethyl-(9CI)
(3S,4R)-4-(2-fluorophenyl)pyrrolidine-3-carboxylic acid
(3S,4R)-4-(3-fluorophenyl)pyrrolidine-3-carboxylic acid
3-AMINO-1,2,3,4-TETRAHYDROQUINOLINE-6-CARBONITRILE HYDROCHLORIDE
Carbamic acid, (4-methoxyphenyl)-, 1-methylethyl ester
Silanamine, N-((4-methoxyphenyl)methyl)-1,1,1-trimethyl-
4H-Pyrido[1,2-a]pyrimidine-3-carboxamide, 1,6,7,8,9,9a-hexahydro-6-methyl-4-oxo-
Desciclovir
D000890 - Anti-Infective Agents > D000998 - Antiviral Agents C471 - Enzyme Inhibitor > C29575 - DNA Polymerase Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent
Bolfo
D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D010575 - Pesticides > D007306 - Insecticides D004791 - Enzyme Inhibitors D016573 - Agrochemicals
Trimethyl-[2-(pyridine-3-carbonyloxy)ethyl]azanium
2',3'-Didehydro-2',3'-dideoxycytidine
{(1R,2R)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl}acetate
(+)-7-Isojasmonate
A jasmonate anion resulting from the removal of a proton from the carboxy group of (+)-7-isojasmonic acid. The major species at pH 7.3.
2-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]acetate
2-[(3-chloro-2-hydroxypropyl)amino]-3-methylbutanoic acid
Octylsulfamic acid
A member of the class of sulfamic acids that is sulfamic acid in which one of the amino hydrogens has been replaced by an octyl group.
6-Ethyl-5-hydroxy-3-oxa-1-azatricyclo[5.3.1.04,11]undec-7-en-2-one
(2S)-2-[2-(pyridine-4-carbonyl)hydrazinyl]propanoic acid
(3S,4R)-3-ethyl-4-[(3-methyl-1H-imidazol-3-ium-4-yl)methyl]-2-oxolanone
4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol
A member of the class of nitrosamines that is butan-1-ol substituted by a pyridin-3-yl group at position 1 and by a methyl(nitroso)amino group at position 4. It is a major metabolite of nitrosamine 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK), which is a carcinogen found in tobacco and responsible for inducing lung cancer in smokers.
Proflavine
C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D000890 - Anti-Infective Agents
2-ethylhexyl sulfate(1-)
A organosulfate oxoanion that is the conjugate base of 2-ethylhexyl sulfate, obtained by deprotonation of the sulfo group; major species at pH 7.3.
jasmonate(1-)
A 5-oxo monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of jasmonic acid. The major species at pH 7.3.
4-Acetamido-2-amino-6-nitrotoluene
A member of the class of amino-nitrotoluenes that is 2-amino-6-nitrotoluene bearing an additional acetamido group at position 4.
2-amino-6-(aminomethyl)-5-methylidene-4-oxo-1,4,5,6,7,8-hexahydropteridin-5-ium
An iminium ion with formula C8H13N6O, that is an intermediate in the biosynthesis of methanopterin by Methanocaldococcus jannaschii.
N-Octyl sulfate
An organosulfate oxoanion that is the conjugate base of octyl hydrogen sulfate. Isolated from Daphnia pulex, it induces morphological changes of phytoplankton Scenedesmus gutwinskii.
Muscarine (chloride)
Muscarine ((+)-Muscarine) chloride is an agonist of prototype mAChR. Muscarine chloride is a toxin that can stimulate the parasympathetic nervous system[1][2].
