Exact Mass: 218.150459
Exact Mass Matches: 218.150459
Found 500 metabolites which its exact mass value is equals to given mass value 218.150459,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
5-Methoxydimethyltryptamine
5-Methoxydimethyltryptamine, like all methoxydimethyltryptamines is a compound that contain the biogenic monoamine tryptamine and is substituted with one methoxy group and two methyl groups. Members of this group include several potent serotonergic hallucinogens found in several unrelated plants, skins of certain toads, and in mammalian brains. They are possibly involved in the etiology of schizophrenia. They are formed as metabolites of serotonin (5-hydroxytryptamine) or tryptamine by the enzyme indolethylamine N-methyltransferase (INMT). The physiological significance of the N-methylating pathway of indoleamine metabolism, and of the methylated end products, is unknown. Because of the known psychotropic properties of the dimethylated amines, their possible involvement in the chemical pathogenesis of mental disorders has received wide interest. The hallucinogenic actions of the methylated indoleamines, like those of LSD, are believed to be mediated through the 5HT2 receptor. (PMID 11763413). 5-Methoxydimethyltryptamine, like all Methoxydimethyltryptamines is a compound that contain the biogenic monoamine tryptamine and is substituted with one methoxy group and two methyl groups. Members of this group include several potent serotonergic hallucinogens found in several unrelated plants, skins of certain toads, and in mammalian brains. They are possibly involved in the etiology of schizophrenia. (PubChem) C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist KEIO_ID M103; [MS2] KO009040 KEIO_ID M103
(S)-3-Mercaptohexyl pentanoate
(S)-3-Mercaptohexyl pentanoate is found in fruits. (S)-3-Mercaptohexyl pentanoate is a constituent of volatile oil of yellow passion fruit (Passiflora edulis f. flavicarpa). Constituent of volatile oil of yellow passion fruit (Passiflora edulis f. flavicarpa). (S)-3-Mercaptohexyl pentanoate is found in fruits.
(S)-3-Methylthiohexyl butyrate
(S)-3-Methylthiohexyl butyrate is found in fruits. (S)-3-Methylthiohexyl butyrate is a constituent of volatile oil of yellow passion fruit (Passiflora edulis f. flavicarpa). Constituent of volatile oil of yellow passion fruit (Passiflora edulis f. flavicarpa). (S)-3-Methylthiohexyl butyrate is found in fruits.
N-despropyl ropinirole
N-despropyl ropinirole is a metabolite of ropinirole. Ropinirole (INN; trade names Requip, Ropark, Adartrel) is a non-ergoline dopamine agonist. It is manufactured by GlaxoSmithKline (GSK), Cipla and Sun Pharmaceutical. It is used in the treatment of Parkinsons disease. Ropinirole is one of three medications approved by the FDA to treat Restless Leg Syndrome, the other two being pramipexole (Mirapex) and gabapentin enacarbil (Horizant). The discovery of the drugs utility in RLS has been used as a successful example of drug repurposing. (Wikipedia)
2,3-Dihydroxypropyl octanoate
C78276 - Agent Affecting Digestive System or Metabolism
1,2,8,8a-Tetrahydro-4,6-dimethyl-1-(1-methylethyl)-2-naphthalenol
[4aR-(4aalpha,6beta,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone
[S-[R*,S*-(E)]]-2-Methyl-6-(4-methylene-2-cyclohexen-1-yl)-2-heptenal
Tricyclo[6.3.0.0(1,5)]undec-2-en-4-one, 2,3,5,9-tetramethyl-
Chamigrenal
Chamigrenal is a natural product found in Schisandra chinensis with data available.
[S-(E)]-4-Methyl-10-methylene-7-(1-methylethenyl)-4-cyclodecen-1-one
1(10)-Aristolen-12-al
(R)-3,4,6,7,8,8a-Hexahydro-5,8a-dimethyl-3-(1-methylethylidene)-2(1H)-nphthalenone
13-Bicyclogermacrenal
gamma-Costal
(1aR,7R,7aR,7bS)-(+)-1a,2,3,5,6,7,7a,7b-Octahydro-1,1,7,7a-tetramethyl-1H-cyclopropa[a]naphthalen-3-one
4,11,11-Trimethyltricyclo[6.3.1.02.5]dodec-7-en-6-ol
[4aS-(4aalpha,6alpha,8aalpha)]-4a,5,6,7,8,8a-Hexahydro-4,8a-dimethyl-6-(1-methylethenyl)-2(1H)-naphthalenone
[3aR-(1E,3aalpha,7beta,7abeta)]-1-Ethylideneoctahydro-4-methylene-7-(1-methylethyl)-2H-inden-2-one
(+)-1,1-dimethyl-4,7-dimethylene-decahydro-cyclopropa[e]azulen-4a-ol|(+)-aromadendra-4(15),10(14)-dien-1-ol
1beta,10beta-epoxy-nardosin-7,11-diene|1??,10??-Epoxy-nardosin-7,11-diene
5-methyl-2-methylidene-8-propan-2-yl-3,4,4a,7,8,8a-hexahydronaphthalen-1-one
(1R*,4S*,5R*,6S*,7R*,9R*)-taynudol|2,8-dimethyl-5-methylene-2a,3,4,5,5a,6,7,8,8a,8b-decahydro-cyclobuta[e]azulen-4-ol
1,1??,2,4,6,7,7??,7??-Octahydro-1,1,7,7??-tetramethyl-5H-cyclopropa (??)-naphthalen-5-one
5,6,7,8-Tetrahydro-5-isopropyl-2-methoxy-3-methylnaphthalene
(E)-2-methyl-3-(5,9-dimethyl-bicyclo[4.3.0]non-9(1)-en-3-yl)-2-propenal
(8Z,13Z)-pentadeca-8,13-dien-11-yn-2-one|pentadeca-(8Z,13Z)-dien-11-yn-2-one|pentadeca-8Z,13Z-dien-11-yn-2-one
4,4a,5,6-Tetrahydro-6-isopropyl-4,4a-dimethylnaphthalene-2(3H)-one
solavetivone
A cyclic ketone derived from spiro[4.5]dec-6-en-8-one by substitution of hydrogens by methyl groups at positions 6 and 10, and by an isopropenyl group at position 2 (the (2R,5S,10R)-diastereoisomer).
(+)-silphiperfol-5-en-3-one A|3-Ketone-(3beta,7betaH)-5-Silphiperfolen-3-ol|silphiperfol-5-en-3-one A
3,3,5,7b-tetramethyl-1,1a,2,5,6,7-hexahydrocyclopropa[e]azulen-4-one
(-)-(6R,7S)-alpha-taylorione|(-)-(6R,7S)-??-Taylorione|4-[2,2-dimethyl-3-(5-methylcyclopenta-1,4-dien-1-yl)cyclopropyl]-butan-2-one
(-)-(6S,7S,10R)-taylocyclane|1,3,3-trimethyl-7-(5-methylcyclopenta-1,4-dien-1-yl)-2-oxabicyclo[2.2.1]heptane
(+)-(1R,5S,6R,9R,10R)-5,9-epoxyamorpha-3,7(11)-diene
1,2,3,4,5,6,7,9a-Octahydro-4,9a-dimethyl-4a,7-methano-4aH-benzocycloheptene-8-carbaldehyde
4-Methyl-2-(2,5,6,6-tetramethyl-2-cyclohexene-1-yl)furan
1,8-Dimethyl-3a-methoxy-1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole
9alpha,11-Epoxy-1betaH,5alphaH,7betaH,9betaH-guaia-3,10(14)-diene
delta5(15)-Isomer-4-Methyl-2-(2,5,6,6-tetramethyl-2-cyclohexen-1-yl)furan
3,8-Dimethyl-4-(1-methylethylidene)-2,4,6,7,8,8a-hexahydro-5(1H)-azulenone
6,10-Dimethyl-3-(1-methylethenyl)bicyclo[5.3.0]dec-6-en-5-one
(+/-)-5,6-dimethyl-2-(2-hydroxyisopropyl)tetralin|1,2,3,4-tetrahydro-alpha,alpha,5,6-tetramethyl-2-naphthalenemethanol
(5E)-2-(2,6-dimethylocta-5,7-dienyl)-4-methylfuran|2-(2,6-Dimethyl-5,7-octadienyl)-4-methylfuran
(-)-4-(1,5-dimethylhex-4-enyl)-2-methylphenol|4-(1,5-dimethylhex-4-enyl)-2-methylphenol
2-Isopropenyl-6-formyl-10-methyl-spiro<4,5>dec-6-ene|2-Isopropenyl-6-formyl-10-methyl-spiro[4,5]dec-6-ene|Premnaspiral
(+/-)-7,8-dimethyl-2-(2-hydroxyisopropyl)tetralin|1,2,3,4-tetrahydro-alpha,alpha-7,8-tetramethyl-2-naphthalenemethanol
(-)-(1S*,5S*,6S*,7S*,10S*)-7-Epi-bourbon-3-en-5,11-oxide|(-)-(1S*,5S*,6S*,7S*,10S*)-bourbon-3-en-5,11-oxide
1,2,3,7,8,8a-Hexahydro-3,6,8,8-tetramethyl-4IH-3a,7-methanoazulen-4-one
1(10)-Aristolen-2-one
1(10)-Aristolen-2-one is a natural product found in Nardostachys jatamansi and Valeriana jatamansi with data available.
(-)-(7S)-(E)-Taylopyran|(-)-(7S)-taylopyran|2,2,6-trimethyl-3-[(E)(2-methylcyclopenta-2-en-1-ylidene)methyl]-3,4-dihydro-2H-pyran
(+)-(1R,2S,6R,8S,10S)-2,8-epoxyamorpha-4,7(11)-diene
2-Hepten-4-one, 2-methyl-6-(4-methyl-3-cyclohexen-1-ylidene)-, (6E)-
xanthorrizol
Xanthorrhizol is a sesquiterpenoid. Xanthorrhizol is a natural product found in Iostephane heterophylla, Cinnamomum iners, and other organisms with data available.
Isobicyclogermacrenal
NA is a natural product found in Aristolochia kaempferi, Aristolochia manshuriensis, and other organisms with data available.
Eudesmane K
Eseroline
A pyrroloindole that is 1,2,3,3a,8,8a-hexahydropyrrolo[2,3-b]indole substituted by methyl groups at positions 1, 3a and 8 and a hydroxy group at position 5. It is a metabolite of physostigmine and causes neuronal cell death by a mechanism involving loss of cell ATP. D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D009294 - Narcotics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics CONFIDENCE standard compound; EAWAG_UCHEM_ID 3583
2-Phenylpiperidine-2-acetamide
CONFIDENCE standard compound; EAWAG_UCHEM_ID 3584
(-)-Eseroline
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.272
1-carboxy-1-(trimethyl-l4-azaneyl)-4-ureidobutan-1-ylium
2-((3-ethoxy-3-oxopropanoyl)oxy)-N,N,N-trimethylethan-1-aminium
(5alpha,10alpha)-3,7(11)-Eudesmadien-2-one
(5beta,7beta,10beta)-3,11-Eudesmadien-2-one
Zerumbone
Zerumbone is a monocyclic sesquiterpene compound isolated from the rhizomes of Zingiber zerumbet Smith. Zerumbone potently inhibits the activation of Epstein-Barr virus with an IC50 of 0.14 mM. Zerumbone has anti-cancer, antioxidant, anti-inflammatory and anti-proliferative activity[1][2]. Zerumbone is a monocyclic sesquiterpene compound isolated from the rhizomes of Zingiber zerumbet Smith. Zerumbone potently inhibits the activation of Epstein-Barr virus with an IC50 of 0.14 mM. Zerumbone has anti-cancer, antioxidant, anti-inflammatory and anti-proliferative activity[1][2].
Mustakone
A sesquiterpenoid isolated from Cyperus rotundus and Cyperus articulatus and has been shown to exhibit antiplasmodial activity.
(+)-8-Hydroxycalamenene
1-(3-DIMETHYLAMINO-PROPYL)-1H-BENZOIMIDAZOL-2-YLAMINE
(1R,2S)-(-)-TRANS-2-(1-METHYL-1-PHENYLETHYL)CYCLOHEXANOL
(1S,5R,6S)-ETHYL5-(PENTAN-3-YL-OXY)-7-OXA-BICYCLO[4.1.0]HEPT-3-ENE-3-CARBOXYLATE
(1S,2R)-(+)-TRANS-2-(1-METHYL-1-PHENYLETHYL)CYCLOHEXANOL
3-Amino-3-fluoromethyl-pyrrolidine-1-carboxylic acid tert-butyl ester
C10H19FN2O2 (218.14304860000001)
1-(3-acetyl-2,4-dihydroxy-6-methoxyphenyl)ethan-1-one
4-CHLORO-7-((2-(TRIMETHYLSILYL)ETHOXY)METHYL)-7H-PYRROLO[2,3-D]PYRIMIDINE
(1S,4S)-(+)-2-(2-CHLORO-BENZYL)-2,5-DIAZA-BICYCLO[2.2.1]HEPTANEDIHYDROCHLORIDE
2-[5-ethyl-5-(hydroxymethyl)-1,3-dioxan-2-yl]-2-methylpropan-1-ol
4,4,5,5-Tetramethyl-2-(m-tolyl)-1,3,2-dioxaborolane
C13H19BO2 (218.14780240000002)
2H-Azepin-2-one, hexahydro-3-[(phenylmethyl)amino]-, (3R)
(4S)-4-tert-butyl-2-(6-methylpyridin-2-yl)-4,5-dihydro-1,3-oxazole
1-(3,4-DIHYDRO-2H-[1,8]NAPHTHYRIDIN-1-YL)-2,2-DIMETHYL-PROPAN-1-ONE
Fenoxazoline
R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AA - Sympathomimetics, plain C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist
2-Oxa-6-azaspiro[3.4]octan-8-amine, 6-(phenylmethyl)-
2,2,7,7-tetramethyltricyclo[6.2.1.01,6]undec-5-en-4-one
4,4,5,5-Tetramethyl-2-(2-methylphenyl)-1,3,2-dioxaborolane
C13H19BO2 (218.14780240000002)
4-Amino-2-fluoromethyl-pyrrolidine-1-carboxylic acid tert-butyl
C10H19FN2O2 (218.14304860000001)
1,3-Di-tert-butyl-1,3,2-diazaphospholidine 2-Oxide
C10H23N2OP (218.15479179999997)
N-(3-ALLYL-PYRIDIN-2-YL)-2,2-DIMETHYL-PROPIONAMIDE
1-cycloheptylpiperazine,hydrochloride
C11H23ClN2 (218.15496679999998)
1-(7-amino-4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)ethanone
(3R,4R)-tert-Butyl4-amino-3-fluoropiperidine-1-carboxylate
C10H19FN2O2 (218.14304860000001)
10-methoxy-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline
9-methoxy-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline
(1aS)-1a,2,3,4,5,6,7aα,7b-Octahydro-1aα,5α,7bα-trimethyl-7H-2β,4aβ-methano-1H-cyclobuta[de]naphthalen-7-one
tert-butyl N-[(3R,4R)-4-fluoropiperidin-3-yl]carbamate
C10H19FN2O2 (218.14304860000001)
(3S,4R)-rel-3-(Boc-aMino)-4-fluoropiperidine
C10H19FN2O2 (218.14304860000001)
1-Methyl-4,4-bipiperidine hydrochloride
C11H23ClN2 (218.15496679999998)
3,9-Diazaspiro[5.5]undecan-2-one, 3-ethyl-, hydrochloride (1:1)
C11H23ClN2 (218.15496679999998)
4,4,5,5-Tetramethyl-2-(p-tolyl)-1,3,2-dioxaborolane
C13H19BO2 (218.14780240000002)
tert-butyl 4-amino-3-fluoropiperidine-1-carboxylate
C10H19FN2O2 (218.14304860000001)
2-methyl-N-[4-(propan-2-ylamino)phenyl]-2-propenamide
germacron
Germacrone is extracted from Rhizoma Curcuma. Germacrone inhibits influenza virus infection[1]. Germacrone is extracted from Rhizoma Curcuma. Germacrone inhibits influenza virus infection[1].
MeODMT
C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist
alpha-Sinensal
Constituent of orange oil. alpha-Sinensal is found in lemon, sweet orange, and citrus.
3,8-dimethyl-5-propan-2-yl-4a,5,6,8a-tetrahydro-1H-naphthalen-2-one
Cyclohexanone, 5-ethenyl-5-methyl-4-(1-methylethenyl)-2-(1-methylethylidene)-, (4R,5S)-rel-
gamma-L-glutamylputrescinium(1+)
Conjugate acid of gamma-L-glutamylputrescine.
2-[(1R,3E)-4,8-dimethylcyclodeca-3,7-dien-1-yl]prop-2-enal
(2Z,6Z,10Z)-2,6,9,9-Tetramethylcycloundeca-2,6,10-trien-1-one
(+)-(S)-dihydro-ar-turmerone
A sesquiterpenoid that is 2-methylheptan-4-one substituted by a 4-methylphenyl group at position 6. It has been isolated from Peltophorum dasyrachis.
(3aS,8bS)-3,4,8b-trimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-7-ol
3-(2,2,3-Trimethylcyclopent-3-enyl)cyclohex-3-enecarbaldehyde
4-(2,2,3-Trimethylcyclopent-3-enyl)cyclohex-3-enecarbaldehyde
(3R)-3,11-dihydroxyundecanoic acid
A dihydroxy monocarboxylic acid that is 11-hydroxyundecanoic acid in which the pro-R hydrogen beta to the carboxy group is replaced by a hydroxy group.
(3R,10R)-3,10-dihydroxyundecanoic acid
An (omega-1)-hydroxy fatty acid that is (10R)-10-hydroxyundecanoic acid in which the 3-pro-R hydrogen is replaced by a hydroxy group.
[(2R)-3-carboxy-2-propanoyloxypropyl]-dimethyl-(trideuteriomethyl)azanium
2-((3-ethoxy-3-oxopropanoyl)oxy)-N,N,N-trimethylethan-1-aminium
1,9,9-Trimethyl-6-methylene-cis-anti-cis-tricyclo(6.3.0.0(3,7))undecan-2-one
1-carboxy-1-(trimethyl-l4-azaneyl)-4-ureidobutan-1-ylium
Nootkatone
(+)-nootkatone is a sesquiterpenoid that is 4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one which is substituted by methyl groups at positions 4 and 4a, and by an isopropenyl group at position 6 (the 4R,4aS,6R stereoisomer). It has a role as a plant metabolite, a fragrance and an insect repellent. It is a sesquiterpenoid, an enone and a carbobicyclic compound. Nootkatone is a natural product found in Teucrium asiaticum, Teucrium oxylepis, and other organisms with data available. A sesquiterpenoid that is 4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one which is substituted by methyl groups at positions 4 and 4a, and by an isopropenyl group at position 6 (the 4R,4aS,6R stereoisomer). Nootkatone, a neuroprotective agent from Vitis vinifera, has antioxidant and anti-inflammatory effects[1]. Nootkatone improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease[2]. Nootkatone, a neuroprotective agent from Vitis vinifera, has antioxidant and anti-inflammatory effects[1]. Nootkatone improves cognitive impairment in lipopolysaccharide-induced mouse model of Alzheimer's disease[2].
erumbone
Zerumbone is a sesquiterpenoid and cyclic ketone that is (1E,4E,8E)-alpha-humulene which is substituted by an oxo group at the carbon atom attached to two double bonds. It is obtained by steam distillation from a type of edible ginger, Zingiber zerumbet Smith, grown particularly in southeast Asia. It has a role as an anti-inflammatory agent, a plant metabolite and a glioma-associated oncogene inhibitor. It is a sesquiterpenoid and a cyclic ketone. It derives from a hydride of an alpha-humulene. Zerumbone is a natural product found in Curcuma amada, Curcuma longa, and other organisms with data available. A sesquiterpenoid and cyclic ketone that is (1E,4E,8E)-alpha-humulene which is substituted by an oxo group at the carbon atom attached to two double bonds. It is obtained by steam distillation from a type of edible ginger, Zingiber zerumbet Smith, grown particularly in southeast Asia. Zerumbone is a monocyclic sesquiterpene compound isolated from the rhizomes of Zingiber zerumbet Smith. Zerumbone potently inhibits the activation of Epstein-Barr virus with an IC50 of 0.14 mM. Zerumbone has anti-cancer, antioxidant, anti-inflammatory and anti-proliferative activity[1][2]. Zerumbone is a monocyclic sesquiterpene compound isolated from the rhizomes of Zingiber zerumbet Smith. Zerumbone potently inhibits the activation of Epstein-Barr virus with an IC50 of 0.14 mM. Zerumbone has anti-cancer, antioxidant, anti-inflammatory and anti-proliferative activity[1][2].
5-Methoxydimethyltryptamine
C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist
(2R,5R,8S)-2,10,10-Trimethyltricyclo[6.3.0.01,5]undec-6-ene-6-carbaldehyde
3,4a,5-trimethyl-4H,4aH,5H,6H,7H,8H,8aH,9H-naphtho[2,3-b]furan
Ala-Lys(1+)
A peptide cation obtained by deprotonation of the carboxy terminus and protonation of the side-chain amino groups and the amino terminus of Ala-Lys; major species at pH 7.3.
5-Methoxy-N,N-dimethyltryptamine
A tryptamine alkaloid that is N,N-dimethyltryptamine substituted by a methoxy group at position 5.
RO5256390
RO5256390 is an agonist of trace amine-associated receptor 1 (TAAR1), a highly conserved G-protein-coupled receptor (GPCR) bound by endogenous trace amines. RO5256390 can be used to reduce multiple behavioral effects of agents of abuse through their actions on the mesocorticolimbic system[1]. RO5256390 is a modulator of monoaminergic neurotransmission, blocks psychostimulant-induced hyperactivity and produces a brain activation pattern reminiscent of the antipsychotic agent olanzapine, suggesting antipsychotic-like properties[2].