Exact Mass: 240.1150236

Exact Mass Matches: 240.1150236

Found 169 metabolites which its exact mass value is equals to given mass value 240.1150236, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Anserine

(2S)-2-(3-aminopropanamido)-3-(1-methyl-1H-imidazol-5-yl)propanoic acid

C10H16N4O3 (240.12223459999998)


Anserine (beta-alanyl-N-3-methylhistidine) is a dipeptide containing beta-alanine and 3-methylhistidine. It is a derivative of carnosine, which had been methylated. The methyl group of anserine is added to carnosine by the enzyme S-adenosylmethionine: carnosine N-methyltransferase (PMID: 29484990). The enzyme is closely related to histamine N-methyltransferase and appears to be present in a majority of anserine-producing species (PMID: 23705015). Anserine is a generally a more metabolically stable derivative of carnosine. Anserine can be found in the skeletal muscle and brain of certain mammals (rabbits, cattle), migratory fish and birds. This dipeptide is normally absent from human tissues and body fluids, and its appearance there is usually an artifact of diet. Anserine can also arise from serum carnosinase deficiency. (OMIM 212200). Anserine was first discovered in goose muscle in 1929, and was named after this extraction (anser is Latin for goose). Anserine, which is water-soluble, is found at high levels in the muscles of different non-human vertebrates, with poultry, rabbit, tuna, plaice, and salmon having generally higher contents than other marine foods, beef, or pork (PMID: 31908682). An increase of urinary anserine excretion has been found in humans after the consumption of chicken, rabbit, and tuna and has been associated with intake of chicken, salmon, and, to a lesser extent, beef (PMID: 31908682). Anserine can undergo cleavage to give rise to 3-methylhistidine.(3-MH). The dipeptide balenine, common in some whales, cleaves to form 1-methylhistidine (1-MH) (PMID: 31908682). There is considerable confusion with regard to the nomenclature of the methylated nitrogen atoms on the imidazole ring of histidine and other histidine-containing peptides such as anserine. In particular, older literature (mostly prior to the year 2000) designated anserine (N-pi methylated) as beta-alanyl-N1-methyl-histidine, whereas according to standard IUPAC nomenclature, anserine is correctly named as beta-alanyl-N3-methyl-histidine. As a result, many papers published prior to the year 2000 incorrectly identified 1MH as a specific marker for dietary consumption of certain foods or various pathophysiological effects when they really were referring to 3MH or vice versa (PMID: 24137022). In particular balenine (a whale or snake-specific dipeptide with 1MH) was often confused with anserine (the poultry dipeptide with 3MH). An animal model study of Alzheimers disease using mice found that treatment with anserine reduced memory loss (PMID: 28974740). Anserine reduced glial inflammatory activity (particularly of astrocyte). The study also found that anserine-treated mice had greater pericyte surface area. The greater area of pericytes was commensurate with improved memory. The anserine-treated mice overall performed better on a spatial memory test (Morris Water Maze) (PMID: 28974740). A human study on 84 elderly subjects showed that subjects who took anserine and carnosine supplements for one year showed increased blood flow in the prefrontal cortex on MRI (PMID: 29896423). Acquisition and generation of the data is financially supported in part by CREST/JST. C26170 - Protective Agent > C275 - Antioxidant KEIO_ID A140; [MS2] KO008819 KEIO_ID A140; [MS3] KO008820 KEIO_ID A140 Anserine, a methylated form of Carnosine, is an orally active, natural Histidine-containing dipeptide found in skeletal muscle of vertebrates. Anserine is not cleaved by serum carnosinase and act as biochemical buffers, chelators, antioxidants, and anti-glycation agents. Anserine improves memory functions in Alzheimer's disease (AD)-model mice[1][2]. Anserine, a methylated form of Carnosine, is an orally active, natural Histidine-containing dipeptide found in skeletal muscle of vertebrates. Anserine is not cleaved by serum carnosinase and act as biochemical buffers, chelators, antioxidants, and anti-glycation agents. Anserine improves memory functions in Alzheimer's disease (AD)-model mice[1][2].

   

Homocarnosine

(2S)-2-(4-aminobutanamido)-3-(1H-imidazol-4-yl)propanoic acid

C10H16N4O3 (240.12223459999998)


Homocarnosine is a normal human metabolite, the brain-specific dipeptide of gamma-aminobutyric acid (GABA) and histidine. (PMID 1266573). Increased concentration of CSF homocarnosine has been found in familial spastic paraplegia. (PMID 842287). Homocarnosinosis (an inherited disorder, OMIM 236130) is characterized by an elevated level of the dipeptide homocarnosine (Hca) in the Cerebrospinal fluid (CSF) and the brain and by carnosinuria and serum carnosinase deficiency, and can co-exist with paraplegia, retinitis pigmentosa, and a progressive mental deficiency. (PMID 3736769). In glial tumors of human brain the content of homocarnosine has been found to be lower than in brain tissue (PMID 1032224), while an increase in content of homocarnosine was observed in brain tissue of animals under experimental trauma of cranium. (PMID 1025883). Homocarnosine is a normal human metabolite, the brain-specific dipeptide of gamma-aminobutyric acid (GABA) and histidine. (PMID 1266573) Acquisition and generation of the data is financially supported in part by CREST/JST. KEIO_ID H013; [MS3] KO008992 KEIO_ID H013; [MS2] KO008991 KEIO_ID H013

   

SCHEMBL18381216

N(alpha)-gamma-L-Glutamylhistamine

C10H16N4O3 (240.12223459999998)


   

Lapachenole

6-methoxy-2,2-dimethyl-2H-benzo[h]chromene

C16H16O2 (240.1150236)


Lapachenole is a member of the class of compounds known as naphthopyrans. Naphthopyrans are compounds containing a pyran ring fused to a naphthalene moiety. Furan is a 6 membered-ring non-aromatic ring with five carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings. Lapachenole is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Lapachenole can be found in mexican oregano, which makes lapachenole a potential biomarker for the consumption of this food product.

   

Dimethylstilbestrol

(E)-4,4-(1,2-Dimethyl-1,2-ethenediyl)bisphenol

C16H16O2 (240.1150236)


   

2,5-dimethoxystilbene

1,4-dimethoxy-2-(2-phenylethenyl)benzene

C16H16O2 (240.1150236)


   
   

Kayametone

4-Methoxy-3,3-dimethylbenzophenone

C16H16O2 (240.1150236)


   

1-Acetoxy-4,6-tetradecadiene-8,10,12-triyne

(4E,6E)-Tetradeca-4,6-dien-8,10,12-triyn-1-yl acetic acid

C16H16O2 (240.1150236)


1-Acetoxy-4,6-tetradecadiene-8,10,12-triyne is found in herbs and spices. 1-Acetoxy-4,6-tetradecadiene-8,10,12-triyne is isolated from roots of Tanacetum vulgare (tansy Isolated from roots of Tanacetum vulgare (tansy). 1-Acetoxy-4,6-tetradecadiene-8,10,12-triyne is found in herbs and spices.

   

(E)-3,5-Dimethoxystilbene

1,3-dimethoxy-5-[(Z)-2-phenylethenyl]benzene

C16H16O2 (240.1150236)


(E)-3,5-Dimethoxystilbene is isolated from wood of Pinus palustris (pitch pine

   

Phenethyl phenylacetate

Benzeneacetic acid, 2-phenylethyl ester

C16H16O2 (240.1150236)


Phenethyl phenylacetate is found in linden. Phenethyl phenylacetate is an imitation fruit flavouring ingredien Imitation fruit flavouring ingredient. Phenethyl phenylacetate is found in linden.

   

Balenine

(2S)-2-[(3-Amino-1-hydroxypropylidene)amino]-3-(1-methyl-1H-imidazol-4-yl)propanoate

C10H16N4O3 (240.12223459999998)


Balenine has been identified in the muscles of several species of mammal (including man), and the chicken. [HMDB] Balenine has been identified in the muscles of several species of mammal (including man), and the chicken.

   

Obtustyrene

3-methoxy-4-[(2E)-3-phenylprop-2-en-1-yl]phenol

C16H16O2 (240.1150236)


Obtustyrene is found in common pea. Obtustyrene is a stress metabolite of pe Stress metabolite of pea. Obtustyrene is found in pulses and common pea.

   

alpha-((2,3-Dimethyl-1-aziridinyl)methyl)-2-nitro-1H-imidazole-1-ethanol

alpha-((2,3-Dimethyl-1-aziridinyl)methyl)-2-nitro-1H-imidazole-1-ethanol

C10H16N4O3 (240.12223459999998)


   

Felbinac ethyl

Ethyl 2-{[1,1-biphenyl]-4-yl}acetic acid

C16H16O2 (240.1150236)


   

Triglycerol

3-[3-(2,3-dihydroxypropoxy)-2-hydroxypropoxy]propane-1,2-diol

C9H20O7 (240.120897)


   

Photoantheole

1-methoxy-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene

C16H16O2 (240.1150236)


4,4-dimethoxystilbene is a member of the class of compounds known as stilbenes. Stilbenes are organic compounds containing a 1,2-diphenylethylene moiety. Stilbenes (C6-C2-C6 ) are derived from the common phenylpropene (C6-C3) skeleton building block. The introduction of one or more hydroxyl groups to a phenyl ring lead to stilbenoids. 4,4-dimethoxystilbene is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 4,4-dimethoxystilbene can be found in anise, which makes 4,4-dimethoxystilbene a potential biomarker for the consumption of this food product.

   
   

(E)-3,4-Dimethoxystilbene

(E)-1-Methoxy-3-[2-(4-methoxyphenyl)ethenyl]-benzene

C16H16O2 (240.1150236)


   

Micrandrol B

2,6-Dihydroxy-1,7-dimethyl-9,10-dihydrophenanthrene

C16H16O2 (240.1150236)


   

(Z)-3,4-Dimethoxystilbene

(Z)-1-Methoxy-3-[2-(4-methoxyphenyl)ethenyl]-benzene

C16H16O2 (240.1150236)


   

DIMETILAN

DIMETILAN

C10H16N4O3 (240.12223459999998)


CONFIDENCE standard compound; INTERNAL_ID 752; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6865; ORIGINAL_PRECURSOR_SCAN_NO 6863 C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor CONFIDENCE standard compound; INTERNAL_ID 752; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6894; ORIGINAL_PRECURSOR_SCAN_NO 6893 CONFIDENCE standard compound; INTERNAL_ID 752; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6897; ORIGINAL_PRECURSOR_SCAN_NO 6895 CONFIDENCE standard compound; INTERNAL_ID 752; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6939; ORIGINAL_PRECURSOR_SCAN_NO 6936 CONFIDENCE standard compound; INTERNAL_ID 752; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6895; ORIGINAL_PRECURSOR_SCAN_NO 6893 CONFIDENCE standard compound; INTERNAL_ID 752; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6902; ORIGINAL_PRECURSOR_SCAN_NO 6900

   

3,3,5,5-Tetramethyldiphenoquinone

3,3,5,5-Tetramethyldiphenoquinone

C16H16O2 (240.1150236)


   

5-acetonyl-5-sec-butyl-barbituric acid|5-Acetonyl-5-sec-butyl-barbitursaeure

5-acetonyl-5-sec-butyl-barbituric acid|5-Acetonyl-5-sec-butyl-barbitursaeure

C11H16N2O4 (240.11100159999998)


   
   

2-ETHYL-5-(2-PHENYLETHENYL)BENZENE-1,3-DIOL

2-ETHYL-5-(2-PHENYLETHENYL)BENZENE-1,3-DIOL

C16H16O2 (240.1150236)


   

6-(4-Methyl-3-pentenyl)-1,4-naphthoquinone

6-(4-Methyl-3-pentenyl)-1,4-naphthoquinone

C16H16O2 (240.1150236)


   

hexadeca-2,4,6,8,10,12,14-heptaenedial

hexadeca-2,4,6,8,10,12,14-heptaenedial

C16H16O2 (240.1150236)


   
   

2-beta-alanylamino-3-(1(3)H-imidazol-4-yl)-butyric acid|3-Methyl-N$a--L-histidin

2-beta-alanylamino-3-(1(3)H-imidazol-4-yl)-butyric acid|3-Methyl-N$a--L-histidin

C10H16N4O3 (240.12223459999998)


   
   
   

3-Hydroxy-1,4-diphenylbutan-2-one

3-Hydroxy-1,4-diphenylbutan-2-one

C16H16O2 (240.1150236)


   

7-formyl-2,3-dihydrolinderazulene|ochracenoid A

7-formyl-2,3-dihydrolinderazulene|ochracenoid A

C16H16O2 (240.1150236)


   

1-Methoxy-3-[2-(4-methoxyphenyl)ethenyl]benzene

1-Methoxy-3-[2-(4-methoxyphenyl)ethenyl]benzene

C16H16O2 (240.1150236)


   

Naphtho(2,3-b)furan, 9-methoxy-3,4,5-trimethyl-

Naphtho(2,3-b)furan, 9-methoxy-3,4,5-trimethyl-

C16H16O2 (240.1150236)


   

1,7-dimethyl-9,10-dihydrophenanthrene-2,6-diol

1,7-dimethyl-9,10-dihydrophenanthrene-2,6-diol

C16H16O2 (240.1150236)


   

4,4-Dimethoxy-trans-stilbene

4,4-Dimethoxy-trans-stilbene

C16H16O2 (240.1150236)


   

L-Anserine

L-Anserine nitrate salt

C10H16N4O3 (240.12223459999998)


MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; MYYIAHXIVFADCU-QMMMGPOBSA-N_STSL_0210_L-Anserine_0500fmol_190326_S2_LC02MS02_048; 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. Anserine, a methylated form of Carnosine, is an orally active, natural Histidine-containing dipeptide found in skeletal muscle of vertebrates. Anserine is not cleaved by serum carnosinase and act as biochemical buffers, chelators, antioxidants, and anti-glycation agents. Anserine improves memory functions in Alzheimer's disease (AD)-model mice[1][2]. Anserine, a methylated form of Carnosine, is an orally active, natural Histidine-containing dipeptide found in skeletal muscle of vertebrates. Anserine is not cleaved by serum carnosinase and act as biochemical buffers, chelators, antioxidants, and anti-glycation agents. Anserine improves memory functions in Alzheimer's disease (AD)-model mice[1][2].

   

Homocarnosine

g-Aminobutyryl histidine

C10H16N4O3 (240.12223459999998)


A histidine derivative that is histidine in which one of the hydrogens attached to the alpha-amino group has been replaced by a 4-aminobutanoyl group.

   

Anserine

L-Anserine

C10H16N4O3 (240.12223459999998)


A dipeptide comprising of beta-alanine and 3-methyl-L-histidine units. C26170 - Protective Agent > C275 - Antioxidant Anserine, a methylated form of Carnosine, is an orally active, natural Histidine-containing dipeptide found in skeletal muscle of vertebrates. Anserine is not cleaved by serum carnosinase and act as biochemical buffers, chelators, antioxidants, and anti-glycation agents. Anserine improves memory functions in Alzheimer's disease (AD)-model mice[1][2]. Anserine, a methylated form of Carnosine, is an orally active, natural Histidine-containing dipeptide found in skeletal muscle of vertebrates. Anserine is not cleaved by serum carnosinase and act as biochemical buffers, chelators, antioxidants, and anti-glycation agents. Anserine improves memory functions in Alzheimer's disease (AD)-model mice[1][2].

   
   
   
   
   
   

Balenine

Beta-alanyl-n tau-methyl histidine

C10H16N4O3 (240.12223459999998)


   

1,1-(Z)-ethene-1,2-diylbis(4-methoxybenzene)

1,1-(Z)-ethene-1,2-diylbis(4-methoxybenzene)

C16H16O2 (240.1150236)


   

Obtustyrene

3-methoxy-4-[(2E)-3-phenylprop-2-en-1-yl]phenol

C16H16O2 (240.1150236)


   

3,5-Dimethoxystilbene

1,3-dimethoxy-5-[(Z)-2-phenylethenyl]benzene

C16H16O2 (240.1150236)


   

1-Acetoxy-4,6-tetradecadiene-8,10,12-triyne

(4E,6E)-tetradeca-4,6-dien-8,10,12-triyn-1-yl acetate

C16H16O2 (240.1150236)


   

alpha -Toluate

Benzeneacetic acid, 2-phenylethyl ester

C16H16O2 (240.1150236)


   

4-ETHYL-4-METHOXYBENZOPHENONE

4-ETHYL-4-METHOXYBENZOPHENONE

C16H16O2 (240.1150236)


   

4-benzyloxy-3,5-dimethylbenzaldehyde

4-benzyloxy-3,5-dimethylbenzaldehyde

C16H16O2 (240.1150236)


   
   

4-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2,6-dimethylcyclohexa-2,5-dien-1-one

4-(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2,6-dimethylcyclohexa-2,5-dien-1-one

C16H16O2 (240.1150236)


   

3-(PYRROLIDIN-1-YLMETHYL)PIPERIDINE

3-(PYRROLIDIN-1-YLMETHYL)PIPERIDINE

C10H22Cl2N2 (240.1159952)


   

4-ethenyl-2-methoxy-1-phenylmethoxybenzene

4-ethenyl-2-methoxy-1-phenylmethoxybenzene

C16H16O2 (240.1150236)


   

Benzoin ethyl ether

Benzoin ethyl ether

C16H16O2 (240.1150236)


   

2,2,5-TRIMETHYL-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

2,2,5-TRIMETHYL-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

C16H16O2 (240.1150236)


   

2,3,5-TRIMETHYL-[1,1-BIPHENYL]-4-CARBOXYLIC ACID

2,3,5-TRIMETHYL-[1,1-BIPHENYL]-4-CARBOXYLIC ACID

C16H16O2 (240.1150236)


   
   

4-Benzyloxy-propiophenone

4-Benzyloxy-propiophenone

C16H16O2 (240.1150236)


   

2,2,4-TRIMETHYL-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

2,2,4-TRIMETHYL-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

C16H16O2 (240.1150236)


   

2-(3,5-DIMETHYL-[1,1-BIPHENYL]-3-YL)ACETIC ACID

2-(3,5-DIMETHYL-[1,1-BIPHENYL]-3-YL)ACETIC ACID

C16H16O2 (240.1150236)


   

2-(3,5-DIMETHYL-[1,1-BIPHENYL]-4-YL)ACETIC ACID

2-(3,5-DIMETHYL-[1,1-BIPHENYL]-4-YL)ACETIC ACID

C16H16O2 (240.1150236)


   

3,4-difluorophenylboronic acid pinacol ester

3,4-difluorophenylboronic acid pinacol ester

C12H15BF2O2 (240.11331040000002)


   

Xenbucin

2-(4-phenylphenyl)butanoic acid

C16H16O2 (240.1150236)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   

diethyl 1-amino-3-methyl-1h-pyrrole-2,4-dicarboxylate

diethyl 1-amino-3-methyl-1h-pyrrole-2,4-dicarboxylate

C11H16N2O4 (240.11100159999998)


   

Benzene,1-methoxy-4-[[(2E)-3-phenyl-2-propen-1-yl]oxy]-

Benzene,1-methoxy-4-[[(2E)-3-phenyl-2-propen-1-yl]oxy]-

C16H16O2 (240.1150236)


   

3,6-bis(2-hydroxyethyl)-2-Pyrazinepropanoic acid

3,6-bis(2-hydroxyethyl)-2-Pyrazinepropanoic acid

C11H16N2O4 (240.11100159999998)


   

3-[4-(Phenoxymethyl)phenyl]propanal

3-[4-(Phenoxymethyl)phenyl]propanal

C16H16O2 (240.1150236)


   

3-[3-(Benzyloxy)phenyl]propanal

3-[3-(Benzyloxy)phenyl]propanal

C16H16O2 (240.1150236)


   

Uracil,1,3-dimethyl-5-N-methylacetamido-6-methylamino- (6CI)

Uracil,1,3-dimethyl-5-N-methylacetamido-6-methylamino- (6CI)

C10H16N4O3 (240.12223459999998)


   

4-ETHYL-2-METHOXYBENZOPHENONE

4-ETHYL-2-METHOXYBENZOPHENONE

C16H16O2 (240.1150236)


   

2-FLUORO-4-N-HEXYLOXYBENZOIC ACID

2-FLUORO-4-N-HEXYLOXYBENZOIC ACID

C13H17FO3 (240.11616640000003)


   

3-(2,4-DIOXO-1,3-DIAZASPIRO[4.5]DEC-3-YL)PROPANOIC ACID

3-(2,4-DIOXO-1,3-DIAZASPIRO[4.5]DEC-3-YL)PROPANOIC ACID

C11H16N2O4 (240.11100159999998)


   

2-(2,6-DIFLUOROPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

2-(2,6-DIFLUOROPHENYL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

C12H15BF2O2 (240.11331040000002)


   

l-(+)-threo-2-(n,n-dimethylamino)-1-(4-nitrophenyl)-1,3-propanediol

l-(+)-threo-2-(n,n-dimethylamino)-1-(4-nitrophenyl)-1,3-propanediol

C11H16N2O4 (240.11100159999998)


   

4,4-Dimethoxystilbene

1,1-(Z)-ethene-1,2-diylbis(4-methoxybenzene)

C16H16O2 (240.1150236)


4,4-dimethoxystilbene is a member of the class of compounds known as stilbenes. Stilbenes are organic compounds containing a 1,2-diphenylethylene moiety. Stilbenes (C6-C2-C6 ) are derived from the common phenylpropene (C6-C3) skeleton building block. The introduction of one or more hydroxyl groups to a phenyl ring lead to stilbenoids. 4,4-dimethoxystilbene is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). 4,4-dimethoxystilbene can be found in anise, which makes 4,4-dimethoxystilbene a potential biomarker for the consumption of this food product.

   

2-Bromo-6-methoxyimidazo[1,2-a]pyridine

2-Bromo-6-methoxyimidazo[1,2-a]pyridine

C11H16N2O4 (240.11100159999998)


   

2,2-BIPIPERIDINE DIHYDROCHLORIDE

2,2-BIPIPERIDINE DIHYDROCHLORIDE

C10H22Cl2N2 (240.1159952)


   

2-[bis(2-hydroxyethyl)amino]ethanol,propane,titanium

2-[bis(2-hydroxyethyl)amino]ethanol,propane,titanium

C9H22NO3Ti- (240.1079072)


   

2-(3-hexylthiophen-2-yl)-1,3-dioxolane

2-(3-hexylthiophen-2-yl)-1,3-dioxolane

C13H20O2S (240.11839400000002)


   

2-Benzyl-3-phenylpropanoic acid

2-Benzyl-3-phenylpropanoic acid

C16H16O2 (240.1150236)


   

1,4-Naphthalenedione,2-cyclohexyl-

1,4-Naphthalenedione,2-cyclohexyl-

C16H16O2 (240.1150236)


   

Benzeneacetic acid, a-ethyl-a-phenyl-

Benzeneacetic acid, a-ethyl-a-phenyl-

C16H16O2 (240.1150236)


   

1-(4-BENZYLOXY-PHENYL)-PROPAN-2-ONE

1-(4-BENZYLOXY-PHENYL)-PROPAN-2-ONE

C16H16O2 (240.1150236)


   

1-(3-TRIFLUOROMETHYLPHENOXY)-2-PROPANONE

1-(3-TRIFLUOROMETHYLPHENOXY)-2-PROPANONE

C16H16O2 (240.1150236)


   

2,4-Difluorophenylboronic acid, pinacol ester

2,4-Difluorophenylboronic acid, pinacol ester

C12H15BF2O2 (240.11331040000002)


   

4-ISOPROPYL-[1,1-BIPHENYL]-2-CARBOXYLIC ACID

4-ISOPROPYL-[1,1-BIPHENYL]-2-CARBOXYLIC ACID

C16H16O2 (240.1150236)


   

4,4-Bipiperidine dihydrochloride

4,4-Bipiperidine dihydrochloride

C10H22Cl2N2 (240.1159952)


   

(2,5-dimethylphenyl)-(4-methoxyphenyl)methanone

(2,5-dimethylphenyl)-(4-methoxyphenyl)methanone

C16H16O2 (240.1150236)


   

2-cyanoguanidine,formaldehyde,1,3,5-triazine-2,4,6-triamine

2-cyanoguanidine,formaldehyde,1,3,5-triazine-2,4,6-triamine

C6H12N10O (240.1195502)


   

(2,2-DIETHOXYETHYL)(P-TOLYL)SULFANE

(2,2-DIETHOXYETHYL)(P-TOLYL)SULFANE

C13H20O2S (240.11839400000002)


   

(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)acetic acid(SALTDATA: FREE)

(1-cyclohexyl-2,5-dioxoimidazolidin-4-yl)acetic acid(SALTDATA: FREE)

C11H16N2O4 (240.11100159999998)


   

(1R,2R)-(-)-2-BENZYLOXYCYCLOHEXYLAMINE

(1R,2R)-(-)-2-BENZYLOXYCYCLOHEXYLAMINE

C11H16N2O4 (240.11100159999998)


   

1-(3-TRIFLUOROMETHYLPHENYL)-[1,4]DIAZEPANE

1-(3-TRIFLUOROMETHYLPHENYL)-[1,4]DIAZEPANE

C16H16O2 (240.1150236)


   

Triglycerol

1,3-Bis(2,3-dihydroxypropyl)-2-propanol

C9H20O7 (240.120897)


   

(2R,4S)-1-(tert-butoxycarbonyl)-4-cyanopyrrolidine-2-carboxylic acid

(2R,4S)-1-(tert-butoxycarbonyl)-4-cyanopyrrolidine-2-carboxylic acid

C11H16N2O4 (240.11100159999998)


   

(2R,4R)-1-(tert-butoxycarbonyl)-4-cyanopyrrolidine-2-carboxylic acid

(2R,4R)-1-(tert-butoxycarbonyl)-4-cyanopyrrolidine-2-carboxylic acid

C11H16N2O4 (240.11100159999998)


   

1-(dimethylamino)-3-(4-nitrophenoxy)propan-2-ol

1-(dimethylamino)-3-(4-nitrophenoxy)propan-2-ol

C11H16N2O4 (240.11100159999998)


   

1-[3-(Benzyloxy)phenyl]-1-propanone

1-[3-(Benzyloxy)phenyl]-1-propanone

C16H16O2 (240.1150236)


   

4-(PYRROLIDIN-1-YLMETHYL)PIPERIDINE DIHYDROCHLORIDE

4-(PYRROLIDIN-1-YLMETHYL)PIPERIDINE DIHYDROCHLORIDE

C10H22Cl2N2 (240.1159952)


   

2,3,5-TRIMETHYL-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

2,3,5-TRIMETHYL-[1,1-BIPHENYL]-3-CARBOXYLIC ACID

C16H16O2 (240.1150236)


   

(2S,4S)-1-(tert-butoxycarbonyl)-4-cyanopyrrolidine-2-carboxylic acid

(2S,4S)-1-(tert-butoxycarbonyl)-4-cyanopyrrolidine-2-carboxylic acid

C11H16N2O4 (240.11100159999998)


   

2,3-difluorophenylboronic acid pinacol ester

2,3-difluorophenylboronic acid pinacol ester

C12H15BF2O2 (240.11331040000002)


   

Ethanone,2-hydroxy-1,2-bis(4-methylphenyl)-

Ethanone,2-hydroxy-1,2-bis(4-methylphenyl)-

C16H16O2 (240.1150236)


   

[4-(6-sulfanylhexoxy)phenyl]methanol

[4-(6-sulfanylhexoxy)phenyl]methanol

C13H20O2S (240.11839400000002)


   

2-(3,5-Difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

2-(3,5-Difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C12H15BF2O2 (240.11331040000002)


   

6-Amino-1,3-dipropyl-5-nitrosouracil

6-Amino-1,3-dipropyl-5-nitrosouracil

C10H16N4O3 (240.12223459999998)


   

6-ethyl-1,2,3,4-tetrahydroanthracene-9,10-dione

6-ethyl-1,2,3,4-tetrahydroanthracene-9,10-dione

C16H16O2 (240.1150236)


   

4-(4-n-propylphenyl)benzoic acid

4-(4-n-propylphenyl)benzoic acid

C16H16O2 (240.1150236)


   

2-(METHYLSULFINYL)ETHANAMINE HYDROCHLORIDE

2-(METHYLSULFINYL)ETHANAMINE HYDROCHLORIDE

C10H24O3Ti (240.1204824)


   

4-(4-BIPHENYLYL)BUTYRIC ACID

4-(4-BIPHENYLYL)BUTYRIC ACID

C16H16O2 (240.1150236)


   

5,5-dimethyl-1,3-bis(oxiranylmethyl)imidazolidine-2,4-dione

5,5-dimethyl-1,3-bis(oxiranylmethyl)imidazolidine-2,4-dione

C11H16N2O4 (240.11100159999998)


   

4-Piperidinylpiperidine dihydrochloride

4-Piperidinylpiperidine dihydrochloride

C10H22Cl2N2 (240.1159952)


   

4-AMinobenzo-12-crown-4

4-AMinobenzo-12-crown-4

C12H18NO4 (240.1235768)


   

1,4-Bipiperidine dihydrochloride

1,4-Bipiperidine dihydrochloride

C10H22Cl2N2 (240.1159952)


   

1-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carboxylic acid

1-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carboxylic acid

C11H16N2O4 (240.11100159999998)


   
   

1-[2-(BENZYLOXY)-4-METHYLPHENYL]ETHANONE

1-[2-(BENZYLOXY)-4-METHYLPHENYL]ETHANONE

C16H16O2 (240.1150236)


   

3-methyl-3,9-diazaspiro[5.5]undecane dihydrochloride

3-methyl-3,9-diazaspiro[5.5]undecane dihydrochloride

C10H22Cl2N2 (240.1159952)


   

2-ETHYL-4-METHOXYBENZOPHENONE

2-ETHYL-4-METHOXYBENZOPHENONE

C16H16O2 (240.1150236)


   

Benzeneacetic acid, a-phenyl-, ethyl ester

Benzeneacetic acid, a-phenyl-, ethyl ester

C16H16O2 (240.1150236)


   

4-Benzyloxy-2,6-dimethylbenzaldehyde

4-Benzyloxy-2,6-dimethylbenzaldehyde

C16H16O2 (240.1150236)


   

9-(Methoxymethyl)-9H-fluorene-9-methanol

9-(Methoxymethyl)-9H-fluorene-9-methanol

C16H16O2 (240.1150236)


   

Cis-3,5-Dimethoxystilbene

Cis-3,5-Dimethoxystilbene

C16H16O2 (240.1150236)


   

(S)-2-Hydrazino-3-(4-hydroxy-3-methoxyphenyl)-2-methylpropionic acid

(S)-2-Hydrazino-3-(4-hydroxy-3-methoxyphenyl)-2-methylpropionic acid

C11H16N2O4 (240.11100159999998)


   

3-Phenylpropyl benzoate

3-Phenylpropyl benzoate

C16H16O2 (240.1150236)


   

1-Propanone, 3-methoxy-1,3-diphenyl-

1-Propanone, 3-methoxy-1,3-diphenyl-

C16H16O2 (240.1150236)


   
   

(2S)-2-[(3-ammoniopropanoyl)amino]-3-(1-methyl-1H-imidazol-5-yl)propanoate

(2S)-2-[(3-ammoniopropanoyl)amino]-3-(1-methyl-1H-imidazol-5-yl)propanoate

C10H16N4O3 (240.12223459999998)


   
   

(2S)-2-azaniumyl-5-{[2-(1H-imidazol-4-yl)ethyl]amino}-5-oxopentanoate

(2S)-2-azaniumyl-5-{[2-(1H-imidazol-4-yl)ethyl]amino}-5-oxopentanoate

C10H16N4O3 (240.12223459999998)


   

(-)-2-(Tert-butylamino)-3-chloropropiophenone

(-)-2-(Tert-butylamino)-3-chloropropiophenone

C13H19ClNO+ (240.11550939999998)


D004791 - Enzyme Inhibitors > D065607 - Cytochrome P-450 Enzyme Inhibitors > D065690 - Cytochrome P-450 CYP2D6 Inhibitors D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors > D018765 - Dopamine Uptake Inhibitors D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018377 - Neurotransmitter Agents > D015259 - Dopamine Agents D049990 - Membrane Transport Modulators D000077444 - Smoking Cessation Agents

   

N-(2,5-difluorophenyl)-2-(1-pyrrolidinyl)acetamide

N-(2,5-difluorophenyl)-2-(1-pyrrolidinyl)acetamide

C12H14F2N2O (240.1074138)


   

1-(p-Anisyl)-3-phenyl-2-propene-1-ol

1-(p-Anisyl)-3-phenyl-2-propene-1-ol

C16H16O2 (240.1150236)


   

1-(2-Naphthalenyl)hexane-1,4-dione

1-(2-Naphthalenyl)hexane-1,4-dione

C16H16O2 (240.1150236)


   

1-(L-norvalin-5-yl)pyrraline

1-(L-norvalin-5-yl)pyrraline

C11H16N2O4 (240.11100159999998)


An N-substituted pyrraline formed via Maillard reaction of L-ornithine with glucose.

   

Barbituric acid, 5-ethyl-5-(1-methyl-3-oxobutyl)-

Barbituric acid, 5-ethyl-5-(1-methyl-3-oxobutyl)-

C11H16N2O4 (240.11100159999998)


   

3-Demethyl-5-methylmenaquinone

3-Demethyl-5-methylmenaquinone

C16H16O2 (240.1150236)


   
   

4-Ethylbenzyl benzoate

4-Ethylbenzyl benzoate

C16H16O2 (240.1150236)


   
   

1-Phenyl-5-methoxybicyclo(3.2.2)nona-3,6-dien-2-one

1-Phenyl-5-methoxybicyclo(3.2.2)nona-3,6-dien-2-one

C16H16O2 (240.1150236)


   
   

N(alpha)-gamma-L-Glutamylhistamine

N(alpha)-gamma-L-Glutamylhistamine

C10H16N4O3 (240.12223459999998)


Histamine having a gamma-L-glutamyl group attached to the side-chain nitrogen.

   
   

Phenethyl phenylacetate

Phenethyl phenylacetate

C16H16O2 (240.1150236)


   
   

anserine zwitterion

anserine zwitterion

C10H16N4O3 (240.12223459999998)


Zwitterionic form of anserine.

   

N(alpha)-gamma-L-glutamylhistamine zwitterion

N(alpha)-gamma-L-glutamylhistamine zwitterion

C10H16N4O3 (240.12223459999998)


Zwitterionic form of N(alpha)-gamma-L-glutamylhistamine.

   

L-Homocarnosine

L-Homocarnosine

C10H16N4O3 (240.12223459999998)


A homocarnosine that has S configuration.

   

L-homocarnosine zwitterion

L-homocarnosine zwitterion

C10H16N4O3 (240.12223459999998)


A zwitterion arising from transfer of a proton from the carboxy to the amino group of L-homocarnosine; major species at pH 7.3.

   
   

tetradeca-4,6-dien-8,10,12-triyn-1-yl acetate

tetradeca-4,6-dien-8,10,12-triyn-1-yl acetate

C16H16O2 (240.1150236)


   

3-methoxy-4-(3-phenylprop-2-en-1-yl)phenol

3-methoxy-4-(3-phenylprop-2-en-1-yl)phenol

C16H16O2 (240.1150236)


   

6-isohexenyl-alpha-naphthoquinone

6-isohexenyl-α-naphthoquinone

C16H16O2 (240.1150236)


{"Ingredient_id": "HBIN012476","Ingredient_name": "6-isohexenyl-alpha-naphthoquinone","Alias": "6-isohexenyl-\u03b1-naphthoquinone","Ingredient_formula": "C16H16O2","Ingredient_Smile": "CC(=CCCC1=CC2=C(C=C1)C(=O)C=CC2=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "31354;11452","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

9-methoxy-3,4,5-trimethylnaphtho[2,3-b]furan

9-methoxy-3,4,5-trimethylnaphtho[2,3-b]furan

C16H16O2 (240.1150236)


   

1-methoxy-4-[(1e)-2-(3-methoxyphenyl)ethenyl]benzene

1-methoxy-4-[(1e)-2-(3-methoxyphenyl)ethenyl]benzene

C16H16O2 (240.1150236)


   

1-methoxy-4-[(1z)-2-(3-methoxyphenyl)ethenyl]benzene

1-methoxy-4-[(1z)-2-(3-methoxyphenyl)ethenyl]benzene

C16H16O2 (240.1150236)


   

2-methyl-3-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione

2-methyl-3-(3-methylbut-2-en-1-yl)naphthalene-1,4-dione

C16H16O2 (240.1150236)


   

6,6,9-trimethylbenzo[c]chromen-2-ol

6,6,9-trimethylbenzo[c]chromen-2-ol

C16H16O2 (240.1150236)


   

1-methoxy-4-[2-(3-methoxyphenyl)ethenyl]benzene

1-methoxy-4-[2-(3-methoxyphenyl)ethenyl]benzene

C16H16O2 (240.1150236)


   

(2s)-2-[(3-amino-1-hydroxypropylidene)amino]-3-(3-methylimidazol-4-yl)propanoic acid

(2s)-2-[(3-amino-1-hydroxypropylidene)amino]-3-(3-methylimidazol-4-yl)propanoic acid

C10H16N4O3 (240.12223459999998)


   

10-(4-hydroxyphenyl)deca-3,5,7,9-tetraen-2-one

10-(4-hydroxyphenyl)deca-3,5,7,9-tetraen-2-one

C16H16O2 (240.1150236)