Exact Mass: 160.1000432

Exact Mass Matches: 160.1000432

Found 242 metabolites which its exact mass value is equals to given mass value 160.1000432, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Tryptamine

2-(1H-indol-3-yl)ethan-1-amine

C10H12N2 (160.1000432)


Tryptamine, also known as TrpN, is a catabolite of tryptophan converted by the gut microbiota. After absorption through the intestinal epithelium, tryptophan catabolites enter the bloodstream and are later excreted in the urine. Both Clostridium sp. and Ruminococcus sp. have been found to convert tryptophan into tryptamine (PMID: 30120222). Tryptamine is a monoamine compound that is a common precursor molecule to many hormones and neurotransmitters. Biosynthesis generally proceeds from the amino acid tryptophan, with tryptamine acting as a precursor for other compounds. Substitutions to the tryptamine molecule give rise to a group of compounds collectively known as tryptamines. The most well-known tryptamines are serotonin, an important neurotransmitter, and melatonin, a hormone involved in regulating the sleep-wake cycle. Tryptamine has been detected, but not quantified in, several different foods, such as onion-family vegetables, acerola, Japanese walnuts, custard apples, and green zucchinis. This could make tryptamine a potential biomarker for the consumption of these foods. Tryptamine is an aminoalkylindole consisting of indole having a 2-aminoethyl group at the 3-position. It has a role as a human metabolite, a plant metabolite and a mouse metabolite. It is an aminoalkylindole, an indole alkaloid, an aralkylamino compound and a member of tryptamines. It is a conjugate base of a tryptaminium. Tryptamine is a natural product found in Mus musculus, Prosopis glandulosa, and other organisms with data available. Occurs widely in plants, especies Lens esculenta (lentil) and the fungi Coprinus micaceus (glistening ink cap) An aminoalkylindole consisting of indole having a 2-aminoethyl group at the 3-position. KEIO_ID T031

   

Rengyol

Trans-1-(2-Hydroxyethyl)-1,4-cyclohexanediol

C8H16O3 (160.10993860000002)


Rengyol is a member of cyclohexanols. Rengyol is a natural product found in Forsythia suspensa, Digitalis chalcantha, and other organisms with data available.

   

Anatabine

(2S)-1,2,3,6-tetrahydro-2,3-bipyridine

C10H12N2 (160.1000432)


Anatabine is one of the minor alkaloids found in plants in the family Solanaceae, which includes the tobacco plant and tomato. Commercial tobacco plants typically produce alkaloids at levels between 2\\\% and 4\\\% of total dry weight, with nicotine accounting for about 90\\\% of the total alkaloid content, and the related compounds anabatine, nornicotine, and anabasine making up nearly all the rest. These compounds are thought to be biologically active, and part of plants natural defense system against insects. It belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group. Anatabine is tobacco alkaloid in urine of smokers and smokeless tobacco users (PMID: 8245163). This Nicotine-related alkaloid is an inhibitor of human cytochrome P-450 2A6 (PMID:14757175). Anatabine is tobacco alkaloid in urine of smokers and smokeless tobacco users (PubMed ID 8245163 ); this Nicotine-related alkaloid is an inhibitor of human cytochrome P-450 2A6 (PubMed ID 14757175 ) [HMDB] (R,S)-Anatabine is a a minor tobacco alkaloid found in the Solanaceae family of plants that can be used as a specific marker for the detection of tobacco use[1].

   

Tolazoline

Ciba vision brand OF tolazoline hydrochloride

C10H12N2 (160.1000432)


A vasodilator that apparently has direct actions on blood vessels and also increases cardiac output. Tolazoline can interact to some degree with histamine, adrenergic, and cholinergic receptors, but the mechanisms of its therapeutic effects are not clear. It is used in treatment of persistent pulmonary hypertension of the newborn. [PubChem] M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain C - Cardiovascular system > C04 - Peripheral vasodilators > C04A - Peripheral vasodilators > C04AB - Imidazoline derivatives C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents

   

2-(1H-Indol-2-yl)ethanamine

2-(1-H-benzimidazol-2-yl)-ethylamine

C10H12N2 (160.1000432)


   

3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium

3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium

C7H14NO3+ (160.0973634)


   

Ethyl (±)-3-hydroxyhexanoate

3-Hydroxyhexanoic acid ethyl ester

C8H16O3 (160.10993860000002)


Ethyl (±)-3-hydroxyhexanoate is found in alcoholic beverages. Ethyl (±)-3-hydroxyhexanoate is a food flavourant. Ethyl (±)-3-hydroxyhexanoate is present in cognac, Scotch whisky, orange juice and peel, grapefruit, pineapple, purple passion fruit and other fruit Ethyl (±)-3-hydroxyhexanoate is a food flavourant. It is found in alcoholic beverages such as cognac, scotch and whisky, and in citrus, and fruits.

   

4-Hydroxyvalproic acid

4-Hydroxyvalproate, (r*,r*)-isomer

C8H16O3 (160.10993860000002)


4-Hydroxyvalproic acid is only found in individuals that have used or taken Valproic Acid. 4-Hydroxyvalproic acid is a metabolite of Valproic Acid. 4-hydroxyvalproic acid belongs to the family of Branched Fatty Acids. These are fatty acids containing a branched chain.

   

5-Hydroxyvalproic acid

2-N-Propyl-5-hydroxypentanoic acid

C8H16O3 (160.10993860000002)


5-Hydroxyvalproic acid is only found in individuals that have used or taken Valproic Acid. 5-Hydroxyvalproic acid is a metabolite of Valproic Acid. 5-hydroxyvalproic acid belongs to the family of Branched Fatty Acids. These are fatty acids containing a branched chain.

   

3-Hydroxyvalproic acid

2-N-Propyl-3-hydroxypentanoic acid

C8H16O3 (160.10993860000002)


3-Hydroxyvalproic acid is only found in individuals that have used or taken Valproic Acid. 3-Hydroxyvalproic acid is a metabolite of Valproic Acid. 3-hydroxyvalproic acid belongs to the family of Branched Fatty Acids. These are fatty acids containing a branched chain.

   

Anabaseine

3-(3,4,5,6-tetrahydropyridin-2-yl)pyridine

C10H12N2 (160.1000432)


D010575 - Pesticides > D007306 - Insecticides D016573 - Agrochemicals Anabaseine is a non-selective nicotinic agonist. Anabaseine stimulates all AChRs, preferentially stimulates skeletal muscle and brain α7 subtypes[1][2]. Anabaseine is also a weak partial agonist at α4β2 nAChRs[3].

   

3-Hydroxyoctanoic acid

3-Hydroxyoctanoic acid, (S)-isomer

C8H16O3 (160.1099386)


3-Hydroxyoctanoic acid (CAS: 14292-27-4) is an organic 3-hydroxy dicarboxylic acid, a metabolite of medium-chain fatty acid oxidation found in human urine. It is believed that urinary 3-hydroxy dicarboxylic acids are derived from the omega-oxidation of 3-hydroxy fatty acids and the subsequent beta-oxidation of longer-chain 3-hydroxy dicarboxylic acids. (PMID:1870421). 3-Hydroxyoctanoic acid has been identified in the human placenta (PMID: 32033212). 3-Hydroxycaprylic acid is an organic (3-hydroxy dicarboxylic) acid, a metabolite of medium-chain fatty acid oxidation found in human urine. It is believed that urinary 3-hydroxy dicarboxylic acids are derived from the w-oxidation of 3-hydroxy fatty acids and the subsequent b-oxidation of longer-chain 3-hydroxy dicarboxylic acids. (PMID 1870421 ) [HMDB]

   

N-Methylmyosmine

3-(4,5-DIHYDRO-1-METHYL-1H-PYRROL-2-YL)PYRIDINE

C10H12N2 (160.1000432)


   

N-Norgramine

(1H-indol-3-yl)-N-Methylmethanamine

C10H12N2 (160.1000432)


N-Norgramine is found in cereals and cereal products. N-Norgramine is detected in Hordeum vulgare (barley). Detected in Hordeum vulgare (barley). N-Norgramine is found in barley and cereals and cereal products.

   
   

Tolazoline

Tolazoline

C10H12N2 (160.1000432)


M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain C - Cardiovascular system > C04 - Peripheral vasodilators > C04A - Peripheral vasodilators > C04AB - Imidazoline derivatives C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents KEIO_ID T030

   

1,2,3,6-Tetrahydro-2,3-bipyridine

1,2,3,6-Tetrahydro-2,3-bipyridine

C10H12N2 (160.1000432)


(R,S)-Anatabine is a a minor tobacco alkaloid found in the Solanaceae family of plants that can be used as a specific marker for the detection of tobacco use[1].

   

8-Hydroxyoctanoate

Omega-hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


8-Hydroxyoctanoate belongs to the class of organic compounds known as medium-chain hydroxy acids and derivatives. These are hydroxy acids with a 6 to 12 carbon atoms long side chain.

   

2-hydroxyoctanoate

alpha-Hydroxy-N-caprylic acid

C8H16O3 (160.10993860000002)


Hydroxyoctanoic acid medium chain substrate of the 2-hydroxy acid oxidases associated with the 3 distinct human 2-hydroxy acid oxidase genes, HAOX1, HAOX2, and HAOX3. (PMID: 10777549) [HMDB] Hydroxyoctanoic acid medium chain substrate of the 2-hydroxy acid oxidases associated with the 3 distinct human 2-hydroxy acid oxidase genes, HAOX1, HAOX2, and HAOX3. (PMID: 10777549). 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1]. 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1].

   

7-Hydroxyoctanoic acid

7-hydroxy-octanoic acid

C8H16O3 (160.10993860000002)


7-Hydroxyoctanoic acid is a normal metabolite of medium-chain fatty acid oxidation, and is excreted in the urine as 7-hydroxyoctanoyl-beta-D-glucuronide (PMID 8799296), and have been found slightly elevated in the urine of persons with abnormal fatty acid metabolism (PMID 2094705) [HMDB] 7-Hydroxyoctanoic acid is a normal metabolite of medium-chain fatty acid oxidation, and is excreted in the urine as 7-hydroxyoctanoyl-beta-D-glucuronide (PMID 8799296), and have been found slightly elevated in the urine of persons with abnormal fatty acid metabolism (PMID 2094705).

   

Ethyl 2-hydroxy-4-methylpentanoate

Ethyl 2-hydroxy-4-methylpentanoic acid

C8H16O3 (160.10993860000002)


Ethyl 2-hydroxy-4-methylpentanoate belongs to the family of Alpha Hydroxy Acids and Derivatives. These are organic compounds containing a carboxylic acid substituted with a hydroxyl group on the adjacent carbon

   

2-Methyl-4-propyl-1,3-oxathiane

2-Methyl-4-propyl-(2R,4S)-rel-1,3-oxathiane

C8H16OS (160.0921806)


(+)-cis-2-Methyl-4-propyl-1,3-oxathiane is found in fruits. (+)-cis-2-Methyl-4-propyl-1,3-oxathiane is a powerful odorant and flavourant characteristic of passion fruit and similar fruit Powerful odorant and flavourant characteristic of passion fruit and similar fruits. (+)-cis-2-Methyl-4-propyl-1,3-oxathiane is found in fruits.

   

(R)-2-Hydroxycaprylic acid

(R)-alpha-Hydroxycaprylic acid

C8H16O3 (160.10993860000002)


(R)-2-Hydroxycaprylic acid is an inhibitor of the medium chain acyl-CoA synthetase. [HMDB] (R)-2-Hydroxycaprylic acid is an inhibitor of the medium chain acyl-CoA synthetase.

   

(R)-3-Hydroxyoctanoic acid

(R)-beta-Hydroxycaprylic acid

C8H16O3 (160.10993860000002)


In humans fatty acids are predominantly formed in the liver and adipose tissue, and mammary glands during lactation. (R)-3-Hydroxyoctanoic acid is an intermediate in fatty acid biosynthesis. Specifically, (R)-3-Hydroxyoctanoic acid is converted from 3-Oxo-Octanoic acid via enzymes; fatty-acid Synthase and 3-oxoacyl- [acyl-carrier-protein] reductase. (E.C: 2.3.1.85 and E.C: 1.1.1.100). Found in milk, strawberries and pineapple concentrate

   

(+/-)-Ethyl 2-hydroxy-3-methylvalerate

(+/-)-ethyl 2-hydroxy-3-methylvaleric acid

C8H16O3 (160.10993860000002)


(+/-)-Ethyl 2-hydroxy-3-methylvalerate is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .

   

(+/-)-3-(Methylthio)heptanal

(+/-)-3-(Methylthio)heptanal

C8H16OS (160.0921806)


(+/-)-3-(Methylthio)heptanal is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")

   

Peroxyoctanoic acid

Octaneperoxoic acid, 1,1-dimethylethyl ester

C8H16O3 (160.10993860000002)


Peroxyoctanoic acid is a component of antimicrobial washes for poultry carcasses. Component of antimicrobial washes for poultry carcasses

   

Isoamyl lactate

3-Methylbutyl 2-hydroxypropanoic acid

C8H16O3 (160.10993860000002)


Isoamyl lactate belongs to the family of Alpha Hydroxy Acids and Derivatives. These are organic compounds containing a carboxylic acid substituted with a hydroxyl group on the adjacent carbon

   

(7R)-7-hydroxyoctanoic Acid

(7R)-(-)-7-Hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


(7R)-7-hydroxyoctanoic Acid is also known as (-)-7-Hydroxycaprylate. (7R)-7-hydroxyoctanoic Acid is considered to be soluble (in water) and acidic. (7R)-7-hydroxyoctanoic Acid can be synthesized from octanoic acid. (7R)-7-hydroxyoctanoic Acid can be synthesized into icas#14 and ascr#14. (7R)-7-hydroxyoctanoic Acid is a fatty acid lipid molecule

   

2-Ethyl-6-hydroxyhexanoic acid

2-Ethyl-6-hydroxyhexanoic acid

C8H16O3 (160.10993860000002)


   

1,2,3,6-Tetrahydro-2,3'-bipyridine

3-(1,2,3,6-tetrahydropyridin-2-yl)pyridine

C10H12N2 (160.1000432)


(R,S)-Anatabine is a a minor tobacco alkaloid found in the Solanaceae family of plants that can be used as a specific marker for the detection of tobacco use[1].

   

Isovaleraldehyde glyceryl acetal

4-Hydroxymethyl-2-(2-methylpropyl)-1,3-dioxolane

C8H16O3 (160.10993860000002)


It is used as a food additive .

   
   

2-Hydroxyoctanoic acid

2-Hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1]. 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1].

   
   

(1-methyl-1H-indol-3-yl)methanamine

(1-methyl-1H-indol-3-yl)methanamine

C10H12N2 (160.1000432)


   
   
   

1H-Pyrrolo[2,3-b]pyridine, 2-(1-methylethyl)-

1H-Pyrrolo[2,3-b]pyridine, 2-(1-methylethyl)-

C10H12N2 (160.1000432)


   
   

ethyl 3-hydroxy-3-methylpentanoate

ethyl 3-hydroxy-3-methylpentanoate

C8H16O3 (160.10993860000002)


   

S-Isopropyl 3-methylbutanethioate

S-Isopropyl 3-methylbutanethioate

C8H16OS (160.0921806)


   
   
   

2-Propylbenzimidazole

2-Propyl-1H-benzimidazole

C10H12N2 (160.1000432)


   

8-Hydroxyoctanoate

8-Hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


KEIO_ID H034

   

2-Hydroxyoctanoate

2-Hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


KEIO_ID H035 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1]. 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1].

   

Tryptamine

5-22-10-00045 (Beilstein Handbook Reference)

C10H12N2 (160.1000432)


   
   

Hydroxyoctanoic acid

2-Hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1]. 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1].

   

Tryptamine (not validated)

Tryptamine (not validated)

C10H12N2 (160.1000432)


Annotation level-2

   
   

2-Hydroxyoctanoic acid

(R)-2-Hydroxycaprylic acid

C8H16O3 (160.10993860000002)


A hydroxy fatty acid that is caprylic (octanoic) acid substituted by a hydroxy group at position 2. 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1]. 2-Hydroxyoctanoic acid is a medium chain acyl-CoA synthetase inhibitor with a Ki of 500 μM[1].

   
   

3-HYDROXYOCTANOIC ACID

DL-b-Hydroxycaprylic acid

C8H16O3 (160.10993860000002)


An 8-carbon, beta-hydroxy fatty acid which may be a marker for primary defects of beta-hydroxy fatty acid metabolism. Repeating unit of poly(3-hydroxyoctanoic acid), a biopolymer used by numerous bacterial species as carbon and energy reserves.

   
   
   
   

4R-hydroxy-octanoic acid

Octanoic acid, 4-hydroxy-, (R)-

C8H16O3 (160.10993860000002)


   

7R-hydroxy-octanoic acid

Octanoic acid, 7-hydroxy-, (R)-

C8H16O3 (160.10993860000002)


   

7S-hydroxy-octanoic acid

Octanoic acid, 7-hydroxy-, (S)-

C8H16O3 (160.10993860000002)


   

3-hydroxy-isoheptanoic acid

3-hydroxy-6-methyl-hexanoic acid

C8H16O3 (160.10993860000002)


   
   
   
   
   

2R-hydroxy-octanoic acid

Octanoic acid, 2-hydroxy-, (R)-

C8H16O3 (160.10993860000002)


   

R-3-Hydroxyoctanoic acid

Octanoic acid, 3-hydroxy-, (R)-

C8H16O3 (160.10993860000002)


   

FEMA 3545

Ethyl (±)-3-hydroxyhexanoate

C8H16O3 (160.10993860000002)


   

Oxane

2-Methyl-4-propyl-(2R,4S)-rel-1,3-oxathiane

C8H16OS (160.0921806)


   

ethyl 2-hydroxy-3-methylpentanoate

(+/-)-Ethyl 2-hydroxy-3-methylvalerate

C8H16O3 (160.10993860000002)


   

3-(Methylthio)heptanal

(+/-)-3-(Methylthio)heptanal

C8H16OS (160.0921806)


   

Kayaester O

Octaneperoxoic acid, 1,1-dimethylethyl ester

C8H16O3 (160.10993860000002)


   

N-Norgramine

(1H-indol-3-ylmethyl)(methyl)amine

C10H12N2 (160.1000432)


   

FA 8:0;O

2-N-Propyl-3-hydroxypentanoic acid

C8H16O3 (160.10993860000002)


   

SFE 8:0;O

(+/-)-Ethyl 2-hydroxy-3-methylvalerate

C8H16O3 (160.10993860000002)


   

3-(1,2,3,6-tetrahydropyridin-4-yl)pyridine

3-(1,2,3,6-tetrahydropyridin-4-yl)pyridine

C10H12N2 (160.1000432)


   

Thiourea,N-(2,2-dimethylpropyl)-N-methyl-

Thiourea,N-(2,2-dimethylpropyl)-N-methyl-

C7H16N2S (160.1034136)


   
   
   

1-butyl-3-ethylthiourea

1-butyl-3-ethylthiourea

C7H16N2S (160.1034136)


   

1-Propanol, 3-[(tetrahydro-2H-pyran-2-yl)oxy]-

1-Propanol, 3-[(tetrahydro-2H-pyran-2-yl)oxy]-

C8H16O3 (160.10993860000002)


   
   

N-(2-Cyanoethyl)-N-methylaniline

N-(2-Cyanoethyl)-N-methylaniline

C10H12N2 (160.1000432)


   

3-METHYL-2-PYRIDIN-2-YL-BUTYRONITRILE

3-METHYL-2-PYRIDIN-2-YL-BUTYRONITRILE

C10H12N2 (160.1000432)


   

(2S)-2-((TETRAHYDRO-2H-PYRAN-2-YL)OXY)PROPAN-1-OL

(2S)-2-((TETRAHYDRO-2H-PYRAN-2-YL)OXY)PROPAN-1-OL

C8H16O3 (160.10993860000002)


   

(2-Methyl-1H-Indol-5-Yl)Methylamine

(2-Methyl-1H-Indol-5-Yl)Methylamine

C10H12N2 (160.1000432)


   

(1-methylindol-7-yl)methanamine

(1-methylindol-7-yl)methanamine

C10H12N2 (160.1000432)


   

9-chloronon-1-ene

9-chloronon-1-ene

C9H17Cl (160.1018712)


   

Thiourea,N-methyl-N-pentyl-

Thiourea,N-methyl-N-pentyl-

C7H16N2S (160.1034136)


   

(1-Methyl-1H-indol-6-yl)methylamine

(1-Methyl-1H-indol-6-yl)methylamine

C10H12N2 (160.1000432)


   

1,2,6-TRIMETHYL-1H-BENZO[D]IMIDAZOLE

1,2,6-TRIMETHYL-1H-BENZO[D]IMIDAZOLE

C10H12N2 (160.1000432)


   

1-Ethyl-2-methyl-1H-benzimidazole

1-Ethyl-2-methyl-1H-benzimidazole

C10H12N2 (160.1000432)


   

TERT-BUTYL (R)-(+)-2-HYDROXYBUTYRATE

TERT-BUTYL (R)-(+)-2-HYDROXYBUTYRATE

C8H16O3 (160.10993860000002)


   

tert-Butyl (2S)-2-hydroxybutanoate

tert-Butyl (2S)-2-hydroxybutanoate

C8H16O3 (160.10993860000002)


   

Ethyl 3-hydroxy-4-methylpentanoate

Ethyl 3-hydroxy-4-methylpentanoate

C8H16O3 (160.10993860000002)


   

METHYL 2-(TRIMETHYLSILYL)PROPIONATE

METHYL 2-(TRIMETHYLSILYL)PROPIONATE

C7H16O2Si (160.09195160000002)


   

TRIMETHYLSILYL BUTYRATE

Butanoic acid, trimethylsilyl ester

C7H16O2Si (160.09195160000002)


   

tert-butyl 2-hydroxy-2-methylpropanoate

tert-butyl 2-hydroxy-2-methylpropanoate

C8H16O3 (160.10993860000002)


   

1,3-Diisopropylthiourea

1,3-Diisopropylthiourea

C7H16N2S (160.1034136)


   

3-(benzylamino)propionitrile

3-(benzylamino)propionitrile

C10H12N2 (160.1000432)


   

4-(2-Amino-2-propanyl)benzonitrile

4-(2-Amino-2-propanyl)benzonitrile

C10H12N2 (160.1000432)


   

1H-Indol-5-amine,1-ethyl-(9CI)

1H-Indol-5-amine,1-ethyl-(9CI)

C10H12N2 (160.1000432)


   

(1-METHYL-1H-IMIDAZOL-2-YL)-(3-NITRO-PHENYL)-METHANONE

(1-METHYL-1H-IMIDAZOL-2-YL)-(3-NITRO-PHENYL)-METHANONE

C10H12N2 (160.1000432)


   

Trimethylsilyl isobutyrate

Trimethylsilyl 2-methylpropanoate

C7H16O2Si (160.09195160000002)


   

3-Methoxy-3-methylbutyl Acetate

3-Methoxy-3-methylbutyl Acetate

C8H16O3 (160.10993860000002)


   

2-(4-Aminophenyl)-2-methylpropanonitril

2-(4-Aminophenyl)-2-methylpropanonitril

C10H12N2 (160.1000432)


   

2,4-Diethyl-6-methyl-1,3,5-trioxane

2,4-Diethyl-6-methyl-1,3,5-trioxane

C8H16O3 (160.10993860000002)


   

ethyl 2-ethyl-2-hydroxy-butanoate

ethyl 2-ethyl-2-hydroxy-butanoate

C8H16O3 (160.10993860000002)


   

1,2-DIMETHYL-1H-INDOL-5-AMINE

1,2-DIMETHYL-1H-INDOL-5-AMINE

C10H12N2 (160.1000432)


   

3-[(4S)-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]-PROPANOL

3-[(4S)-2,2-DIMETHYL-1,3-DIOXOLAN-4-YL]-PROPANOL

C8H16O3 (160.10993860000002)


   

2,5,6-Trimethyl-1H-benzimidazole

2,5,6-Trimethyl-1H-benzimidazole

C10H12N2 (160.1000432)


   

Furan,2,5-diethoxytetrahydro-

Furan,2,5-diethoxytetrahydro-

C8H16O3 (160.10993860000002)


   

1,3-Dipropylthiourea

1,3-Dipropylthiourea

C7H16N2S (160.1034136)


   

3-thiomorpholin-4-ylpropan-1-amine

3-thiomorpholin-4-ylpropan-1-amine

C7H16N2S (160.1034136)


   

4-(Tetrahydro-2-furanyloxy)-1-butanol

4-(Tetrahydro-2-furanyloxy)-1-butanol

C8H16O3 (160.10993860000002)


   

2-Propyl-1H-pyrrolo[2,3-c]pyridine

2-Propyl-1H-pyrrolo[2,3-c]pyridine

C10H12N2 (160.1000432)


   

2-(2-Aminophenyl)-2-methylpropanenitrile

2-(2-Aminophenyl)-2-methylpropanenitrile

C10H12N2 (160.1000432)


   

1H-Indazole,3-ethyl-5-methyl-

1H-Indazole,3-ethyl-5-methyl-

C10H12N2 (160.1000432)


   

1H-Indazole,3,6,7-trimethyl-

1H-Indazole,3,6,7-trimethyl-

C10H12N2 (160.1000432)


   
   

1-methoxy-1-trimethylsilyloxypropene

1-methoxy-1-trimethylsilyloxypropene

C7H16O2Si (160.09195160000002)


   

2-Amino-5-isopropylbenzonitrile

2-Amino-5-isopropylbenzonitrile

C10H12N2 (160.1000432)


   
   

2-tert-butylisonicotinonitrile

2-tert-butylisonicotinonitrile

C10H12N2 (160.1000432)


   

1H-Benzimidazole,1,5,6-trimethyl-(9CI)

1H-Benzimidazole,1,5,6-trimethyl-(9CI)

C10H12N2 (160.1000432)


   

Benzeneacetonitrile, a-(dimethylamino)-

Benzeneacetonitrile, a-(dimethylamino)-

C10H12N2 (160.1000432)


   

(R)-2-(HYDROXYMETHYL)-1,4-BENZODIOXANE

(R)-2-(HYDROXYMETHYL)-1,4-BENZODIOXANE

C8H16O3 (160.10993860000002)


   

1H-BENZIMIDAZOLE, 2-ETHYL-6-METHYL-

1H-BENZIMIDAZOLE, 2-ETHYL-6-METHYL-

C10H12N2 (160.1000432)


   

4,5-DIHYDRO-1H-BENZO[D]AZEPIN-2-AMINE

4,5-DIHYDRO-1H-BENZO[D]AZEPIN-2-AMINE

C10H12N2 (160.1000432)


   

2-[(dimethylamino)methyl]benzonitrile

2-[(dimethylamino)methyl]benzonitrile

C10H12N2 (160.1000432)


   

N-Methyl-N-(4-Methylphenyl)aminoacetonitrile

N-Methyl-N-(4-Methylphenyl)aminoacetonitrile

C10H12N2 (160.1000432)


   

5,5-DIMETHYL-1,3-DIOXANE-2-ETHANOL

5,5-DIMETHYL-1,3-DIOXANE-2-ETHANOL

C8H16O3 (160.10993860000002)


   

2-(1H-Indol-5-yl)ethanamine

2-(1H-Indol-5-yl)ethanamine

C10H12N2 (160.1000432)


   

1-(1H-INDOL-3-YL)-ETHYLAMINE

1-(1H-INDOL-3-YL)-ETHYLAMINE

C10H12N2 (160.1000432)


   

(1-METHYL-1H-INDOL-2-YL)METHANAMINE

(1-METHYL-1H-INDOL-2-YL)METHANAMINE

C10H12N2 (160.1000432)


   

2-(3-Aminophenyl)-2-methylpropanenitrile

2-(3-Aminophenyl)-2-methylpropanenitrile

C10H12N2 (160.1000432)


   

3-P-TOLYLAMINO-PROPIONITRILE

3-P-TOLYLAMINO-PROPIONITRILE

C10H12N2 (160.1000432)


   

2-propyl-1H-pyrrolo[2,3-b]pyridine

2-propyl-1H-pyrrolo[2,3-b]pyridine

C10H12N2 (160.1000432)


   

tert-Butyl 4-hydroxybutanoate

tert-Butyl 4-hydroxybutanoate

C8H16O3 (160.10993860000002)


   

2-(Indol-1-yl)ethylamine

2-(Indol-1-yl)ethylamine

C10H12N2 (160.1000432)


   

1-(1H-indol-5-yl)ethanamine

1-(1H-indol-5-yl)ethanamine

C10H12N2 (160.1000432)


   

3-(Aminomethyl)-N,N-dimethyltetrahydro-3-thiophenamine

3-(Aminomethyl)-N,N-dimethyltetrahydro-3-thiophenamine

C7H16N2S (160.1034136)


   

Thiourea,N,N,N-triethyl-

Thiourea,N,N,N-triethyl-

C7H16N2S (160.1034136)


   

1H-Benzimidazole,1,2,4-trimethyl-(9CI)

1H-Benzimidazole,1,2,4-trimethyl-(9CI)

C10H12N2 (160.1000432)


   

3-Ethylaminomethyl-benzonitrile

3-Ethylaminomethyl-benzonitrile

C10H12N2 (160.1000432)


   

2,3-Dimethyl-1H-indol-7-amine

2,3-Dimethyl-1H-indol-7-amine

C10H12N2 (160.1000432)


   
   

1-propylbenzimidazole

1-propylbenzimidazole

C10H12N2 (160.1000432)


   

1H-Benzimidazole,2-ethyl-1-methyl-(9CI)

1H-Benzimidazole,2-ethyl-1-methyl-(9CI)

C10H12N2 (160.1000432)


   

Tetracyclo[3.2.0.02,7.04,6]heptane-3-carbonitrile, 3-(dimethylamino)- (9CI)

Tetracyclo[3.2.0.02,7.04,6]heptane-3-carbonitrile, 3-(dimethylamino)- (9CI)

C10H12N2 (160.1000432)


   

2-(N,3-dimethylanilino)acetonitrile

2-(N,3-dimethylanilino)acetonitrile

C10H12N2 (160.1000432)


   

2-Isopropylpyrazolo[1,5-a]pyridine

2-Isopropylpyrazolo[1,5-a]pyridine

C10H12N2 (160.1000432)


   

tert-Butyl (3S)-3-hydroxybutanoate

tert-Butyl (3S)-3-hydroxybutanoate

C8H16O3 (160.10993860000002)


   
   

2-methyl-2-(4-methylpyridin-2-yl)propanenitrile

2-methyl-2-(4-methylpyridin-2-yl)propanenitrile

C10H12N2 (160.1000432)


   

3-Pyridinecarbonitrile,2-methyl-4-(1-methylethyl)-(9CI)

3-Pyridinecarbonitrile,2-methyl-4-(1-methylethyl)-(9CI)

C10H12N2 (160.1000432)


   

2-(3-(dimethylamino)phenyl)acetonitrile

2-(3-(dimethylamino)phenyl)acetonitrile

C10H12N2 (160.1000432)


   
   

Ethyl 2-hydroxy-4-methylvalerate

ethyl 2-hydroxy-4-methyl valerate

C8H16O3 (160.10993860000002)


   

L-2-amino-4-guanidinobutyric acid hydrochloride

L-2-amino-4-guanidinobutyric acid hydrochloride

C5H12N4O2 (160.0960212)


   

1-(1-METHYL-1H-INDOL-4-YL)METHYLAMINE 97

1-(1-METHYL-1H-INDOL-4-YL)METHYLAMINE 97

C10H12N2 (160.1000432)


   

(2-(METHYLSULFONYL)PHENYL)METHANAMINE

(2-(METHYLSULFONYL)PHENYL)METHANAMINE

C8H16O3 (160.10993860000002)


   

2-(1H-Indol-4-yl)ethanamine

2-(1H-Indol-4-yl)ethanamine

C10H12N2 (160.1000432)


   

2-(1H-indol-7-yl)ethanamine

2-(1H-indol-7-yl)ethanamine

C10H12N2 (160.1000432)


   

3-hydroxy-4,4-dimethyl-pentanoic acid methyl ester

3-hydroxy-4,4-dimethyl-pentanoic acid methyl ester

C8H16O3 (160.10993860000002)


   
   

4-((Dimethylamino)methyl)benzonitrile

4-((Dimethylamino)methyl)benzonitrile

C10H12N2 (160.1000432)


   

4-amino-3-ethyl-5-methylbenzonitrile

4-amino-3-ethyl-5-methylbenzonitrile

C10H12N2 (160.1000432)


   

1H-Indol-5-amine,2,3-dimethyl-

1H-Indol-5-amine,2,3-dimethyl-

C10H12N2 (160.1000432)


   

Amyl lactate

Propanoic acid,2-hydroxy-, pentyl ester

C8H16O3 (160.10993860000002)


   

Propanenitrile,2-methyl-2-(phenylamino)-

Propanenitrile,2-methyl-2-(phenylamino)-

C10H12N2 (160.1000432)


   
   

1H-Indazole,3-(1-methylethyl)-(9CI)

1H-Indazole,3-(1-methylethyl)-(9CI)

C10H12N2 (160.1000432)


   

1H-1,5-Benzodiazepine,2,3-dihydro-1-methyl-(9CI)

1H-1,5-Benzodiazepine,2,3-dihydro-1-methyl-(9CI)

C10H12N2 (160.1000432)


   

Isoindazole,1-ethyl-3-methyl- (2CI)

Isoindazole,1-ethyl-3-methyl- (2CI)

C10H12N2 (160.1000432)


   

6-(2-Methyl-2-propanyl)nicotinonitrile

6-(2-Methyl-2-propanyl)nicotinonitrile

C10H12N2 (160.1000432)


   

1H-Benzimidazole,2,4,5-trimethyl-(9CI)

1H-Benzimidazole,2,4,5-trimethyl-(9CI)

C10H12N2 (160.1000432)


   

N-cyanoethyl-m-toluidine

N-cyanoethyl-m-toluidine

C10H12N2 (160.1000432)


   

2-amino-3,5,6-trimethylbenzonitrile

2-amino-3,5,6-trimethylbenzonitrile

C10H12N2 (160.1000432)


   

(5-METHYL-2-PHENYL-1H-IMIDAZOL-4-YL)-ACETONITRILE

(5-METHYL-2-PHENYL-1H-IMIDAZOL-4-YL)-ACETONITRILE

C10H12N2 (160.1000432)


   

ISOBUTYRIC ACID 2-ETHOXYETHYL ESTER

ISOBUTYRIC ACID 2-ETHOXYETHYL ESTER

C8H16O3 (160.10993860000002)


   

2-(3,4,5,6-Tetrahydropyridin-2-yl)pyridine

2-(3,4,5,6-Tetrahydropyridin-2-yl)pyridine

C10H12N2 (160.1000432)


   
   

Ethyl 2-hydroxy-4-methylvalerate, (2R)-

Ethyl 2-hydroxy-4-methylvalerate, (2R)-

C8H16O3 (160.10993860000002)


   

Methyl 3-hydroxy-2-methylhexanoate

Methyl 3-hydroxy-2-methylhexanoate

C8H16O3 (160.10993860000002)


   

3-Hydroxy-4-methylheptanoic acid

3-Hydroxy-4-methylheptanoic acid

C8H16O3 (160.10993860000002)


   

3-Hydroxy-3-methylheptanoic acid

3-Hydroxy-3-methylheptanoic acid

C8H16O3 (160.10993860000002)


   

Guanidine, N-butyl-N-nitro-

Guanidine, N-butyl-N-nitro-

C5H12N4O2 (160.0960212)


   
   
   

2-Hydroxy-2-propylpentanoic acid

2-Hydroxy-2-propylpentanoic acid

C8H16O3 (160.10993860000002)


   
   

(1S,3S)-3-butylthiolane 1-oxide

(1S,3S)-3-butylthiolane 1-oxide

C8H16OS (160.0921806)


   

Artonil

1H-Imidazole, 4,5-dihydro-2-(phenylmethyl)- (9CI)

C10H12N2 (160.1000432)


M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain C - Cardiovascular system > C04 - Peripheral vasodilators > C04A - Peripheral vasodilators > C04AB - Imidazoline derivatives C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D014665 - Vasodilator Agents

   

(2S,4R)-4-hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

(2S,4R)-4-hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

C7H14NO3+ (160.0973634)


   

(2S,4S)-2-carboxy-4-hydroxy-1,1-dimethylpyrrolidinium

(2S,4S)-2-carboxy-4-hydroxy-1,1-dimethylpyrrolidinium

C7H14NO3+ (160.0973634)


   

8-Azoniabicyclo[3.2.1]octane-1,2,3-triol

8-Azoniabicyclo[3.2.1]octane-1,2,3-triol

C7H14NO3+ (160.0973634)


   

2-(1-Hydroxyethyl)valeric acid methyl ester

2-(1-Hydroxyethyl)valeric acid methyl ester

C8H16O3 (160.10993860000002)


   

Propyl 3-hydroxy-2-methylbutanoate

Propyl 3-hydroxy-2-methylbutanoate

C8H16O3 (160.10993860000002)


   

(2R,3S)-3-Hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

(2R,3S)-3-Hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

C7H14NO3+ (160.0973634)


   

(2R)-4-Hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

(2R)-4-Hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

C7H14NO3+ (160.0973634)


   

2-isopropyl-1H-benzo[d]imidazole

2-isopropyl-1H-benzo[d]imidazole

C10H12N2 (160.1000432)


   

(1-Methyl-1H-indol-5-yl)methanamine

(1-Methyl-1H-indol-5-yl)methanamine

C10H12N2 (160.1000432)


   

hexaamminenickel(II)

hexaamminenickel(II)

H18N6Ni+2 (160.0946338)


   

(3R,4R)-4-hydroxy-1,1-dimethyl-3-pyrrolidin-1-iumcarboxylic acid

(3R,4R)-4-hydroxy-1,1-dimethyl-3-pyrrolidin-1-iumcarboxylic acid

C7H14NO3+ (160.0973634)


   

(2S)-3-hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

(2S)-3-hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylic acid

C7H14NO3+ (160.0973634)


   
   

(2S,3S)-3-Methylbutan-1,2,4-triol 1,2-isopropylidene acetal

(2S,3S)-3-Methylbutan-1,2,4-triol 1,2-isopropylidene acetal

C8H16O3 (160.10993860000002)


   

2-Butene-1,4-diol, TMS derivative

2-Butene-1,4-diol, TMS derivative

C7H16O2Si (160.09195160000002)


   

4-Cyano-4-(2-cyanoethyl)cyclohexene

4-Cyano-4-(2-cyanoethyl)cyclohexene

C10H12N2 (160.1000432)


   

Methyl (3S,4S)-3-hydroxy-4-methylhexanoate

Methyl (3S,4S)-3-hydroxy-4-methylhexanoate

C8H16O3 (160.10993860000002)


   

Anabaseine

Anabaseine

C10H12N2 (160.1000432)


D010575 - Pesticides > D007306 - Insecticides D016573 - Agrochemicals Anabaseine is a non-selective nicotinic agonist. Anabaseine stimulates all AChRs, preferentially stimulates skeletal muscle and brain α7 subtypes[1][2]. Anabaseine is also a weak partial agonist at α4β2 nAChRs[3].

   

N-Methyl-3-aminomethylindole

N-Methyl-3-aminomethylindole

C10H12N2 (160.1000432)


   
   

3-dehydrocarnitinium

3-Carboxy-N,N,N-trimethyl-2-oxo-1-propanaminium

C7H14NO3+ (160.0973634)


A quaternary ammonium ion that is the conjugate acid of 3-dehydrocarnitine.

   

8-Hydroxyoctanoic acid

8-Hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


An omega-hydroxy fatty acid that is caprylic acid in which one of the hydrogens of the terminal methyl group is replaced by a hydroxy group.

   

Anatabine

(-)-Anatabine

C10H12N2 (160.1000432)


   

2-Methyl-4-propyl-1,3-oxathiane

2-Methyl-4-propyl-1,3-oxathiane

C8H16OS (160.0921806)


An organosulfur heterocyclic compound and an oxacycle that is 1,3-oxathiane substituted by a methyl group at position 2 and a propyl group at position 4 respectively.

   

(S)-3-hydroxyoctanoic acid

(S)-3-hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


The (S)-enantiomer of 3-hydroxyoctanoic acid.

   
   

Isoamyl lactate

lactic acid isoamyl ester

C8H16O3 (160.10993860000002)


   

(R)-3-Hydroxyoctanoic acid

(R)-3-Hydroxyoctanoic acid

C8H16O3 (160.10993860000002)


The (R)-enantiomer of 3-hydroxyoctanoic acid; an important building block in the biomedical and pharmaceutical fields.

   
   
   

5-OH-VPA

2-N-Propyl-5-hydroxypentanoic acid

C8H16O3 (160.10993860000002)


   

(7R)-7-hydroxyoctanoic Acid

(7R)-7-hydroxyoctanoic Acid

C8H16O3 (160.10993860000002)


An (omega-1)-hydroxy fatty acid that is octanoic acid in which the 7-pro-R hydrogen has been replaced by a hydroxy group.

   

Octanoic acid, 7-hydroxy-, (S)-

Octanoic acid, 7-hydroxy-, (S)-

C8H16O3 (160.10993860000002)


   

3-methylbutyl 2-hydroxypropanoate

3-methylbutyl 2-hydroxypropanoate

C8H16O3 (160.10993860000002)


A carboxylic ester obtained by the formal condensation of the carboxy group of 2-hydroxypropanoic acid with the hydroxy group of isoamylol.

   

3-(Methylaminomethyl)indole

3-(Methylaminomethyl)indole

C10H12N2 (160.1000432)


An aminoalkylindole that is indole carrying a methylaminomethyl substituent at postion 3.

   
   
   
   

Methylpropyloxathiane

Methylpropyloxathiane

C8H16OS (160.0921806)


   

(2s,4r)-2-carboxy-4-hydroxy-1,1-dimethylpyrrolidin-1-ium

(2s,4r)-2-carboxy-4-hydroxy-1,1-dimethylpyrrolidin-1-ium

[C7H14NO3]+ (160.0973634)


   

2-ethyl-3-hydroxyhexanoic acid

2-ethyl-3-hydroxyhexanoic acid

C8H16O3 (160.10993860000002)


   

2(Methoxymethyl)-2,4,5-trimethyl-1,3-dioxolane

NA

C8H16O3 (160.10993860000002)


{"Ingredient_id": "HBIN005917","Ingredient_name": "2(Methoxymethyl)-2,4,5-trimethyl-1,3-dioxolane","Alias": "NA","Ingredient_formula": "C8H16O3","Ingredient_Smile": "CC1C(OC(O1)(C)COC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "40277","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   
   
   

1-(1-methylindol-3-yl)methanamine

1-(1-methylindol-3-yl)methanamine

C10H12N2 (160.1000432)


   

(1r,4r)-1-(2-hydroxyethyl)cyclohexane-1,4-diol

(1r,4r)-1-(2-hydroxyethyl)cyclohexane-1,4-diol

C8H16O3 (160.10993860000002)


   

butyl (3s)-3-hydroxybutanoate

butyl (3s)-3-hydroxybutanoate

C8H16O3 (160.10993860000002)