Exact Mass: 181.0539

Exact Mass Matches: 181.0539

Found 500 metabolites which its exact mass value is equals to given mass value 181.0539, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

L-Tyrosine

(2S)-2-amino-3-(4-hydroxyphenyl)propanoic acid

C9H11NO3 (181.0739)


Tyrosine (Tyr) or L-tyrosine is an alpha-amino acid. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon). Amino acids are organic compounds that contain amino (–NH2) and carboxyl (–COOH) functional groups, along with a side chain (R group) specific to each amino acid. L-tyrosine is one of 20 proteinogenic amino acids, i.e., the amino acids used in the biosynthesis of proteins. Tyrosine is found in all organisms ranging from bacteria to plants to animals. It is classified as a non-polar, uncharged (at physiological pH) aromatic amino acid. Tyrosine is a non-essential amino acid, meaning the body can synthesize it – usually from phenylalanine. The conversion of phenylalanine to tyrosine is catalyzed by the enzyme phenylalanine hydroxylase, a monooxygenase. This enzyme catalyzes the reaction causing the addition of a hydroxyl group to the end of the 6-carbon aromatic ring of phenylalanine, such that it becomes tyrosine. Tyrosine is found in many high-protein food products such as chicken, turkey, fish, milk, yogurt, cottage cheese, cheese, peanuts, almonds, pumpkin seeds, sesame seeds, soy products, lima beans, avocados and bananas. Tyrosine is one of the few amino acids that readily passes the blood-brain barrier. Once in the brain, it is a precursor for the neurotransmitters dopamine, norepinephrine and epinephrine, better known as adrenalin. These neurotransmitters are an important part of the bodys sympathetic nervous system, and their concentrations in the body and brain are directly dependent upon dietary tyrosine. Tyrosine is not found in large concentrations throughout the body, probably because it is rapidly metabolized. Folic acid, copper and vitamin C are cofactor nutrients of these reactions. Tyrosine is also the precursor for hormones, including thyroid hormones (diiodotyrosine), catecholestrogens and the major human pigment, melanin. Tyrosine is an important amino acid in many proteins, peptides and even enkephalins, the bodys natural pain reliever. Valine and other branched amino acids, and possibly tryptophan and phenylalanine may reduce tyrosine absorption. A number of genetic errors of tyrosine metabolism have been identified, such as hawkinsinuria and tyrosinemia I. The most common feature of these diseases is the increased amount of tyrosine in the blood, which is marked by decreased motor activity, lethargy and poor feeding. Infection and intellectual deficits may occur. Vitamin C supplements can help reverse these disease symptoms. Some adults also develop elevated tyrosine in their blood. This typically indicates a need for more vitamin C. More tyrosine is needed under stress, and tyrosine supplements prevent the stress-induced depletion of norepinephrine and can help aleviate biochemical depression. However, tyrosine may not be good for treating psychosis. Many antipsychotic medications apparently function by inhibiting tyrosine metabolism. L-Dopa, which is directly used in Parkinsons, is made from tyrosine. Tyrosine, the nutrient, can be used as an adjunct in the treatment of Parkinsons. Peripheral metabolism of tyrosine necessitates large doses of tyrosine, however, compared to L-Dopa (http://www.dcnutrition.com). In addition to its role as a precursor for neurotransmitters, tyrosine plays an important role for the function of many proteins. Within many proteins or enzymes, certain tyrosine residues can be tagged (at the hydroxyl group) with a phosphate group (phosphorylated) by specialized protein kinases. In its phosphorylated form, tyrosine is called phosphotyrosine. Tyrosine phosphorylation is considered to be one of the key steps in signal transduction and regulation of enzymatic activity. Tyrosine (or its precursor phenylalanine) is also needed to synthesize the benzoquinone structure which forms part of coenzyme Q10. L-tyrosine is an optically active form of tyrosine having L-configuration. It has a role as an EC 1.3.1.43 (arogenate dehydrogenase) inhibitor, a nutraceutical, a micronutrient and a fundamental metabolite. It is an erythrose 4-phosphate/phosphoenolpyruvate family amino acid, a proteinogenic amino acid, a tyrosine and a L-alpha-amino acid. It is functionally related to a L-tyrosinal. It is a conjugate base of a L-tyrosinium. It is a conjugate acid of a L-tyrosinate(1-). It is an enantiomer of a D-tyrosine. It is a tautomer of a L-tyrosine zwitterion. Tyrosine is a non-essential amino acid. In animals it is synthesized from [phenylalanine]. It is also the precursor of [epinephrine], thyroid hormones, and melanin. L-Tyrosine is a metabolite found in or produced by Escherichia coli (strain K12, MG1655). L-Tyrosine is the levorotatory isomer of the aromatic amino acid tyrosine. L-tyrosine is a naturally occurring tyrosine and is synthesized in vivo from L-phenylalanine. It is considered a non-essential amino acid; however, in patients with phenylketonuria who lack phenylalanine hydroxylase and cannot convert phenylalanine into tyrosine, it is considered an essential nutrient. In vivo, tyrosine plays a role in protein synthesis and serves as a precursor for the synthesis of catecholamines, thyroxine, and melanin. Tyrosine is an essential amino acid that readily passes the blood-brain barrier. Once in the brain, it is a precursor for the neurotransmitters dopamine, norepinephrine and epinephrine, better known as adrenalin. These neurotransmitters are an important part of the bodys sympathetic nervous system, and their concentrations in the body and brain are directly dependent upon dietary tyrosine. Tyrosine is not found in large concentrations throughout the body, probably because it is rapidly metabolized. Folic acid, copper and vitamin C are cofactor nutrients of these reactions. Tyrosine is also the precursor for hormones, thyroid, catecholestrogens and the major human pigment, melanin. Tyrosine is an important amino acid in many proteins, peptides and even enkephalins, the bodys natural pain reliever. Valine and other branched amino acids, and possibly tryptophan and phenylalanine may reduce tyrosine absorption. A number of genetic errors of tyrosine metabolism occur. Most common is the increased amount of tyrosine in the blood of premature infants, which is marked by decreased motor activity, lethargy and poor feeding. Infection and intellectual deficits may occur. Vitamin C supplements reverse the disease. Some adults also develop elevated tyrosine in their blood. This indicates a need for more vitamin C. More tyrosine is needed under stress, and tyrosine supplements prevent the stress-induced depletion of norepinephrine and can cure biochemical depression. However, tyrosine may not be good for psychosis. Many antipsychotic medications apparently function by inhibiting tyrosine metabolism. L-dopa, which is directly used in Parkinsons, is made from tyrosine. Tyrosine, the nutrient, can be used as an adjunct in the treatment of Parkinsons. Peripheral metabolism of tyrosine necessitates large doses of tyrosine, however, compared to L-dopa. A non-essential amino acid. In animals it is synthesized from PHENYLALANINE. It is also the precursor of EPINEPHRINE; THYROID HORMONES; and melanin. Dietary supplement, nutrient. Flavouring ingredient. L-Tyrosine is found in many foods, some of which are blue crab, sweet rowanberry, lemon sole, and alpine sweetvetch. An optically active form of tyrosine having L-configuration. L-Tyrosine. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=60-18-4 (retrieved 2024-07-01) (CAS RN: 60-18-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex. L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex.

   

Beta-Tyrosine

3-Amino-3-(4-hydroxyphenyl)propionic acid

C9H11NO3 (181.0739)


The use of tyrosine kinase receptor inhibitors is increasingly becoming a valuable therapeutic alternative in tumors carrying activated tyrosine kinase receptors. GMR beta tyrosine residues are not necessary for activation of the JAK/STAT pathway, or for proliferation, viability, or adhesion signaling in Ba/F3 cells, although tyrosine residues significantly affect the magnitude of the response. (PMID:10372132). The use of tyrosine kinase receptor inhibitors is increasingly becoming a valuable therapeutic alternative in tumors carrying activated tyrosine kinase receptors. KEIO_ID A176

   

L-Threo-3-Phenylserine

(2Rs,3Sr)-2-amino-3-Hydroxy-3-phenylpropanoic acid

C9H11NO3 (181.0739)


Incorporated into the benzoyl moiety of urinary hippuric acid [HMDB] Incorporated into the benzoyl moiety of urinary hippuric acid.

   

Meta-Tyrosine

(2S)-2-Azaniumyl-3-(3-hydroxyphenyl)propanoate

C9H11NO3 (181.0739)


Meta-Tyrosine, or M-Tyrosine for short, is a natural weed suppressant found in certain Fine fescue grass. M-tyrosine exudes out of the grass plants roots and is then absorbed by neighbouring weed seedlings. The weed plants will either die or be stunted from the toxic acid. DL-m-Tyrosine shows effects on Arabidopsis root growth. Carbidopa combination with DL-m-tyrosine shows a potent hypotensive effect[1][2].

   

2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one

2,4-dihydroxy-3,4-dihydro-2H-1,4-benzoxazin-3-one

C8H7NO4 (181.0375)


2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is a benzoxazinoid precursor of 2-aminophenol sulfate. It is a metabolite found in urine of individuals that have consumed whole grains. It is a particularly strong biomarker for whole grain rye bread consumption (PMID: 23307617). Isolated from seedlings of rye and sweet corn (Zea mays). 2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products and fats and oils.

   

GLUFOSINATE

L-2-Amino-4-(hydroxymethylphosphinyl)butanoate

C5H12NO4P (181.0504)


D010575 - Pesticides > D006540 - Herbicides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   

2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate

5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid

C8H7NO4 (181.0375)


2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is an intermediate in vitamin B6 metabolism(KEGG ID C06050). It is the 4th to last step in the synthesis of succinate semialdehyde, which is an intermediate in butanoate metabolism. 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is converted from 4-pyridoxate and is then converted to 3-hydroxy-2-methylpyridine-4,5-dicarboxylate. [HMDB] 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is an intermediate in vitamin B6 metabolism(KEGG ID C06050). It is the 4th to last step in the synthesis of succinate semialdehyde, which is an intermediate in butanoate metabolism. 2-Methyl-3-hydroxy-5-formylpyridine-4-carboxylate is converted from 4-pyridoxate and is then converted to 3-hydroxy-2-methylpyridine-4,5-dicarboxylate.

   

4-Hydroxy-4-(3-pyridyl)-butanoic acid

gamma-(3-Pyridyl)-gamma-hydroxybutyric acid

C9H11NO3 (181.0739)


4-Hydroxy-4-(3-pyridyl)-butanoic acid is a nitrosonornicotine metabolite derived from tobacco smoke. (PMID: 796709). This nicotine-related compound was separated by HPLC as a cotinine metabolite in human urine and an urinary metabolites of (methylnitrosamino)(pyridyl)butanone in rats. (MID: 10362230). 4-Hydroxy-4-(3-pyridyl)-butanoic acid is a nitrosonornicotine metabolite derived from tobacco smoke. (PMID: 796709)

   

N-hydroxy-L-phenylalanine

2-(hydroxyamino)-3-phenylpropanoic acid

C9H11NO3 (181.0739)


   

4,6-Pteridinedione, 2-amino-1,5,7,8-tetrahydro-

4,6-Pteridinedione, 2-amino-1,5,7,8-tetrahydro-

C6H7N5O2 (181.06)


   

D-Tyrosine

2-amino-3-(4-hydroxyphenyl)propanoic acid

C9H11NO3 (181.0739)


   

Glufosinate

2-amino-4-[hydroxy(methyl)phosphoryl]butanoic acid

C5H12NO4P (181.0504)


D010575 - Pesticides > D006540 - Herbicides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   

D-Thr-OH

D-Tyrosine

C9H11NO3 (181.0739)


An optically active form of tyrosine having D-configuration.

   

3-amino-3-(4-hydroxyphenyl)propanoic acid

(R)-3-Amino-3-(4-hydroxy-phenyl)-propionic acid

C9H11NO3 (181.0739)


A beta-amino acid comprising propionic acid having amino and 4-hydroxyphenyl groups attached at the 3-position.

   

o-Tyrosine

2-Amino-3-(2-hydroxyphenyl)propanoic acid

C9H11NO3 (181.0739)


o-Tyrosine is a normal human metabolite. Its presence is possible due to the hydroxylation of l-phenylalanine by hydroxyl radical (*OH), and is proposed as an hydroxy radical biomarker of oxidative damage to proteins. o-Tyrosine might also be included in the diet and absorbed. It has been associated with disease such as Kwashiorkor, a severe form of protein-energy malnutrition. However, many publications mention that the results are inconclusive, and o-tyrosine is not selectively altered by antioxidant intervention, exercise training or age. (PMID: 14670743, 10969271, 9887186) [HMDB] o-Tyrosine is a normal human metabolite. Its presence is possible due to the hydroxylation of l-phenylalanine by hydroxyl radical (*OH), and is proposed as an hydroxy radical biomarker of oxidative damage to proteins. o-Tyrosine might also be included in the diet and absorbed. It has been associated with disease such as Kwashiorkor, a severe form of protein-energy malnutrition. However, many publications mention that the results are inconclusive, and o-tyrosine is not selectively altered by antioxidant intervention, exercise training or age. (PMID:14670743, 10969271, 9887186).

   

Acamprosate

N-Acetylhomotaurine, magnesium (2:1) salt

C5H11NO4S (181.0409)


Acamprosate, also known by the brand name Campral™, is a drug used for treating alcohol dependence. Acamprosate is thought to stabilize the chemical balance in the brain that would otherwise be disrupted by alcoholism, possibly by blocking glutaminergic N-methyl-D-aspartate receptors, while gamma-aminobutyric acid type A receptors are activated. Reports indicate that acamprosate only works with a combination of attending support groups and abstinence from alcohol. Certain serious side effects include allergic reactions, irregular heartbeats, and low or high blood pressure, while less serious side effects include headaches, insomnia, and impotence. Acamprosate should not be taken by people with kidney problems or allergies to the drug. N - Nervous system > N07 - Other nervous system drugs > N07B - Drugs used in addictive disorders > N07BB - Drugs used in alcohol dependence D002491 - Central Nervous System Agents > D000427 - Alcohol Deterrents C26170 - Protective Agent > C1509 - Neuroprotective Agent

   

8-Hydroxy-7-methylguanine

2-amino-7-methyl-6,7,8,9-tetrahydro-3H-purine-6,8-dione

C6H7N5O2 (181.06)


8-Hydroxy-7-methylguanine is a modified nucleoside. 8-Hydroxy-7-methylguanine is an endogenous methylated nucleoside found in human fluids; methylated purine bases are present in higher amounts in tumor-bearing patients compared to healthy controls. Human exposure to carcinogenic alkylating agents can lead to the formation of covalently bound adducts in DNA, some of which are excreted in urine as alkylated purines following DNA degradation and repair; the N2 position of guanine is one of the major sites for DNA modification by various carcinogens. Measurements of RNA or DNA catabolites in urine can be used as a measure for the metabolism of each of the three major species of RNA. An accumulation of modified ribonucleosides appears in the serum of uremic patients. (PMID: 3506820, 5961889, 16527824, 16061253, 8043914, 2428556, 7159514, 9607216) [HMDB] 8-Hydroxy-7-methylguanine is a modified nucleoside. 8-Hydroxy-7-methylguanine is an endogenous methylated nucleoside found in human fluids; methylated purine bases are present in higher amounts in tumor-bearing patients compared to healthy controls. Human exposure to carcinogenic alkylating agents can lead to the formation of covalently bound adducts in DNA, some of which are excreted in urine as alkylated purines following DNA degradation and repair; the N2 position of guanine is one of the major sites for DNA modification by various carcinogens. Measurements of RNA or DNA catabolites in urine can be used as a measure for the metabolism of each of the three major species of RNA. An accumulation of modified ribonucleosides appears in the serum of uremic patients. (PMID: 3506820, 5961889, 16527824, 16061253, 8043914, 2428556, 7159514, 9607216).

   

(R)-2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one

2,7-dihydroxy-3,4-dihydro-2H-1,4-benzoxazin-3-one

C8H7NO4 (181.0375)


Identified in sweet corn extracts. (R)-2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products and fats and oils. (R)-2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one is found in cereals and cereal products. Identified in sweet corn extracts.

   

4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline

4,6,7-Trihydroxy-1,2,3,4-tetrahydroisoquinoline

C9H11NO3 (181.0739)


This compound belongs to the family of Isoquinolines and Derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine

   

Methionine sulfone

(2S)-2-Amino-4-(Methylsulfonyl)-Butanoic Acid

C5H11NO4S (181.0409)


S-dioxymethionine, also known as (S)-amino-4-(methylsulphonyl)butyric acid or methionine sulfone, is a member of the class of compounds known as L-alpha-amino acids. L-alpha-amino acids are alpha amino acids which have the L-configuration of the alpha-carbon atom. S-dioxymethionine is soluble (in water) and a moderately acidic compound (based on its pKa). S-dioxymethionine can be found in garden onion, which makes S-dioxymethionine a potential biomarker for the consumption of this food product. Methionine sulfone (CAS: 820-10-0), also known as L-methionine-S-dioxide, belongs to the class of organic compounds known as L-alpha-amino acids. These are alpha-amino acids which have the L-configuration at the alpha-carbon atom. Methionine sulfone is a very strong basic compound (based on its pKa). Methionine sulfone has been detected, but not quantified, in garden onions. This could make methionine sulfone a potential biomarker for the consumption of these foods.

   

DL-Methionine sulfone

Methionine sulfone, 35S-labeled, (+-)-isomer

C5H11NO4S (181.0409)


   

2-Amino-3-hydroxy-3-phenylpropanoic acid

(2Rs,3Sr)-2-amino-3-Hydroxy-3-phenylpropanoic acid

C9H11NO3 (181.0739)


   

2-Nitrophenyl acetate

2-Nitrophenyl acetic acid

C8H7NO4 (181.0375)


   

3-Aminophthalic acid

3-aminobenzene-1,2-dicarboxylic acid

C8H7NO4 (181.0375)


   

4-Hydroxy-3-nitrophenylacetaldehyde

2-(4-Hydroxy-3-nitrophenyl)acetaldehyde

C8H7NO4 (181.0375)


   

4-Nitrophenyl acetate

4-Nitrophenyl acetate, 14C-labeled

C8H7NO4 (181.0375)


   

4-Nitrophenylacetic acid

2-(4-Nitrophenoxy)acetic acid

C8H7NO4 (181.0375)


   

6-Chloro-2,3,4,5-tetrahydro-1H-3-benzazepine

6-Chloro-2,3,4,5-tetrahydro-1H-3-benzazepine

C10H12ClN (181.0658)


   

Pentaerythritol mononitrate

2-(hydroxymethyl)-2-[(nitrooxy)methyl]propane-1,3-diol

C5H11NO6 (181.0586)


   

pyrrolobenzodiazepine

Pyrrolo(2,1-c)(1,4)benzodiazepine

C11H7N3 (181.064)


   

(R+)-3-(4-hydroxyphenyl)lactate

(2R)-2-Hydroxy-3-(4-hydroxyphenyl)propanoic acid

C9H9O4 (181.0501)


(r+)-3-(4-hydroxyphenyl)lactate, also known as (2r)-2-hydroxy-3-(4-hydroxyphenyl)propanoate or P-hydroxyphenyllactic acid, is a member of the class of compounds known as phenylpropanoic acids. Phenylpropanoic acids are compounds with a structure containing a benzene ring conjugated to a propanoic acid (r+)-3-(4-hydroxyphenyl)lactate is soluble (in water) and a weakly acidic compound (based on its pKa). (r+)-3-(4-hydroxyphenyl)lactate can be found in a number of food items such as muskmelon, coconut, lemon grass, and kohlrabi, which makes (r+)-3-(4-hydroxyphenyl)lactate a potential biomarker for the consumption of these food products.

   

Tyrosine

L-Tyrosine

C9H11NO3 (181.0739)


COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex. L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex.

   

Lysichitalexin

2-(4-Methyloxyphenyl)-1-nitroethane

C9H11NO3 (181.0739)


   

6-Methylthioguanine

Purine, 2-amino-6- (methylthio)-

C6H7N5S (181.0422)


   

3-(4-fluorophenyl)-3-oxopropanamide

3-(4-fluorophenyl)-3-oxopropanamide

C9H8FNO2 (181.0539)


   

L-Methionine sulfone

(2S)-2-Amino-4-(Methylsulfonyl)-Butanoic Acid

C5H11NO4S (181.0409)


An L-methionine derivative in which the sulfur has been oxidised to the corresponding sulfone. MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; UCUNFLYVYCGDHP_STSL_0130_Methionine sulfone_8000fmol_180506_S2_LC02_MS02_203; 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. Acquisition and generation of the data is financially supported in part by CREST/JST.

   

2,6-Dimethoxybenzamide

2,6-Dimethoxybenzamide

C9H11NO3 (181.0739)


   

4-Hydroxy-N-(2-hydroxyethyl)benzamide

4-Hydroxy-N-(2-hydroxyethyl)benzamide

C9H11NO3 (181.0739)


   

3-Me ether,oxime-3,4-Dihydroxyacetophenone

3-Me ether,oxime-3,4-Dihydroxyacetophenone

C9H11NO3 (181.0739)


   

COC(C(OC1=CC=CC=C1)N)=O

COC(C(OC1=CC=CC=C1)N)=O

C9H11NO3 (181.0739)


   

S-(2-hydroxyethyl)cysteine sulfoxide

S-(2-hydroxyethyl)cysteine sulfoxide

C5H11NO4S (181.0409)


   

ACMC-20mgak

ACMC-20mgak

C8H7NO4 (181.0375)


   

AKOS012074821

AKOS012074821

C9H11NOS (181.0561)


   

2,3-Dimethoxybenzaldoxime

2,3-Dimethoxybenzaldoxime

C9H11NO3 (181.0739)


   

2,6-Pyridinedicarboxylic acid monomethyl ester

2,6-Pyridinedicarboxylic acid monomethyl ester

C8H7NO4 (181.0375)


   

Methyl 2-amino-3-hydroxy-4-methylbenzoate

Methyl 2-amino-3-hydroxy-4-methylbenzoate

C9H11NO3 (181.0739)


   

24195-02-6

24195-02-6

C8H7NO4 (181.0375)


   

2-hydroxy-3-formylaminobenzoic acid

2-hydroxy-3-formylaminobenzoic acid

C8H7NO4 (181.0375)


   

CHEMBL1615625

CHEMBL1615625

C6H7N5O2 (181.06)


   

Ehretiamide

Ehretiamide

C9H11NO3 (181.0739)


   

[Z]-5alpha,6beta-dihydroxy-4beta-methoxy-2-cyclohexene-Delta1,alpha-acetonitrile

[Z]-5alpha,6beta-dihydroxy-4beta-methoxy-2-cyclohexene-Delta1,alpha-acetonitrile

C9H11NO3 (181.0739)


   

3-Hydroxy-6-methoxybenzoxazole-2(3H)-one

3-Hydroxy-6-methoxybenzoxazole-2(3H)-one

C8H7NO4 (181.0375)


   

Methyl 5-(1-hydroxyethyl)pyridine-3-carboxylate

Methyl 5-(1-hydroxyethyl)pyridine-3-carboxylate

C9H11NO3 (181.0739)


   

2-(methoxycarbonyl)nicotinic acid

2-(methoxycarbonyl)nicotinic acid

C8H7NO4 (181.0375)


   

Ethyl 6-methoxynicotinate

Ethyl 6-methoxynicotinate

C9H11NO3 (181.0739)


   

N-benzyl O-methyl thiocarbamate

N-benzyl O-methyl thiocarbamate

C9H11NOS (181.0561)


   

3-Methoxy-2-(methylamino)benzoic acid

3-Methoxy-2-(methylamino)benzoic acid

C9H11NO3 (181.0739)


   

4-hydroxy-8-isocyano-1-oxaspiro<4.4>cyclonon-8-en-2-one|4-hydroxy-8-isocyano-1-oxaspiro[4.4]cyclonon-8-en-2-one|4-hydroyxy-8-isocyano-1-oxaspiro[4,4]cyclonon-8-en-2-one

4-hydroxy-8-isocyano-1-oxaspiro<4.4>cyclonon-8-en-2-one|4-hydroxy-8-isocyano-1-oxaspiro[4.4]cyclonon-8-en-2-one|4-hydroyxy-8-isocyano-1-oxaspiro[4,4]cyclonon-8-en-2-one

C9H11NO3 (181.0739)


   

5-(trans-2-Carbamoyl-vinyl)-furan-2-carbonsaeure|5-(trans-2-carbamoyl-vinyl)-furan-2-carboxylic acid

5-(trans-2-Carbamoyl-vinyl)-furan-2-carbonsaeure|5-(trans-2-carbamoyl-vinyl)-furan-2-carboxylic acid

C8H7NO4 (181.0375)


   

N-(4-Hydroxy-2-methoxyphenyl)acetamide

N-(4-Hydroxy-2-methoxyphenyl)acetamide

C9H11NO3 (181.0739)


   

3,4-Dimethoxybenzamide

3,4-Dimethoxybenzamide

C9H11NO3 (181.0739)


   

2,4-DIMETHOXYBENZALDOXIME

2,4-DIMETHOXYBENZALDOXIME

C9H11NO3 (181.0739)


   

Veratraldehyde oxime

Veratraldehyde oxime

C9H11NO3 (181.0739)


   

1-methoxy-4-(2-nitroethyl)benzene

1-methoxy-4-(2-nitroethyl)benzene

C9H11NO3 (181.0739)


   

Bryonamide A

Benzamide, 4-hydroxy-N-(2-hydroxyethyl)-

C9H11NO3 (181.0739)


   

Acamprosate

3-(acetylamino)propanesulphonic acid

C5H11NO4S (181.0409)


N - Nervous system > N07 - Other nervous system drugs > N07B - Drugs used in addictive disorders > N07BB - Drugs used in alcohol dependence D002491 - Central Nervous System Agents > D000427 - Alcohol Deterrents C26170 - Protective Agent > C1509 - Neuroprotective Agent CONFIDENCE standard compound; INTERNAL_ID 2145 CONFIDENCE standard compound; EAWAG_UCHEM_ID 2848

   

Tyrosine

L-(-)-Tyrosine

C9H11NO3 (181.0739)


An alpha-amino acid that is phenylalanine bearing a hydroxy substituent at position 4 on the phenyl ring. Annotation level-2 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 56 COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS CONFIDENCE standard compound; INTERNAL_ID 3 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.053 Acquisition and generation of the data is financially supported by the Max-Planck-Society L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex. L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex.

   

L-Tyrosine

L-Tyrosine

C9H11NO3 (181.0739)


MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; OUYCCCASQSFEME-QMMMGPOBSA-N_STSL_0110_L-Tyrosine_0500fmol_180506_S2_LC02_MS02_57; 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. L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex. L-Tyrosine is a non-essential amino acid which can inhibit citrate synthase activity in the posterior cortex.

   

o-Tyrosine

DL-o-Tyrosine

C9H11NO3 (181.0739)


   

3-Amino-3-(4-hydroxyphenyl)propionic acid

3-Amino-3-(4-hydroxyphenyl)propionic acid

C9H11NO3 (181.0739)


   

3-Hydroxyphenylalanine

3-Hydroxyphenylalanine

C9H11NO3 (181.0739)


   
   

dl-4-hydroxyphenyllactic acid

dl-4-hydroxyphenyllactic acid

[C9H9O4]- (181.0501)


   

ADRENALONE

ADRENALONE

C9H11NO3 (181.0739)


B - Blood and blood forming organs > B02 - Antihemorrhagics > B02B - Vitamin k and other hemostatics > B02BC - Local hemostatics A - Alimentary tract and metabolism > A01 - Stomatological preparations > A01A - Stomatological preparations C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D006401 - Hematologic Agents > D003029 - Coagulants > D006490 - Hemostatics D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents

   

DIBOA

2,4-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one

C8H7NO4 (181.0375)


A lactol that consists of 1,4-benzoxazine bearing two hydroxy substituents at positions 2 and 4 as well as a keto group at position 3. Annotation level-3

   

Tyrosine (Not validated)

Tyrosine (Not validated)

C9H11NO3 (181.0739)


Annotation level-2

   

Tyrosine; LC-tDDA; CE10

Tyrosine; LC-tDDA; CE10

C9H11NO3 (181.0739)


   

Tyrosine; LC-tDDA; CE20

Tyrosine; LC-tDDA; CE20

C9H11NO3 (181.0739)


   

Tyrosine; LC-tDDA; CE30

Tyrosine; LC-tDDA; CE30

C9H11NO3 (181.0739)


   

Methionine sulfone; LC-tDDA; CE10

Methionine sulfone; LC-tDDA; CE10

C5H11NO4S (181.0409)


   

Methionine sulfone; LC-tDDA; CE20

Methionine sulfone; LC-tDDA; CE20

C5H11NO4S (181.0409)


   

Methionine sulfone; LC-tDDA; CE30

Methionine sulfone; LC-tDDA; CE30

C5H11NO4S (181.0409)


   

Methionine sulfone; LC-tDDA; CE40

Methionine sulfone; LC-tDDA; CE40

C5H11NO4S (181.0409)


   

Methionine sulfone; AIF; CE0; CorrDec

Methionine sulfone; AIF; CE0; CorrDec

C5H11NO4S (181.0409)


   

Methionine sulfone; AIF; CE10; CorrDec

Methionine sulfone; AIF; CE10; CorrDec

C5H11NO4S (181.0409)


   

Methionine sulfone; AIF; CE30; CorrDec

Methionine sulfone; AIF; CE30; CorrDec

C5H11NO4S (181.0409)


   

Methionine sulfone; AIF; CE0; MS2Dec

Methionine sulfone; AIF; CE0; MS2Dec

C5H11NO4S (181.0409)


   

Methionine sulfone; AIF; CE10; MS2Dec

Methionine sulfone; AIF; CE10; MS2Dec

C5H11NO4S (181.0409)


   

Methionine sulfone; AIF; CE30; MS2Dec

Methionine sulfone; AIF; CE30; MS2Dec

C5H11NO4S (181.0409)


   

IS_4-HYDROXYPHENYL-D4-ALANINE

IS_4-HYDROXYPHENYL-D4-ALANINE

C9H11NO3 (181.0739)


   

8-Hydroxy-7-methylguanine

8-Hydroxy-7-methylguanine

C6H7N5O2 (181.06)


An oxopurine that is guanine with an oxo group at position 8 and a methyl substituent at position 7.

   

DL-o-Tyrosine

(±)-2-Amino-3-(2-hydroxyphenyl)propionic acid

C9H11NO3 (181.0739)


   

2,7-dihydroxy-3,4-dihydro-2H-1,4-benzoxazin-3-one

2,7-dihydroxy-3,4-dihydro-2H-1,4-benzoxazin-3-one

C8H7NO4 (181.0375)


   

Meta-Tyrosine

(2S)-2-Azaniumyl-3-(3-hydroxyphenyl)propanoate

C9H11NO3 (181.0739)


   

2-Hydroxy-N-(4-hydroxyphenyl)propanamide

2-Hydroxy-N-(4-hydroxyphenyl)propanamide

C9H11NO3 (181.0739)


   

Benzonitrile, 4-(4-pyrimidinyl)- (9CI)

Benzonitrile, 4-(4-pyrimidinyl)- (9CI)

C11H7N3 (181.064)


   

4-ethoxybenzenecarbothioamide

4-ethoxybenzenecarbothioamide

C9H11NOS (181.0561)


   

1H-Benzimidazol-2-amine,5-chloro-1-methyl-(9CI)

1H-Benzimidazol-2-amine,5-chloro-1-methyl-(9CI)

C8H8ClN3 (181.0407)


   

Pyrrolidine, 3-methyl-1-(trifluoroacetyl)- (8CI,9CI)

Pyrrolidine, 3-methyl-1-(trifluoroacetyl)- (8CI,9CI)

C7H10F3NO (181.0714)


   

2-phenylpyrimidine-5-carbonitrile

2-phenylpyrimidine-5-carbonitrile

C11H7N3 (181.064)


   

2-ISOPROPOXY-ISONICOTINIC ACID

2-ISOPROPOXY-ISONICOTINIC ACID

C9H11NO3 (181.0739)


   

1-(4-bromophenyl)pyrene

1-(4-bromophenyl)pyrene

C9H11NOS (181.0561)


   

2-amino-2-(4-methoxyphenyl)acetic acid

2-amino-2-(4-methoxyphenyl)acetic acid

C9H11NO3 (181.0739)


   

2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

C6H7N5S (181.0422)


   

Benzaldehyde,2,3-dimethoxy-, oxime

Benzaldehyde,2,3-dimethoxy-, oxime

C9H11NO3 (181.0739)


   

1-(4-FLUOROPHENYL)-2-NITROPROPENE

1-(4-FLUOROPHENYL)-2-NITROPROPENE

C9H8FNO2 (181.0539)


   

1-Fluoro-2-(2-nitropropenyl)benzene

1-Fluoro-2-(2-nitropropenyl)benzene

C9H8FNO2 (181.0539)


   

2-Hydroxy-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione

2-Hydroxy-3a,4,7,7a-tetrahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione

C8H7NO4 (181.0375)


   

4-amino-3-nitrobenzamide

4-amino-3-nitrobenzamide

C7H7N3O3 (181.0487)


   

Amino(3-methoxyphenyl)acetic acid

Amino(3-methoxyphenyl)acetic acid

C9H11NO3 (181.0739)


   

2-Amino-2-(2-methoxyphenyl)acetic acid

2-Amino-2-(2-methoxyphenyl)acetic acid

C9H11NO3 (181.0739)


   

3-Nitrobenzhydrazide

3-Nitrobenzhydrazide

C7H7N3O3 (181.0487)


   

3-BORONOBENZOTHIOAMIDE

3-BORONOBENZOTHIOAMIDE

C7H8BNO2S (181.0369)


   

Benzoic acid, 2-nitro-,hydrazide

Benzoic acid, 2-nitro-,hydrazide

C7H7N3O3 (181.0487)


   

5,8-Difluoro-quinolin-4-ol

5,8-Difluoro-quinolin-4-ol

C9H5F2NO (181.0339)


   

Ethyl 4-Ethynylbenzoate

Ethyl 4-Ethynylbenzoate

C9H11NO3 (181.0739)


   

3-DIMETHYLAMINO-1-THIOPHEN-3-YL-PROPENONE

3-DIMETHYLAMINO-1-THIOPHEN-3-YL-PROPENONE

C9H11NOS (181.0561)


   

(R)-2-Methoxy-phenylglycine

(R)-2-Methoxy-phenylglycine

C9H11NO3 (181.0739)


   

Amino(2-methoxyphenyl)acetic acid

Amino(2-methoxyphenyl)acetic acid

C9H11NO3 (181.0739)


   

(R)-(-)-1-(4-Fluorophenyl)Ethyl Isothiocyanate

(R)-(-)-1-(4-Fluorophenyl)Ethyl Isothiocyanate

C9H8FNS (181.0361)


   

5-Amino-2-methoxy-4-methylbenzoic acid

5-Amino-2-methoxy-4-methylbenzoic acid

C9H11NO3 (181.0739)


   

3-Chloroquinuclidine hydrochloride

3-Chloroquinuclidine hydrochloride

C7H13Cl2N (181.0425)


   

Methyl 2-nitrobenzoate

Methyl 2-nitrobenzoate

C8H7NO4 (181.0375)


   

[3,3-Bipyridine]-4-carbonitrile

[3,3-Bipyridine]-4-carbonitrile

C11H7N3 (181.064)


   

N,N-dimethyl-2-sulfanylbenzamide

N,N-dimethyl-2-sulfanylbenzamide

C9H11NOS (181.0561)


   

1H-Benzimidazol-5-amine,2-chloro-1-methyl-(9CI)

1H-Benzimidazol-5-amine,2-chloro-1-methyl-(9CI)

C8H8ClN3 (181.0407)


   

Methyl 2-(3-amino-4-hydroxyphenyl)acetate

Methyl 2-(3-amino-4-hydroxyphenyl)acetate

C9H11NO3 (181.0739)


   

Veratramide

Veratramide

C9H11NO3 (181.0739)


   

Methyl 5-amino-2-methoxybenzoate

Methyl 5-amino-2-methoxybenzoate

C9H11NO3 (181.0739)


   

4-Acetamidothioanisole

4-Acetamidothioanisole

C9H11NOS (181.0561)


   

2-Amino-6-chloro-1,2,3,4-tetrahydronaphthalene

2-Amino-6-chloro-1,2,3,4-tetrahydronaphthalene

C10H12ClN (181.0658)


   

2-Amino-5-nitro benzamide

2-Amino-5-nitro benzamide

C7H7N3O3 (181.0487)


   

4-(AMINOETHYL)SALICYLIC ACID

4-(AMINOETHYL)SALICYLIC ACID

C9H11NO3 (181.0739)


   

Hydrazinecarbothioamide,N-(phenylmethyl)-

Hydrazinecarbothioamide,N-(phenylmethyl)-

C8H11N3S (181.0674)


   

(4-Methyl-3-nitrophenyl)boronic acid

(4-Methyl-3-nitrophenyl)boronic acid

C7H8BNO4 (181.0546)


   

4-Aminophthalic acid

4-Aminophthalic acid

C8H7NO4 (181.0375)


   

ACETIC ACID 4-METHOXY-PYRIDIN-2-YLMETHYL ESTER

ACETIC ACID 4-METHOXY-PYRIDIN-2-YLMETHYL ESTER

C9H11NO3 (181.0739)


   

D-Glucose-d1-4

D-Glucose-d1-4

C6H11DO6 (181.0697)


   

3-(3-Chlorophenyl)pyrrolidine

3-(3-Chlorophenyl)pyrrolidine

C10H12ClN (181.0658)


   

2-Methoxy-4-nitrobenzaldehyde

2-Methoxy-4-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

methyl 6-(1-hydroxyethyl)pyridine-3-carboxylate

methyl 6-(1-hydroxyethyl)pyridine-3-carboxylate

C9H11NO3 (181.0739)


   

ETHYL 2-AMINO-3-OXOBUTANOATE HYDROCHLORIDE

ETHYL 2-AMINO-3-OXOBUTANOATE HYDROCHLORIDE

C6H12ClNO3 (181.0506)


   

(2S,3R)-(-)-3-(BENZYLOXYMETHYL)OXIRANE-2-METHANOL4-NITROBENZOICACIDESTER

(2S,3R)-(-)-3-(BENZYLOXYMETHYL)OXIRANE-2-METHANOL4-NITROBENZOICACIDESTER

C9H11NO3 (181.0739)


   

methyl (4-amino-3-hydroxyphenyl)acetate

methyl (4-amino-3-hydroxyphenyl)acetate

C9H11NO3 (181.0739)


   

D-Galactose-d

D-Galactose-d

C6H11DO6 (181.0697)


   

PYRROLIDINE, 1-(3-CHLOROPHENYL)-

PYRROLIDINE, 1-(3-CHLOROPHENYL)-

C10H12ClN (181.0658)


   

2-Amino-4-nitrobenzamide

2-Amino-4-nitrobenzamide

C7H7N3O3 (181.0487)


   

L-threo-3-phenylserine

L-threo-3-phenylserine

C9H11NO3 (181.0739)


A L-phenylalanine derivative carrying a hydroxy substituent at position 3.

   

(R)-3-HYDROXYETHYLMORPHOLINE

(R)-3-HYDROXYETHYLMORPHOLINE

C10H12ClN (181.0658)


   

ethyl 5-formyl-2-methyl-1H-pyrrole-3-carboxylate

ethyl 5-formyl-2-methyl-1H-pyrrole-3-carboxylate

C9H11NO3 (181.0739)


   

4-(4-Methylphenyl)-3-thiosemicarbazide

4-(4-Methylphenyl)-3-thiosemicarbazide

C8H11N3S (181.0674)


   

D-THREO-3-PHENYLSERINE

(2R,3S)-2-amino-3-hydroxy-3-phenylpropanoic acid

C9H11NO3 (181.0739)


   

1-Trifluoroacetyl piperidine

1-Trifluoroacetyl piperidine

C7H10F3NO (181.0714)


   

5,7-Difluoroquinolin-4-ol

5,7-Difluoroquinolin-4-ol

C9H5F2NO (181.0339)


   

2-METHYL-5-NITRONICOTINAMIDE

2-METHYL-5-NITRONICOTINAMIDE

C7H7N3O3 (181.0487)


   

N-(4-Methoxyphenyl)ethanethioamide

N-(4-Methoxyphenyl)ethanethioamide

C9H11NOS (181.0561)


   

Ethyl 4-(hydroxyMethyl)picolinate

Ethyl 4-(hydroxyMethyl)picolinate

C9H11NO3 (181.0739)


   

2-(3-HYDROXYPYRROLIDIN-1-YL)ACETIC ACID HYDROCHLORIDE

2-(3-HYDROXYPYRROLIDIN-1-YL)ACETIC ACID HYDROCHLORIDE

C6H12ClNO3 (181.0506)


   

2-Nitro-5-hydroxyacetophenone

2-Nitro-5-hydroxyacetophenone

C8H7NO4 (181.0375)


   

2-((2-METHOXYPHENYL)AMINO)ACETIC ACID

2-((2-METHOXYPHENYL)AMINO)ACETIC ACID

C9H11NO3 (181.0739)


   

3-AMINO-5-CHLORO-6-METHYL-7-AZAINDOLE

3-AMINO-5-CHLORO-6-METHYL-7-AZAINDOLE

C8H8ClN3 (181.0407)


   

2-[p-Chlorophenyl]pyrolidine

2-[p-Chlorophenyl]pyrolidine

C10H12ClN (181.0658)


   

Pyrrolidine, 3-methyl-1-(trifluoroacetyl)-, (R)- (9CI)

Pyrrolidine, 3-methyl-1-(trifluoroacetyl)-, (R)- (9CI)

C7H10F3NO (181.0714)


   

6-methyl-5-nitropyridine-2-carboxamide

6-methyl-5-nitropyridine-2-carboxamide

C7H7N3O3 (181.0487)


   

4-chloro-N-(cyclopropylmethyl)aniline

4-chloro-N-(cyclopropylmethyl)aniline

C10H12ClN (181.0658)


   

2-(Methoxycarbonyl)isonicotinic acid

2-(Methoxycarbonyl)isonicotinic acid

C8H7NO4 (181.0375)


   

2-Methylpyridine-3,5-dicarboxylic Acid

2-Methylpyridine-3,5-dicarboxylic Acid

C8H7NO4 (181.0375)


   

4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

4-acetyl-3,5-dimethyl-1H-pyrrole-2-carboxylic acid

C9H11NO3 (181.0739)


   

L-2-Hydroxyphenylalanine

2-Hydroxy-L-Phenylalanine

C9H11NO3 (181.0739)


   

5-(3,5-DIFLUOROPHENYL)ISOXAZOLE

5-(3,5-DIFLUOROPHENYL)ISOXAZOLE

C9H5F2NO (181.0339)


   

DICHLORO(DIPROPYLAMINO)BORANE+

DICHLORO(DIPROPYLAMINO)BORANE+

C6H14BCl2N (181.0596)


   

4,5-DIMETHOXY-2-FLUOROBENZONITRILE

4,5-DIMETHOXY-2-FLUOROBENZONITRILE

C9H8FNO2 (181.0539)


   

4-Hydroxy-3-Nitroacetophenone

4-Hydroxy-3-Nitroacetophenone

C8H7NO4 (181.0375)


   

2-Methyl-5-nitrobenzoic acid

2-Methyl-5-nitrobenzoic acid

C8H7NO4 (181.0375)


   

D-Proline, 4-hydroxy-, methyl ester hydrochloride

D-Proline, 4-hydroxy-, methyl ester hydrochloride

C6H12ClNO3 (181.0506)


   

1-bromoheptane-7,7,7-d3

1-bromoheptane-7,7,7-d3

C7H12BrD3 (181.0545)


   

(2S)-2-Ammonio-3-(3-hydroxyphenyl)propanoate

(2S)-2-Ammonio-3-(3-hydroxyphenyl)propanoate

C9H11NO3 (181.0739)


   

(R)-3-AMINO-3-(2-HYDROXYPHENYL)PROPANOIC ACID

(R)-3-AMINO-3-(2-HYDROXYPHENYL)PROPANOIC ACID

C9H11NO3 (181.0739)


   

3-(4-Nitrophenyl)-1-propanol

3-(4-Nitrophenyl)-1-propanol

C9H11NO3 (181.0739)


   

2-Methoxy-6-(methylamino)benzoic acid

2-Methoxy-6-(methylamino)benzoic acid

C9H11NO3 (181.0739)


   

N-METHYL-4-(METHYLTHIO)BENZAMIDE

N-METHYL-4-(METHYLTHIO)BENZAMIDE

C9H11NOS (181.0561)


   

5-METHYL-4,5,6,7-TETRAHYDROBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID

5-METHYL-4,5,6,7-TETRAHYDROBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID

C9H11NO3 (181.0739)


   

3-ACETYL-2,6-DIMETHOXYPYRIDINE

3-ACETYL-2,6-DIMETHOXYPYRIDINE

C9H11NO3 (181.0739)


   

Ethyl (4-oxo-1(4H)-pyridinyl)acetate

Ethyl (4-oxo-1(4H)-pyridinyl)acetate

C9H11NO3 (181.0739)


   

2-Methyl-5-nitrophenylboronic acid

2-Methyl-5-nitrophenylboronic acid

C7H8BNO4 (181.0546)


   

6-METHYL-2,3-PYRIDINEDICARBOXYLIC ACID

6-METHYL-2,3-PYRIDINEDICARBOXYLIC ACID

C8H7NO4 (181.0375)


   

3-amino-5-nitrobenzamide

3-amino-5-nitrobenzamide

C7H7N3O3 (181.0487)


   

4-Chloro-5,6-diMethyl-7H-pyrrolo[2,3-d]pyriMidine

4-Chloro-5,6-diMethyl-7H-pyrrolo[2,3-d]pyriMidine

C8H8ClN3 (181.0407)


   

2-(2-hydroxyethylamino)benzoic acid

2-(2-hydroxyethylamino)benzoic acid

C9H11NO3 (181.0739)


   

7-CHLORO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE HYDROCHLORIDE

7-CHLORO-2,3,4,5-TETRAHYDRO-1H-BENZO[B]AZEPINE HYDROCHLORIDE

C10H12ClN (181.0658)


   

(4-chlorophenyl)(cyclopropyl)methylamine

(4-chlorophenyl)(cyclopropyl)methylamine

C10H12ClN (181.0658)


   

2,6-Dimethyl-4-nitroanisole

2,6-Dimethyl-4-nitroanisole

C9H11NO3 (181.0739)


   

Benzoic acid,4-methyl-2-nitro-

Benzoic acid,4-methyl-2-nitro-

C8H7NO4 (181.0375)


   

1H-PYRROLE-2-PROPANOIC ACID, .BETA.-OXO-, ETHYL ESTER

1H-PYRROLE-2-PROPANOIC ACID, .BETA.-OXO-, ETHYL ESTER

C9H11NO3 (181.0739)


   

1-NAPHTHALENECARBONYL CYANIDE

1-NAPHTHALENECARBONYL CYANIDE

C12H7NO (181.0528)


   

2-(2-Chlorophenyl)pyrrolidine

2-(2-Chlorophenyl)pyrrolidine

C10H12ClN (181.0658)


   

3-Methoxy-4-nitrobenzaldehyde

3-Methoxy-4-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

4-Chloro-6-methyl-5-(2-propynyl)-2-pyrimidinamine

4-Chloro-6-methyl-5-(2-propynyl)-2-pyrimidinamine

C8H8ClN3 (181.0407)


   

4-chloro-1-methylindazol-3-amine

4-chloro-1-methylindazol-3-amine

C8H8ClN3 (181.0407)


   

3-cyclopropyl-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

3-cyclopropyl-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

C8H11N3S (181.0674)


   

L-Tyrosine(15N)

L-Tyrosine(15N)

C9H11NO3 (181.0739)


   

2-Amino-6-nitrobenzamide

2-Amino-6-nitrobenzamide

C7H7N3O3 (181.0487)


   

4-pyrimidin-2-ylbenzonitrile

4-pyrimidin-2-ylbenzonitrile

C11H7N3 (181.064)


   

2-Pyrrolidinone, 1-(trifluoroacetyl)- (9CI)

2-Pyrrolidinone, 1-(trifluoroacetyl)- (9CI)

C6H6F3NO2 (181.0351)


   

trimethyl-[2-(1,3-thiazol-2-yl)ethynyl]silane

trimethyl-[2-(1,3-thiazol-2-yl)ethynyl]silane

C8H11NSSi (181.0381)


   

Pyrrolo[1,2-a]pyrazin-1(2H)-one, 3,4-dihydro-7-nitro- (9CI)

Pyrrolo[1,2-a]pyrazin-1(2H)-one, 3,4-dihydro-7-nitro- (9CI)

C7H7N3O3 (181.0487)


   

Pyrrolo[1,2-a]pyrazin-1(2H)-one, 3,4-dihydro-6-nitro- (9CI)

Pyrrolo[1,2-a]pyrazin-1(2H)-one, 3,4-dihydro-6-nitro- (9CI)

C7H7N3O3 (181.0487)


   

3-CARBOXY-4-METHYL-MORPHOLINE HCL

3-CARBOXY-4-METHYL-MORPHOLINE HCL

C6H12ClNO3 (181.0506)


   

6-methoxy-3,4-dihydro-2H-1,3-benzothiazine

6-methoxy-3,4-dihydro-2H-1,3-benzothiazine

C9H11NOS (181.0561)


   

3-Amino-5-carboxylphenylboronic acid

3-Amino-5-carboxylphenylboronic acid

C7H8BNO4 (181.0546)


   

PROPANOIC ACID, 2-METHYL-2-(2-PYRIDINYLOXY)-

PROPANOIC ACID, 2-METHYL-2-(2-PYRIDINYLOXY)-

C9H11NO3 (181.0739)


   

PROPANOIC ACID, 2-METHYL-2-(4-PYRIDINYLOXY)-

PROPANOIC ACID, 2-METHYL-2-(4-PYRIDINYLOXY)-

C9H11NO3 (181.0739)


   

5-Methoxy-2-nitrobenzaldehyde

5-Methoxy-2-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

methyl 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylate

methyl 5-formyl-2,4-dimethyl-1h-pyrrole-3-carboxylate

C9H11NO3 (181.0739)


   

2-amino-4-ethoxybenzoic acid

2-amino-4-ethoxybenzoic acid

C9H11NO3 (181.0739)


   

3-(2,6-Difluorophenyl)-3-oxopropanenitrile

3-(2,6-Difluorophenyl)-3-oxopropanenitrile

C9H5F2NO (181.0339)


   

3-(2,5-Difluorophenyl)-3-oxopropanenitrile

3-(2,5-Difluorophenyl)-3-oxopropanenitrile

C9H5F2NO (181.0339)


   

4-(AMINOMETHYL)-3-METHOXY BENZOIC ACID

4-(AMINOMETHYL)-3-METHOXY BENZOIC ACID

C9H11NO3 (181.0739)


   

Ethyl 2-carboxypyridine-3-carboxylate

Ethyl 2-carboxypyridine-3-carboxylate

C8H7NO4 (181.0375)


   

(6-Chloro-1H-benzo[d]imidazol-2-yl)methanamine

(6-Chloro-1H-benzo[d]imidazol-2-yl)methanamine

C8H8ClN3 (181.0407)


   

4-isopropyl-2-nitrophenol

4-isopropyl-2-nitrophenol

C9H11NO3 (181.0739)


   

methyl 4-formyl-2,5-dimethyl-1h-pyrrole-3-carboxylate

methyl 4-formyl-2,5-dimethyl-1h-pyrrole-3-carboxylate

C9H11NO3 (181.0739)


   

2-methoxy-6-nitrobenzaldehyde

2-methoxy-6-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

N-[1-(1,3-benzodioxol-5-yl)ethyl]hydroxylamine

N-[1-(1,3-benzodioxol-5-yl)ethyl]hydroxylamine

C9H11NO3 (181.0739)


   

N-(4-Chlorobenzyl)cyclopropanamine

N-(4-Chlorobenzyl)cyclopropanamine

C10H12ClN (181.0658)


   

3-Methoxy-2-nitrobenzaldehyde

3-Methoxy-2-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

3-Acetamido thioanisole

3-Acetamido thioanisole

C9H11NOS (181.0561)


   

2-Methylthioadenine

1H-Purin-6-amine,2-(methylthio)-

C6H7N5S (181.0422)


   

ethyl 1-methyl-alpha-oxo-1H-pyrrole-2-acetate

ethyl 1-methyl-alpha-oxo-1H-pyrrole-2-acetate

C9H11NO3 (181.0739)


   

METHYL 4-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]OXY)BENZENECARBOXYLATE

METHYL 4-([3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]OXY)BENZENECARBOXYLATE

C8H11N3S (181.0674)


   

(S)-Methyl morpholine-3-carboxylate hydrobromide

(S)-Methyl morpholine-3-carboxylate hydrobromide

C6H12ClNO3 (181.0506)


   

(3S,4S)-4-(Furan-2-yl)pyrrolidine-3-carboxylic acid

(3S,4S)-4-(Furan-2-yl)pyrrolidine-3-carboxylic acid

C9H11NO3 (181.0739)


   

[6-(Methoxycarbonyl)-3-pyridinyl]boronic acid

[6-(Methoxycarbonyl)-3-pyridinyl]boronic acid

C7H8BNO4 (181.0546)


   

2-ISOPROPYL-6-NITROPHENOL

2-ISOPROPYL-6-NITROPHENOL

C9H11NO3 (181.0739)


   

4-Nitrophenylacetic acid

4-Nitrophenylacetic acid

C8H7NO4 (181.0375)


   

2-Hydroxy-D-phenylalanine

2-Hydroxy-D-phenylalanine

C9H11NO3 (181.0739)


   

(2S,3S)-3-Amino-2-hydroxy-3-phenyl-propionic acid

(2S,3S)-3-Amino-2-hydroxy-3-phenyl-propionic acid

C9H11NO3 (181.0739)


   

ETHYL 5-CYCLOPROPYLISOXAZOLE-3-CARBOXYLATE

ETHYL 5-CYCLOPROPYLISOXAZOLE-3-CARBOXYLATE

C9H11NO3 (181.0739)


   

1-(3-Hydroxy-2-nitrophenyl)ethanone

1-(3-Hydroxy-2-nitrophenyl)ethanone

C8H7NO4 (181.0375)


   

(2R,3S)-3-Amino-3-phenyl-1,2-propanediol

(2R,3S)-3-Amino-3-phenyl-1,2-propanediol

C9H11NO3 (181.0739)


   

3-(2-Formyl-4-methyl-1H-pyrrol-3-yl)-propionic acid

3-(2-Formyl-4-methyl-1H-pyrrol-3-yl)-propionic acid

C9H11NO3 (181.0739)


   

1-(2-Hydroxy-5-nitrophenyl)ethanone

1-(2-Hydroxy-5-nitrophenyl)ethanone

C8H7NO4 (181.0375)


   

Ethyl 2-(hydroxyMethyl)pyridine-4-carboxylate

Ethyl 2-(hydroxyMethyl)pyridine-4-carboxylate

C9H11NO3 (181.0739)


   

8-chloro-4-methyl-1,2,3,4-tetrahydroisoquinoline

8-chloro-4-methyl-1,2,3,4-tetrahydroisoquinoline

C10H12ClN (181.0658)


   

2-(4-methoxyphenoxy)acetamide

2-(4-methoxyphenoxy)acetamide

C9H11NO3 (181.0739)


   

Ethyl 2-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylate

Ethyl 2-Methyl-6-oxo-1,6-dihydropyridine-3-carboxylate

C9H11NO3 (181.0739)


   

Hydrazinecarbothioamide,N-(2-methylphenyl)-

Hydrazinecarbothioamide,N-(2-methylphenyl)-

C8H11N3S (181.0674)


   

7-chloro-2,3,4,5-tetrahydro-1H-3-benzazepine

7-chloro-2,3,4,5-tetrahydro-1H-3-benzazepine

C10H12ClN (181.0658)


   

2,4-Pyridinecarboxylic acid, 4-methyl ester

2,4-Pyridinecarboxylic acid, 4-methyl ester

C8H7NO4 (181.0375)


   

N-Hydroxymethyl-3,4,5,6-tetrahydrophthalimide

N-Hydroxymethyl-3,4,5,6-tetrahydrophthalimide

C9H11NO3 (181.0739)


   

p-Hydroxyphenyl dimethylcarbamate

p-Hydroxyphenyl dimethylcarbamate

C9H11NO3 (181.0739)


   

2-CARBOXY-4-METHYL-MORPHOLINE HCL

2-CARBOXY-4-METHYL-MORPHOLINE HCL

C6H12ClNO3 (181.0506)


   

3,5-Dimethoxybenzamide

3,5-Dimethoxybenzamide

C9H11NO3 (181.0739)


   

dichloro(diisopropylamino)borane

dichloro(diisopropylamino)borane

C6H14BCl2N (181.0596)


   

2-Hydroxy-6-methylpyridine-3-carboxylic acid ethyl ester

2-Hydroxy-6-methylpyridine-3-carboxylic acid ethyl ester

C9H11NO3 (181.0739)


   

5-AMINO-2-ETHOXYBENZOIC ACID

5-AMINO-2-ETHOXYBENZOIC ACID

C9H11NO3 (181.0739)


   

5-HYDROXYPIPERIDINE-3-CARBOXYLIC ACID HYDROCHLORIDE

5-HYDROXYPIPERIDINE-3-CARBOXYLIC ACID HYDROCHLORIDE

C6H12ClNO3 (181.0506)


   

dl-methionine sulfone

dl-methionine sulfone

C5H11NO4S (181.0409)


   

3-Amino-3-(2-hydroxyphenyl)propionic acid

3-Amino-3-(2-hydroxyphenyl)propionic acid

C9H11NO3 (181.0739)


   

ETHYL2-ETHOXY-2-IMINOACETATEHYDROCHLORIDE

ETHYL2-ETHOXY-2-IMINOACETATEHYDROCHLORIDE

C6H12ClNO3 (181.0506)


   

1-Methoxy-2,5-dimethyl-3-nitrobenzene

1-Methoxy-2,5-dimethyl-3-nitrobenzene

C9H11NO3 (181.0739)


   

5-Methoxy-1,2-dimethyl-3-nitrobenzene

5-Methoxy-1,2-dimethyl-3-nitrobenzene

C9H11NO3 (181.0739)


   

Methyl 3-amino-5-methoxybenzoate

Methyl 3-amino-5-methoxybenzoate

C9H11NO3 (181.0739)


   

5,6-Difluoro-1H-indole-3-carbaldehyde

5,6-Difluoro-1H-indole-3-carbaldehyde

C9H5F2NO (181.0339)


   

ETHYL 5-(HYDROXYMETHYL)PICOLINATE

ETHYL 5-(HYDROXYMETHYL)PICOLINATE

C9H11NO3 (181.0739)


   

Ethyl 5-hydroxy-2-methylnicotinate

Ethyl 5-hydroxy-2-methylnicotinate

C9H11NO3 (181.0739)


   

3-Morpholinylacetic acid hydrochloride (1:1)

3-Morpholinylacetic acid hydrochloride (1:1)

C6H12ClNO3 (181.0506)


   

1-(2-Methoxyethyl)-4-nitrobenzene

1-(2-Methoxyethyl)-4-nitrobenzene

C9H11NO3 (181.0739)


   

(4-ISOPROPYL-3-METHYL-PHENOXY)-ACETICACID

(4-ISOPROPYL-3-METHYL-PHENOXY)-ACETICACID

C9H11NO3 (181.0739)


   

Methyl morpholine-3-carboxylate hydrochloride

Methyl morpholine-3-carboxylate hydrochloride

C6H12ClNO3 (181.0506)


   

Pyrrolidine, 2-methyl-1-(trifluoroacetyl)- (8CI)

Pyrrolidine, 2-methyl-1-(trifluoroacetyl)- (8CI)

C7H10F3NO (181.0714)


   

5-MORPHOLIN-4-YL-FURAN-2-CARBALDEHYDE

5-MORPHOLIN-4-YL-FURAN-2-CARBALDEHYDE

C9H11NO3 (181.0739)


   

3-(2-nitrophenyl)propan-1-ol

3-(2-nitrophenyl)propan-1-ol

C9H11NO3 (181.0739)


   

2-(2-pyridyl)ethylthiourea

2-(2-pyridyl)ethylthiourea

C8H11N3S (181.0674)


   

5-(2-AMINO-ETHYL)-2-HYDROXY-BENZOICACID

5-(2-AMINO-ETHYL)-2-HYDROXY-BENZOICACID

C9H11NO3 (181.0739)


   

2-Methyl-3-nitrobenzoic acid

2-Methyl-3-nitrobenzoic acid

C8H7NO4 (181.0375)


   

triethylammonium bromide

triethylammonium bromide

C6H16BrN (181.0466)


   

3-Methyl-4-nitrobenzoic acid

3-Methyl-4-nitrobenzoic acid

C8H7NO4 (181.0375)


   

2-Nitro-5-methylbenzoic acid

2-Nitro-5-methylbenzoic acid

C8H7NO4 (181.0375)


   

3-Methyl-2-nitrobenzoic acid

3-Methyl-2-nitrobenzoic acid

C8H7NO4 (181.0375)


   

2-methoxy-5-nitrobenzaldehyde

2-methoxy-5-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

2-AMINO-4-METHOXYPHENYLACETIC ACID

2-AMINO-4-METHOXYPHENYLACETIC ACID

C9H11NO3 (181.0739)


   

3-Propoxypyridine-2-carboxylic Acid

3-Propoxypyridine-2-carboxylic Acid

C9H11NO3 (181.0739)


   

1-methyl-3,4-dihydroisoquinoline hydrochloride

1-methyl-3,4-dihydroisoquinoline hydrochloride

C10H12ClN (181.0658)


   

N-(2-Chlorobenzyl)cyclopropanamine

N-(2-Chlorobenzyl)cyclopropanamine

C10H12ClN (181.0658)


   

5-acetyl-2,4-dimethyl-1h-pyrrole-3-carboxylic acid

5-acetyl-2,4-dimethyl-1h-pyrrole-3-carboxylic acid

C9H11NO3 (181.0739)


   

2-Methyl-4-nitrobenzoic acid

2-Methyl-4-nitrobenzoic acid

C8H7NO4 (181.0375)


   

2-Amino-5,6-difluoroquinazoline

2-Amino-5,6-difluoroquinazoline

C8H5F2N3 (181.0452)


   

4-AMINO-TETRAHYDRO-PYRAN-4-CARBOXYLIC ACID HCL

4-AMINO-TETRAHYDRO-PYRAN-4-CARBOXYLIC ACID HCL

C6H12ClNO3 (181.0506)


   

5-Methyl-2,3-pyridinedicarboxylic acid

5-Methyl-2,3-pyridinedicarboxylic acid

C8H7NO4 (181.0375)


   

Benzene,1-methoxy-2,5-dimethyl-4-nitro-

Benzene,1-methoxy-2,5-dimethyl-4-nitro-

C9H11NO3 (181.0739)


   

4-Pyridinepropanoic acid, 2-methoxy-

4-Pyridinepropanoic acid, 2-methoxy-

C9H11NO3 (181.0739)


   

8-chloro-2-ethylimidazo[1,2-a]pyrazine

8-chloro-2-ethylimidazo[1,2-a]pyrazine

C8H8ClN3 (181.0407)


   

7-Chloro-2,5-diMethylpyrazolo[1,5-a]pyriMidine

7-Chloro-2,5-diMethylpyrazolo[1,5-a]pyriMidine

C8H8ClN3 (181.0407)


   

(S)-2-(4-chlorophenyl) pyrrolidine

(S)-2-(4-chlorophenyl) pyrrolidine

C10H12ClN (181.0658)


   

(R)-2-(4-chlorophenyl)pyrrolidine

(R)-2-(4-chlorophenyl)pyrrolidine

C10H12ClN (181.0658)


   

Methyl 2-amino-3-methoxybenzoate

Methyl 2-amino-3-methoxybenzoate

C9H11NO3 (181.0739)


   

4-Methyl-2-nitrophenylboronic acid

4-Methyl-2-nitrophenylboronic acid

C7H8BNO4 (181.0546)


   

4-acetamido-3-nitropyridine

4-acetamido-3-nitropyridine

C7H7N3O3 (181.0487)


   

N-(3-Nitro-2-pyridinyl)-acetamide

N-(3-Nitro-2-pyridinyl)-acetamide

C7H7N3O3 (181.0487)


   

Methyl aminolevulinate hydrochloride

Methyl aminolevulinate hydrochloride

C6H12ClNO3 (181.0506)


C1420 - Photosensitizing Agent

   

2-amino-4-methoxy-3-methylbenzoic acid

2-amino-4-methoxy-3-methylbenzoic acid

C9H11NO3 (181.0739)


   

METHYL3-FORMYL-4,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLATE

METHYL3-FORMYL-4,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLATE

C9H11NO3 (181.0739)


   

2,3-Difluorobenzoylacetonitrile

2,3-Difluorobenzoylacetonitrile

C9H5F2NO (181.0339)


   

1-amino-1-benzylthiourea

1-amino-1-benzylthiourea

C8H11N3S (181.0674)


   

2-(4-methoxyphenyl)ethanethioamide

2-(4-methoxyphenyl)ethanethioamide

C9H11NOS (181.0561)


   

(S)-1-(3-NITROPHENYL)PROPAN-1-OL

(S)-1-(3-NITROPHENYL)PROPAN-1-OL

C9H11NO3 (181.0739)


   

Benzaldehyde,2,4-dimethoxy-, oxime

Benzaldehyde,2,4-dimethoxy-, oxime

C9H11NO3 (181.0739)


   

2-Amino-6-hydroxymethyl-purine-8-methanol

2-Amino-6-hydroxymethyl-purine-8-methanol

C6H7N5O2 (181.06)


   

Benzamide,2,3-dimethoxy-

Benzamide,2,3-dimethoxy-

C9H11NO3 (181.0739)


   

Styramate

1,2-Ethanediol,1-phenyl-, 2-carbamate

C9H11NO3 (181.0739)


M - Musculo-skeletal system > M03 - Muscle relaxants > M03B - Muscle relaxants, centrally acting agents > M03BA - Carbamic acid esters C78281 - Agent Affecting Musculoskeletal System > C29696 - Muscle Relaxant C78272 - Agent Affecting Nervous System > C264 - Anticonvulsant Agent

   

methyl 2-(4-aminophenoxy)acetate

methyl 2-(4-aminophenoxy)acetate

C9H11NO3 (181.0739)


   

3-Pyridinecarboxylicacid, 1,6-dihydro-1-methyl-6-oxo-, ethyl ester

3-Pyridinecarboxylicacid, 1,6-dihydro-1-methyl-6-oxo-, ethyl ester

C9H11NO3 (181.0739)


   

ETHYL 6-(HYDROXYMETHYL)NICOTINATE

ETHYL 6-(HYDROXYMETHYL)NICOTINATE

C9H11NO3 (181.0739)


   

H-cis-Hyp-OMe hydrochloride

H-cis-Hyp-OMe hydrochloride

C6H12ClNO3 (181.0506)


   

3-Methyl-5-nitrobenzoic acid

3-Methyl-5-nitrobenzoic acid

C8H7NO4 (181.0375)


   

N-(3-Chlorobenzyl)cyclopropanamine

N-(3-Chlorobenzyl)cyclopropanamine

C10H12ClN (181.0658)


   

2-amino-3-(4-hydroxyphenyl)propanoic acid

2-amino-3-(4-hydroxyphenyl)propanoic acid

C9H11NO3 (181.0739)


   

6-Isopropoxynicotinic acid

6-Isopropoxynicotinic acid

C9H11NO3 (181.0739)


   

methyl 2-cyano-2-(oxan-4-ylidene)acetate

methyl 2-cyano-2-(oxan-4-ylidene)acetate

C9H11NO3 (181.0739)


   

4-(Dimethylamino)-2-hydroxybenzoic acid

4-(Dimethylamino)-2-hydroxybenzoic acid

C9H11NO3 (181.0739)


   

(2R,3S)-3-Phenylisoserine

(2R,3S)-3-Phenylisoserine

C9H11NO3 (181.0739)


   

3-Pyridinecarboxylicacid,2-methoxy-4,6-dimethyl-

3-Pyridinecarboxylicacid,2-methoxy-4,6-dimethyl-

C9H11NO3 (181.0739)


   

1H,4H-Bis[1,2,5]oxadiazolo[3,4-b:3,4-e]pyrazin-4-amine(9CI)

1H,4H-Bis[1,2,5]oxadiazolo[3,4-b:3,4-e]pyrazin-4-amine(9CI)

C4H3N7O2 (181.0348)


   

3-(3,5-Difluorophenyl)-3-oxopropanenitrile

3-(3,5-Difluorophenyl)-3-oxopropanenitrile

C9H5F2NO (181.0339)


   

2-(2-aminoethoxy)benzoic acid

2-(2-aminoethoxy)benzoic acid

C9H11NO3 (181.0739)


   

DL-4-Methoxyphenylglycine

DL-4-Methoxyphenylglycine

C9H11NO3 (181.0739)


   

2-(3-methoxyphenyl)ethanethioamide

2-(3-methoxyphenyl)ethanethioamide

C9H11NOS (181.0561)


   

3-ETHOXYBENZENE-1-CARBOTHIOAMIDE

3-ETHOXYBENZENE-1-CARBOTHIOAMIDE

C9H11NOS (181.0561)


   

2-ethoxybenzenecarbothioamide

2-ethoxybenzenecarbothioamide

C9H11NOS (181.0561)


   

METHYL 4-ACETYL-1-METHYL-1H-PYRROLE-2-CARBOXYLATE

METHYL 4-ACETYL-1-METHYL-1H-PYRROLE-2-CARBOXYLATE

C9H11NO3 (181.0739)


   

3-(4-NITRO-1H-IMIDAZOL-1-YL)CYCLOBUTANONE

3-(4-NITRO-1H-IMIDAZOL-1-YL)CYCLOBUTANONE

C7H7N3O3 (181.0487)


   

5-nitro-2,3-dihydro-1,4-benzodioxine

5-nitro-2,3-dihydro-1,4-benzodioxine

C8H7NO4 (181.0375)


   

ethyl 2-methyl-6-oxo-1H-pyridine-4-carboxylate

ethyl 2-methyl-6-oxo-1H-pyridine-4-carboxylate

C9H11NO3 (181.0739)


   

3-Methoxy Acetaminophen

3-Methoxy Acetaminophen

C9H11NO3 (181.0739)


   

p-Nitrophenylurea

p-Nitrophenylurea

C7H7N3O3 (181.0487)


   

Methyl morpholine-2-carboxylate hydrochloride

Methyl morpholine-2-carboxylate hydrochloride

C6H12ClNO3 (181.0506)


   

2-Methyl-3-nitrophenylboronic acid

2-Methyl-3-nitrophenylboronic acid

C7H8BNO4 (181.0546)


   

1-(3-nitrophenyl)propan-1-ol

1-(3-nitrophenyl)propan-1-ol

C9H11NO3 (181.0739)


   

L-4-Hydroxyphenylalanine-3-13C

L-4-Hydroxyphenylalanine-3-13C

C9H11NO3 (181.0739)


   

2-Homomorpholinecarboxylic Acid Hydrochloride

2-Homomorpholinecarboxylic Acid Hydrochloride

C6H12ClNO3 (181.0506)


   

UNII:45KGG1D4BI

UNII:45KGG1D4BI

C9H11NO3 (181.0739)


   

4-(HYDROXYMETHYL)-3,4-DIHYDRO-2H-PYRANO[3,2-B]PYRIDIN-4-OL

4-(HYDROXYMETHYL)-3,4-DIHYDRO-2H-PYRANO[3,2-B]PYRIDIN-4-OL

C9H11NO3 (181.0739)


   

(R)-6-chloro-2-Methyl-1,2,3,4-tetrahydroquinoline

(R)-6-chloro-2-Methyl-1,2,3,4-tetrahydroquinoline

C10H12ClN (181.0658)


   

methyl 2-amino-4-(hydroxymethyl)benzoate

methyl 2-amino-4-(hydroxymethyl)benzoate

C9H11NO3 (181.0739)


   

ethyl 3-amino-2-hydroxybenzoate

ethyl 3-amino-2-hydroxybenzoate

C9H11NO3 (181.0739)


   

Methyl 4-amino-3-methoxybenzoate

Methyl 4-amino-3-methoxybenzoate

C9H11NO3 (181.0739)


   

5-chloro-1,2,3,4-tetrahydronaphthalen-1-amine

5-chloro-1,2,3,4-tetrahydronaphthalen-1-amine

C10H12ClN (181.0658)


   

7-Chloro-1,2,3,4-tetrahydro-naphthalen-2-ylamine

7-Chloro-1,2,3,4-tetrahydro-naphthalen-2-ylamine

C10H12ClN (181.0658)


   

4-(Methoxycarbonyl)nicotinic acid

4-(Methoxycarbonyl)nicotinic acid

C8H7NO4 (181.0375)


   

Carbamic acid,N-(3-hydroxyphenyl)-, ethyl ester

Carbamic acid,N-(3-hydroxyphenyl)-, ethyl ester

C9H11NO3 (181.0739)


   

(2S,4S)-BOC-4-CYCLOHEXYL-PYRROLIDINE-2-CARBOXYLICACID

(2S,4S)-BOC-4-CYCLOHEXYL-PYRROLIDINE-2-CARBOXYLICACID

C6H12ClNO3 (181.0506)


   

aminoterephthalic acid

aminoterephthalic acid

C8H7NO4 (181.0375)


   

5-Aminoisophthalic acid

5-Aminoisophthalic acid

C8H7NO4 (181.0375)


   

3-nitro-4-anisaldehyde

3-nitro-4-anisaldehyde

C8H7NO4 (181.0375)


   

1H-Pyrrole-2-carboxylicacid, 4-acetyl-3,5-dimethyl-

1H-Pyrrole-2-carboxylicacid, 4-acetyl-3,5-dimethyl-

C9H11NO3 (181.0739)


   

2-hydroxy-3-methyl-5-nitrobenzaldehyde

2-hydroxy-3-methyl-5-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

6-(Methoxycarbonyl)nicotinic acid

6-(Methoxycarbonyl)nicotinic acid

C8H7NO4 (181.0375)


   

N-HYDROXY-4-NITRO-BENZAMIDINE

N-HYDROXY-4-NITRO-BENZAMIDINE

C7H7N3O3 (181.0487)


   

5-(1-PYRROLIDINYL)-2-THIOPHENECARBALDEHYDE

5-(1-PYRROLIDINYL)-2-THIOPHENECARBALDEHYDE

C9H11NOS (181.0561)


   

(5-FORMYL-2,4-DIMETHYL-1H-PYRROL-3-YL)-ACETIC ACID

(5-FORMYL-2,4-DIMETHYL-1H-PYRROL-3-YL)-ACETIC ACID

C9H11NO3 (181.0739)


   

2-Methyl-6-nitrobenzoic acid

2-Methyl-6-nitrobenzoic acid

C8H7NO4 (181.0375)


   

N,N,N-Trimethyl-1-propanaminium bromide

N,N,N-Trimethyl-1-propanaminium bromide

C6H16BrN (181.0466)


   

4-Cyclopropyl-1-fluoro-2-nitrobenzene

4-Cyclopropyl-1-fluoro-2-nitrobenzene

C9H8FNO2 (181.0539)


   

(2-(Methoxycarbonyl)pyridin-4-yl)boronic acid

(2-(Methoxycarbonyl)pyridin-4-yl)boronic acid

C7H8BNO4 (181.0546)


   

(3R)-3-Amino-3-(3-hydroxyphenyl)propanoic acid

(3R)-3-Amino-3-(3-hydroxyphenyl)propanoic acid

C9H11NO3 (181.0739)


   

(S)-3-AMINO-3-(2-HYDROXYPHENYL)PROPANOIC ACID

(S)-3-AMINO-3-(2-HYDROXYPHENYL)PROPANOIC ACID

C9H11NO3 (181.0739)


   

5-Chloro-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-amine

5-Chloro-2-methyl-1H-pyrrolo[2,3-b]pyridin-3-amine

C8H8ClN3 (181.0407)


   

[1,7]Naphthyridin-8-ylamine hydrochloride

[1,7]Naphthyridin-8-ylamine hydrochloride

C8H8ClN3 (181.0407)


   

(2R,3S,4R,5R)-2-deuterio-2,3,4,5,6-pentahydroxyhexanal

(2R,3S,4R,5R)-2-deuterio-2,3,4,5,6-pentahydroxyhexanal

C6H11DO6 (181.0697)


   

2-azanyl-3-(4-hydroxyphenyl)propanoic acid

2-azanyl-3-(4-hydroxyphenyl)propanoic acid

C9H11NO3 (181.0739)


   

3-(Cyanomethyl)-1H-indole-4-carbonitrile

3-(Cyanomethyl)-1H-indole-4-carbonitrile

C11H7N3 (181.064)


   

Acetyleneboronic acid MIDA ester,Acetynylboronic acid MIDA ester,Ethyneboronic acid MIDA ester

Acetyleneboronic acid MIDA ester,Acetynylboronic acid MIDA ester,Ethyneboronic acid MIDA ester

C7H8BNO4 (181.0546)


   

N-(5-Nitro-2-pyridinyl)acetamide

N-(5-Nitro-2-pyridinyl)acetamide

C7H7N3O3 (181.0487)


   

Ethyl 2-methoxyisonicotinate

Ethyl 2-methoxyisonicotinate

C9H11NO3 (181.0739)


   

2-aminoisophthalicacid

2-aminoisophthalicacid

C8H7NO4 (181.0375)


   

3-fluoro-4-(2-hydroxyethoxy)benzonitrile

3-fluoro-4-(2-hydroxyethoxy)benzonitrile

C9H8FNO2 (181.0539)


   

2,3-dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic acid

2,3-dihydro-[1,4]dioxino[2,3-c]pyridine-7-carboxylic acid

C8H7NO4 (181.0375)


   

4-Methoxy-2-nitrobenzaldehyde

4-Methoxy-2-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

5-(Methoxycarbonyl)-2-pyridinecarboxylic acid

5-(Methoxycarbonyl)-2-pyridinecarboxylic acid

C8H7NO4 (181.0375)


   

1-(2-hydroxy-4-nitrophenyl)ethanone

1-(2-hydroxy-4-nitrophenyl)ethanone

C8H7NO4 (181.0375)


   

Methyl 4-nitrobenzoate

Methyl 4-nitrobenzoate

C8H7NO4 (181.0375)


   

1-(4-CHLOROPHENYL)CYCLOBUTANAMINE

1-(4-CHLOROPHENYL)CYCLOBUTANAMINE

C10H12ClN (181.0658)


   

2-HYDROXY-1-(3-NITROPHENYL)-1-ETHANONE

2-HYDROXY-1-(3-NITROPHENYL)-1-ETHANONE

C8H7NO4 (181.0375)


   

2-Hydroxy-1-(4-nitrophenyl)-1-ethanone

2-Hydroxy-1-(4-nitrophenyl)-1-ethanone

C8H7NO4 (181.0375)


   

H-Gly-Ala-NH2 · HCl

H-Gly-Ala-NH2 · HCl

C5H12ClN3O2 (181.0618)


   

(R)-2-(2-chlorophenyl)pyrrolidine

(R)-2-(2-chlorophenyl)pyrrolidine

C10H12ClN (181.0658)


   

3-(Methoxycarbonyl)isonicotinic acid

3-(Methoxycarbonyl)isonicotinic acid

C8H7NO4 (181.0375)


   

2-AMINO-4-(TERT-BUTYL)-1,3-THIAZOLE-5-CARBONITRILE

2-AMINO-4-(TERT-BUTYL)-1,3-THIAZOLE-5-CARBONITRILE

C8H11N3S (181.0674)


   

7,8-Difluoro-4-hydroxyquinoline

7,8-Difluoro-4-hydroxyquinoline

C9H5F2NO (181.0339)


   

[5-(Methoxycarbonyl)-2-pyridinyl]boronic acid

[5-(Methoxycarbonyl)-2-pyridinyl]boronic acid

C7H8BNO4 (181.0546)


   

3-(2,4-Difluorophenyl)-3-oxopropanenitrile

3-(2,4-Difluorophenyl)-3-oxopropanenitrile

C9H5F2NO (181.0339)


   

4-HYDROXY-6,7-DIFLUOROQUINOLINE

4-HYDROXY-6,7-DIFLUOROQUINOLINE

C9H5F2NO (181.0339)


   

5H-Indeno(1,2-b)pyridin-5-one

5H-Indeno(1,2-b)pyridin-5-one

C12H7NO (181.0528)


   

2,2-BIPYRIDINE-5-CARBONITRILE

2,2-BIPYRIDINE-5-CARBONITRILE

C11H7N3 (181.064)


   

3-Nitrophenylaceticacid

3-Nitrophenylacetic acid

C8H7NO4 (181.0375)


   

N-(5-NITROPYRIDIN-2-YL)GUANIDINE

N-(5-NITROPYRIDIN-2-YL)GUANIDINE

C6H7N5O2 (181.06)


   

tans-4-Hydroxy-D-proline methyl ester hydrochloride

tans-4-Hydroxy-D-proline methyl ester hydrochloride

C6H12ClNO3 (181.0506)


   

1-[1-(4-Chlorophenyl)cyclopropyl]methanamine

1-[1-(4-Chlorophenyl)cyclopropyl]methanamine

C10H12ClN (181.0658)


   

3-(4-Chlorophenyl)pyrrolidine

3-(4-Chlorophenyl)pyrrolidine

C10H12ClN (181.0658)


   

4-fluoro-alpha-methylbenzyl isothiocyanate

4-fluoro-alpha-methylbenzyl isothiocyanate

C9H8FNS (181.0361)


   

2-(Trimethylsilyl)ethanesulfonamide

2-(Trimethylsilyl)ethanesulfonamide

C5H15NO2SSi (181.0593)


   

3-(2-Chlorophenyl)pyrrolidine

3-(2-Chlorophenyl)pyrrolidine

C10H12ClN (181.0658)


   

4-Cyanobenzenecarboximidamide hydrochloride (1:1)

4-Cyanobenzenecarboximidamide hydrochloride (1:1)

C8H8ClN3 (181.0407)


   

2-Nitrophenylacetic acid

(2-Nitrophenyl)acetic acid

C8H7NO4 (181.0375)


   

1-propylene-3-methylimidazolium hexafluorophosphate

1-propylene-3-methylimidazolium hexafluorophosphate

C8H11N3S (181.0674)


   

(S)-2-(2-CHLOROPHENYL)PYRROLIDINE

(S)-2-(2-CHLOROPHENYL)PYRROLIDINE

C10H12ClN (181.0658)


   
   

2-aminopentanediamide,hydrochloride

2-aminopentanediamide,hydrochloride

C5H12ClN3O2 (181.0618)


   

2,2,2-TRIFLUORO-1-(PIPERIDIN-4-YL)ETHANONE

2,2,2-TRIFLUORO-1-(PIPERIDIN-4-YL)ETHANONE

C7H10F3NO (181.0714)


   

4-CHLORO-1,6-DIMETHYL-1H-IMIDAZO[4,5-C]PYRIDINE

4-CHLORO-1,6-DIMETHYL-1H-IMIDAZO[4,5-C]PYRIDINE

C8H8ClN3 (181.0407)


   

6,8-difluoro-1H-quinolin-4-one

6,8-difluoro-1H-quinolin-4-one

C9H5F2NO (181.0339)


   

HOMOQUINOLINIC ACID

HOMOQUINOLINIC ACID

C8H7NO4 (181.0375)


   

Methyl 3-nitrobenzoate

Methyl 3-nitrobenzoate

C8H7NO4 (181.0375)


   

2-hydroxy-3-nitroacetophenone

2-hydroxy-3-nitroacetophenone

C8H7NO4 (181.0375)


   

4-Chloro-5-ethyl-7H-pyrrolo[2,3-d]pyrimidine

4-Chloro-5-ethyl-7H-pyrrolo[2,3-d]pyrimidine

C8H8ClN3 (181.0407)


   

(3R,4R,5S,6S)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol

(3R,4R,5S,6S)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol

C6H11DO6 (181.0697)


   

6-AMINOBENZO[D][1,3]DIOXOLE-5-CARBOXYLIC ACID

6-AMINOBENZO[D][1,3]DIOXOLE-5-CARBOXYLIC ACID

C8H7NO4 (181.0375)


   

6-Cyano-2,2-bipyridine

6-Cyano-2,2-bipyridine

C11H7N3 (181.064)


   

6-chloro-N-methylbenzimidazol-1-amine

6-chloro-N-methylbenzimidazol-1-amine

C8H8ClN3 (181.0407)


   

3-Chloro-6-ethyl-5-methylpyrazine-2-carbonitrile

3-Chloro-6-ethyl-5-methylpyrazine-2-carbonitrile

C8H8ClN3 (181.0407)


   

5-AMINOMETHYL-3-CHLORO-1H-PYRROLO[2,3-C]PYRIDINE

5-AMINOMETHYL-3-CHLORO-1H-PYRROLO[2,3-C]PYRIDINE

C8H8ClN3 (181.0407)


   

3-Methoxy-5-nitrobenzaldehyde

3-Methoxy-5-nitrobenzaldehyde

C8H7NO4 (181.0375)


   

1-(2-CHLOROETHOXY)-1,1,2,3,3,3-HEXAFLUOROPROPANE

1-(2-CHLOROETHOXY)-1,1,2,3,3,3-HEXAFLUOROPROPANE

C10H12ClN (181.0658)


   

4-Methyl-3-nitrobenzoic acid

4-Methyl-3-nitrobenzoic acid

C8H7NO4 (181.0375)


   

2-(3-chlorophenyl)pyrrolidine

2-(3-chlorophenyl)pyrrolidine

C10H12ClN (181.0658)


   

2-aminoterephthalic acid

2-aminoterephthalic acid

C8H7NO4 (181.0375)


   

1-(3-Hydroxy-4-nitrophenyl)-ethanone

1-(3-Hydroxy-4-nitrophenyl)-ethanone

C8H7NO4 (181.0375)


   

4-nitrobenzhydrazide

4-Nitrobenzohydrazide

C7H7N3O3 (181.0487)


   

5-(Methoxycarbonyl)pyridine-3-boronic acid

5-(Methoxycarbonyl)pyridine-3-boronic acid

C7H8BNO4 (181.0546)


   

(2S,4R)-4-HYDROXYPIPERIDINE-2-CARBOXYLIC ACID, HYDROCHLORIDE

(2S,4R)-4-HYDROXYPIPERIDINE-2-CARBOXYLIC ACID, HYDROCHLORIDE

C6H12ClNO3 (181.0506)


   

N-HYDROXY-3-NITROBENZENECARBOXIMIDAMIDE

N-HYDROXY-3-NITROBENZENECARBOXIMIDAMIDE

C7H7N3O3 (181.0487)


   

PYRROLIDINE, 1-(4-CHLOROPHENYL)-

PYRROLIDINE, 1-(4-CHLOROPHENYL)-

C10H12ClN (181.0658)


   

(E)-3-(6-BROMO-1H-INDOL-3-YL)ACRYLICACID

(E)-3-(6-BROMO-1H-INDOL-3-YL)ACRYLICACID

C9H11NOS (181.0561)


   

beta-alanine, N-methyl-N-(methylsulfonyl)-

beta-alanine, N-methyl-N-(methylsulfonyl)-

C5H11NO4S (181.0409)


   

3-methyl phenyl thiosemicarbazide

3-methyl phenyl thiosemicarbazide

C8H11N3S (181.0674)


   

H-Hyp-OMe hydrochloride

H-Hyp-OMe hydrochloride

C6H12ClNO3 (181.0506)


   

2-Amino-3-nitrobenzamide

2-Amino-3-nitrobenzamide

C7H7N3O3 (181.0487)


   

2,3-Dihydro-6-nitro-1,4-benzodioxin

2,3-Dihydro-6-nitro-1,4-benzodioxin

C8H7NO4 (181.0375)


   

1,2-difluoro-4-(2-isocyanatoethenyl)benzene

1,2-difluoro-4-(2-isocyanatoethenyl)benzene

C9H5F2NO (181.0339)


   

Methyl (4S)-4-hydroxy-L-prolinate hydrochloride (1:1)

Methyl (4S)-4-hydroxy-L-prolinate hydrochloride (1:1)

C6H12ClNO3 (181.0506)


   

1H-Benzotriazole,1-(chloromethyl)-5-methyl-(9CI)

1H-Benzotriazole,1-(chloromethyl)-5-methyl-(9CI)

C8H8ClN3 (181.0407)


   

4-methyl-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-amine

4-methyl-7,8-dihydro-5H-thiopyrano[4,3-d]pyrimidin-2-amine

C8H11N3S (181.0674)


   

d-Glufosinate

d-Glufosinate

C5H12NO4P (181.0504)


   

3-[(2-Hydroxyethyl)sulfinyl]-L-alanine

3-[(2-Hydroxyethyl)sulfinyl]-L-alanine

C5H11NO4S (181.0409)


   

2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one

2,7-Dihydroxy-2H-1,4-benzoxazin-3(4H)-one

C8H7NO4 (181.0375)


   

Pentaerythritol mononitrate

Pentaerythritol mononitrate

C5H11NO6 (181.0586)


   

(2-Methylanilino)thiourea

(2-Methylanilino)thiourea

C8H11N3S (181.0674)


   

3-Nitrophenyl acetate

3-Nitrophenyl acetate

C8H7NO4 (181.0375)


   

1,9-Dimethyl-8-azaxanthin

1,9-Dimethyl-8-azaxanthin

C6H7N5O2 (181.06)


   

(R+)-3-(4-hydroxyphenyl)lactate

(2R)-2-Hydroxy-3-(4-hydroxyphenyl)propanoic acid

C9H9O4- (181.0501)


(r+)-3-(4-hydroxyphenyl)lactate, also known as (2r)-2-hydroxy-3-(4-hydroxyphenyl)propanoate or P-hydroxyphenyllactic acid, is a member of the class of compounds known as phenylpropanoic acids. Phenylpropanoic acids are compounds with a structure containing a benzene ring conjugated to a propanoic acid (r+)-3-(4-hydroxyphenyl)lactate is soluble (in water) and a weakly acidic compound (based on its pKa). (r+)-3-(4-hydroxyphenyl)lactate can be found in a number of food items such as muskmelon, coconut, lemon grass, and kohlrabi, which makes (r+)-3-(4-hydroxyphenyl)lactate a potential biomarker for the consumption of these food products.

   

3-(4-Hydroxyphenyl)lactate

3-(4-Hydroxyphenyl)lactate

C9H9O4- (181.0501)


A 2-hydroxy carboxylate that is obtained by removal of a proton from the carboxylic acid group of 3-(4-hydroxyphenyl)lactic acid. COVID info from COVID-19 Disease Map Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Hexyl sulfate

Hexyl sulfate

C6H13O4S- (181.0535)


   

3-(2,3-Dihydroxyphenyl)propanoate

3-(2,3-Dihydroxyphenyl)propanoate

C9H9O4- (181.0501)


The conjugate base of 3-(2,3-dihydroxyphenyl)propanoic acid.

   

3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate

3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate

C9H9O4- (181.0501)


3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate obtained by deprotonation of the carboxy group of 3-[(1E,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid; major species at pH 7.3.

   

Diisopropyl phosphate

Diisopropyl phosphate

C6H14O4P- (181.063)


   

7,8-Dihydroxanthopterin

7,8-Dihydroxanthopterin

C6H7N5O2 (181.06)


A dihydropterin that is the 7,8-dihydro derivative of xanthopterin.

   

3-(3,4-dihydroxyphenyl)propanoate

3-(3,4-dihydroxyphenyl)propanoate

C9H9O4- (181.0501)


A monocarboxylic acid anion that is the conjugate base of 3-(3,4-dihydroxyphenyl)propanoic acid.

   

(4-Hydroxy-3-methoxyphenyl)acetate

(4-Hydroxy-3-methoxyphenyl)acetate

C9H9O4- (181.0501)


   

(4R)-3,4-dihydro-4-hydroxyphenylpyruvate

(4R)-3,4-dihydro-4-hydroxyphenylpyruvate

C9H9O4- (181.0501)


   

3-(cis-5,6-Dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate

3-(cis-5,6-Dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate

C9H9O4- (181.0501)


   

3-Acetamidopropylphosphonic acid

3-Acetamidopropylphosphonic acid

C5H12NO4P (181.0504)


   

methylphoracetophenone

methylphoracetophenone

C9H9O4- (181.0501)


   

3,4-Dimethoxybenzoate

3,4-Dimethoxybenzoate

C9H9O4- (181.0501)


   

2-Hydroxyethiin

2-Hydroxyethiin

C5H11NO4S (181.0409)


   

2-Methoxymandelate

2-Methoxymandelate

C9H9O4- (181.0501)


   

(R+)-3-(4-hydroxyphenyl)lactate

(R+)-3-(4-hydroxyphenyl)lactate

C9H9O4- (181.0501)


   

Methionine sulfone zwitterion

Methionine sulfone zwitterion

C5H11NO4S (181.0409)


An L-alpha-amino acid zwitterion obtained by transfer of a proton from the carboxy to the amino group of methionine sulfone; major miscrospecies at pH 7.3.

   

3,5-Dimethoxybenzoate

3,5-Dimethoxybenzoate

C9H9O4- (181.0501)


The conjugate base of 3,5-dimethoxybenzoic acid.

   

2,4-Dihydroxy-3,6-dimethylbenzoate

2,4-Dihydroxy-3,6-dimethylbenzoate

C9H9O4- (181.0501)


   

Carboxycarbamoyl phenol

Carboxycarbamoyl phenol

C8H7NO4 (181.0375)


   

3-(4-Hydroxycyclohex-2-en-1-ylidene)pyruvate

3-(4-Hydroxycyclohex-2-en-1-ylidene)pyruvate

C9H9O4- (181.0501)


   

(E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

(E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

C9H9O4- (181.0501)


   

5-Methylorsellinate

5-Methylorsellinate

C9H9O4- (181.0501)


A dihydroxybenzoate that is the conjugate base of 5-methylorsellinic acid, obtained by the deprotonation of the carboxy group. It is the major species at pH 7.3.

   

(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinoyl]butyrate

(2S)-2-azaniumyl-4-[hydroxy(methyl)phosphinoyl]butyrate

C5H12NO4P (181.0504)


   

Methyl 5-amino-4-oxovalerate hydrochloride

Methyl 5-amino-4-oxovalerate hydrochloride

C6H12ClNO3 (181.0506)


   

3,4-Dihydro-4-hydroxyphenylpyruvate

3,4-Dihydro-4-hydroxyphenylpyruvate

C9H9O4- (181.0501)


   

(2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate

(2R)-2-azaniumyl-4-[hydroxy(methyl)phosphoryl]butanoate

C5H12NO4P (181.0504)


   

3-Guanidinopropane sulfonate

3-Guanidinopropane sulfonate

C4H11N3O3S (181.0521)


   

gamma-Guanidinopropane sulfonic acid

gamma-Guanidinopropane sulfonic acid

C4H11N3O3S (181.0521)


   

3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate

3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvate

C9H9O4- (181.0501)


A 3-(4-hydroxycyclohex-2-en-1-ylidene)pyruvate obtained by deprotonation of the carboxy group of 3-[(1Z,4R)-4-hydroxycyclohex-2-en-1-ylidene]pyruvic acid; major species at pH 7.3.

   

4-(2-Carboxy-2-hydroxyethyl)phenolate

4-(2-Carboxy-2-hydroxyethyl)phenolate

C9H9O4- (181.0501)


   

Glufosinate-p

Glufosinate-p

C5H12NO4P (181.0504)


D010575 - Pesticides > D006540 - Herbicides D004791 - Enzyme Inhibitors D016573 - Agrochemicals

   

5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid

5-formyl-3-hydroxy-2-methylpyridine-4-carboxylic acid

C8H7NO4 (181.0375)


   

P-NITROPHENYLACETATE

4-Nitrophenyl acetate

C8H7NO4 (181.0375)


An acetate ester resulting from the formal condensation of the hydroxy group of 4-nitrophenol with the carboxy group of acetic acid.

   

(R)-3-(4-Hydroxyphenyl)lactate

(R)-3-(4-Hydroxyphenyl)lactate

C9H9O4- (181.0501)


   

4-Hydroxy-3-nitrophenylacetaldehyde

4-Hydroxy-3-nitrophenylacetaldehyde

C8H7NO4 (181.0375)


   

3-methylorsellinate

3-methylorsellinate

C9H9O4 (181.0501)


A dihydroxybenzoate that is the conjugate base of 3-methylorsellinic acid, obtained by the deprotonation of the carboxy group. It is the major species at pH 7.3.

   

Homovanillate

Homovanillate

C9H9O4 (181.0501)


A hydroxy monocarboxylic acid anion which is obtained by deprotonation of the carboxy group of homovanillic acid.

   

Methylhydroxyformylpyridinecarboxylate

Methylhydroxyformylpyridinecarboxylate

C8H7NO4 (181.0375)


   

Hydroxymethylguanine

Hydroxymethylguanine

C6H7N5O2 (181.06)


   

2-amino-3-(2-hydroxyethanesulfinyl)propanoic acid

2-amino-3-(2-hydroxyethanesulfinyl)propanoic acid

C5H11NO4S (181.0409)


   

6-(methoxycarbonyl)pyridine-2-carboxylic acid

6-(methoxycarbonyl)pyridine-2-carboxylic acid

C8H7NO4 (181.0375)


   

methyl n-benzyl-1-sulfanylmethanimidate

methyl n-benzyl-1-sulfanylmethanimidate

C9H11NOS (181.0561)


   

3-[(1-hydroxyethylidene)amino]pyrazine-2-carboxylic acid

3-[(1-hydroxyethylidene)amino]pyrazine-2-carboxylic acid

C7H7N3O3 (181.0487)


   

5-hydroxy-7h,8h-imidazo[1,5-c]pyrimidine-7-carboxylic acid

5-hydroxy-7h,8h-imidazo[1,5-c]pyrimidine-7-carboxylic acid

C7H7N3O3 (181.0487)


   

4-[(1e)-2-nitroethenyl]benzene-1,2-diol

4-[(1e)-2-nitroethenyl]benzene-1,2-diol

C8H7NO4 (181.0375)


   

(2r)-2,4-dihydroxy-2h-1,4-benzoxazin-3-one

(2r)-2,4-dihydroxy-2h-1,4-benzoxazin-3-one

C8H7NO4 (181.0375)


   

4-(2-nitroethenyl)benzene-1,2-diol

4-(2-nitroethenyl)benzene-1,2-diol

C8H7NO4 (181.0375)


   

(2r)-2-amino-3-[(s)-2-hydroxyethanesulfinyl]propanoic acid

(2r)-2-amino-3-[(s)-2-hydroxyethanesulfinyl]propanoic acid

C5H11NO4S (181.0409)