Exact Mass: 291.0718

Exact Mass Matches: 291.0718

Found 74 metabolites which its exact mass value is equals to given mass value 291.0718, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

   

prontosil

p-[(2,4-diaminophenyl)azo]benzenesulphonamide

C12H13N5O2S (291.079)


A diphenyldiazene compound having two amino substituents at the 2- and 4-positions and an aminosulphonyl substituent at the 4-position. It was the first antibacterial drug, (introduced 1935) and the first of the sulfonamide antibiotics. C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent

   

Crufomate

Crufomate

C12H19ClNO3P (291.0791)


C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent CONFIDENCE standard compound; INTERNAL_ID 237; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9553; ORIGINAL_PRECURSOR_SCAN_NO 9552 CONFIDENCE standard compound; INTERNAL_ID 237; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9578; ORIGINAL_PRECURSOR_SCAN_NO 9577 CONFIDENCE standard compound; INTERNAL_ID 237; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9598; ORIGINAL_PRECURSOR_SCAN_NO 9597 CONFIDENCE standard compound; INTERNAL_ID 237; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9618; ORIGINAL_PRECURSOR_SCAN_NO 9616 CONFIDENCE standard compound; INTERNAL_ID 237; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9590; ORIGINAL_PRECURSOR_SCAN_NO 9588 CONFIDENCE standard compound; INTERNAL_ID 237; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9626; ORIGINAL_PRECURSOR_SCAN_NO 9624

   

Hawkinsin

2-Amino-3-{[2-(carboxymethyl)-2,5-dihydroxycyclohex-3-en-1-yl]sulphanyl}propanoic acid

C11H17NO6S (291.0777)


Hawkinsin is a sulfur amino acid identified as (2-L-cystein-S-yl-1,4-dihydroxycyclohex-5-en-1-yl)acetic acid. It is a reactive byproduct of abnormal tyrosine metabolism. Normally, the breakdown of the amino acid tyrosine involves the conversion of 4-hydroxyphenylpyruvate to homogentisate by 4-hydroxyphenylpyruvate dioxygenase. Complete deficiency of this enzyme leads to an inborn error of metabolism called tyrosinemia III. In rare cases, however, the enzyme is still able to produce the reactive intermediate 1,2-epoxyphenyl acetic acid but is unable to convert this intermediate to homogentisate (PMID: 11073718). The intermediate then spontaneously reacts with glutathione to form hawkinsin. Chronically high levels of hawkinsin are associated with hawkinsinuria (characterized by the inability to break down the amino acid tyrosine). Patients with hawkinsinuria excrete hawkinsin in their urine throughout their life. The features of this condition usually appear around the time infants are weaned off breast milk and begin to use formula. The signs and symptoms may include the following: failure to gain weight and grow at the expected rate (failure to thrive), abnormally high acid levels in the blood (acidosis), and fine or sparse hair. Hawkinsin is an acidogen and a metabotoxin. An acidogen is an acidic compound that induces acidosis, which has multiple adverse effects on many organ systems. A metabotoxin is an endogenously produced metabolite that causes adverse health effects at chronically high levels. Hawkinsin is an organic acid. Abnormally high levels of organic acids in the blood (organic acidemia), urine (organic aciduria), the brain, and other tissues lead to general metabolic acidosis. Acidosis typically occurs when arterial pH falls below 7.35. In infants with acidosis, the initial symptoms include poor feeding, vomiting, loss of appetite, weak muscle tone (hypotonia), and lack of energy (lethargy). These can progress to heart, liver, and kidney abnormalities, seizures, coma, and possibly death. These are also the characteristic symptoms of untreated hawkinsinuria. Many affected children with organic acidemias experience intellectual disability or delayed development. In adults, acidosis or acidemia is characterized by headaches, confusion, feeling tired, tremors, sleepiness, and seizures. Hawkinsin is a sulfur amino acid identified as (2-l-cystein-S-yl, 4-dihydroxycyclohex-5-en-1-yl)acetic acid. Patients with hawkinsinuria excrete this metabolite in their urine throughout their life, although symptoms of metabolic acidosis and tyrosinemia improve in the first year of life. Alterations in the structure and activity of 4-hydroxyphenylpyruvic acid dioxygenase are causally related to two different metabolic disorders, tyrosinemia type III and hawkinsinuria. (PMID 11073718) [HMDB]

   

Orciprenaline-3-O-sulfate

(3-hydroxy-5-{1-hydroxy-2-[(propan-2-yl)amino]ethyl}phenyl)oxidanesulfonic acid

C11H17NO6S (291.0777)


Orciprenaline-3-O-sulfate is a metabolite of orciprenaline. Orciprenaline is a bronchodilator used in the treatment of asthma. Orciprenaline is a moderately selective beta2-adrenergic receptor agonist that stimulates receptors of the smooth muscle in the lungs, uterus, and vasculature supplying skeletal muscle, with minimal or no effect on alpha-adrenergic receptors. (Wikipedia)

   

Acetamide, N-[4-[(2-pyridinylamino)sulfonyl]phenyl]-

N-{4-[(pyridin-2-yl)sulphamoyl]phenyl}ethanimidic acid

C13H13N3O3S (291.0678)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

2',3'-Dideoxycytidine-5'-monophosphate

{[5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}phosphonic acid

C9H14N3O6P (291.062)


   

Cloranolol

1-(2,5-Dichlorophenoxy)-3-tertiary-butylamino-2-propanol

C13H19Cl2NO2 (291.0793)


C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AA - Beta blocking agents, non-selective 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

   

Prontosil

4-[2-(2,4-Diaminophenyl)diazen-1-yl]benzene-1-sulphonamide

C12H13N5O2S (291.079)


   

zomepirac

5-(4-Chlorobenzoyl)-1,4-dimethyl-1H-pyrrole-2-acetate dihydrate

C15H14ClNO3 (291.0662)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents

   

Megistoquinone II

Megistoquinone II

C14H13NO6 (291.0743)


   

Epoxyquinomicin C

Epoxyquinomicin C

C14H13NO6 (291.0743)


   
   

zomepirac

zomepirac

C15H14ClNO3 (291.0662)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents

   
   

5-Cytidine monophosphate

5-Cytidine monophosphate

C9H14N3O6P (291.062)


   

E-dimethyl rhoifolinate

E-dimethyl rhoifolinate

C14H13NO6 (291.0743)


   

Zomepirac; AIF; CE0; CorrDec

Zomepirac; AIF; CE0; CorrDec

C15H14ClNO3 (291.0662)


   

Zomepirac; AIF; CE10; CorrDec

Zomepirac; AIF; CE10; CorrDec

C15H14ClNO3 (291.0662)


   

Zomepirac; AIF; CE30; CorrDec

Zomepirac; AIF; CE30; CorrDec

C15H14ClNO3 (291.0662)


   

Zomepirac; AIF; CE0; MS2Dec

Zomepirac; AIF; CE0; MS2Dec

C15H14ClNO3 (291.0662)


   

Zomepirac; AIF; CE10; MS2Dec

Zomepirac; AIF; CE10; MS2Dec

C15H14ClNO3 (291.0662)


   

Zomepirac; AIF; CE30; MS2Dec

Zomepirac; AIF; CE30; MS2Dec

C15H14ClNO3 (291.0662)


   

Metaproterenol 3-O-sulfate

Metaproterenol 3-O-sulfate

C11H17NO6S (291.0777)


   

N4-Acetylsulfapyridine

N4-Acetylsulfapyridine

C13H13N3O3S (291.0678)


   

Zalcitabine monophosphate

Zalcitabine monophosphate

C9H14N3O6P (291.062)


   

4-(1-Pyrrolidinylsulforylmenthyl)phenylhydrazine hydrochloride

4-(1-Pyrrolidinylsulforylmenthyl)phenylhydrazine hydrochloride

C11H18ClN3O2S (291.0808)


   

Amidapsone

Amidapsone

C13H13N3O3S (291.0678)


C254 - Anti-Infective Agent > C849 - Sulfone Anti-Infective Agent

   

2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidine,hydrochloride

2-(3,4,5-trimethoxyphenyl)-1,3-thiazolidine,hydrochloride

C12H18ClNO3S (291.0696)


   

4-Chloro-2-methyl-3-(3-oxobutyl)quinoline-6-carboxylic acid

4-CHLORO-2-METHYL-3-(3-OXO-BUTYL)-QUINOLINE-6-CARBOXYLIC ACID

C15H14ClNO3 (291.0662)


   

4-(2-bromoacetamido)-2,2,6,6-tetramethyl-1-piperidinyloxy

4-(2-bromoacetamido)-2,2,6,6-tetramethyl-1-piperidinyloxy

C11H20BrN2O2 (291.0708)


   

3-[(4-Amino-3-methylphenyl)azo]benzenesulfonic acid

3-[(4-Amino-3-methylphenyl)azo]benzenesulfonic acid

C13H13N3O3S (291.0678)


   

N-[4-(pyridin-3-ylsulfamoyl)phenyl]acetamide

N-[4-(pyridin-3-ylsulfamoyl)phenyl]acetamide

C13H13N3O3S (291.0678)


   

1H-Benz[g]indole-3-carboxaldehyde,2-(5-methyl-2-thienyl)-(9CI)

1H-Benz[g]indole-3-carboxaldehyde,2-(5-methyl-2-thienyl)-(9CI)

C18H13NOS (291.0718)


   

3-(2-Bromoacetamidomethyl)-PROXYL3-(2-Bromoacetamidomethyl)-2,2,5,5-tetramethyl-1-pyrrolidinoxy

3-(2-Bromoacetamidomethyl)-PROXYL3-(2-Bromoacetamidomethyl)-2,2,5,5-tetramethyl-1-pyrrolidinoxy

C11H20BrN2O2 (291.0708)


   

Radafaxine hydrochloride

Radafaxine (hydrochloride)

C13H19Cl2NO2 (291.0793)


C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent

   

Benzyl (2,4-difluoro-3-formylphenyl)carbamate

Benzyl (2,4-difluoro-3-formylphenyl)carbamate

C15H11F2NO3 (291.0707)


   

[3-(Benzylsulfamoyl)phenyl]boronic acid

[3-(Benzylsulfamoyl)phenyl]boronic acid

C13H14BNO4S (291.0737)


   

N-[2-(Piperazin-1-yl)phenyl]methylsulphonamide hydrochloride

N-[2-(Piperazin-1-yl)phenyl]methylsulphonamide hydrochloride

C11H18ClN3O2S (291.0808)


   

3,3,3-trifluoro-2-methyl-2-(phenylmethoxycarbonylamino)propanoic acid

3,3,3-trifluoro-2-methyl-2-(phenylmethoxycarbonylamino)propanoic acid

C12H12F3NO4 (291.0718)


   

ethyl (E)-3-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate

ethyl (E)-3-(2-chlorophenyl)-2-(1,2,4-triazol-1-ylmethyl)prop-2-enoate

C14H14ClN3O2 (291.0774)


   

2,3-PYRIDINEDICARBOXYLIC ACID, 5-(TRIFLUOROMETHYL)-, DIETHYL ESTER

2,3-PYRIDINEDICARBOXYLIC ACID, 5-(TRIFLUOROMETHYL)-, DIETHYL ESTER

C12H12F3NO4 (291.0718)


   
   

7-Amino-3-(1-pyridylmethyl)-3-cephem-4-carboxylic Acid

7-Amino-3-(1-pyridylmethyl)-3-cephem-4-carboxylic Acid

C13H13N3O3S (291.0678)


   

2-chloro-N-(2,5-dimethoxyphenyl)benzamide

2-chloro-N-(2,5-dimethoxyphenyl)benzamide

C15H14ClNO3 (291.0662)


   

(S,S)-Hydroxy Bupropion

(S,S)-Hydroxy Bupropion

C13H19Cl2NO2 (291.0793)


   

(5-((((Benzyloxy)carbonyl)amino)methyl)thiophen-2-yl)boronic acid

(5-((((Benzyloxy)carbonyl)amino)methyl)thiophen-2-yl)boronic acid

C13H14BNO4S (291.0737)


   

[4-(Benzylsulfamoyl)phenyl]boronic acid

[4-(Benzylsulfamoyl)phenyl]boronic acid

C13H14BNO4S (291.0737)


   

Cytidine 5-monophosphate

2,3-Dideoxycytidine-5-monophosphate

C9H14N3O6P (291.062)


   
   

Cloranolol

Cloranolol

C13H19Cl2NO2 (291.0793)


C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AA - Beta blocking agents, non-selective 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

   

(2-l-cystein-S-yl-1,4-dihydroxycyclohex-5-en-1-yl)-acetic acid

(2-l-cystein-S-yl-1,4-dihydroxycyclohex-5-en-1-yl)-acetic acid

C11H17NO6S (291.0777)


   
   

N-(5-chloro-2-hydroxyphenyl)-2-ethoxybenzamide

N-(5-chloro-2-hydroxyphenyl)-2-ethoxybenzamide

C15H14ClNO3 (291.0662)


   

N-(5-chloro-2-hydroxyphenyl)-2-(4-methoxyphenyl)acetamide

N-(5-chloro-2-hydroxyphenyl)-2-(4-methoxyphenyl)acetamide

C15H14ClNO3 (291.0662)


   

4-Hydroxy-3,6-dioxo-2,5-diphenylcyclohexa-1,4-dien-1-olate

4-Hydroxy-3,6-dioxo-2,5-diphenylcyclohexa-1,4-dien-1-olate

C18H11O4- (291.0657)


   

(2R)-2-amino-N-[4-chloro-2-[oxo(1H-pyrrol-2-yl)methyl]phenyl]propanamide

(2R)-2-amino-N-[4-chloro-2-[oxo(1H-pyrrol-2-yl)methyl]phenyl]propanamide

C14H14ClN3O2 (291.0774)


   

3-amino-N-[4-chloro-2-[oxo(1H-pyrrol-2-yl)methyl]phenyl]propanamide

3-amino-N-[4-chloro-2-[oxo(1H-pyrrol-2-yl)methyl]phenyl]propanamide

C14H14ClN3O2 (291.0774)


   

Acetamide, N-[4-[(2-pyridinylamino)sulfonyl]phenyl]-

Acetamide, N-[4-[(2-pyridinylamino)sulfonyl]phenyl]-

C13H13N3O3S (291.0678)


D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

Hawkinsin

Hawkinsin

C11H17NO6S (291.0777)


A cysteine derivative that is cysteine in which the thiol group is substituted by a [2-(carboxymethyl)-2,5-dihydroxycyclohex-3-en-1-yl]sulfanediyl group. Hawkinsinuria is an inherited disorder which is characterized by the inability to break down the amino acid tyrosine. This results in the finding of certain metabolites in the urine, such as hawkinsin.

   

Orciprenaline-3-O-sulfate

Orciprenaline-3-O-sulfate

C11H17NO6S (291.0777)


   

methyl 4-methoxy-5-[(1e)-3-methoxy-3-oxoprop-1-en-1-yl]furo[2,3-b]pyridine-6-carboxylate

methyl 4-methoxy-5-[(1e)-3-methoxy-3-oxoprop-1-en-1-yl]furo[2,3-b]pyridine-6-carboxylate

C14H13NO6 (291.0743)


   

(e)-n-({5-[(r)-methanesulfinyl]-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

(e)-n-({5-[(r)-methanesulfinyl]-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

C13H13N3O3S (291.0678)


   

methyl 4-methoxy-5-(3-methoxy-3-oxoprop-1-en-1-yl)furo[2,3-b]pyridine-6-carboxylate

methyl 4-methoxy-5-(3-methoxy-3-oxoprop-1-en-1-yl)furo[2,3-b]pyridine-6-carboxylate

C14H13NO6 (291.0743)


   

methyl 4-methoxy-5-[(1z)-3-methoxy-3-oxoprop-1-en-1-yl]furo[2,3-b]pyridine-6-carboxylate

methyl 4-methoxy-5-[(1z)-3-methoxy-3-oxoprop-1-en-1-yl]furo[2,3-b]pyridine-6-carboxylate

C14H13NO6 (291.0743)


   

2-hydroxy-4,7-dimethoxy-3-(2-methoxyethenyl)quinoline-5,8-dione

2-hydroxy-4,7-dimethoxy-3-(2-methoxyethenyl)quinoline-5,8-dione

C14H13NO6 (291.0743)


   

(z)-n-({5-methanesulfinyl-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

(z)-n-({5-methanesulfinyl-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

C13H13N3O3S (291.0678)


   

(e)-n-({5-[(s)-methanesulfinyl]-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

(e)-n-({5-[(s)-methanesulfinyl]-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

C13H13N3O3S (291.0678)


   

(2r,3r,4s,4ar)-2h,3h,4h,4ah,9h-[1,3]dioxolo[4,5-j]phenanthridine-2,3,4,6-tetrol

(2r,3r,4s,4ar)-2h,3h,4h,4ah,9h-[1,3]dioxolo[4,5-j]phenanthridine-2,3,4,6-tetrol

C14H13NO6 (291.0743)


   

2h,3h,4h,4ah,9h-[1,3]dioxolo[4,5-j]phenanthridine-2,3,4,6-tetrol

2h,3h,4h,4ah,9h-[1,3]dioxolo[4,5-j]phenanthridine-2,3,4,6-tetrol

C14H13NO6 (291.0743)


   

2-hydroxy-n-[(1r,2s,6r)-2-hydroxy-6-(hydroxymethyl)-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]benzenecarboximidic acid

2-hydroxy-n-[(1r,2s,6r)-2-hydroxy-6-(hydroxymethyl)-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]benzenecarboximidic acid

C14H13NO6 (291.0743)


   

n-({5-methanesulfinyl-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

n-({5-methanesulfinyl-4-methoxy-[2,2'-bipyridin]-6-yl}methylidene)hydroxylamine

C13H13N3O3S (291.0678)


   

2-hydroxy-n-[2-hydroxy-6-(hydroxymethyl)-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]benzenecarboximidic acid

2-hydroxy-n-[2-hydroxy-6-(hydroxymethyl)-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]benzenecarboximidic acid

C14H13NO6 (291.0743)


   

2-hydroxy-4,7-dimethoxy-3-[(1e)-2-methoxyethenyl]quinoline-5,8-dione

2-hydroxy-4,7-dimethoxy-3-[(1e)-2-methoxyethenyl]quinoline-5,8-dione

C14H13NO6 (291.0743)