Exact Mass: 307.1055822

Exact Mass Matches: 307.1055822

Found 80 metabolites which its exact mass value is equals to given mass value 307.1055822, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

   

Tolnaftate

N-Methyl-N-(3-methylphenyl)-1-(naphthalen-2-yloxy)methanethioamide

C19H17NOS (307.1030792)


Tolnaftate is a synthetic over-the-counter anti-fungal agent. It may come as a cream, powder, spray, or liquid aerosol, and is used to treat jock itch, athletes foot and ringworm. It is sold under several brand names, most notably Tinactin (Schering-Plough Corporation) and Odor-Eaters (Combe Incorporated). Other brands are Absorbine, Aftate, Desenex, Genaspor, NP 27, and Ting.and Odor-Eaters (Combe Incorporated). Other brands are Absorbine, Aftate, Desenex, Genaspor, NP 27, and Ting. [HMDB] Tolnaftate is a synthetic over-the-counter anti-fungal agent. It may come as a cream, powder, spray, or liquid aerosol, and is used to treat jock itch, athletes foot and ringworm. It is sold under several brand names, most notably Tinactin (Schering-Plough Corporation) and Odor-Eaters (Combe Incorporated). Other brands are Absorbine, Aftate, Desenex, Genaspor, NP 27, and Ting.and Odor-Eaters (Combe Incorporated). Other brands are Absorbine, Aftate, Desenex, Genaspor, NP 27, and Ting. D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent

   

Aspergillomarasmine A

2-({2-[(2-amino-2-carboxyethyl)amino]-2-carboxyethyl}amino)butanedioic acid

C10H17N3O8 (307.1015602)


Aspergillomarasmine A is a metabolite of the cereal fungus (Aspergillus flavus), found only in young culture D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids

   

Tryptophyl-Cysteine

2-{[2-amino-1-hydroxy-3-(1H-indol-3-yl)propylidene]amino}-3-sulphanylpropanoic acid

C14H17N3O3S (307.09905720000006)


Tryptophyl-Cysteine is a dipeptide composed of tryptophan and cysteine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

   

Cysteinyl-Tryptophan

2-[(2-Amino-1-hydroxy-3-sulphanylpropylidene)amino]-3-(1H-indol-3-yl)propanoic acid

C14H17N3O3S (307.09905720000006)


Cysteinyl-Tryptophan is a dipeptide composed of cysteine and tryptophan. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

   

Hydroxyfasudil

5-(1,4-Diazepane-1-sulphonyl)isoquinolin-1-ol

C14H17N3O3S (307.09905720000006)


   

N-[1-(2-Oxochromen-3-yl)ethylideneamino]pyridine-4-carboxamide

N-[1-(2-oxo-2H-chromen-3-yl)ethylidene]pyridine-4-carbohydrazide

C17H13N3O3 (307.09568680000007)


   

Toluidine

(1Z)-1-[2-(4-methyl-2-nitrophenyl)hydrazin-1-ylidene]-1,2-dihydronaphthalen-2-one

C17H13N3O3 (307.09568680000007)


Toluidine, also known as toluidine red or c.i. pigment red 3, is a member of the class of compounds known as naphthalenes. Naphthalenes are compounds containing a naphthalene moiety, which consists of two fused benzene rings. Toluidine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Toluidine can be found in wild celery, which makes toluidine a potential biomarker for the consumption of this food product. The chemical properties of the toluidines are quite similar to those of aniline, and toluidines have properties in common with other aromatic amines. Due to the amino group bonded to the aromatic ring, the toluidines are weakly basic. The toluidines are poorly soluble in pure water but dissolve well in acidic water due to formation of ammonium salts, as usual for organic amines. ortho- and meta-toluidines are viscous Liquids, but para-toluidine is a flaky solid. This difference is related to the fact that the p-toluidine molecules are more symmetrical. p-Toluidine can be obtained from reduction of p-nitrotoluene. p-Toluidine reacts with formaldehyde to form Tr√∂gers base . Toluidine, also known as toluidine red or c.i. pigment red 3, is a member of the class of compounds known as naphthalenes. Naphthalenes are compounds containing a naphthalene moiety, which consists of two fused benzene rings. Toluidine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Toluidine can be found in wild celery, which makes toluidine a potential biomarker for the consumption of this food product. The chemical properties of the toluidines are quite similar to those of aniline, and toluidines have properties in common with other aromatic amines. Due to the amino group bonded to the aromatic ring, the toluidines are weakly basic. The toluidines are poorly soluble in pure water but dissolve well in acidic water due to formation of ammonium salts, as usual for organic amines. ortho- and meta-toluidines are viscous liquids, but para-toluidine is a flaky solid. This difference is related to the fact that the p-toluidine molecules are more symmetrical. p-Toluidine can be obtained from reduction of p-nitrotoluene. p-Toluidine reacts with formaldehyde to form Trögers base .

   

tolnaftate

tolnaftate

C19H17NOS (307.1030792)


D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent CONFIDENCE standard compound; EAWAG_UCHEM_ID 3131

   

Demethyl

1-[(4-Hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol--hydrogen chloride (1/1)

C16H17NO3.HCl (307.09751480000006)


Higenamine hydrochloride (Norcoclaurine hydrochloride), a β2-AR agonist, is a key component of the Chinese herb aconite root that prescribes for treating symptoms of heart failure in the oriental Asian countries. Higenamine hydrochloride (Norcoclaurine hydrochloride) has anti-apoptotic effects[1][2]. Higenamine hydrochloride is a selective LSD1 inhibitor (IC50=1.47 μM) that can be isolated from aconite. Higenamine hydrochloride has anti-inflammatory and antibacterial activity. Higenamine (Norcoclaurine) can attenuate IL-1β-induced Apoptosis through ROS-mediated PI3K/Akt signaling pathway. Higenamine hydrochloride protects brain cells from oxygen deprivation. Higenamine can promote bone formation in osteoporosis through the SMAD2/3 pathway. Higenamine hydrochloride can be used to study cancer, inflammation, cardiorenal syndrome and other diseases[1][2][3][4][5][6]. Higenamine hydrochloride (Norcoclaurine hydrochloride), a β2-AR agonist, is a key component of the Chinese herb aconite root that prescribes for treating symptoms of heart failure in the oriental Asian countries. Higenamine hydrochloride (Norcoclaurine hydrochloride) has anti-apoptotic effects[1][2].

   
   
   

CP_M308a

CP_M308a

C15H18ClN3O2 (307.1087478)


CONFIDENCE Transformation product, tentative ID (Level 3 structure); INTERNAL_ID 2101

   

CP_M308b

CP_M308b

C15H18ClN3O2 (307.1087478)


CONFIDENCE Transformation product, tentative ID (Level 3 structure); INTERNAL_ID 2102

   

CP_M308c

CP_M308c

C15H18ClN3O2 (307.1087478)


CONFIDENCE Transformation product, tentative ID (Level 3 structure); INTERNAL_ID 2103

   
   

2-indolylcarbonyl alpha-L-rhamnopyranoside|3-indolylcarbonyl alpha-L-rhamnopyranoside

2-indolylcarbonyl alpha-L-rhamnopyranoside|3-indolylcarbonyl alpha-L-rhamnopyranoside

C15H17NO6 (307.1055822)


   
   
   

Demethyl

1-[(4-Hydroxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol--hydrogen chloride (1/1)

C16H18ClNO3 (307.0975148)


Higenamine hydrochloride (Norcoclaurine hydrochloride), a β2-AR agonist, is a key component of the Chinese herb aconite root that prescribes for treating symptoms of heart failure in the oriental Asian countries. Higenamine hydrochloride (Norcoclaurine hydrochloride) has anti-apoptotic effects[1][2]. Higenamine hydrochloride is a selective LSD1 inhibitor (IC50=1.47 μM) that can be isolated from aconite. Higenamine hydrochloride has anti-inflammatory and antibacterial activity. Higenamine (Norcoclaurine) can attenuate IL-1β-induced Apoptosis through ROS-mediated PI3K/Akt signaling pathway. Higenamine hydrochloride protects brain cells from oxygen deprivation. Higenamine can promote bone formation in osteoporosis through the SMAD2/3 pathway. Higenamine hydrochloride can be used to study cancer, inflammation, cardiorenal syndrome and other diseases[1][2][3][4][5][6]. Higenamine hydrochloride (Norcoclaurine hydrochloride), a β2-AR agonist, is a key component of the Chinese herb aconite root that prescribes for treating symptoms of heart failure in the oriental Asian countries. Higenamine hydrochloride (Norcoclaurine hydrochloride) has anti-apoptotic effects[1][2].

   

tolnaftate

tolnaftate

C19H17NOS (307.1030792)


D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent CONFIDENCE standard compound; INTERNAL_ID 850; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10164; ORIGINAL_PRECURSOR_SCAN_NO 10163 CONFIDENCE standard compound; INTERNAL_ID 850; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10182; ORIGINAL_PRECURSOR_SCAN_NO 10181 CONFIDENCE standard compound; INTERNAL_ID 850; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10208; ORIGINAL_PRECURSOR_SCAN_NO 10207 CONFIDENCE standard compound; INTERNAL_ID 850; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10225; ORIGINAL_PRECURSOR_SCAN_NO 10224 CONFIDENCE standard compound; INTERNAL_ID 850; DATASET 20200303_ENTACT_RP_MIX508; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10249; ORIGINAL_PRECURSOR_SCAN_NO 10244

   
   
   

Cys-TRP

2-[2-amino-3-(1H-indol-3-yl)propanamido]-3-sulfanylpropanoic acid

C14H17N3O3S (307.09905720000006)


   

TRP-Cys

2-(2-amino-3-sulfanylpropanamido)-3-(1H-indol-3-yl)propanoic acid

C14H17N3O3S (307.09905720000006)


   

Toxin C

2-({2-[(2-amino-2-carboxyethyl)amino]-2-carboxyethyl}amino)butanedioic acid

C10H17N3O8 (307.1015602)


D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids

   

(2S)-4-oxo-2-(phenylmethoxycarbonylamino)-4-prop-2-enoxybutanoate

(2S)-4-oxo-2-(phenylmethoxycarbonylamino)-4-prop-2-enoxybutanoate

C15H17NO6 (307.1055822)


   

8-hydroxyquinoline-beta-d-galactopyranoside

8-hydroxyquinoline-beta-d-galactopyranoside

C15H17NO6 (307.1055822)


   

4-chloro-7-methoxy-5-(1-methylpiperidin-4-yl)oxyquinazoline

4-chloro-7-methoxy-5-(1-methylpiperidin-4-yl)oxyquinazoline

C15H18ClN3O2 (307.1087478)


   

Ethanone, 1-(3,5-dihydroxyphenyl)-2-[methyl(phenylmethyl)amino]-, hydrochloride

Ethanone, 1-(3,5-dihydroxyphenyl)-2-[methyl(phenylmethyl)amino]-, hydrochloride

C16H18ClNO3 (307.0975148)


   

N-(2-Methyl-5-nitrophenyl)-4-(pyridin-3-yl)pyrimidin-2-amine

N-(2-Methyl-5-nitrophenyl)-4-(pyridin-3-yl)pyrimidin-2-amine

C16H13N5O2 (307.1069198)


   

[1-[(2-methylpropan-2-yl)oxycarbonyl]-5-methylsulfanylindol-2-yl]boronic acid

[1-[(2-methylpropan-2-yl)oxycarbonyl]-5-methylsulfanylindol-2-yl]boronic acid

C14H18BNO4S (307.10495380000003)


   

(4-CYCLOHEXYL-5-FURAN-2-YL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID

(4-CYCLOHEXYL-5-FURAN-2-YL-4H-[1,2,4]TRIAZOL-3-YLSULFANYL)-ACETIC ACID

C14H17N3O3S (307.09905720000006)


   

(2E,4E)-4-(1-ETHYLQUINOLIN-2(1H)-YLIDENE)-1-PHENYLBUT-2-EN-1-ONE

(2E,4E)-4-(1-ETHYLQUINOLIN-2(1H)-YLIDENE)-1-PHENYLBUT-2-EN-1-ONE

C19H17NOS (307.1030792)


   
   

4-[3-[4-(Methylsulfonyl)phenyl]-1,2,4-oxadiazol-5-yl]piperidine

4-[3-[4-(Methylsulfonyl)phenyl]-1,2,4-oxadiazol-5-yl]piperidine

C14H17N3O3S (307.09905720000006)


   

2-(4-boronophenyl)-6-methylquinoline-4-carboxylic acid

2-(4-boronophenyl)-6-methylquinoline-4-carboxylic acid

C17H14BNO4 (307.10158340000004)


   

4-(5-Isoquinolinylsulfonyl)-1,4-diazepan-1-ol

4-(5-Isoquinolinylsulfonyl)-1,4-diazepan-1-ol

C14H17N3O3S (307.09905720000006)


   
   
   

3-(2-Chloro-1-oxopropyl)spiro[2H-1,3-benzoxazine-2,1-cyclohexan]-4(3H)-one

3-(2-Chloro-1-oxopropyl)spiro[2H-1,3-benzoxazine-2,1-cyclohexan]-4(3H)-one

C16H18ClNO3 (307.0975148)


   

14H-Benzo[c]benzofuro[2,3-a]carbazole

14H-Benzo[c]benzofuro[2,3-a]carbazole

C22H13NO (307.09970880000003)


   

Sulfasymazine

Sulfasymazine

C13H17N5O2S (307.1102902)


C254 - Anti-Infective Agent > C29739 - Sulfonamide Anti-Infective Agent D000890 - Anti-Infective Agents > D013424 - Sulfanilamides

   

8-HYDROXYQUINOLINE-BETA-D-GLUCOPYRANOSIDE

8-HYDROXYQUINOLINE-BETA-D-GLUCOPYRANOSIDE

C15H17NO6 (307.1055822)


   

A-68930 hydrochloride

A-68930 hydrochloride

C16H18ClNO3 (307.0975148)


A68930 hydrochloride, as a dopamine D1 receptor agonist, can be used for the research of bronchiectasis[1].

   

ETHYL 4-HYDROXY-5,6,8-TRIMETHOXYQUINOLINE-2-CARBOXYLATE

ETHYL 4-HYDROXY-5,6,8-TRIMETHOXYQUINOLINE-2-CARBOXYLATE

C15H17NO6 (307.1055822)


   

BUPRANOLOL hydrochloride

BUPRANOLOL hydrochloride

C14H23Cl2NO2 (307.1105758)


D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents

   
   

4-allyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol

4-allyl-5-(3,4,5-trimethoxyphenyl)-4H-1,2,4-triazole-3-thiol

C14H17N3O3S (307.09905720000006)


   
   

6-Amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-4-pyrimidinone

6-Amino-1-[2-(3,4-dimethoxyphenyl)ethyl]-2-sulfanylidene-4-pyrimidinone

C14H17N3O3S (307.09905720000006)


   

3-(Dimethylaminomethylideneamino)-4-methoxy-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester

3-(Dimethylaminomethylideneamino)-4-methoxy-2-thieno[2,3-b]pyridinecarboxylic acid ethyl ester

C14H17N3O3S (307.09905720000006)


   

6-Hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carboxylic acid pyridin-3-ylamide

6-Hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carboxylic acid pyridin-3-ylamide

C17H13N3O3 (307.09568680000007)


   

2-(2-Fluorophenyl)-5-[(2-phenylethyl)amino]-1,3-oxazole-4-carbonitrile

2-(2-Fluorophenyl)-5-[(2-phenylethyl)amino]-1,3-oxazole-4-carbonitrile

C18H14FN3O (307.1120846)


   

4-[(7r,7as)-7-Hydroxy-1,3-Dioxotetrahydro-1h-Pyrrolo[1,2-C]imidazol-2(3h)-Yl]-1-Naphthonitrile

4-[(7r,7as)-7-Hydroxy-1,3-Dioxotetrahydro-1h-Pyrrolo[1,2-C]imidazol-2(3h)-Yl]-1-Naphthonitrile

C17H13N3O3 (307.09568680000007)


   

2-[2-(2-fluorophenyl)pyridin-4-yl]-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one

2-[2-(2-fluorophenyl)pyridin-4-yl]-1,5,6,7-tetrahydro-4H-pyrrolo[3,2-c]pyridin-4-one

C18H14FN3O (307.1120846)


   

3-(4-chlorophenyl)-2-cyclopropyl-4-(1H-1,2,4-triazol-1-yl)butane-1,3-diol

3-(4-chlorophenyl)-2-cyclopropyl-4-(1H-1,2,4-triazol-1-yl)butane-1,3-diol

C15H18ClN3O2 (307.1087478)


   

1-[2-(4-chlorophenyl)-3-cyclopropyl-2-hydroxybutyl]-1H-1,2,4-triazol-5-ol

1-[2-(4-chlorophenyl)-3-cyclopropyl-2-hydroxybutyl]-1H-1,2,4-triazol-5-ol

C15H18ClN3O2 (307.1087478)


   

1-[2-(4-chlorophenyl)-3-cyclopropyl-2-hydroxybutyl]-1H-1,2,4-triazol-3-ol

1-[2-(4-chlorophenyl)-3-cyclopropyl-2-hydroxybutyl]-1H-1,2,4-triazol-3-ol

C15H18ClN3O2 (307.1087478)


   

N-[1-(2-Oxochromen-3-yl)ethylideneamino]pyridine-4-carboxamide

N-[1-(2-Oxochromen-3-yl)ethylideneamino]pyridine-4-carboxamide

C17H13N3O3 (307.09568680000007)


   

N-[4-(pyridin-2-ylcarbamoyl)phenyl]furan-2-carboxamide

N-[4-(pyridin-2-ylcarbamoyl)phenyl]furan-2-carboxamide

C17H13N3O3 (307.09568680000007)


   

1-(5-Isoquinolinyl)-3-(2-phenylethyl)thiourea

1-(5-Isoquinolinyl)-3-(2-phenylethyl)thiourea

C18H17N3S (307.11431220000003)


   

N-(4-cyano-2-methyl-3-pyrazolyl)-5-(4-methylphenyl)-3-isoxazolecarboxamide

N-(4-cyano-2-methyl-3-pyrazolyl)-5-(4-methylphenyl)-3-isoxazolecarboxamide

C16H13N5O2 (307.1069198)


   

1-hydroxy-2-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-benzotriazin-3-one

1-hydroxy-2-(5-phenyl-1H-pyrazol-3-yl)-4H-1,2,4-benzotriazin-3-one

C16H13N5O2 (307.1069198)


   
   
   
   

2-oxo-3-[(1S)-3-oxo-1-phenylbutyl]-2H-1-benzopyran-4-olate

2-oxo-3-[(1S)-3-oxo-1-phenylbutyl]-2H-1-benzopyran-4-olate

C19H15O4- (307.097029)


   

2-oxo-3-[(1R)-3-oxo-1-phenylbutyl]-2H-1-benzopyran-4-olate

2-oxo-3-[(1R)-3-oxo-1-phenylbutyl]-2H-1-benzopyran-4-olate

C19H15O4- (307.097029)


   

(Z)-3-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-fluorophenyl)prop-2-enenitrile

(Z)-3-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-(2-fluorophenyl)prop-2-enenitrile

C18H14FN3O (307.1120846)


   

2-Heptenal, PFBO, # 1

2-Heptenal, PFBO, # 1

C14H14F5NO (307.0995494)


   

2-({2-[(2-amino-2-carboxyethyl)amino]-2-carboxyethyl}amino)butanedioic acid

2-({2-[(2-amino-2-carboxyethyl)amino]-2-carboxyethyl}amino)butanedioic acid

C10H17N3O8 (307.1015602)


D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids

   
   

5,8-dihydroxy-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

5,8-dihydroxy-10-methyl-1,9,12-triazatetracyclo[9.8.0.0²,⁷.0¹³,¹⁸]nonadeca-2,4,6,8,11,13,15,17-octaen-19-one

C17H13N3O3 (307.09568680000007)