Exact Mass: 329.098

Exact Mass Matches: 329.098

Found 70 metabolites which its exact mass value is equals to given mass value 329.098, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Fluridone

1-methyl-3-phenyl-5-[3-(trifluoromethyl)phenyl]-1,4-dihydropyridin-4-one

C19H14F3NO (329.1027)


CONFIDENCE standard compound; INTERNAL_ID 704; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8814; ORIGINAL_PRECURSOR_SCAN_NO 8813 CONFIDENCE standard compound; INTERNAL_ID 704; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8806; ORIGINAL_PRECURSOR_SCAN_NO 8805 CONFIDENCE standard compound; INTERNAL_ID 704; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8777; ORIGINAL_PRECURSOR_SCAN_NO 8775 CONFIDENCE standard compound; INTERNAL_ID 704; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8811; ORIGINAL_PRECURSOR_SCAN_NO 8810 CONFIDENCE standard compound; INTERNAL_ID 704; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8752; ORIGINAL_PRECURSOR_SCAN_NO 8747 CONFIDENCE standard compound; INTERNAL_ID 704; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8718; ORIGINAL_PRECURSOR_SCAN_NO 8717 D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

Desulfoglucotropeolin

Desulfobenzylglucosinolate

C14H19NO6S (329.0933)


A aralkylglucosinolate consisting of glucotropeolin lacking the oxime O-sulfo group.

   

(Z)-N-Feruloyl-5-hydroxyanthranilic acid

5-Hydroxy-2-{[(2E)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]amino}benzoate

C17H15NO6 (329.0899)


Avenanthramide b is a member of the class of compounds known as avenanthramides. Avenanthramides are a group of phenolic alkaloids consisting of conjugate of three phenylpropanoids (ferulic, caffeic, or p-coumaric acid) and anthranilic acid. Avenanthramide b is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Avenanthramide b can be found in cereals and cereal products, which makes avenanthramide b a potential biomarker for the consumption of this food product. (Z)-N-Feruloyl-5-hydroxyanthranilic acid is found in cereals and cereal products. (Z)-N-Feruloyl-5-hydroxyanthranilic acid is isolated from oats (Avena sativa).

   

7-Hydroxyamoxapine

13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-5-ol

C17H16ClN3O2 (329.0931)


7-Hydroxyamoxapine is a metabolite of amoxapine. Amoxapine (Amokisan, Asendin, Asendis, Defanyl, Demolox, Moxadil) is a tetracyclic antidepressant of the dibenzoxazepine family, though it is often classified as a secondary amine tricyclic antidepressant. It is the N-demethylated metabolite of Loxapine. (Wikipedia)

   

8-Hydroxyamoxapine

13-chloro-10-(piperazin-1-yl)-2-oxa-9-azatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-6-ol

C17H16ClN3O2 (329.0931)


8-Hydroxyamoxapine is a metabolite of amoxapine. Amoxapine (Amokisan, Asendin, Asendis, Defanyl, Demolox, Moxadil) is a tetracyclic antidepressant of the dibenzoxazepine family, though it is often classified as a secondary amine tricyclic antidepressant. It is the N-demethylated metabolite of Loxapine. (Wikipedia)

   
   

2,3-Di-O-acetyl-5-deoxy-5-fuluro-D-cytidine

2,3-Di-O-acetyl-5-deoxy-5-fuluro-D-cytidine

C13H16FN3O6 (329.1023)


   

Maybridge4_002086

Maybridge4_002086

C20H15N3S (329.0987)


   

Metolachlor-TP NOA413173

Metolachlor-TP NOA413173

C14H19NO6S (329.0933)


CONFIDENCE standard compound; UCHEM_ID 4179 UCHEM_ID 4179; CONFIDENCE standard compound

   
   

(E)-4-(6-(3,4-dihydroxystyryl)-4-hydroxy-2-oxo-2H-pyran-3-yl)pyrrolidin-2-one|phaeolschidin E

(E)-4-(6-(3,4-dihydroxystyryl)-4-hydroxy-2-oxo-2H-pyran-3-yl)pyrrolidin-2-one|phaeolschidin E

C17H15NO6 (329.0899)


   

DTXSID60693997

DTXSID60693997

C17H15NO6 (329.0899)


   
   

2`,3`-di-O-acetyl-5`-deoxy-5-fluorocytidin

2,3-Di-O-acetyl-5-deoxy-5-fluoro-D-cytidine

C13H16FN3O6 (329.1023)


CONFIDENCE standard compound; INTERNAL_ID 2002

   

2,3-di-O-acetyl-5-deoxy-5-fluorocytidine

2,3-Di-O-acetyl-5-deoxy-5-fluoro-D-cytidine

C13H16FN3O6 (329.1023)


A member of the class of cytidines that is a metabolite of the drug capecitabine. CONFIDENCE standard compound; EAWAG_UCHEM_ID 2862 EAWAG_UCHEM_ID 2862; CONFIDENCE standard compound

   
   
   

Metolachlor-NOA 413173

Metolachlor-NOA 413173

C14H19NO6S (329.0933)


CONFIDENCE standard compound; INTERNAL_ID 2557

   

Avenanthramide-C methyl ester

2-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]amino]5-hydroxy-benzoic acid, methyl ester

C17H15NO6 (329.0899)


   

Isradipine Metabolite (3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-d

Isradipine Metabolite (3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-d

C16H15N3O5 (329.1012)


   

Avenanthramide b

5-hydroxy-2-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamido]benzoic acid

C17H15NO6 (329.0899)


A monohydroxybenzoic acid resulting from the formal condensation of the carboxy group of ferulic acid with the amino group of 2-amino-5-hydroxybenzoic acid. It is an oat phytoalexin produced in response to pathogen attack and elicitation.

   
   
   

(Z)-2-Amino-alpha-[1-(tert-butoxycarbonyl)]-1-methylethoxyimino-4-thiazolacetic acid

(Z)-2-Amino-alpha-[1-(tert-butoxycarbonyl)]-1-methylethoxyimino-4-thiazolacetic acid

C13H19N3O5S (329.1045)


   

1-(3-nitrophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline hydrochloride

1-(3-nitrophenyl)-2,3,4,9-tetrahydro-1H-beta-carboline hydrochloride

C17H16ClN3O2 (329.0931)


   
   

[diethyl(4-methyl-2-oxo-2H-benzopyran-7-yl)]ammonium hydrogen sulphate

[diethyl(4-methyl-2-oxo-2H-benzopyran-7-yl)]ammonium hydrogen sulphate

C14H19NO6S (329.0933)


   

1H-Indole-1-carboxylic acid, 2-borono-6-(trifluoromethyl)-, 1-(1,1-dimethylethyl) ester (9CI)

1H-Indole-1-carboxylic acid, 2-borono-6-(trifluoromethyl)-, 1-(1,1-dimethylethyl) ester (9CI)

C14H15BF3NO4 (329.1046)


   

4-(3,5-DICHLORO-PHENYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

4-(3,5-DICHLORO-PHENYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER

C16H21Cl2NO2 (329.0949)


   
   

Solvent Violet 13

Solvent Violet 13

C21H15NO3 (329.1052)


   
   

Tris(4-formylphenyl)amine

Tris(4-formylphenyl)amine

C21H15NO3 (329.1052)


   

Pirolate

Pirolate

C16H15N3O5 (329.1012)


C78273 - Agent Affecting Respiratory System > C29712 - Anti-asthmatic Agent

   

METHYL 6-(4-NITROPHENYLAMINO)-5-OXO-1,2,3,5-TETRAHYDROINDOLIZINE-8-CARBOXYLATE

METHYL 6-(4-NITROPHENYLAMINO)-5-OXO-1,2,3,5-TETRAHYDROINDOLIZINE-8-CARBOXYLATE

C16H15N3O5 (329.1012)


   
   

disperse blue 72

disperse blue 72

C21H15NO3 (329.1052)


   

N-(2-Fluorenyl)phthalamic acid

N-(2-Fluorenyl)phthalamic acid

C21H15NO3 (329.1052)


   

4-(1-phenylethyl)-3-(5-propyl-3-thiophenyl)-1H-1,2,4-triazole-5-thione

4-(1-phenylethyl)-3-(5-propyl-3-thiophenyl)-1H-1,2,4-triazole-5-thione

C17H19N3S2 (329.102)


   

Dimethyl 2-[(phenoxycarbonyl)amino]terephthalate

Dimethyl 2-[(phenoxycarbonyl)amino]terephthalate

C17H15NO6 (329.0899)


   

1-S-(N-hydroxy-2-phenylethanimidoyl)-1-thio-beta-D-glucopyranose

1-S-(N-hydroxy-2-phenylethanimidoyl)-1-thio-beta-D-glucopyranose

C14H19NO6S (329.0933)


   

(S)-2-(N-(2-Ethyl-6-methylphenyl)-2-sulfoacetamido)propanoic acid

(S)-2-(N-(2-Ethyl-6-methylphenyl)-2-sulfoacetamido)propanoic acid

C14H19NO6S (329.0933)


   

4-({[(4-Methylpiperazin-1-YL)amino]carbonothioyl}amino)benzenesulfonamide

4-({[(4-Methylpiperazin-1-YL)amino]carbonothioyl}amino)benzenesulfonamide

C12H19N5O2S2 (329.098)


   

2-(4-Hydroxybiphenyl-3-Yl)-4-Methyl-1h-Isoindole-1,3(2h)-Dione

2-(4-Hydroxybiphenyl-3-Yl)-4-Methyl-1h-Isoindole-1,3(2h)-Dione

C21H15NO3 (329.1052)


   

5-[(Z)-(5-Chloro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-N-(diethylamino)ethyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

5-[(Z)-(5-Chloro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-N-(diethylamino)ethyl]-2,4-dimethyl-1H-pyrrole-3-carboxamide

C17H16ClN3O2 (329.0931)


   

5-hydroxy-2-[[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid

5-hydroxy-2-[[(E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoyl]amino]benzoic acid

C17H15NO6 (329.0899)


   

4-[[(4-Acetyloxy-3-methoxyphenyl)-oxomethyl]amino]benzoic acid

4-[[(4-Acetyloxy-3-methoxyphenyl)-oxomethyl]amino]benzoic acid

C17H15NO6 (329.0899)


   

1-[1-Naphthalenyl(oxo)methyl]-3-indolecarboxylic acid methyl ester

1-[1-Naphthalenyl(oxo)methyl]-3-indolecarboxylic acid methyl ester

C21H15NO3 (329.1052)


   

4-chloro-1-methyl-N-[1-[(4-methylphenyl)methyl]-3-pyrazolyl]-3-pyrazolecarboxamide

4-chloro-1-methyl-N-[1-[(4-methylphenyl)methyl]-3-pyrazolyl]-3-pyrazolecarboxamide

C16H16ClN5O (329.1043)


   

N-[3-(4-chlorophenyl)-5-oxo-4-pyrazolidinyl]-3-methylbenzamide

N-[3-(4-chlorophenyl)-5-oxo-4-pyrazolidinyl]-3-methylbenzamide

C17H16ClN3O2 (329.0931)


   

N-(3-chloro-4-methylphenyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide

N-(3-chloro-4-methylphenyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide

C17H16ClN3O2 (329.0931)


   

N-[1-[2-(2-chlorophenoxy)ethyl]-2-benzimidazolyl]acetamide

N-[1-[2-(2-chlorophenoxy)ethyl]-2-benzimidazolyl]acetamide

C17H16ClN3O2 (329.0931)


   

2-Hydroxy-7,8-dihydropteroate

2-Hydroxy-7,8-dihydropteroate

C14H13N6O4- (329.0998)


   

3,7-Bis(dimethylamino)-4-nitrophenothiazin-5-ium

3,7-Bis(dimethylamino)-4-nitrophenothiazin-5-ium

C16H17N4O2S+ (329.1072)


   

3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-, 3-methyl ester

3,5-Pyridinedicarboxylic acid, 4-(2,1,3-benzoxadiazol-4-yl)-1,4-dihydro-2,6-dimethyl-, 3-methyl ester

C16H15N3O5 (329.1012)


   

(5E)-5-[[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-methylimino-1,3-thiazolidin-4-one

(5E)-5-[[1-(2-fluorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-2-methylimino-1,3-thiazolidin-4-one

C17H16FN3OS (329.0998)


   

[(2R,3R,4R)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate

[(2R,3R,4R)-4-acetyloxy-5-(4-amino-5-fluoro-2-oxopyrimidin-1-yl)-2-methyloxolan-3-yl] acetate

C13H16FN3O6 (329.1023)


   
   
   

Tri-butyltin chloride

Tri-butyltin chloride

C12H30ClSn- (329.1058)


   

FLURIDONE

FLURIDONE

C19H14F3NO (329.1027)


D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

Valiglurax

Valiglurax

C16H10F3N5 (329.0888)


Valiglurax (VU0652957) is a potent, orally active and selective mGlu4 positive allosteric modulator with EC50 values of 64.6 nM and 197 nM for hmGlu4/Gqi5 and rmGlu4 GIRK, respectively. Valiglurax is a central nervous system (CNS) penetrant. Valiglurax can be used in research of Parkinson's disease[1].

   

n-[(1z)-1,4-bis(3,4-dihydroxyphenyl)-3-oxobut-1-en-2-yl]carboximidic acid

n-[(1z)-1,4-bis(3,4-dihydroxyphenyl)-3-oxobut-1-en-2-yl]carboximidic acid

C17H15NO6 (329.0899)


   

2,3- diacetoxyl maytenusone

NA

C13H16FN3O6 (329.1023)


{"Ingredient_id": "HBIN003960","Ingredient_name": "2,3- diacetoxyl maytenusone","Alias": "NA","Ingredient_formula": "C13H16FN3O6","Ingredient_Smile": "CC1C(C(C(O1)N2C=C(C(=NC2=O)N)F)OC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "42934","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

6-[2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-3-(5-hydroxy-3,4-dihydro-2h-pyrrol-3-yl)pyran-2-one

6-[2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-3-(5-hydroxy-3,4-dihydro-2h-pyrrol-3-yl)pyran-2-one

C17H15NO6 (329.0899)


   

5-hydroxy-2-{[(2e)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]amino}benzoic acid

5-hydroxy-2-{[(2e)-1-hydroxy-3-(4-hydroxy-3-methoxyphenyl)prop-2-en-1-ylidene]amino}benzoic acid

C17H15NO6 (329.0899)


   

n-[1,4-bis(3,4-dihydroxyphenyl)-3-oxobut-1-en-2-yl]carboximidic acid

n-[1,4-bis(3,4-dihydroxyphenyl)-3-oxobut-1-en-2-yl]carboximidic acid

C17H15NO6 (329.0899)


   

7-acetyl-1,7-dihydroxy-3-methoxy-5h,6h-cyclohepta[b]quinoline-8,11-dione

7-acetyl-1,7-dihydroxy-3-methoxy-5h,6h-cyclohepta[b]quinoline-8,11-dione

C17H15NO6 (329.0899)


   

(7r)-7-acetyl-1,7-dihydroxy-3-methoxy-5h,6h-cyclohepta[b]quinoline-8,11-dione

(7r)-7-acetyl-1,7-dihydroxy-3-methoxy-5h,6h-cyclohepta[b]quinoline-8,11-dione

C17H15NO6 (329.0899)


   

6-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-3-(5-hydroxy-3,4-dihydro-2h-pyrrol-3-yl)pyran-2-one

6-[(1e)-2-(3,4-dihydroxyphenyl)ethenyl]-4-hydroxy-3-(5-hydroxy-3,4-dihydro-2h-pyrrol-3-yl)pyran-2-one

C17H15NO6 (329.0899)