Exact Mass: 329.1058

Exact Mass Matches: 329.1058

Found 67 metabolites which its exact mass value is equals to given mass value 329.1058, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

griffonin

(Z)-2-((4R,5S,6S)-4,5-Dihydroxy-6-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)cyclohex-2-en-1-ylidene)acetonitrile

C14H19NO8 (329.1111)


Lithospermoside is a glycoside. Lithospermoside is a natural product found in Tylosema fassoglense, Semiaquilegia adoxoides, and other organisms with data available. Lithospermoside (Griffonin) is a nature product isolated from the stem bark of Semiaquilegia adoxoides [1]. Lithospermoside (Griffonin) is a nature product isolated from the stem bark of Semiaquilegia adoxoides [1].

   

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

   

Dopamine glucuronide

(2S,3S,4S,5R,6S)-6-[4-(2-aminoethyl)-2-hydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

C14H19NO8 (329.1111)


Dopamine glucuronide is a natural human metabolite of Dopamine generated in the liver by UDP glucuonyltransferase. Glucuronidation is used to assist in the excretion of toxic substances, drugs or other substances that cannot be used as an energy source. Glucuronic acid is attached via a glycosidic bond to the substance, and the resulting glucuronide, which has a much higher water solubility than the original substance, is eventually excreted by the kidneys. Dopamine glucuronide is a natural human metabolite of Dopamine generated in the liver by UDP glucuonyltransferase.

   

5-(Acetoxymethyl)-2-methyl-5,6,7,7a-tetrahydro-3ah-pyrano[3,2-d]oxazole-6,7-diyl diacetate

5-(Acetoxymethyl)-2-methyl-5,6,7,7a-tetrahydro-3ah-pyrano[3,2-D]oxazole-6,7-diyl diacetic acid

C14H19NO8 (329.1111)


   

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)


   
   
   

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

   
   
   
   
   
   
   

Dopamine glucuronide

4-(2-Aminoethyl)-2-hydroxyphenyl beta-delta-glucopyranosiduronic acid

C14H19NO8 (329.1111)


   

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)


   

alpha-hydroxyalprazolam-d5

alpha-hydroxyalprazolam-d5

C17H8ClD5N4O (329.1092)


   
   

(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)


   

BICYCLO[4.1.0]HEPTANE-7-CARBOXYLIC ACID

BICYCLO[4.1.0]HEPTANE-7-CARBOXYLIC ACID

C18H19NO3S (329.1086)


   

Etofylline nicotinate

2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl nicotinate

C15H15N5O4 (329.1124)


C - Cardiovascular system > C04 - Peripheral vasodilators > C04A - Peripheral vasodilators > C04AD - Purine derivatives

   

N,N-DiBoc-4-amino-6-chloropyrimidine

N,N-DiBoc-4-amino-6-chloropyrimidine

C14H20ClN3O4 (329.1142)


   

4-{[(1,3-Dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1h-purin-8-yl)methyl]amino}benzoic acid

Benzoic acid,4-[[(2,3,6,9-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-yl)methyl]amino]-

C15H15N5O4 (329.1124)


   

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)


   

5-Epilithospermoside

5-Epilithospermoside

C14H19NO8 (329.1111)


   
   

Solvent Violet 13

Solvent Violet 13

C21H15NO3 (329.1052)


   

p-phenetidine citrate

p-phenetidine citrate

C14H19NO8 (329.1111)


   

(S)-3-(4-Fluoro-benzenesulfonyl)-pyrrolidine-1-carboxylic acid tert-butyl ester

(S)-3-(4-Fluoro-benzenesulfonyl)-pyrrolidine-1-carboxylic acid tert-butyl ester

C15H20FNO4S (329.1097)


   

(R)-3-(4-Fluoro-benzenesulfonyl)-pyrrolidine-1-carboxylic acid tert-butyl ester

(R)-3-(4-Fluoro-benzenesulfonyl)-pyrrolidine-1-carboxylic acid tert-butyl ester

C15H20FNO4S (329.1097)


   

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)


   

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)


   

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)


   

2-(4,6-Dimethyl-2-pyrimidinyl)-4-[(4-fluorophenyl)thio]-5-methyl-3-pyrazolamine

2-(4,6-Dimethyl-2-pyrimidinyl)-4-[(4-fluorophenyl)thio]-5-methyl-3-pyrazolamine

C16H16FN5S (329.111)


   

4-Methyl-3-[[1-oxo-3-(phenylthio)propyl]amino]benzoic acid methyl ester

4-Methyl-3-[[1-oxo-3-(phenylthio)propyl]amino]benzoic acid methyl ester

C18H19NO3S (329.1086)


   

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)


   

3-Phenyl-2-thiophen-2-yl-4,5-dihydroimidazo[1,2-a]quinolin-10-ium

3-Phenyl-2-thiophen-2-yl-4,5-dihydroimidazo[1,2-a]quinolin-10-ium

C21H17N2S+ (329.1112)


   

(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)


   
   
   
   
   
   
   

2-methyl-5-nitrobenzyl alpha-D-glucopyranoside

2-methyl-5-nitrobenzyl alpha-D-glucopyranoside

C14H19NO8 (329.1111)


   

(2S,3S,4S,5R)-6-[4-(2-aminoethyl)-2-hydroxyphenoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid

(2S,3S,4S,5R)-6-[4-(2-aminoethyl)-2-hydroxyphenoxy]-3,4,5-trihydroxy-2-oxanecarboxylic acid

C14H19NO8 (329.1111)


   

Tri-butyltin chloride

Tri-butyltin chloride

C12H30ClSn- (329.1058)


   

FLURIDONE

FLURIDONE

C19H14F3NO (329.1027)


D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

   

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"}

   

2-[(1z,4r,5r,6s)-4,5-dihydroxy-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

2-[(1z,4r,5r,6s)-4,5-dihydroxy-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

C14H19NO8 (329.1111)


   

2-[(1z,4s,5r,6r)-4,5-dihydroxy-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

2-[(1z,4s,5r,6r)-4,5-dihydroxy-6-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

C14H19NO8 (329.1111)


   

2-[(1z,4r,5s,6s)-4,5-dihydroxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

2-[(1z,4r,5s,6s)-4,5-dihydroxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

C14H19NO8 (329.1111)


   

2-[(1z)-4,5-dihydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

2-[(1z)-4,5-dihydroxy-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-ylidene]acetonitrile

C14H19NO8 (329.1111)


   

(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[4-(2-nitroethyl)phenoxy]oxane-3,4,5-triol

(2r,3s,4s,5r,6s)-2-(hydroxymethyl)-6-[4-(2-nitroethyl)phenoxy]oxane-3,4,5-triol

C14H19NO8 (329.1111)