Exact Mass: 326.06377940000004
Exact Mass Matches: 326.06377940000004
Found 79 metabolites which its exact mass value is equals to given mass value 326.06377940000004,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
TRIPHENYL PHOSPHATE
C18H15O4P (326.07079200000004)
CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9628; ORIGINAL_PRECURSOR_SCAN_NO 9627 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9676; ORIGINAL_PRECURSOR_SCAN_NO 9675 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9722; ORIGINAL_PRECURSOR_SCAN_NO 9720 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9722; ORIGINAL_PRECURSOR_SCAN_NO 9721 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9686; ORIGINAL_PRECURSOR_SCAN_NO 9683 CONFIDENCE standard compound; INTERNAL_ID 491; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9737; ORIGINAL_PRECURSOR_SCAN_NO 9735 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3638 CONFIDENCE standard compound; INTERNAL_ID 2464 CONFIDENCE standard compound; INTERNAL_ID 8249 CONFIDENCE standard compound; INTERNAL_ID 8795 CONFIDENCE standard compound; INTERNAL_ID 4175
Fertaric acid
Fertaric acid is a the ester of tartaric acid and the phenolic acid ferulic acid, a type of polyphenol. Polyphenol are secondary plant metabolites and components of grapes, wines and beers. They contribute to the sensory characteristics of wine. Yeast can influence the polyphenolic wine composition by adsorbing them throught its cell wall during wine making. [Caridi 2004]
Feruloyltartaric acid
Feruloyltartaric acid, also known as trans-fertaric acid or feruloyltartarate, belongs to coumaric acids and derivatives class of compounds. Those are aromatic compounds containing Aromatic compounds containing a cinnamic acid moiety (or a derivative thereof) hydroxylated at the C2 (ortho-), C3 (meta-), or C4 (para-) carbon atom of the benzene ring. Feruloyltartaric acid is practically insoluble (in water) and a moderately acidic compound (based on its pKa). Feruloyltartaric acid can be found in common grape, grape wine, sherry, and vinegar, which makes feruloyltartaric acid a potential biomarker for the consumption of these food products.
3,5,7-Ttrihydroxylchromone 3-O-??-D-xylopyranoside
(2R,2S,4S)-gamma-Glutamylmarasmine|gamma-Glutamylmarasmine
C10H18N2O6S2 (326.06062479999997)
(-)-3-O-galloylshikimic acid|(-)-shikimic acid 3-O-gallate|3-O-galloyl shikimic acid|3-O-galloyl-(-)-shikimic acid|3-O-Galloylshikimic acid|5-O-galloylshikimic acid|shikimic acid 5-O-gallate
4-O-galloyl-(-)-shikimic acid|4-O-Galloylshikimic acid
METHYL 3-([[3-(TRIFLUOROMETHYL)PHENYL]THIO]METHYL)BENZOATE
C16H13F3O2S (326.05883140000003)
ethyl 3-bromo-4-(4-methylpiperazin-1-yl)benzoate
C14H19BrN2O2 (326.06298139999996)
3-bromo-4-(4-propan-2-ylpiperazin-1-yl)benzoic acid
C14H19BrN2O2 (326.06298139999996)
3-bromo-4-[(4-ethylpiperazin-1-yl)methyl]benzoic acid
C14H19BrN2O2 (326.06298139999996)
methyl 3-bromo-4-[(3-methylpiperazin-1-yl)methyl]benzoate
C14H19BrN2O2 (326.06298139999996)
4-Boc-7-Bromo-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine
C14H19BrN2O2 (326.06298139999996)
(6Z,6Z)-6,6-{1,2-Ethanediylbis[imino(Z)methylylidene]}bis(2,4-c yclohexadien-1-one) - nickel (1:1)
C16H16N2NiO2 (326.05651859999995)
1-(2,4-DICHLOROPHENETHYL)HYDRAZINEHYDROCHLORIDE
C15H16Cl2N2O2 (326.05887759999996)
Silane, [(5-bromo-2,3-dihydro-1H-inden-1-yl)oxy](1,1-dimethylethyl)dimethyl-
[4-(6-acetyloxy-1-benzothiophen-2-yl)phenyl] acetate
C18H14O4S (326.06127640000005)
2-Boc-5-bromo-1,2,3,4-tetrahydroisoquinolin-8-amine
C14H19BrN2O2 (326.06298139999996)
3-(2-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C14H19BrN2O2 (326.06298139999996)
3-(3-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C14H19BrN2O2 (326.06298139999996)
3-(4-BROMO-PHENYLAMINO)-AZETIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C14H19BrN2O2 (326.06298139999996)
4-CHLORO-2-[2-PHENYLVINYL]-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDINE
C18H15ClN2S (326.06444200000004)
2-(4-(2-Bromoethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
C14H20BBrO3 (326.06887800000004)
2-(3-(2-Bromoethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
C14H20BBrO3 (326.06887800000004)
2-(3-Bromo-5-ethoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
C14H20BBrO3 (326.06887800000004)
2-Pentafluorophenyl-malonic acid diethyl ester
C13H11F5O4 (326.05774660000003)
Tris(4-hydroxyphenyl)phosphine oxide
C18H15O4P (326.07079200000004)
5-tert-butyl-2-[(2,4-dichlorophenyl)methyl]pyrazole-3-carboxylic acid
C15H16Cl2N2O2 (326.05887759999996)
Dimethyl(acetylacetonate)gold(III), (99.9\\%-Au)
C7H13AuO2 (326.05810979999995)
7-(4-methylsulfanylphenyl)-5-thiophen-2-yl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
4-(1-Sulfo-1-carboxylethyl) Edaravone
C13H14N2O6S (326.05725440000003)
4-[[(2-Methyl-1,3-benzothiazol-6-yl)-oxomethyl]amino]benzoic acid methyl ester
C17H14N2O3S (326.07250940000006)
N-(2-methoxyphenyl)-N-[(Z)-(3-oxo-1-benzothiophen-2-ylidene)amino]acetamide
C17H14N2O3S (326.07250940000006)
2-(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)-N-phenylacetamide
C17H14N2O3S (326.07250940000006)
2-[(4-Chlorophenyl)methyl]-4-(prop-2-enylthio)quinazoline
C18H15ClN2S (326.06444200000004)
5-(1,3-benzodioxol-5-yl)-3-[3-(methylthio)phenyl]-1H-imidazol-2-one
C17H14N2O3S (326.07250940000006)
2-amino-4,6-dimethyl-3-oxo-3H-phenoxazine-1,9-dicarboxylate
C16H10N2O6-2 (326.05388400000004)
(2S,3S)-trans-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of trans-ferulic acid with one of the hydroxy groups of D-tartaric acid.
1-Methyl-4-[(4-methylphenyl)thio]-3-nitro-2-quinolinone
C17H14N2O3S (326.07250940000006)
N-(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)-2-furancarboxamide
C17H14N2O3S (326.07250940000006)
1-(Phenylmethyl)-3-[4-(trifluoromethoxy)phenyl]thiourea
C15H13F3N2OS (326.07006440000004)
4-[2,3,5,6-Tetrafluoro-4-(1-propen-1-yl)phenoxy]benzoic acid
C16H10F4O3 (326.05660379999995)
3-(4-Fluorophenyl)-6-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-[[[5-(Phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]methyl]benzoic acid
C17H14N2O3S (326.07250940000006)
1,1-Difluoro-2-[(4-hydroxy-1-adamantyl)oxy]-2-oxoethanesulfonic acid
C12H16F2O6S (326.06356200000005)
(2R,3R)-cis-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of cis-ferulic acid with one of the hydroxy groups of L-tartaric acid.
(2S,3S)-cis-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of cis-ferulic acid with one of the hydroxy groups of D-tartaric acid.
(3E)-3-[[4-(Methylamino)-3-nitrophenyl]methylidene]thiochromen-4-one
C17H14N2O3S (326.07250940000006)
(2R,3R)-trans-fertaric acid
A cinnamate ester obtained by formal condensation of the carboxy group of trans-ferulic acid with one of the hydroxy groups of L-tartaric acid.
3a-chloro-6a-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-4-hydroxy-tetrahydrocyclopenta[c]furan-1-one
C15H15ClO6 (326.05571199999997)
3,5,7-ttrihydroxylchromone 3-o-β-d-xylopyra-noside
{"Ingredient_id": "HBIN007586","Ingredient_name": "3,5,7-ttrihydroxylchromone 3-o-\u03b2-d-xylopyra-noside","Alias": "NA","Ingredient_formula": "C14H14O9","Ingredient_Smile": "C1C(C(C(C(O1)OC2=COC3=CC(=CC(=C3C2=O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "22055","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-2-amino-4-{[(1r)-1-carboxy-2-[(r)-(methylsulfanyl)methanesulfinyl]ethyl]-c-hydroxycarbonimidoyl}butanoic acid
C10H18N2O6S2 (326.06062479999997)
(5r)-4,5-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)cyclohex-1-ene-1-carboxylic acid
(5r)-3,5-dihydroxy-4-(3,4,5-trihydroxybenzoyloxy)cyclohex-1-ene-1-carboxylic acid
4,5-dihydroxy-3-(3,4,5-trihydroxybenzoyloxy)cyclohex-1-ene-1-carboxylic acid
2,3-dihydroxy-2-[(2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]butanedioic acid
3,4-dihydroxy-5-(3,4,5-trihydroxybenzoyloxy)cyclohex-1-ene-1-carboxylic acid
5-hydroxy-3-(4-hydroxy-3-nitrophenyl)-4-(4-hydroxyphenyl)pyrrol-2-one
C16H10N2O6 (326.05388400000004)
2-amino-4-{[1-carboxy-2-(methylsulfanyl)methanesulfinylethyl]-c-hydroxycarbonimidoyl}butanoic acid
C10H18N2O6S2 (326.06062479999997)
3,5-dihydroxy-4-(3,4,5-trihydroxybenzoyloxy)cyclohex-1-ene-1-carboxylic acid
(3r,4s,5r)-3,5-dihydroxy-4-(3,4,5-trihydroxybenzoyloxy)cyclohex-1-ene-1-carboxylic acid
(3ar,4s,6ar)-3a-chloro-6a-[2-(2,5-dihydroxyphenyl)-2-oxoethyl]-4-hydroxy-tetrahydrocyclopenta[c]furan-1-one
C15H15ClO6 (326.05571199999997)