Exact Mass: 451.0687572
Exact Mass Matches: 451.0687572
Found 82 metabolites which its exact mass value is equals to given mass value 451.0687572,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Glucoalyssin
A thia-glucosinolic acid that is glucoberteroin in which the sulfur atom of the methyl thioether group has been oxidised to the corresponding sulfoxide. Acquisition and generation of the data is financially supported by the Max-Planck-Society
4-Phenylbutyl glucosinolate
4-Phenylbutyl glucosinolate is found in brassicas. 4-Phenylbutyl glucosinolate is present in horseradish (Armoracia lapathifolia). Present in horseradish (Armoracia lapathifolia). 4-Phenylbutyl glucosinolate is found in horseradish and brassicas.
(beta-1-O-[N-(2-formyl-3-chlorophenyl)anthraniloyl]-D-glucupyranuronic acid)
C20H18ClNO9 (451.06700480000006)
(beta-1-O-[N-(2-formyl-3-chlorophenyl)anthraniloyl]-D-glucupyranuronic acid) belongs to the family of Glucuronides. These are compounds comprising the glucuronic acid linked to another substance via a glycosidic bond.
5-Chloro-N-(4-methoxy-3-(piperazin-1-yl)phenyl)-3-methylbenzo[b]thiophene-2-sulfonamide
4-Methylsulfonyl-3-butenyl glucosinolate
4-methylsulfonyl-3-butenyl glucosinolate is a member of the class of compounds known as alkylglucosinolates. Alkylglucosinolates are organic compounds containing a glucosinolate moiety that carries an alkyl chain. 4-methylsulfonyl-3-butenyl glucosinolate is slightly soluble (in water) and an extremely strong acidic compound (based on its pKa). 4-methylsulfonyl-3-butenyl glucosinolate can be found in radish, which makes 4-methylsulfonyl-3-butenyl glucosinolate a potential biomarker for the consumption of this food product.
beta-D-Glucopyranose,1-thio-,1-(5-(methylsulfinyl)-N-(sulfooxy)-4-pentenimidate
Acquisition and generation of the data is financially supported by the Max-Planck-Society
1-<(caffeoyloxy)(carboxy)methoxy>-1H-pyrrole-2,3,5-tricarboxylic acid|1-[(caffeoyloxy)(carboxy)methoxy]-1H-pyrrole-2,3,5-tricarboxylic acid|1-[Caffeoyloxy(carboxy)methoxy]-1H-pyrrole-2,3,4-tricarboxylix acid
C18H13NO13 (451.03868880000005)
4-Phenylbutyl glucosinolate
4-DAMP
D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018680 - Cholinergic Antagonists
2-Thiophenecarboxamide, 5-chloro-N-[(1R)-1-(methoxymethyl)-2-[[3-methyl-4-(3-oxo-4-morpholinyl)phenyl]amino]-2-oxoethyl]-
C20H22ClN3O5S (451.0968632000001)
4-(p-dimethylaminophenyl)-2,6-diphenylpyrylium perchlorate
C25H22ClNO5 (451.11864320000007)
(5S,6R)-6-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-5-(4-fluorophenyl)-3-morpholinone
C20H16F7NO3 (451.10183500000005)
5-Amino-2-[2-[4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-2-sulphophenyl]vinyl]benzenesulphonic acid
SeMicarbazide-13C,15N2 Hydrochloride
13CH6ClN15N2O (451.06297359999996)
1H-BenziMidazole, 2-[[[3-Methyl-4-(2,2,2-trifluoroethoxy)-2-pyridinyl]Methyl]sulfinyl]-1-(2,2,2-trifluoroethyl)-
DL-ERYTHRO-4-FLUOROGLUTAMIC ACID
C20H23BrClN3O2 (451.06620680000003)
1-(4-chlorophenyl)-6-[[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]thio]-2H-pyrazolo[3,4-d]pyrimidin-4-one
[[(E)-5-methylsulfinyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-sulfanyloxan-2-yl]pent-4-enoyl]amino] hydrogen sulfate
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-6-methylsulfinyl-N-sulfooxyhexanimidothioate
beta-D-Glucopyranose, 1-thio-, 1-(6-(methylsulfinyl)-N-(sulfooxy)hexanimidate)
5-[(4-Fluorophenyl)methyl]-7-(4-methylphenyl)sulfonyl-[1,3]dioxolo[4,5-g]quinolin-8-one
6-(4-bromophenyl)-3-methyl-1-[2-(2H-tetrazol-5-yl)ethyl]-4-(trifluoromethyl)pyrazolo[3,4-b]pyridine
C17H13BrF3N7 (451.03678340000005)
5-chloro-2-[(4-methylphenyl)methylsulfonyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-pyrimidinecarboxamide
5-chloro-2-[(3-methylphenyl)methylsulfonyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-pyrimidinecarboxamide
[4-[5-Chloro-2-(3-chlorophenyl)-7-pyrazolo[1,5-a]pyrimidinyl]-1-piperazinyl]-phenylmethanone
3-[[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(2-furanylmethyl)propanamide
C20H16F3N3O4S (451.08135720000007)
N-(2-chlorophenyl)-4-[[(2-methoxy-4-nitroanilino)-sulfanylidenemethyl]hydrazo]-4-oxobutanamide
C18H18ClN5O5S (451.07171280000006)
3-(4-fluorophenyl)-1-[(6-oxo-5H-[1,3]dioxolo[4,5-g]quinolin-7-yl)methyl]-1-(thiophen-2-ylmethyl)urea
C23H18FN3O4S (451.10020000000003)
3-[[2-[[6-Fluoro-2-(4-fluorophenyl)-4-quinazolinyl]thio]-1-oxoethyl]amino]benzoic acid
C23H15F2N3O3S (451.08021440000005)
2-[(4-cyanophenyl)methylthio]-N-(2-methoxyphenyl)-1,3-benzoxazole-5-sulfonamide
1-(3-Methoxyphenyl)-2-[[4-methyl-5-[[(4-phenyl-2-thiazolyl)amino]methyl]-1,2,4-triazol-3-yl]thio]ethanone
5-bromo-N-[3-(dimethylamino)propyl]-N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-thiophenecarboxamide
N-[(2R,3S,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
N-[(2S,3R,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
N-[(2R,3R,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
N-[(2R,3R,6S)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
2-[(1S,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
C21H22FNO7S (451.11009540000003)
2-[(1R,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
C21H22FNO7S (451.11009540000003)
2-[(1S,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
C21H22FNO7S (451.11009540000003)
N-[(2S,3R,6S)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
N-[(2R,3S,6S)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
N-[(2S,3S,6S)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
N-[(2S,3S,6R)-6-[2-[(3,4-dichlorophenyl)methylamino]-2-oxoethyl]-2-(hydroxymethyl)-3-oxanyl]-3-pyridinecarboxamide
C21H23Cl2N3O4 (451.10655380000003)
2-[(1R,3R,4aR,9aS)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
C21H22FNO7S (451.11009540000003)
2-[(1S,3R,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
C21H22FNO7S (451.11009540000003)
2-[(1R,3S,4aS,9aR)-6-[(4-fluorophenyl)sulfonylamino]-1-(hydroxymethyl)-3,4,4a,9a-tetrahydro-1H-pyrano[3,4-b]benzofuran-3-yl]acetic acid methyl ester
C21H22FNO7S (451.11009540000003)
(2R,4R,5R)-2-[4-(1-benzofuran-2-yl)-6-chloropyrimido[4,5-b]indol-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
C23H18ClN3O5 (451.09349280000004)
2-amino-n-{[(2r,3s,4r,5r)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxysulfonyl}propanimidic acid
C13H18ClN7O7S (451.06769080000004)
1-[carboxy({[3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})methoxy]pyrrole-2,3,5-tricarboxylic acid
C18H13NO13 (451.03868880000005)
(2s)-2-amino-n-{[(2r,3s,4r,5r)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxysulfonyl}propanimidic acid
C13H18ClN7O7S (451.06769080000004)
4-[(2s)-2-{[(6-bromo-1h-indol-3-yl)(hydroxy)methylidene]amino}-2-carboxyethyl]-1,3-dimethyl-5-(methylsulfanyl)-2h-imidazol-2-yl
5-(2-{[(6-bromo-1h-indol-3-yl)(hydroxy)methylidene]amino}-2-carboxyethyl)-1,3-dimethyl-4-(methylsulfanyl)imidazol-1-ium
methyl (5r,6s)-6,11,13-trihydroxy-9,19-dioxo-4,18-dioxa-17-azahexacyclo[15.6.1.0²,¹⁵.0³,¹².0⁵,¹⁰.0²⁰,²⁴]tetracosa-1(24),2(15),3(12),10,13,20,22-heptaene-5-carboxylate
C23H17NO9 (451.09032720000005)
[(e)-(6-methanesulfinyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}hexylidene)amino]oxysulfonic acid
methyl (10s,11s)-3,5,10-trihydroxy-7,19-dioxo-12,18-dioxa-17-azahexacyclo[15.6.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹.0²⁰,²⁴]tetracosa-1(24),2(15),3,5,13,20,22-heptaene-11-carboxylate
C23H17NO9 (451.09032720000005)
[(e)-[(4s)-4-hydroxy-6-(methylsulfanyl)-1-{[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}hexylidene]amino]oxysulfonic acid
methyl (10s,11r)-3,5,10-trihydroxy-7,19-dioxo-12,18-dioxa-17-azahexacyclo[15.6.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹.0²⁰,²⁴]tetracosa-1(24),2(15),3,5,13,20,22-heptaene-11-carboxylate
C23H17NO9 (451.09032720000005)
(2s)-2-amino-n-{[(2r,3s,4r,5s)-5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxysulfonyl}propanimidic acid
C13H18ClN7O7S (451.06769080000004)
2-amino-n-{[5-(6-amino-2-chloropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxysulfonyl}propanimidic acid
C13H18ClN7O7S (451.06769080000004)
1-[(r)-carboxy({[(2e)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy})methoxy]pyrrole-2,3,5-tricarboxylic acid
C18H13NO13 (451.03868880000005)
methyl (5s,6s)-6,11,13-trihydroxy-9,19-dioxo-4,18-dioxa-17-azahexacyclo[15.6.1.0²,¹⁵.0³,¹².0⁵,¹⁰.0²⁰,²⁴]tetracosa-1(24),2(15),3(12),10,13,20,22-heptaene-5-carboxylate
C23H17NO9 (451.09032720000005)