Exact Mass: 451.0687572

Exact Mass Matches: 451.0687572

Found 70 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

5-Methylsulfinylpentyl glucosinolate

C13H25NO10S3 (451.064055)

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

5-Benzoylphosphoadenosine

C17H18N5O8P (451.0892958)

4-Phenylbutyl glucosinolate

{[(e)-(5-phenyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulphanyl}pentylidene)amino]oxy}sulphonic acid

C17H25NO9S2 (451.097068)

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)

(2S,3S,4S,5R,6S)-6-{2-[(3-chloro-2-formylphenyl)amino]benzoyloxy}-3,4,5-trihydroxyoxane-2-carboxylic 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

5-Chloro-N-(4-methoxy-3-(piperazin-1-yl)phenyl)-3-methylbenzo[b]thiophene-2-sulphonamide

C20H22ClN3O3S2 (451.0791052)

4-Methylsulfonyl-3-butenyl glucosinolate

{[(e)-[(4E)-5-methanesulphonyl-1-{[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulphanyl}pent-4-en-1-ylidene]amino]oxy}sulphonic acid

C12H21NO11S3 (451.0276716)

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.

Acquisition and generation of the data is financially supported by the Max-Planck-Society

MMV688921

C23H18ClN3O5 (451.09349280000004)

Yokonoside

C20H21NO11 (451.1114556)

Tri-Ac-(-)-Urothione

C17H17N5O6S2 (451.0620222)

BE-54017

C23H18ClN3O5 (451.09349280000004)

C23H17NO9

C23H17NO9 (451.09032720000005)

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

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)

5-Methylsulfinyl-n-pentyl glucosinolate

C13H25NO10S3 (451.064055)

MMV688921

C23H18N3O5Cl (451.09349280000004)

(Methylsulfinyl)pentyl glucosinolate

C13H25NO10S3 (451.064055)

Annotation level-3

Flumazenil glucoronide

C19H18FN3O9 (451.102703)

4-Phenylbutyl glucosinolate

{[(E)-(5-phenyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}pentylidene)amino]oxy}sulfonic acid

C17H25NO9S2 (451.097068)

Cytonal disodium salt

C18H22NaO8P2+ (451.0687572)

4-DAMP

4-Damp methiodide

C21H26INO2 (451.1008206)

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)

[[(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

C12H21NO11S3 (451.0276716)

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)

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)