Exact Mass: 452.0590886

Exact Mass Matches: 452.0590886

Found 91 metabolites which its exact mass value is equals to given mass value 452.0590886, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Acid Orange 3

2-Anilino-5-(2,4-dinitroanilino)-benzenesulfonic acid

C18H13N4NaO7S (452.04026280000005)

3,4-Hexahydroxydiphenoylarabinose

3,4,5,13,14,20,21,22-octahydroxy-9,12,16-trioxatetracyclo[16.4.0.0²,⁷.0¹⁰,¹⁵]docosa-1(22),2,4,6,18,20-hexaene-8,17-dione

C19H16O13 (452.0590886)

3,4-Hexahydroxydiphenoylarabinose is found in fruits. 3,4-Hexahydroxydiphenoylarabinose is isolated from fruits of Psidium guajava (guava). Isolated from fruits of Psidium guajava (guava). 3,4-Hexahydroxydiphenoylarabinose is found in fruits.

Torvanol A

(2E)-3-{4-hydroxy-3-methoxy-5-[6-methoxy-4-(sulphooxy)-3,4-dihydro-2H-1-benzopyran-3-yl]phenyl}prop-2-enoic acid

C20H20O10S (452.077714)

Torvanol A is found in fruits. Torvanol A is a constituent of the fruit of Solanum torvum. Constituent of the fruit of Solanum torvum. Torvanol A is found in fruits.

Allura red AC

6-Hydroxy-5-[(e)-2-(2-methoxy-5-methyl-4-sulphophenyl)diazen-1-yl]naphthalene-2-sulphonic acid

C18H16N2O8S2 (452.03480559999997)

Colour additive used in gelatins, puddings, custards, beverages, sauces, toppings, fruits, dairy products, bakery products, jams, jellies, condiments, meat and poultry Allura Red AC is a red azo dye that goes by several names including: Allura Red, Food Red 17, C.I. 16035, FD&C Red 40, 2-naphthalenesulfonic acid, 6-hydroxy-5-((2-methoxy-5-methyl-4-sulfophenyl)azo)-, disodium salt, and disodium 6-hydroxy-5-((2-methoxy-5-methyl-4-sulfophenyl)azo)-2-naphthalene-sulfonate. It is used as a food dye and has the E number E129. Allura Red AC was originally introduced in the United States as a replacement for the use of amaranth as a food coloring. Allura Red AC is one of many High Production Volume Chemicals. Some manufacturers of Allura Red AC include: Asim Products, Sanchi Chemicals Pvt. Ltd., and Warner-Jenkinson Europe Ltd. Upon its introduction into the market, there were fears that Allura Red AC was carcinogenic; however, studies have since shown that this is not the case.[citation needed] The initial reports of its consumption causing tumors have since been shown to have been caused by the presence of para-cresidine.[citation needed] Although para-cresidine is an important reactant in the manufacture of Allura Red AC and is a known carcinogen, further studies conducted since have found no trace of para-cresidine to be present in food-grade Allura Red AC.[citation needed]. Colour additive used in gelatins, puddings, custards, beverages, sauces, toppings, fruits, dairy products, bakery products, jams, jellies, condiments, meat and poultry

Lirodenine

4-{[(4-cyanophenyl)(phenyl)phosphoroso](phenyl)phosphoroso}benzonitrile

C26H18N2O2P2 (452.08434679999993)

Lirodenine is a member of the class of compounds known as benzonitriles. Benzonitriles are organic compounds containing a benzene bearing a nitrile substituent. Lirodenine is practically insoluble (in water) and an extremely weak basic (essentially neutral) compound (based on its pKa). Lirodenine can be found in custard apple, which makes lirodenine a potential biomarker for the consumption of this food product.

[(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate

C20H20O12 (452.09547200000003)

Polyhydroxyflavonoid glycosides

C20H20O12 (452.09547200000003)

1-O-p-hydroxybenzoyl-6-O-galloyl-beta-D-glucoside|1-O-p-hydroxybenzoyl-6-O-galloyl-beta-glucose

C20H20O12 (452.09547200000003)

premithramycinone G

C23H16O10 (452.0743436)

2-O-beta-D-(6-O-gentisoylglucopyranosyl)gentisic acid

C20H20O12 (452.09547200000003)

7-O-Methylmangiferin

C20H20O12 (452.09547200000003)

2-C-beta-D-glycopyranosyl-1,6,7-trihydroxy-3-methoxyxanthone|homomangiferin

C20H20O12 (452.09547200000003)

2-O-p-hydroxybenzoyl-6-O-galloyl-glucopyranose

C20H20O12 (452.09547200000003)

(8S,9R,10Xi)-10-iodo-6-methoxy-10,11-dihydro-cinchonan-9-ol|(8S,9R,10Xi)-10-Jod-6-methoxy-10,11-dihydro-cinchonan-9-ol

C20H25IN2O2 (452.09606999999994)

4-O-Methylpeniosanguin

C27H16O7 (452.0895986)

1,5,8-trihydroxy-4-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one

NCGC00380244-01!1,5,8-trihydroxy-4-methoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyxanthen-9-one

C20H20O12 (452.09547200000003)

[(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate

NCGC00380291-01![(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate

C20H20O12 (452.09547200000003)

[(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate [IIN-based: Match]

NCGC00380291-01![(2R,3S,4S,5R,6S)-6-(3,4-dihydroxybenzoyl)oxy-3,4,5-trihydroxyoxan-2-yl]methyl 3,4-dihydroxybenzoate [IIN-based: Match]

C20H20O12 (452.09547200000003)

Curry red

6-hydroxy-5-[2-(2-methoxy-5-methyl-4-sulfophenyl)diazen-1-yl]naphthalene-2-sulfonic acid

C18H16N2O8S2 (452.03480559999997)

3,4-Hexahydroxydiphenoylarabinose

3,4,5,13,14,20,21,22-octahydroxy-9,12,16-trioxatetracyclo[16.4.0.0^{2,7}.0^{10,15}]docosa-1(18),2(7),3,5,19,21-hexaene-8,17-dione

C19H16O13 (452.0590886)

Torvanol A

(2E)-3-{4-hydroxy-3-methoxy-5-[6-methoxy-4-(sulfooxy)-3,4-dihydro-2H-1-benzopyran-3-yl]phenyl}prop-2-enoic acid

C20H20O10S (452.077714)

1,5,8-Trihydroxy-4-methoxy-9-oxo-9H-xanthen-3-yl ?-D-glucopyranoside

C20H20O12 (452.09547200000003)

1,6-Bis-O-(3,4-dihydroxybenzoyl)-?-D-glucopyranose

C20H20O12 (452.09547200000003)

(5-BROMOTHIOPHEN-2-YL)TRIBUTYLSTANNANE

C16H29BrSSn (452.01952040000003)

Samarium,tris(2,4-pentanedionato-kO2,kO4)-, (OC-6-11)-

C15H24O6Sm (452.0770214)

cesium,tetraphenylboranuide

C24H20BCs (452.07123)

1H,1H,2H,2H-PERFLUOROOCTYLMETHYLDIMETHOXYSILANE

C11H13F13O2Si (452.04771939999995)

1-O-Acetyl-3,5-bis-O-(4-chlorobenzoyl)-2-deoxy-β-D-erythro-pentof uranose

C21H18Cl2O7 (452.04295379999996)

1,1-((1,4-phenylenebis(oxy))bis(4,1-phenylene))bis(1H-pyrrole-2,5-dione)

C26H16N2O6 (452.1008316)

(3-trimethylsilyl-2-propynyl)triphenylphosphonium bromide

C24H26BrPSi (452.07246660000004)

Bispyribac sodium

C19H17N4NaO8 (452.09440420000004)

D010575 - Pesticides > D006540 - Herbicides D016573 - Agrochemicals

N-(6-((4,5-DICYANO-1-METHYL-1H-IMIDAZOL-2-YL)DIAZENYL)-1-METHYL-1,2,3,4-TETRAHYDROQUINOLIN-7-YL)-1,1,1-TRIFLUOROMETHANESULFONAMIDE

C17H15F3N8O2S (452.0990726)

8-Bromo-7-but-2-ynyl-3-methyl-1-(4-methyl-quinazolin-2-ylmethyl)-3,7-dihydro-purine-2,6-dione

C20H17BrN6O2 (452.05962819999996)

1-O-Acetyl-3,5-bis-(4-chlorobenzoyl)-2-deoxy-D-ribose

C21H18Cl2O7 (452.04295379999996)

ethylenediaminetetraacetic acid tetrasodium salt

C10H20N2Na4O12 (452.0607)

Solvent black 7

C16H26ClIN2OSi (452.05476059999995)

2-Deoxy-beta-D-erythro-pentofuranose 1-acetate 3,5-bis(4-chlorobenzoate)

C21H18Cl2O7 (452.04295379999996)

1-Thio-beta-D-glucopyranose 2,3,4,6-tetraacetate 1-(O-ethylcarbonodithioate)

C17H24O10S2 (452.08108439999995)

LY-487379

C21H19F3N2O4S (452.1017570000001)

LY487379 is a selective human mGluR2 positive allosteric modulator (PAM). LY487379 potentiates glutamate-stimulated [35S]GTPγS binding with EC50 values of 1.7 μM and >10 μM for mGlu2 and mGlu3 receptors respectively. LY487379 promotes cognitive flexibility and facilitates behavioral inhibition in a rat model. LY487379 can be used for schizophrenia research[2].