Exact Mass: 435.9631

Exact Mass Matches: 435.9631

Found 37 metabolites which its exact mass value is equals to given mass value 435.9631, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Fipronil

5-Amino-1-(2,6-dichloro-alpha,alpha,alpha-trifluoro-p-tolyl)-4-trifluoromethylsulfinylpyrazole-3-carbonitile

C12H4Cl2F6N4OS (435.9387)


CONFIDENCE standard compound; INTERNAL_ID 591; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5015; ORIGINAL_PRECURSOR_SCAN_NO 5012 CONFIDENCE standard compound; INTERNAL_ID 591; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5011; ORIGINAL_PRECURSOR_SCAN_NO 5006 CONFIDENCE standard compound; INTERNAL_ID 591; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4981; ORIGINAL_PRECURSOR_SCAN_NO 4979 CONFIDENCE standard compound; INTERNAL_ID 591; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5023; ORIGINAL_PRECURSOR_SCAN_NO 5019 CONFIDENCE standard compound; INTERNAL_ID 591; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5006; ORIGINAL_PRECURSOR_SCAN_NO 5004 D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 1041 CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8783 CONFIDENCE standard compound; INTERNAL_ID 3464 CONFIDENCE standard compound; INTERNAL_ID 2413 D010575 - Pesticides > D007306 - Insecticides D016573 - Agrochemicals Fipronil is a broad-spectrum insecticide effective against Lepidoptera species as well as thrips, locusts, ants, cockroaches, fleas and ticks. Fipronil selectively inhibits GABA receptor with IC50s of 30 nM and 1600 nM for cockroach and rat GABA receptors, respectively. Glutamate-gated chloride channels (GluCls), which are present in cockroaches but not in mammals, are sensitive to the blocking effect of Fipronil. Fipronil also induces apoptosis in HepG2 cells and promotes the expression of CYP1A1 and CYP3A4 mRNA in human hepatocytes[1][2].

   

Sertaconazole

1-{2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole

C20H15Cl3N2OS (435.9971)


Sertaconazole is only found in individuals that have used or taken this drug. Sertaconazole nitrate is an antifungal medication of the imidazole class. It is available as a cream to treat skin infections such as athletes foot. [Wikipedia]Sertaconazole interacts with 14-alpha demethylase, a cytochrome P-450 enzyme necessary to convert lanosterol to ergosterol. As ergosterol is an essential component of the fungal cell membrane, inhibition of its synthesis results in increased cellular permeability causing leakage of cellular contents. Sertaconazole may also inhibit endogenous respiration, interact with membrane phospholipids, inhibit the transformation of yeasts to mycelial forms, inhibit purine uptake, and impair triglyceride and/or phospholipid biosynthesis. G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AF - Imidazole derivatives D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AC - Imidazole and triazole derivatives D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent

   

{2,6-dihydroxy-4-[4-hydroxy-7-(hydroxymethyl)-11-oxo-2,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),6,9-pentaen-3-yl]phenoxy}dihydroxyoxo-λ⁶-sulfanylium

{2,6-Dihydroxy-4-[4-hydroxy-7-(hydroxymethyl)-11-oxo-2,8-dioxatricyclo[7.3.1.0,(1)(3)]trideca-1(12),3,5(13),6,9-pentaen-3-yl]phenoxy}dihydroxyoxo-lambda-sulfanylium

C18H12O11S (436.01)


{2,6-dihydroxy-4-[4-hydroxy-7-(hydroxymethyl)-11-oxo-2,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),6,9-pentaen-3-yl]phenoxy}dihydroxyoxo-λ⁶-sulfanylium is classified as a member of the 3-hydroxyflavonoids. 3-hydroxyflavonoids are flavonoids that bear one hydroxyl group at the C-3 position of the flavonoid skeleton. {2,6-dihydroxy-4-[4-hydroxy-7-(hydroxymethyl)-11-oxo-2,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),6,9-pentaen-3-yl]phenoxy}dihydroxyoxo-λ⁶-sulfanylium is considered to be a practically insoluble (in water) and a moderately acidic compound. {2,6-dihydroxy-4-[4-hydroxy-7-(hydroxymethyl)-11-oxo-2,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),3,5(13),6,9-pentaen-3-yl]phenoxy}dihydroxyoxo-λ⁶-sulfanylium can be found in humans.

   

Edtmp

[({2-[bis(phosphonomethyl)amino]ethyl}(phosphonomethyl)amino)methyl]phosphonic acid

C6H20N2O12P4 (435.9967)


   

4-O-Methyldiploicin

4-O-Methyldiploicin

C17H12Cl4O5 (435.9439)


   
   

octyl 3,3-diiodoacrylate

octyl 3,3-diiodoacrylate

C11H18I2O2 (435.9396)


   

3,5-Dibromo-4-[3-(dimethylamino)propoxy]phenethylcarbamic acid methyl ester

3,5-Dibromo-4-[3-(dimethylamino)propoxy]phenethylcarbamic acid methyl ester

C15H22Br2N2O3 (435.9997)


   

DIPLOICIN METHYL ETHER

DIPLOICIN METHYL ETHER

C17H12Cl4O5 (435.9439)


   

Fipronil

Pesticide5_Fipronil_C12H4Cl2F6N4OS_5-Amino-1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-[(trifluoromethyl)sulfinyl]-1H-pyrazole-3-carbonitrile

C12H4Cl2F6N4OS (435.9387)


D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents D010575 - Pesticides > D007306 - Insecticides D016573 - Agrochemicals CONFIDENCE standard compound; EAWAG_UCHEM_ID 2666 EAWAG_UCHEM_ID 2666; CONFIDENCE standard compound Fipronil is a broad-spectrum insecticide effective against Lepidoptera species as well as thrips, locusts, ants, cockroaches, fleas and ticks. Fipronil selectively inhibits GABA receptor with IC50s of 30 nM and 1600 nM for cockroach and rat GABA receptors, respectively. Glutamate-gated chloride channels (GluCls), which are present in cockroaches but not in mammals, are sensitive to the blocking effect of Fipronil. Fipronil also induces apoptosis in HepG2 cells and promotes the expression of CYP1A1 and CYP3A4 mRNA in human hepatocytes[1][2].

   

sertaconazole

1-{2-[(7-chloro-1-benzothiophen-3-yl)methoxy]-2-(2,4-dichlorophenyl)ethyl}-1H-imidazole

C20H15Cl3N2OS (435.9971)


G - Genito urinary system and sex hormones > G01 - Gynecological antiinfectives and antiseptics > G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids > G01AF - Imidazole derivatives D - Dermatologicals > D01 - Antifungals for dermatological use > D01A - Antifungals for topical use > D01AC - Imidazole and triazole derivatives D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent

   

7,7-dibromo-4,4-dimethoxy-3,3-spirobi[1,2-dihydroindene]

7,7-dibromo-4,4-dimethoxy-3,3-spirobi[1,2-dihydroindene]

C19H18Br2O2 (435.9673)


   

1-chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane

1-chloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane

C8HClF16 (435.9511)


   

Neodymium nitrate hydrate (1:3:6)

Neodymium nitrate hydrate (1:3:6)

H12N3NdO15 (435.9346)


   

4-Bromo-3-[4-(chloromethyl)-3-fluorobenzoyl]-N,N-dimethyl-1H-indo le-1-carboxamide

4-Bromo-3-[4-(chloromethyl)-3-fluorobenzoyl]-N,N-dimethyl-1H-indo le-1-carboxamide

C19H15BrClFN2O2 (435.9989)


   

Neodymium Nitrate Hexahydrate

Neodymium Nitrate Hexahydrate

H12N3NdO15 (435.9346)


   

Edtmp

Ethylenebis(nitrilodimethylene)tetraphosphonic acid

C6H20N2O12P4 (435.9967)


D064449 - Sequestering Agents > D002614 - Chelating Agents

   

Sodium pentadecafluorooctanoate

Sodium pentadecafluorooctanoate

C8F15NaO2 (435.9556)


   

2,3-dibromo-1-(2,3,4,5,6-pentamethylphenyl)-3-phenylpropan-1-one

2,3-dibromo-1-(2,3,4,5,6-pentamethylphenyl)-3-phenylpropan-1-one

C20H22Br2O (436.0037)


   

bicyclo[2.2.1]hepta-2,5-diene,rhodium,trifluoromethanesulfonate

bicyclo[2.2.1]hepta-2,5-diene,rhodium,trifluoromethanesulfonate

C15H16F3O3RhS (435.9827)


   
   

Mercury(Ⅰ) sulfide

Mercury(Ⅰ) sulfide

Hg2S (435.9133)


   

Diphenyl 4-bromo-alpha-chlorobenzylphosphonate

Diphenyl 4-bromo-alpha-chlorobenzylphosphonate

C19H15BrClO3P (435.9631)


   

(3,5-DIBROMO-4-METHOXYPHENYL)(2-ETHYL-3-BENZOFURANYL)-METHANONE

(3,5-DIBROMO-4-METHOXYPHENYL)(2-ETHYL-3-BENZOFURANYL)-METHANONE

C18H14Br2O3 (435.931)


   

4,5,6,7-tetrathiocino<1,2-b:3,4-b>diimidazolyl-1,3,8,10-tetraethyl-2,9-dithione

4,5,6,7-tetrathiocino<1,2-b:3,4-b>diimidazolyl-1,3,8,10-tetraethyl-2,9-dithione

C14H20N4S6 (436.0012)


   

Arasertaconazole

Arasertaconazole

C20H15Cl3N2OS (435.9971)


C254 - Anti-Infective Agent > C514 - Antifungal Agent

   
   
   
   

Heptadecafluorooctan-1-ol

Heptadecafluorooctan-1-ol

C8HF17O (435.9756)


   

[6-Hydroxy-11-oxo-7-(3,4,5-trihydroxyphenyl)-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-3-yl]methyl hydrogen sulfate

[6-Hydroxy-11-oxo-7-(3,4,5-trihydroxyphenyl)-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-3-yl]methyl hydrogen sulfate

C18H12O11S (436.01)


   

LY2389575 (hydrochloride)

LY2389575 (hydrochloride)

C15H16BrCl3N4 (435.9624)


LY2389575 hydrochloride is a selective and noncompetitive mGlu3 negative allosteric modulator (NAM), with an IC50 value of 190 nM. LY2389575 hydrochloride induces an increase in Mrc1 levels. LY2389575 hydrochloride also independently amplifies Amyloid beta (Aβ) toxicity and can be used in study of Alzheimer's disease[1][2][3].

   

n-(2-{3,5-dibromo-4-[3-(dimethylamino)propoxy]phenyl}ethyl)methoxycarboximidic acid

n-(2-{3,5-dibromo-4-[3-(dimethylamino)propoxy]phenyl}ethyl)methoxycarboximidic acid

C15H22Br2N2O3 (435.9997)


   

(1s,2s,4s,5z,7r,12s)-10-bromo-4-(3-bromopropa-1,2-dien-1-yl)-7-chloro-2,12-dimethyl-3,13-dioxabicyclo[7.3.1]trideca-5,9-diene

(1s,2s,4s,5z,7r,12s)-10-bromo-4-(3-bromopropa-1,2-dien-1-yl)-7-chloro-2,12-dimethyl-3,13-dioxabicyclo[7.3.1]trideca-5,9-diene

C16H19Br2ClO2 (435.944)


   

12-bromo-4-(3-bromopropa-1,2-dien-1-yl)-7-chloro-1,2-dimethyl-3,13-dioxabicyclo[7.3.1]trideca-5,9-diene

12-bromo-4-(3-bromopropa-1,2-dien-1-yl)-7-chloro-1,2-dimethyl-3,13-dioxabicyclo[7.3.1]trideca-5,9-diene

C16H19Br2ClO2 (435.944)


   

(1r,2s,4s,5e,7r,12s)-12-bromo-4-(3-bromopropa-1,2-dien-1-yl)-7-chloro-1,2-dimethyl-3,13-dioxabicyclo[7.3.1]trideca-5,9-diene

(1r,2s,4s,5e,7r,12s)-12-bromo-4-(3-bromopropa-1,2-dien-1-yl)-7-chloro-1,2-dimethyl-3,13-dioxabicyclo[7.3.1]trideca-5,9-diene

C16H19Br2ClO2 (435.944)


   

5,7,13,15-tetrachloro-6,14-dimethoxy-4,12-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-10-one

5,7,13,15-tetrachloro-6,14-dimethoxy-4,12-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3,5,7,11,13-hexaen-10-one

C17H12Cl4O5 (435.9439)