Exact Mass: 428.0257352

Exact Mass Matches: 428.0257352

Found 96 metabolites which its exact mass value is equals to given mass value 428.0257352, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

IDP

[({[(2R,3S,4R)-3,4-dihydroxy-5-(6-oxo-6,9-dihydro-3H-purin-9-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid

C10H14N4O11P2 (428.0134314)


An inosine nucleotide containing a pyrophosphate group esterified to C5 of the sugar moiety. [HMDB] IDP is an inosine nucleotide containing a pyrophosphate group esterified to C5 of the sugar moiety. Acquisition and generation of the data is financially supported in part by CREST/JST.

   

Aerugipen

Ticarcillin disodium

C15H14N2O6S2. 2Na (428.0088664)


Same as: D02241

   

Theaflavic acid

3,4,6-trihydroxy-5-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-5H-benzo[7]annulene-8-carboxylic acid

C21H16O10 (428.0743436)


Epitheaflavic acid is found in tea. Epitheaflavic acid is isolated from black tea Camellia sinensis. Isolated from black tea Camellia sinensis. Epitheaflavic acid is found in tea.

   

3-Chloro-2-methyl-N-(4-(2-(4-methylpiperazin-1-yl)-2-oxoethyl)thiazol-2-yl)benzenesulfonamide

3-chloro-2-methyl-N-{4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-1,3-thiazol-2-yl}benzene-1-sulfonamide

C17H21ClN4O3S2 (428.07435460000005)


   
   
   

PRZ_M429

PRZ_M429

C15H19Cl3N2O4S (428.0131064000001)


CONFIDENCE Transformation product, tentative ID (Level 2b); INTERNAL_ID 2009

   
   
   
   

4-(3,4-Dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carboxylic acid 1,2-dicarboxyethyl ester

4-(3,4-Dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carboxylic acid 1,2-dicarboxyethyl ester

C21H16O10 (428.0743436)


   
   
   
   
   

18,18-dibromo-(9E)-octadeca-9,17-dien-5,7-diynoic acid|18,18-Dibromo-9,17-octadecadiene-5,7-diynoic acid,9Ci-(E)-form

18,18-dibromo-(9E)-octadeca-9,17-dien-5,7-diynoic acid|18,18-Dibromo-9,17-octadecadiene-5,7-diynoic acid,9Ci-(E)-form

C18H22Br2O2 (427.99864319999995)


   
   

5-IDP

Inosine-5-diphosphate sodium salt

C10H14N4O11P2 (428.0134314)


   

1-[(Z)-but-2-en-2-yl]-2,8,10-trichloro-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one

NCGC00380824-01!1-[(Z)-but-2-en-2-yl]-2,8,10-trichloro-3,9-dihydroxy-4,7-dimethylbenzo[b][1,4]benzodioxepin-6-one

C19H15Cl3O5 (427.998503)


   
   

Diethylstilbestryl disulfate

Diethylstilbestryl disulfate

C18H20O8S2 (428.059956)


   

Aerugipen

Ticarcillin disodium salt

C15H14N2Na2O6S2 (428.0088664)


   

Theaflavic acid

3,4,6-trihydroxy-5-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-2-yl)-5H-benzo[7]annulene-8-carboxylic acid

C21H16O10 (428.0743436)


   

18,18-dibromo-9E,17-octadecadien-5,7-diynoic acid

18,18-dibromo-9E,17-octadecadien-5,7-diynoic acid

C18H22Br2O2 (427.99864319999995)


   
   

Melarsomine

Melarsomine

C13H21AsN8S2 (428.0546486)


C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent

   

METHYL PERFLUOROOCTANOATE

METHYL PERFLUOROOCTANOATE

C9H3F15O2 (427.9893518)


   

Methyl 4-acetoxy-7-(benzyloxy)-8-bromo-2-naphthoate

Methyl 4-acetoxy-7-(benzyloxy)-8-bromo-2-naphthoate

C21H17BrO5 (428.0259292)


   

(1-Carboxyethyl)-triphenylphosphonium bromide methyl ester

(1-Carboxyethyl)-triphenylphosphonium bromide methyl ester

C22H22BrO2P (428.0540702)


   

(Carbethoxymethyl-1,2-13C2)triphenylphosphonium bromide

(Carbethoxymethyl-1,2-13C2)triphenylphosphonium bromide

C22H22BrO2P (428.0540702)


   

1H,1H,2H,2H,3H,3H-PERFLUORODECAN-1-OL

1H,1H,2H,2H,3H,3H-PERFLUORODECAN-1-OL

C10H7F15O (428.0257352)


   

(2-Ethoxy-2-oxoethyl)triphenylphosphonium bromide

(2-Ethoxy-2-oxoethyl)triphenylphosphonium bromide

C22H22BrO2P (428.0540702)


   

Ticarcillin sodium

Ticarcillin disodium salt

C15H14N2Na2O6S2 (428.0088664)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D010406 - Penicillins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams C254 - Anti-Infective Agent > C258 - Antibiotic > C260 - Beta-Lactam Antibiotic

   

4-N-OCTYLOXYBENZOIC ACID 2,4,5-TRICHLOROPHENYL ESTER

4-N-OCTYLOXYBENZOIC ACID 2,4,5-TRICHLOROPHENYL ESTER

C21H23Cl3O3 (428.0712698)


   

Tetraphenylstannane

Tetraphenylstannane

C24H20Sn (428.058691)


   

(3-Carboxypropyl)(triphenyl)phosphonium bromide

(3-Carboxypropyl)(triphenyl)phosphonium bromide

C22H22BrO2P (428.0540702)


   

((1,3-Dioxolan-2-yl)methyl)triphenylphosphonium bromide

((1,3-Dioxolan-2-yl)methyl)triphenylphosphonium bromide

C22H22BrO2P (428.0540702)


   

Estra-1,3,5(10)-triene-3,17-diol,2,4-dibromo-, (17b)-(9CI)

Estra-1,3,5(10)-triene-3,17-diol,2,4-dibromo-, (17b)-(9CI)

C18H22Br2O2 (427.99864319999995)


   

(Dimethylamino)dimethyl(2,3,4,5,6-pentafluorophenoxy)methanaminium hexafluorophosphate

(Dimethylamino)dimethyl(2,3,4,5,6-pentafluorophenoxy)methanaminium hexafluorophosphate

C11H12F11N2OP (428.05115639999997)


   

1-Chloro-3,5-di(4-chlorbenzoyl)-2-deoxy-D-ribose

1-Chloro-3,5-di(4-chlorbenzoyl)-2-deoxy-D-ribose

C19H15Cl3O5 (427.998503)


   

tribenzyltin chloride

tribenzyltin chloride

C21H21ClSn (428.0353686)


   

ethyl 1-(4-bromophenyl)-6,8-dimethoxypyrazolo[4,5,1-hi]indole-5-carboxylate

ethyl 1-(4-bromophenyl)-6,8-dimethoxypyrazolo[4,5,1-hi]indole-5-carboxylate

C20H17BrN2O4 (428.0371622)


   

3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluorononanoic acid

3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluorononanoic acid

C9H3F15O2 (427.9893518)


   

1-Boc-4-(3-Iodo-1H-indazol-4-yl)piperazine

1-Boc-4-(3-Iodo-1H-indazol-4-yl)piperazine

C16H21IN4O2 (428.07091959999997)


   

Ferrate(3-), trisethanedioato(2-)-.kappa.O1,.kappa.O2-, triammonium, trihydrate, (OC-6-11)-

Ferrate(3-), trisethanedioato(2-)-.kappa.O1,.kappa.O2-, triammonium, trihydrate, (OC-6-11)-

C6FeO12.3(NH4).3(H2O) (428.00872880000003)


   

1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose

1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose

C19H15Cl3O5 (427.998503)


   

tert-Butyl 4-(3-iodo-1H-indazol-6-yl)piperazine-1-carboxylate

tert-Butyl 4-(3-iodo-1H-indazol-6-yl)piperazine-1-carboxylate

C16H21IN4O2 (428.07091959999997)


   

1-[(Triisopropylsilyl)ethynyl]-1,2-benziodoxol-3(1H)-one

1-[(Triisopropylsilyl)ethynyl]-1,2-benziodoxol-3(1H)-one

C18H25IO2Si (428.06685)


   

Uprosertib

Uprosertib

C18H16Cl2F2N4O2 (428.061832)


C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C61074 - Serine/Threonine Kinase Inhibitor C274 - Antineoplastic Agent > C1742 - Angiogenesis Inhibitor > C155764 - AKT Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor Uprosertib (GSK2141795) is a potent and selective pan-Akt inhibitor with IC50 values of 180/328/38 nM for Akt1/Akt2/Akt3, respectively.

   
   

Tetrahydrothiamine diphosphate

Tetrahydrothiamine diphosphate

C12H22N4O7P2S (428.0684402)


   

Perfluorohexyl ethylphosphonic acid

Perfluorohexyl ethylphosphonic acid

C8H6F13O3P (427.98469719999997)


   
   

6-o-Phosphoryl inosine monophosphate

6-o-Phosphoryl inosine monophosphate

C10H14N4O11P2 (428.0134314)


   

S-{propyl[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl}cysteine

S-{propyl[2-(2,4,6-trichlorophenoxy)ethyl]carbamoyl}cysteine

C15H19Cl3N2O4S (428.0131064000001)


   

3,4,5-trihydroxy-6-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulene-8-carboxylic acid

3,4,5-trihydroxy-6-oxo-1-(3,5,7-trihydroxy-3,4-dihydro-2H-chromen-2-yl)benzo[7]annulene-8-carboxylic acid

C21H16O10 (428.0743436)


   
   

[({[(2R,3S,4R)-3,4-dihydroxy-5-(6-oxo-6,9-dihydro-3H-purin-9-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid

[({[(2R,3S,4R)-3,4-dihydroxy-5-(6-oxo-6,9-dihydro-3H-purin-9-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid

C10H14N4O11P2 (428.0134314)


   

1-Amino-4-(4-chloroanilino)-9,10-dioxo-2-anthracenesulfonic acid

1-Amino-4-(4-chloroanilino)-9,10-dioxo-2-anthracenesulfonic acid

C20H13ClN2O5S (428.0233678000001)


   

N-(3,5-dichloro-2-pyridinyl)-2-[(1-phenyl-2-benzimidazolyl)thio]acetamide

N-(3,5-dichloro-2-pyridinyl)-2-[(1-phenyl-2-benzimidazolyl)thio]acetamide

C20H14Cl2N4OS (428.0265334)


   

N-(4-bromo-2-methylphenyl)-4-[(1-methyl-2-oxo-4-quinolinyl)oxy]butanamide

N-(4-bromo-2-methylphenyl)-4-[(1-methyl-2-oxo-4-quinolinyl)oxy]butanamide

C21H21BrN2O3 (428.0735456)


   

3-(4-oxo-1H-quinazolin-2-yl)propanoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester

3-(4-oxo-1H-quinazolin-2-yl)propanoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester

C20H17BrN2O4 (428.0371622)


   
   
   

CMP-5-phosphonoformate(3-)

CMP-5-phosphonoformate(3-)

C10H12N3O12P2 (427.9896232)


An organophosphate oxoanion obtained by removal of three protons from CMP-5-phosphonoformic acid; major species at pH 7.3.

   

idp

idp

C10H14N4O11P2 (428.0134314)


A purine ribonucleoside 5-diphosphate having inosine as the nucleobase.

   

4,5-dihydroxy-6-{[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-5,6-dihydro-4h-pyran-2-carboxylic acid

4,5-dihydroxy-6-{[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-5,6-dihydro-4h-pyran-2-carboxylic acid

C21H16O10 (428.0743436)


   

2-[4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carbonyloxy]butanedioic acid

2-[4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carbonyloxy]butanedioic acid

C21H16O10 (428.0743436)


   

3,5,6-tris(acetyloxy)-9-oxoxanthen-1-yl acetate

3,5,6-tris(acetyloxy)-9-oxoxanthen-1-yl acetate

C21H16O10 (428.0743436)


   

4-(but-2-en-2-yl)-5,13,15-trichloro-6,14-dihydroxy-7,12-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

4-(but-2-en-2-yl)-5,13,15-trichloro-6,14-dihydroxy-7,12-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

C19H15Cl3O5 (427.998503)


   

(2r)-2-[4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carbonyloxy]butanedioic acid

(2r)-2-[4-(3,4-dihydroxyphenyl)-6,7-dihydroxynaphthalene-2-carbonyloxy]butanedioic acid

C21H16O10 (428.0743436)


   

3-carboxy-6,7-dihydroxy-1-(3',4'-dihydroxy-phenyl)-naphthalene-9,2''-o-malicacid ester

NA

C21H16O10 (428.0743436)


{"Ingredient_id": "HBIN008377","Ingredient_name": "3-carboxy-6,7-dihydroxy-1-(3',4'-dihydroxy-phenyl)-naphthalene-9,2''-o-malicacid ester","Alias": "NA","Ingredient_formula": "C21H16O10","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3167","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   
   

16,18-dibromooctadeca-15,17-dien-5,7-diynoic acid

16,18-dibromooctadeca-15,17-dien-5,7-diynoic acid

C18H22Br2O2 (427.99864319999995)


   

(1s,4ar,4bs,8s,8as,10as)-1-bromo-8a-(bromomethyl)-8-isopropyl-10a-methyl-4-methylidene-2,3,4a,4b,7,8,9,10-octahydro-1h-phenanthrene

(1s,4ar,4bs,8s,8as,10as)-1-bromo-8a-(bromomethyl)-8-isopropyl-10a-methyl-4-methylidene-2,3,4a,4b,7,8,9,10-octahydro-1h-phenanthrene

C20H30Br2 (428.07141)


   

(4s,5r,6s)-4,5-dihydroxy-6-{[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-5,6-dihydro-4h-pyran-2-carboxylic acid

(4s,5r,6s)-4,5-dihydroxy-6-{[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxy}-5,6-dihydro-4h-pyran-2-carboxylic acid

C21H16O10 (428.0743436)


   

3-[7-methyl-6,8-dioxo-7-(3,4,6-trihydroxy-2-methylbenzoyloxy)isochromen-3-yl]prop-2-enoic acid

3-[7-methyl-6,8-dioxo-7-(3,4,6-trihydroxy-2-methylbenzoyloxy)isochromen-3-yl]prop-2-enoic acid

C21H16O10 (428.0743436)


   

7-{[(1s,3s,4r,5s,8r)-4,8-dihydroxy-7-oxo-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy}-5,6-dihydroxy-2-phenylchromen-4-one

7-{[(1s,3s,4r,5s,8r)-4,8-dihydroxy-7-oxo-2,6-dioxabicyclo[3.2.1]octan-3-yl]oxy}-5,6-dihydroxy-2-phenylchromen-4-one

C21H16O10 (428.0743436)


   

(1r,4s,5s,12r)-2,13-dioxo-8-oxa-22,23-dithia-3,14-diazahexacyclo[10.9.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0¹⁵,²⁰]tricosa-6,9,15,17,19-pentaen-5-yl acetate

(1r,4s,5s,12r)-2,13-dioxo-8-oxa-22,23-dithia-3,14-diazahexacyclo[10.9.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0¹⁵,²⁰]tricosa-6,9,15,17,19-pentaen-5-yl acetate

C20H16N2O5S2 (428.0500606)


   

4-[(2e)-but-2-en-2-yl]-5,13,15-trichloro-6,14-dihydroxy-7,12-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

4-[(2e)-but-2-en-2-yl]-5,13,15-trichloro-6,14-dihydroxy-7,12-dimethyl-2,9-dioxatricyclo[9.4.0.0³,⁸]pentadeca-1(15),3(8),4,6,11,13-hexaen-10-one

C19H15Cl3O5 (427.998503)


   

7-({4,8-dihydroxy-7-oxo-2,6-dioxabicyclo[3.2.1]octan-3-yl}oxy)-5,6-dihydroxy-2-phenylchromen-4-one

7-({4,8-dihydroxy-7-oxo-2,6-dioxabicyclo[3.2.1]octan-3-yl}oxy)-5,6-dihydroxy-2-phenylchromen-4-one

C21H16O10 (428.0743436)


   

(1s,4bs,8s,8as,10as)-1-bromo-8a-(bromomethyl)-8-isopropyl-4,10a-dimethyl-1,2,3,4b,7,8,9,10-octahydrophenanthrene

(1s,4bs,8s,8as,10as)-1-bromo-8a-(bromomethyl)-8-isopropyl-4,10a-dimethyl-1,2,3,4b,7,8,9,10-octahydrophenanthrene

C20H30Br2 (428.07141)


   

3,6,7-tris(acetyloxy)-9-oxoxanthen-2-yl acetate

3,6,7-tris(acetyloxy)-9-oxoxanthen-2-yl acetate

C21H16O10 (428.0743436)


   

3-acetyl-2,7-dihydroxy-1-methoxy-4,6,11-trioxo-4a,12-dihydro-1h-5-oxatetracene-12a-carboxylic acid

3-acetyl-2,7-dihydroxy-1-methoxy-4,6,11-trioxo-4a,12-dihydro-1h-5-oxatetracene-12a-carboxylic acid

C21H16O10 (428.0743436)


   

3-[(7r)-7-methyl-6,8-dioxo-7-(3,4,6-trihydroxy-2-methylbenzoyloxy)isochromen-3-yl]prop-2-enoic acid

3-[(7r)-7-methyl-6,8-dioxo-7-(3,4,6-trihydroxy-2-methylbenzoyloxy)isochromen-3-yl]prop-2-enoic acid

C21H16O10 (428.0743436)


   

2,13-dioxo-8-oxa-22,23-dithia-3,14-diazahexacyclo[10.9.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0¹⁵,²⁰]tricosa-6,9,15,17,19-pentaen-5-yl acetate

2,13-dioxo-8-oxa-22,23-dithia-3,14-diazahexacyclo[10.9.2.0¹,¹⁴.0³,¹².0⁴,¹⁰.0¹⁵,²⁰]tricosa-6,9,15,17,19-pentaen-5-yl acetate

C20H16N2O5S2 (428.0500606)


   

(15e,17z)-16,18-dibromooctadeca-15,17-dien-5,7-diynoic acid

(15e,17z)-16,18-dibromooctadeca-15,17-dien-5,7-diynoic acid

C18H22Br2O2 (427.99864319999995)


   

3,6,7-tris(acetyloxy)-9-oxoxanthen-1-yl acetate

3,6,7-tris(acetyloxy)-9-oxoxanthen-1-yl acetate

C21H16O10 (428.0743436)


   

3,5,6-tris(acetyloxy)-9-oxoxanthen-4-yl acetate

3,5,6-tris(acetyloxy)-9-oxoxanthen-4-yl acetate

C21H16O10 (428.0743436)


   

1-bromo-8a-(bromomethyl)-8-isopropyl-10a-methyl-4-methylidene-2,3,4a,4b,7,8,9,10-octahydro-1h-phenanthrene

1-bromo-8a-(bromomethyl)-8-isopropyl-10a-methyl-4-methylidene-2,3,4a,4b,7,8,9,10-octahydro-1h-phenanthrene

C20H30Br2 (428.07141)


   

3,5,6-tris(acetyloxy)-9-oxoxanthen-2-yl acetate

3,5,6-tris(acetyloxy)-9-oxoxanthen-2-yl acetate

C21H16O10 (428.0743436)


   

1-bromo-8a-(bromomethyl)-8-isopropyl-4,10a-dimethyl-1,2,3,4b,7,8,9,10-octahydrophenanthrene

1-bromo-8a-(bromomethyl)-8-isopropyl-4,10a-dimethyl-1,2,3,4b,7,8,9,10-octahydrophenanthrene

C20H30Br2 (428.07141)