Exact Mass: 517.076

Exact Mass Matches: 517.076

Found 47 metabolites which its exact mass value is equals to given mass value 517.076, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

dTDP-4-amino-2,4-dideoxy-beta-L-xylose

dTDP-4-amino-2,4-dideoxy-beta-L-xylose

C15H25N3O13P2 (517.0863)


   

4beta-(2-Aminoethylthio)epicatechin 3-gallate

4-[(2-Aminoethyl)sulphanyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoic acid

C24H23NO10S (517.1043)


4beta-(2-Aminoethylthio)epicatechin 3-gallate is found in alcoholic beverages. 4beta-(2-Aminoethylthio)epicatechin 3-gallate is a constituent of Vitis vinifera (wine grape). Constituent of Vitis vinifera (wine grape). 4beta-(2-Aminoethylthio)epicatechin 3-gallate is found in alcoholic beverages and fruits.

   

Mdz-glucuronide

6-{[12-chloro-9-(2-fluorophenyl)-2,4,8-triazatricyclo[8.4.0.0^{2,6}]tetradeca-1(10),3,5,8,11,13-hexaen-3-yl]methoxy}-3,4,5-trihydroxyoxane-2-carboxylic acid

C24H21ClFN3O7 (517.1052)


   

5-Carboxypyranocyanidin 3-O-beta-glucopyranoside

7-carboxy-3-(3,4-dihydroxyphenyl)-11-hydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2λ⁴,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(13),2,4,6,9,11-hexaen-2-ylium

C24H21O13 (517.0982)


5-carboxypyranocyanidin 3-o-beta-glucopyranoside is a member of the class of compounds known as anthocyanidin-3-o-glycosides. Anthocyanidin-3-o-glycosides are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C3-position. 5-carboxypyranocyanidin 3-o-beta-glucopyranoside is practically insoluble (in water) and a moderately acidic compound (based on its pKa). 5-carboxypyranocyanidin 3-o-beta-glucopyranoside can be found in garden onion, which makes 5-carboxypyranocyanidin 3-o-beta-glucopyranoside a potential biomarker for the consumption of this food product.

   
   

5-Carboxypyranocyanidin 3-O-beta-glucopyranoside

2- (3,4-Dihydroxyphenyl) -3- (beta-D-glucopyranosyloxy) -7-hydroxy-10-carboxy-5,4- (epoxyetheno) -1-benzopyrylium

C24H21O13 (517.0982)


   
   

Fenticonazole nitrate

Fenticonazole nitrate

C24H21Cl2N3O4S (517.063)


D000890 - Anti-Infective Agents > D000935 - Antifungal Agents C254 - Anti-Infective Agent > C514 - Antifungal Agent

   

4-Hydroxymidazolam glucuronide

4-Hydroxymidazolam beta-D-Glucuronide

C24H21ClFN3O7 (517.1052)


   

α-Hydroxymidazolam glucuronide

α-Hydroxymidazolam glucuronide

C24H21ClFN3O7 (517.1052)


   

Oxotolrestat glucuronide

Oxotolrestat glucuronide

C22H22F3NO10 (517.1196)


   

4beta-(2-Aminoethylthio)epicatechin 3-gallate

4-[(2-aminoethyl)sulfanyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

C24H23NO10S (517.1043)


   

5-Carboxypyranocyanidin 3-O-beta-glucopyranoside

5-Carboxypyranocyanidin 3-O-beta-glucopyranoside

C24H21O13+ (517.0982)


   

3-Iodo-4-methyl-N-{4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluor omethyl)phenyl}benzamide

3-Iodo-4-methyl-N-{4-[(4-methyl-1-piperazinyl)methyl]-3-(trifluor omethyl)phenyl}benzamide

C21H23F3IN3O (517.0838)


   

Ethyl 6-(4-iodophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate

Ethyl 6-(4-iodophenyl)-1-(4-methoxyphenyl)-7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate

C22H20IN3O4 (517.0499)


   

Fmoc-Phe(CF2PO3)-OH

Fmoc-Phe(CF2PO3)-OH

C25H22F2NO7P (517.1102)


   

MGCD-265

N-(3-fluoro-4-(2-(1-methyl-1H-imidazol-4-yl)thieno[3,2-b]pyridin-7-yloxy)phenylcarbamothioyl)-2-phenylacetamide

C26H20FN5O2S2 (517.1042)


   

Tegobuvir

Tegobuvir

C25H14F7N5 (517.1137)


C254 - Anti-Infective Agent > C281 - Antiviral Agent C471 - Enzyme Inhibitor > C783 - Protease Inhibitor

   

Talampicillin hydrochloride

Talampicillin hydrochloride

C24H24ClN3O6S (517.1074)


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

   
   

(E)-N-(2-(2-(1-(3-Bromophenyl)ethylidene)hydrazinyl)-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl)benzamide

(E)-N-(2-(2-(1-(3-Bromophenyl)ethylidene)hydrazinyl)-2-oxo-1-(4-oxo-3,4-dihydrophthalazin-1-yl)ethyl)benzamide

C25H20BrN5O3 (517.0749)


   

N-4-(2,3-Bis(bis(carboxymethyl)amino)propyl)phenyl bromoacetamide

N-4-(2,3-Bis(bis(carboxymethyl)amino)propyl)phenyl bromoacetamide

C19H24BrN3O9 (517.0696)


   

(7R)-9-acetyl-1-allyl-2,7-difluoro-10-methyl-6H-spiro[chromeno[3,4:5,6]pyrano[2,3-d]pyrimidine-7,3-indole]-2,6,8(1H,9H)-trione

(7R)-9-acetyl-1-allyl-2,7-difluoro-10-methyl-6H-spiro[chromeno[3,4:5,6]pyrano[2,3-d]pyrimidine-7,3-indole]-2,6,8(1H,9H)-trione

C27H17F2N3O6 (517.1085)


   

Fenticonazole nitrate, (R)-

Fenticonazole nitrate, (R)-

C24H21Cl2N3O4S (517.063)


   

Fenticonazole nitrate, (S)-

Fenticonazole nitrate, (S)-

C24H21Cl2N3O4S (517.063)


   

N6-Benzyl adenosine-5-diphosphate

N6-Benzyl adenosine-5-diphosphate

C17H21N5O10P2 (517.0764)


   

5-((4-((6-Chlorothieno[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)methyl)-2-fluorobenzonitrile fumarate

5-((4-((6-Chlorothieno[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)methyl)-2-fluorobenzonitrile fumarate

C23H21ClFN5O4S (517.0987)


   

3-Hydroxyquinaldate adenylate

3-Hydroxyquinaldate adenylate

C20H18N6O9P- (517.0873)


   

3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoate

3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-2-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoate

C24H21O13- (517.0982)


   

pelargonidin-3-O-(6-O-malonyl-beta-D-glucoside)

pelargonidin-3-O-(6-O-malonyl-beta-D-glucoside)

C24H21O13- (517.0982)


   

3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoate

3-oxo-3-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxyoxan-2-yl]methoxy]propanoate

C24H21O13- (517.0982)


   

(2S)-2-[hydroxy-[(2R,3S,4S)-2,3,4-trihydroxy-5-(8-hydroxy-2,4-dioxo-1,5-dihydropyrimido[4,5-b]quinolin-10-yl)pentoxy]phosphoryl]oxypropanoic acid

(2S)-2-[hydroxy-[(2R,3S,4S)-2,3,4-trihydroxy-5-(8-hydroxy-2,4-dioxo-1,5-dihydropyrimido[4,5-b]quinolin-10-yl)pentoxy]phosphoryl]oxypropanoic acid

C19H24N3O12P (517.1098)


   

[7-carboxy-3-(3,4-dihydroxyphenyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-11-ylidene]oxidanium

[7-carboxy-3-(3,4-dihydroxyphenyl)-4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-11-ylidene]oxidanium

C24H21O13+ (517.0982)


   
   

Flumarin (TN)

Flumarin (TN)

C16H18F2N5NaO7S2 (517.0513)


D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D002511 - Cephalosporins D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D047090 - beta-Lactams D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D007769 - Lactams

   

Talampicillin HCl

Talampicillin HCl

C24H24ClN3O6S (517.1074)


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

   

Estramustine phosphate(2-)

Estramustine phosphate(2-)

C23H30Cl2NO6P-2 (517.1188)


   

[7-(Ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate

[7-(Ethoxycarbonylamino)-2-oxochromen-4-yl]methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate

C23H23N3O9S (517.1155)


   

1-[[(4R,5S)-8-bromo-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-cyclopentyl-1-methylurea

1-[[(4R,5S)-8-bromo-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-cyclopentyl-1-methylurea

C21H32BrN3O5S (517.1246)


   

1-[[(4S,5S)-8-bromo-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-cyclopentyl-1-methylurea

1-[[(4S,5S)-8-bromo-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-cyclopentyl-1-methylurea

C21H32BrN3O5S (517.1246)


   

benzyl (2S)-2-[[[(E)-4-(5-chloro-2,4-dioxopyrimidin-1-yl)but-2-enyl]-phenoxyphosphoryl]amino]propanoate

benzyl (2S)-2-[[[(E)-4-(5-chloro-2,4-dioxopyrimidin-1-yl)but-2-enyl]-phenoxyphosphoryl]amino]propanoate

C24H25ClN3O6P (517.1169)


   

1-hydroxymidazolam beta-D-glucuronide

1-hydroxymidazolam beta-D-glucuronide

C24H21ClFN3O7 (517.1052)


A beta-D-glucosiduronic acid that is beta-D-glucuronic acid in which the anomeric hydroxyl hydrogen has been replaced by a 8-chloro-6-(2-fluorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-4-yl group. It is the glucuronidated conjugate of the midazolam metabolite, 1-hydroxymidazolam.

   

4-Hydroxymidazolam beta-D-Glucuronide

4-Hydroxymidazolam beta-D-Glucuronide

C24H21ClFN3O7 (517.1052)


A beta-D-glucosiduronic acid that is beta-D-glucuronic acid in which the anomeric hydroxyl hydrogen has been replaced by a 8-chloro-6-(2-fluorophenyl)-1-methyl-4H-imidazo[1,5-a][1,4]benzodiazepin-4-yl group. It is the glucuronidated conjugate of the midazolam metabolite, 4-hydroxymidazolam.

   

5-carboxypyranocyanidin-3-o-β-glucopyrano-side

NA

C24H21O13+ (517.0982)


{"Ingredient_id": "HBIN011490","Ingredient_name": "5-carboxypyranocyanidin-3-o-\u03b2-glucopyrano-side","Alias": "NA","Ingredient_formula": "C24H21O13+","Ingredient_Smile": "C1=CC(=C(C=C1C2=[O+]C3=CC(=CC4=C3C(=C2OC5C(C(C(C(O5)CO)O)O)O)C=C(O4)C(=O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3182","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

3-carboxy-7-(3,4-dihydroxyphenyl)-11-hydroxy-6-{[(2r,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2λ⁴,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),2,4,6,9(13),10-hexaen-2-ylium

3-carboxy-7-(3,4-dihydroxyphenyl)-11-hydroxy-6-{[(2r,3r,4s,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2λ⁴,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),2,4,6,9(13),10-hexaen-2-ylium

[C24H21O13]+ (517.0982)


   

(2r,3s,4s)-4-[(2-aminoethyl)sulfanyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

(2r,3s,4s)-4-[(2-aminoethyl)sulfanyl]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2h-1-benzopyran-3-yl 3,4,5-trihydroxybenzoate

C24H23NO10S (517.1043)


   

3-carboxy-7-(3,4-dihydroxyphenyl)-11-hydroxy-6-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2λ⁴,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),2,4,6,9(13),10-hexaen-2-ylium

3-carboxy-7-(3,4-dihydroxyphenyl)-11-hydroxy-6-{[(2s,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2λ⁴,8-dioxatricyclo[7.3.1.0⁵,¹³]trideca-1(12),2,4,6,9(13),10-hexaen-2-ylium

[C24H21O13]+ (517.0982)