Exact Mass: 535.115764

Exact Mass Matches: 535.115764

Found 57 metabolites which its exact mass value is equals to given mass value 535.115764, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

11-O-Demethylpradimicinone I

11-O-Demethylpradimicinone I

C27H21NO11 (535.1114556)


   

Cyanidin-3-(6-malonylglucoside)

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

C24H23O14 (535.1087758)


   

Lipoyl-AMP

{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[5-(1,2-dithiolan-3-yl)pentanoyl]oxy})phosphinic acid

C18H26N5O8PS2 (535.0960366)


Lipoyl-amp is part of the Protein modification, and Lipoic acid metabolism pathways. It is a substrate for: Lipoyltransferase 1, mitochondrial.

   

Malvidin 3-(6-acetylglucoside)

3-({6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1lambda4-chromen-1-ylium

C25H27O13+ (535.1451592000001)


Isolated from grape skins of port wine. Malvidin 3-(6-acetylglucoside) is found in many foods, some of which are alcoholic beverages, common grape, fruits, and summer grape. Malvidin 3-(6-acetylglucoside) is found in alcoholic beverages. Malvidin 3-(6-acetylglucoside) is isolated from grape skins of port wine.

   

Cyanidin 3-(6'-malonylglucoside)

3-[(6-{[(2-carboxyacetyl)oxy]methyl}-3,4,5-trihydroxyoxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1λ⁴-chromen-1-ylium

C24H23O14+ (535.1087758)


Isolated from red chicory leaves (Cichorium intybus). Cyanidin 3-(6-malonylglucoside) is found in many foods, some of which are lettuce, passion fruit, romaine lettuce, and sweet orange. Cyanidin 3-(6-malonylglucoside) is found in chicory. Cyanidin 3-(6-malonylglucoside) is isolated from red chicory leaves (Cichorium intybus).

   

Cyanidin 3-(3'-malonyl-glucoside)

3-({4-[(2-carboxyacetyl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1λ⁴-chromen-1-ylium

C24H23O14+ (535.1087758)


Cyanidin 3-(3-malonyl-glucoside) is found in onion-family vegetables. Cyanidin 3-(3-malonyl-glucoside) is a constituent of caucus (Allium victorialis). Constituent of caucus (Allium victorialis). Cyanidin 3-(3-malonyl-glucoside) is found in onion-family vegetables.

   

(R)-4A-(Ethoxymethyl)-1-(4-fluorophenyl)-6-((4-(trifluoromethyl)phenyl)sulfonyl)-4,4a,5,6,7,8-hexahydro-1H-pyrazolo[3,4-g]isoquinoline

(R)-4a-(Ethoxymethyl)-1-(4-fluorophenyl)-6-((4-(trifluoromethyl)phenyl)sulphonyl)-4,4a,5,6,7,8-hexahydro-1H-pyrazolo[3,4-g]isoquinoline

C26H25F4N3O3S (535.1552668)


   

TTF-1

3-{2-[4,5-bis(hexylsulphanyl)-2H-1,3-dithiol-2-ylidene]-5-(methylsulphanyl)-2H-1,3-dithiol-4-yl}propanenitrile

C22H33NS7 (535.0657898000001)


   

Hydroxy dabrafenib

2,6-Difluoro-N-{2-fluoro-3-[2-(1-hydroxy-2-methylpropan-2-yl)-5-(2-imino-1,2-dihydropyrimidin-4-yl)-1,3-thiazol-4-yl]phenyl}benzene-1-sulphonamide

C23H20F3N5O3S2 (535.0959606000001)


   

Malvidin 3-(6'-acetyl-galactoside)

3-{[(3R,4S,5R,6R)-6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1lambda4-chromen-1-ylium

C25H27O13 (535.1451592000001)


Malvidin 3-(6-acetyl-galactoside) 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. Malvidin 3-(6-acetyl-galactoside) is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Malvidin 3-(6-acetyl-galactoside) can be found in highbush blueberry and lowbush blueberry, which makes malvidin 3-(6-acetyl-galactoside) a potential biomarker for the consumption of these food products.

   

Cyanidin 3-(3'-malonylglucoside)

3-{[(2S,3R,4S,5R,6R)-4-[(2-carboxyacetyl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1λ⁴-chromen-1-ylium

C24H23O14+ (535.1087758)


Cyanidin 3-(3-malonylglucoside) 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. Cyanidin 3-(3-malonylglucoside) is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Cyanidin 3-(3-malonylglucoside) can be found in garlic, which makes cyanidin 3-(3-malonylglucoside) a potential biomarker for the consumption of this food product.

   

DIBOA dihexose

(2R)-2-{[(2S,3R,4S,5R,6R)-3,5-dihydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-4-hydroxy-7-methoxy-3,4-dihydro-2H-1,4-benzoxazin-3-one

C21H29NO15 (535.1537124)


   
   
   

Simaomicin alpha

Antibiotic D 42067alpha

C28H25NO10 (535.147839)


   

Cyanidin 3-(3-malonylglucoside)

3,4,5,7-Tetrahydroxy-3- [ [ 3-O- (3-hydroxy-1,3-dioxopropyl) -beta-D-glucopyranosyl ] oxy ] flavylium

C24H23O14 (535.1087758)


   

11-(Methylsulfinyl)undecyl glucosinolate

11-(Methylsulfinyl)undecyl glucosinolate

C19H37NO10S3 (535.1579502)


   

Malvidin 3-(6-acetylglucoside)

3-({6-[(acetyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-5,7-dihydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1$l^{4}-chromen-1-ylium

C25H27O13 (535.1451592000001)


   

DIMBOA + O-Hex-Hex

DIMBOA + O-Hex-Hex

C21H29NO15 (535.1537124)


Annotation level-3

   
   
   
   
   

11-(Methylsulfinyl)undecyl-glucosinolate

11-(Methylsulfinyl)undecyl-glucosinolate

C19H37NO10S3 (535.1579502)


   

Cyanidin 3-(6-malonyl)glucoside

Cyanidin 3-(6-malonyl)glucoside

[C24H23O14]+ (535.1087758)


   

Cyanidin-3-(6-malonylglucoside)

Cyanidin-3-(6-malonylglucoside)

[C24H23O14]+ (535.1087758)


   

Cyanidin 3-malonylglucoside

3-[(6-{[(2-carboxyacetyl)oxy]methyl}-3,4,5-trihydroxyoxan-2-yl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1$l^{4}-chromen-1-ylium

C24H23O14+ (535.1087758)


   

Cyanidin 3-(3''-malonylglucoside)

3-({4-[(2-carboxyacetyl)oxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl}oxy)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-1$l^{4}-chromen-1-ylium

C24H23O14 (535.1087758)


   

Cyanidin 3-(3-malonylglucoside)

Cyanidin 3-(3-malonylglucoside)

C24H23O14+ (535.1087758)


   

Cyanidin 3-(6-malonylglucoside)

Cyanidin-3-O-(6-O-malonyl-beta-D-glucopyranoside)

C24H23O14 (535.1087758)


Cyanidin 3-(6′-malonylglucoside). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=171828-62-9 (retrieved 2024-09-18) (CAS RN: 171828-62-9). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

   
   

Chromium,tris(1-phenyl-1,3-butanedionato-kO1,kO3)-

Chromium,tris(1-phenyl-1,3-butanedionato-kO1,kO3)-

C30H27CrO6 (535.1212642)


   

(2S,3S)-Ethyl 2-(dibenzylamino)-4,4,4-trifluoro-3-(tosyloxy) butanoate

(2S,3S)-Ethyl 2-(dibenzylamino)-4,4,4-trifluoro-3-(tosyloxy) butanoate

C27H28F3NO5S (535.1640194)


   

[4-[2-(Diethylamino)ethoxy]-3-iodophenyl][2-(1-hydroxybutyl)-3-benzofuranyl]-methanone

[4-[2-(Diethylamino)ethoxy]-3-iodophenyl][2-(1-hydroxybutyl)-3-benzofuranyl]-methanone

C25H30INO4 (535.121949)


   

Halofantrine hydrochloride

Halofantrine hydrochloride

C26H31Cl3F3NO (535.1423202)


D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000981 - Antiprotozoal Agents C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C277 - Antiprotozoal Agent

   

2-Aminomethyl-7-chloro-2,3-dihydro-5-(2-fluorophenyl)-1H-1,4-benzodiazepine Dimaleate

2-Aminomethyl-7-chloro-2,3-dihydro-5-(2-fluorophenyl)-1H-1,4-benzodiazepine Dimaleate

C24H23ClFN3O8 (535.115764)


   

5-chloro-1-cyclopropyl-6,7-bis((4-methoxybenzyl)oxy)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

5-chloro-1-cyclopropyl-6,7-bis((4-methoxybenzyl)oxy)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

C29H26ClNO7 (535.1397716000001)


   

Iofolastat (123I)

Iofolastat (123I)

C19H26IN3O7 (535.0815436)


C1446 - Radiopharmaceutical Compound > C2124 - Radioconjugate

   

5H-Indeno(1,2-C)isoquinoline-9-sulfonamide, 6,11-dihydro-N-(3-(4-morpholinyl)propyl)-5-oxo-, methanesulfonate (1:1)

5H-Indeno(1,2-C)isoquinoline-9-sulfonamide, 6,11-dihydro-N-(3-(4-morpholinyl)propyl)-5-oxo-, methanesulfonate (1:1)

C24H29N3O7S2 (535.1446844000001)


C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C62554 - Poly (ADP-Ribose) Polymerase Inhibitor C471 - Enzyme Inhibitor

   

(R)-lipoyl-AMP

(R)-lipoyl-AMP

C18H26N5O8PS2 (535.0960366)


A lipoyl-AMP in which the lipoyl moiety has (R)-configuration.

   

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

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

C24H23O14+ (535.1087758)


   

N-acetyldemethylphosphinothricin adenylate

N-acetyldemethylphosphinothricin adenylate

C16H21N6O11P2- (535.0743516)


   

Malvidin 3-(6-acetyl-galactoside)

Malvidin 3-(6-acetyl-galactoside)

C25H27O13+ (535.1451592000001)


   
   

[(1R)-1-ethylsulfonyl-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]yl]methanol

[(1R)-1-ethylsulfonyl-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]yl]methanol

C24H29N3O7S2 (535.1446844000001)


   

[(1S)-1-ethylsulfonyl-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]yl]methanol

[(1S)-1-ethylsulfonyl-7-methoxy-2-(3-methoxyphenyl)sulfonyl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]yl]methanol

C24H29N3O7S2 (535.1446844000001)


   

1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[4-methyl-3-[[(3E)-2-oxo-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-6-yl]amino]phenyl]urea

1-[2-fluoro-5-(trifluoromethyl)phenyl]-3-[4-methyl-3-[[(3E)-2-oxo-3-(1H-pyrrol-2-ylmethylidene)-1H-indol-6-yl]amino]phenyl]urea

C28H21F4N5O2 (535.1631294)


   

Cyanidin 3-(6-malonylglucoside)

Cyanidin 3-(6-malonylglucoside)

C24H23O14+ (535.1087758)


   

Lipoyl-AMP

Lipoyl-AMP

C18H26N5O8PS2 (535.0960366)


A purine ribonucleoside 5-monophosphate having adenine as the nucleobase and a lipoyl group attached to one of the phosphate OH groups.

   

Cyanidin-3-(6-malonylglucoside)

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

C24H23O14+ (535.1087758)


   

malvidin 3-O-(6-O-acetyl-beta-D-glucoside)

malvidin 3-O-(6-O-acetyl-beta-D-glucoside)

C25H27O13 (535.1451592000001)


An anthocyanin cation that is malvidin substituted at position 3 by a 6-O-acetyl-beta-D-glucosyl residue.

   

Mito-apocynin (C2)

Mito-apocynin (C2)

C28H27BrNO3P (535.0911822)


Mito-apocynin (C2), an orally active mitochondria-targeted triphenylphosphonium (TPP)-based compound, is synthesized by conjugating the Apocynin moiety with a TPP + cation. Mito-apocynin (C2) exhibits antineuroinflammatory effect[1].

   

Malvidin 3-(6'-acetylglucoside)

Malvidin 3-(6'-acetylglucoside)

C25H27O13 (535.1451592000001)


   

Malvidin 3-O-(6'-acetyl)-galactoside

Malvidin 3-O-(6'-acetyl)-galactoside

C25H27O13 (535.1451592000001)


   

(7s,10s,17s)-3,7,10,28-tetrahydroxy-14-methoxy-24,25-dimethyl-12,18,20-trioxa-25-azaheptacyclo[15.11.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹.0²¹,²⁹.0²²,²⁷]nonacosa-1(29),2(15),3,6(11),13,21,23,27-octaene-5,26-dione

(7s,10s,17s)-3,7,10,28-tetrahydroxy-14-methoxy-24,25-dimethyl-12,18,20-trioxa-25-azaheptacyclo[15.11.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹.0²¹,²⁹.0²²,²⁷]nonacosa-1(29),2(15),3,6(11),13,21,23,27-octaene-5,26-dione

C28H25NO10 (535.147839)


   

3,7,10,28-tetrahydroxy-14-methoxy-24,25-dimethyl-12,18,20-trioxa-25-azaheptacyclo[15.11.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹.0²¹,²⁹.0²²,²⁷]nonacosa-1(29),2(15),3,6(11),13,21,23,27-octaene-5,26-dione

3,7,10,28-tetrahydroxy-14-methoxy-24,25-dimethyl-12,18,20-trioxa-25-azaheptacyclo[15.11.1.0²,¹⁵.0⁴,¹³.0⁶,¹¹.0²¹,²⁹.0²²,²⁷]nonacosa-1(29),2(15),3,6(11),13,21,23,27-octaene-5,26-dione

C28H25NO10 (535.147839)


   

11-chloro-1,9,10,12,15a-pentahydroxy-16-methoxy-3,14-dimethyl-7,7a-dihydro-6h-2-azahexaphene-8,15-dione

11-chloro-1,9,10,12,15a-pentahydroxy-16-methoxy-3,14-dimethyl-7,7a-dihydro-6h-2-azahexaphene-8,15-dione

C28H22ClNO8 (535.1033882)