Exact Mass: 887.2090998

Exact Mass Matches: 887.2090998

Found 21 metabolites which its exact mass value is equals to given mass value 887.2090998, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

3-trans,5-cis-Octadienoyl-CoA

4-({[({[(2S,3S,4R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonomethyl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-3,3-dimethyl-N-[2-({2-[(2E,4Z)-octa-2,4-dienoylsulphanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]butanimidic acid

C30H48N7O16P3S (887.2090998)


3-trans,5-cis-Octadienoyl-CoA is a metabolite formed during the beta-oxidation of unsaturated fatty acids with double bonds extending from odd-numbered carbon atoms by mitochondrial delta 3,delta 2-enoyl-CoA isomerase (EC 5.3.3.8) from 2-trans-5-cis-octadienoyl-CoA. 2-trans-5-cis-octadienoyl-CoA is formed by medium-chain acyl-CoA dehydrogenase (EC 1.3.99.3) from 5-cis-Octenoyl-CoA, a putative metabolite of linolenic acid.(PMID 1495956) [HMDB] 3-trans,5-cis-Octadienoyl-CoA is a metabolite formed during the beta-oxidation of unsaturated fatty acids with double bonds extending from odd-numbered carbon atoms by mitochondrial delta 3,delta 2-enoyl-CoA isomerase (EC 5.3.3.8) from 2-trans-5-cis-octadienoyl-CoA. 2-trans-5-cis-octadienoyl-CoA is formed by medium-chain acyl-CoA dehydrogenase (EC 1.3.99.3) from 5-cis-Octenoyl-CoA, a putative metabolite of linolenic acid.(PMID 1495956).

   

Malvidin 3-O-(6-O-(4-O-malonyl-alpha-rhamnopyranosyl)-beta-glucopyranoside)-5-O-beta-glucopyranoside

Malvidin 3-O-(6-O-(4-O-malonyl-alpha-rhamnopyranosyl)-beta-glucopyranoside)-5-O-beta-glucopyranoside

C38H47O24 (887.2457162000001)


   

Malvidin 3-O-(6-O-(4-O-alpha-rhamnopyranosyl-beta-glucopyranoside)-5-O-(6-O-malonyl-beta-glucopyranoside)

Malvidin 3-O-(6-O-(4-O-alpha-rhamnopyranosyl-beta-glucopyranoside)-5-O-(6-O-malonyl-beta-glucopyranoside)

C38H47O24 (887.2457162000001)


   

Malvidin 3-O- (6-O- (4-O-malonyl-alpha-rhamnopyranosyl) -beta-glucopyranoside) -5-O-beta-glucopyranoside

2- (4-Hydroxy-3,5-dimethoxyphenyl) -3- [ [ 6-O- [ 4-O- (carboxyacetyl) -alpha-L-rhamnopyranosyl ] -beta-D-glucopyranosyl ] oxy ] -5- (beta-D-glucopyranosyloxy) -7-hydroxy-1-benzopyrylium

C38H47O24 (887.2457162000001)


   

Salviamalvin

3,5,7,4-Tetrahydroxy-3,5-dimethoxyflavylium 3- (6"-p-coumarylglucoside) -5- (6"-malonylglucoside)

C41H43O22 (887.2245877999999)


   

lissoclibadin 1

lissoclibadin 1

C39H57N3O6S7 (887.2292181999999)


An organosulfur heterocyclic compound isolated from the ascidian Lissoclinum badium. It has been shown to exhibit cytotoxicity against human cancer cell lines.

   
   
   
   
   

cyanidin O-O-[6-O-(6-O-4-hydroxycinnamoyl-beta-D-glucosyl)-2-O-beta-D-xylosyl-beta-D-galactoside]

cyanidin O-O-[6-O-(6-O-4-hydroxycinnamoyl-beta-D-glucosyl)-2-O-beta-D-xylosyl-beta-D-galactoside]

C41H43O22- (887.2245877999999)


   
   

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-methylcyclohexa-1,5-diene-1-carbothioate

S-[2-[3-[[(2R)-4-[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-2-hydroxy-3,3-dimethylbutanoyl]amino]propanoylamino]ethyl] 4-methylcyclohexa-1,5-diene-1-carbothioate

C29H44N7O17P3S (887.1727164)


   
   
   

2-(3,4-dihydroxyphenyl)-3-({6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranosyl-(1->6)-[beta-D-xylopyranosyl-(1->2)]-beta-D-galactopyranosyl}oxy)chromenium-5,7-diolate

2-(3,4-dihydroxyphenyl)-3-({6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranosyl-(1->6)-[beta-D-xylopyranosyl-(1->2)]-beta-D-galactopyranosyl}oxy)chromenium-5,7-diolate

C41H43O22- (887.2245877999999)


   

PubChem CID: 44632923; (Acyl-CoA); [M+H]+

PubChem CID: 44632923; (Acyl-CoA); [M+H]+

C29H44N7O17P3S (887.1727164)


   

trans-oct-2-enoyl-CoA(4-)

trans-oct-2-enoyl-CoA(4-)

C29H44N7O17P3S (887.1727164)


A trans-2,3-didehydroacyl-CoA(4-) arising from deprotonation of the phosphate and diphosphate OH groups of trans-oct-2-enoyl-CoA; major species at pH 7.3.

   

cis-3-octenoyl-CoA(4-)

cis-3-octenoyl-CoA(4-)

C29H44N7O17P3S (887.1727164)


A cis-3-enoyl-CoA(4-) arising from deprotonation of the phosphate and diphosphate OH groups of cis-3-octenoyl-CoA; major species at pH 7.3.

   

3-trans,5-cis-Octadienoyl-CoA

3-trans,5-cis-Octadienoyl-CoA

C30H48N7O16P3S (887.2090998)


   

(3E)-octenoyl-CoA(4-)

(3E)-octenoyl-CoA(4-)

C29H44N7O17P3S (887.1727164)


A trans-3-enoyl-CoA(4-) obtained by deprotonation of the phosphate and diphosphate OH groups of (3E)-octenoyl-CoA; major species at pH 7.3.