Exact Mass: 1041.3186

Exact Mass Matches: 1041.3186

Found 25 metabolites which its exact mass value is equals to given mass value 1041.3186, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

trans-2-Enoyl-OPC8-CoA

{[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-{[(2E)-8-[(2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl]oct-2-enoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid

C39H62N7O18P3S (1041.3085)


trans-2-Enoyl-OPC8-CoA participates in alpha-linolenic acid metabolism. trans-2-Enoyl-OPC8-CoA is converted from OPC8-CoA via acyl-CoA oxidase [EC:1.3.3.6]. α-linolenic acid is a carboxylic acid with an 18-carbon chain and three cis double bonds. The first double bond is located at the third carbon from the n end. Thus, α-linolenic acid is a polyunsaturated n−3 (omega-3) fatty acid. It is an isomer of γ-linolenic acid, a polyunsaturated n−6 (omega-6) fatty acid. [HMDB] trans-2-Enoyl-OPC8-CoA participates in alpha-linolenic acid metabolism. trans-2-Enoyl-OPC8-CoA is converted from OPC8-CoA via acyl-CoA oxidase [EC:1.3.3.6]. α-linolenic acid is a carboxylic acid with an 18-carbon chain and three cis double bonds. The first double bond is located at the third carbon from the n end. Thus, α-linolenic acid is a polyunsaturated n−3 (omega-3) fatty acid. It is an isomer of γ-linolenic acid, a polyunsaturated n−6 (omega-6) fatty acid.

   
   

CoA 18:4;O

{[(2R,3R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-2,2-dimethyl-3-({2-[(2-{[(2E)-8-[(2S)-3-oxo-2-[(2Z)-pent-2-en-1-yl]cyclopentyl]oct-2-enoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)propoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid

C39H62N7O18P3S (1041.3085)


   

PSS-CYANOPROPYLDIMETHYLSILYLOXY-HEPTACY&

PSS-CYANOPROPYLDIMETHYLSILYLOXY-HEPTACY&

C41H75NO13Si9 (1041.3162)


   

(9Z,12Z)-18-hydroxyoctadecadienoyl-CoA(4-)

(9Z,12Z)-18-hydroxyoctadecadienoyl-CoA(4-)

C39H62N7O18P3S-4 (1041.3085)


   
   
   

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] (E)-8-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]oct-2-enethioate

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] (E)-8-[(1S,2S)-3-oxo-2-[(Z)-pent-2-enyl]cyclopentyl]oct-2-enethioate

C39H62N7O18P3S (1041.3085)


   
   
   

trans-2-Enoyl-OPC8-CoA; (Acyl-CoA); [M+H]+

trans-2-Enoyl-OPC8-CoA; (Acyl-CoA); [M+H]+

C39H62N7O18P3S (1041.3085)


   

(E)-2,3-didehydropristanoyl-CoA(4-)

(E)-2,3-didehydropristanoyl-CoA(4-)

C40H66N7O17P3S-4 (1041.3449)


   
   

[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-[10-[(1R)-2-hexylcyclopropyl]decanoylsulfanyl]ethylamino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphate

[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-2-[[[[(3R)-4-[[3-[2-[10-[(1R)-2-hexylcyclopropyl]decanoylsulfanyl]ethylamino]-3-oxopropyl]amino]-3-hydroxy-2,2-dimethyl-4-oxobutoxy]-oxidophosphoryl]oxy-oxidophosphoryl]oxymethyl]-4-hydroxyoxolan-3-yl] phosphate

C40H66N7O17P3S-4 (1041.3449)


   

CID10079754; (Acyl-CoA); [M+H]+

CID10079754; (Acyl-CoA); [M+H]+

C37H64F2N7O17P3S (1041.326)


   

2-Difluoromethylpentadecanoyl-CoA, 4; (Acyl-CoA); [M+H]+

2-Difluoromethylpentadecanoyl-CoA, 4; (Acyl-CoA); [M+H]+

C37H64F2N7O17P3S (1041.326)


   

9r,13r-Opda-CoA; (Acyl-CoA); [M+H]+

9r,13r-Opda-CoA; (Acyl-CoA); [M+H]+

C39H62N7O18P3S (1041.3085)


   

PubChem CID: 44237210; (Acyl-CoA); [M+H]+

PubChem CID: 44237210; (Acyl-CoA); [M+H]+

C39H62N7O18P3S (1041.3085)


   

(9Z,12Z)-18-hydroxyoctadecadienoyl-CoA(4-)

(9Z,12Z)-18-hydroxyoctadecadienoyl-CoA(4-)

C39H62N7O18P3S (1041.3085)


A polyunsaturated fatty acyl-CoA(4-) obtained by deprotonation of the phosphate and diphosphate OH groups of (9Z,12Z)-18-hydroxyoctadecadienoyl-CoA; major species at pH 7.3.

   

3-oxooleoyl-CoA(4-)

3-oxooleoyl-CoA(4-)

C39H62N7O18P3S (1041.3085)


A monounsaturated fatty acyl-CoA(4-) obtained by deprotonation of the phosphate and diphosphate OH groups of 3-oxooleoyl-CoA; major species at pH 7.3.

   

(11Z)-3-oxooctadecenoyl-CoA(4-)

(11Z)-3-oxooctadecenoyl-CoA(4-)

C39H62N7O18P3S (1041.3085)


A 3-oxo-fatty acyl-CoA(4-) obtained by deprotonation of the phosphate and diphosphate OH groups of (11Z)-3-oxooctadecenoyl-CoA; major species at pH 7.3.

   

(E)-2,3-didehydropristanoyl-CoA(4-)

(E)-2,3-didehydropristanoyl-CoA(4-)

C40H66N7O17P3S (1041.3449)


A multi-methyl-branched fatty acyl-CoA(4-) arising from deprotonation of the phosphate and diphosphate OH groups of (E)-2,3-didehydropristanoyl-CoA; major species at pH 7.3

   
   

n-[15-(3-carbamimidamidopropyl)-5-[(3-chloro-4-hydroxyphenyl)methyl]-6,13,16,21-tetrahydroxy-8-isopropyl-4,11-dimethyl-3,9,22-trioxo-2-(sec-butyl)-10-oxa-1,4,7,14,17-pentaazabicyclo[16.3.1]docosa-6,13,16-trien-12-yl]-2,3-bis(sulfooxy)propanimidic acid

n-[15-(3-carbamimidamidopropyl)-5-[(3-chloro-4-hydroxyphenyl)methyl]-6,13,16,21-tetrahydroxy-8-isopropyl-4,11-dimethyl-3,9,22-trioxo-2-(sec-butyl)-10-oxa-1,4,7,14,17-pentaazabicyclo[16.3.1]docosa-6,13,16-trien-12-yl]-2,3-bis(sulfooxy)propanimidic acid

C39H60ClN9O18S2 (1041.3186)


   

(2r)-n-[(2s,5s,8s,11r,12s,15s,18s,21r)-2-[(2s)-butan-2-yl]-15-(3-carbamimidamidopropyl)-5-[(3-chloro-4-hydroxyphenyl)methyl]-6,13,16,21-tetrahydroxy-8-isopropyl-4,11-dimethyl-3,9,22-trioxo-10-oxa-1,4,7,14,17-pentaazabicyclo[16.3.1]docosa-6,13,16-trien-12-yl]-2,3-bis(sulfooxy)propanimidic acid

(2r)-n-[(2s,5s,8s,11r,12s,15s,18s,21r)-2-[(2s)-butan-2-yl]-15-(3-carbamimidamidopropyl)-5-[(3-chloro-4-hydroxyphenyl)methyl]-6,13,16,21-tetrahydroxy-8-isopropyl-4,11-dimethyl-3,9,22-trioxo-10-oxa-1,4,7,14,17-pentaazabicyclo[16.3.1]docosa-6,13,16-trien-12-yl]-2,3-bis(sulfooxy)propanimidic acid

C39H60ClN9O18S2 (1041.3186)