Exact Mass: 849.5636

Exact Mass Matches: 849.5636

Found 103 metabolites which its exact mass value is equals to given mass value 849.5636, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

PS(20:0/18:1(12Z)-2OH(9,10))

(2S)-2-amino-3-({[(2R)-2-{[(9S,10S,12Z)-9,10-dihydroxyoctadec-12-enoyl]oxy}-3-(icosanoyloxy)propoxy](hydroxy)phosphoryl}oxy)propanoic acid

C44H84NO12P (849.5731)


PS(20:0/18:1(12Z)-2OH(9,10)) is an oxidized phosphatidylserine (PS). Oxidized phosphatidylserines are glycerophospholipids in which a phosphorylserine moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized phosphatidylserines belong to a group of biomolecules that have a role as signaling molecules. The biosynthesis of oxidized lipids is mediated by several enzymatic families, including cyclooxygenases (COX), lipoxygenases (LOX) and cytochrome P450s (CYP). Non-enzymatically oxidized lipids are produced by uncontrolled oxidation through free radicals and are considered harmful to human health (PMID: 33329396). As is the case with diacylglycerols, phosphatidylserines can have many different combinations of fatty acids of varying lengths, saturation and degrees of oxidation attached at the C-1 and C-2 positions. PS(20:0/18:1(12Z)-2OH(9,10)), in particular, consists of one chain of one eicosanoyl at the C-1 position and one chain of 9,10-hydroxy-octadecenoyl at the C-2 position. Phospholipids are ubiquitous in nature and are key components of the lipid bilayer of cells, as well as being involved in metabolism and signaling. Similarly to what occurs with phospholipids, the fatty acid distribution at the C-1 and C-2 positions of glycerol within oxidized phospholipids is continually in flux, owing to phospholipid degradation and the continuous phospholipid remodeling that occurs while these molecules are in membranes. Oxidized PSs can be synthesized via three different routes. In one route, the oxidized PS is synthetized de novo following the same mechanisms as for PSs but incorporating oxidized acyl chains (PMID: 33329396). An alternative is the transacylation of one of the non-oxidized acyl chains with an oxidized acylCoA (PMID: 33329396). The third pathway results from the oxidation of the acyl chain while still attached to the PS backbone, mainly through the action of LOX (PMID: 33329396).

   

PS(18:1(12Z)-2OH(9,10)/20:0)

(2S)-2-amino-3-({[(2R)-3-{[(9R,10R,12Z)-9,10-dihydroxyoctadec-12-enoyl]oxy}-2-(icosanoyloxy)propoxy](hydroxy)phosphoryl}oxy)propanoic acid

C44H84NO12P (849.5731)


PS(18:1(12Z)-2OH(9,10)/20:0) is an oxidized phosphatidylserine (PS). Oxidized phosphatidylserines are glycerophospholipids in which a phosphorylserine moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized phosphatidylserines belong to a group of biomolecules that have a role as signaling molecules. The biosynthesis of oxidized lipids is mediated by several enzymatic families, including cyclooxygenases (COX), lipoxygenases (LOX) and cytochrome P450s (CYP). Non-enzymatically oxidized lipids are produced by uncontrolled oxidation through free radicals and are considered harmful to human health (PMID: 33329396). As is the case with diacylglycerols, phosphatidylserines can have many different combinations of fatty acids of varying lengths, saturation and degrees of oxidation attached at the C-1 and C-2 positions. PS(18:1(12Z)-2OH(9,10)/20:0), in particular, consists of one chain of one 9,10-hydroxy-octadecenoyl at the C-1 position and one chain of eicosanoyl at the C-2 position. Phospholipids are ubiquitous in nature and are key components of the lipid bilayer of cells, as well as being involved in metabolism and signaling. Similarly to what occurs with phospholipids, the fatty acid distribution at the C-1 and C-2 positions of glycerol within oxidized phospholipids is continually in flux, owing to phospholipid degradation and the continuous phospholipid remodeling that occurs while these molecules are in membranes. Oxidized PSs can be synthesized via three different routes. In one route, the oxidized PS is synthetized de novo following the same mechanisms as for PSs but incorporating oxidized acyl chains (PMID: 33329396). An alternative is the transacylation of one of the non-oxidized acyl chains with an oxidized acylCoA (PMID: 33329396). The third pathway results from the oxidation of the acyl chain while still attached to the PS backbone, mainly through the action of LOX (PMID: 33329396).

   

PS(20:0/18:1(12Z)-2OH(9,10))

PS(20:0/18:1(12Z)-2OH(9,10))

C44H84NO12P (849.5731)


   

PS(18:1(12Z)-2OH(9,10)/20:0)

PS(18:1(12Z)-2OH(9,10)/20:0)

C44H84NO12P (849.5731)


   
   
   

SHexCer 12:2;2O/26:0;O

SHexCer 12:2;2O/26:0;O

C44H83NO12S (849.5636)


   

SHexCer 20:0;2O/18:2;O

SHexCer 20:0;2O/18:2;O

C44H83NO12S (849.5636)


   

SHexCer 19:2;2O/19:0;O

SHexCer 19:2;2O/19:0;O

C44H83NO12S (849.5636)


   

SHexCer 21:2;2O/17:0;O

SHexCer 21:2;2O/17:0;O

C44H83NO12S (849.5636)


   

SHexCer 15:1;2O/23:1;O

SHexCer 15:1;2O/23:1;O

C44H83NO12S (849.5636)


   

SHexCer 16:2;2O/22:0;O

SHexCer 16:2;2O/22:0;O

C44H83NO12S (849.5636)


   

SHexCer 22:0;2O/16:2;O

SHexCer 22:0;2O/16:2;O

C44H83NO12S (849.5636)


   

SHexCer 22:1;2O/16:1;O

SHexCer 22:1;2O/16:1;O

C44H83NO12S (849.5636)


   

SHexCer 13:2;2O/25:0;O

SHexCer 13:2;2O/25:0;O

C44H83NO12S (849.5636)


   

SHexCer 14:1;2O/24:1;O

SHexCer 14:1;2O/24:1;O

C44H83NO12S (849.5636)


   

SHexCer 17:1;2O/21:1;O

SHexCer 17:1;2O/21:1;O

C44H83NO12S (849.5636)


   

SHexCer 23:1;2O/15:1;O

SHexCer 23:1;2O/15:1;O

C44H83NO12S (849.5636)


   

SHexCer 13:1;2O/25:1;O

SHexCer 13:1;2O/25:1;O

C44H83NO12S (849.5636)


   

SHexCer 14:0;2O/24:2;O

SHexCer 14:0;2O/24:2;O

C44H83NO12S (849.5636)


   

SHexCer 15:2;2O/23:0;O

SHexCer 15:2;2O/23:0;O

C44H83NO12S (849.5636)


   

SHexCer 26:2;2O/12:0;O

SHexCer 26:2;2O/12:0;O

C44H83NO12S (849.5636)


   

SHexCer 20:1;2O/18:1;O

SHexCer 20:1;2O/18:1;O

C44H83NO12S (849.5636)


   

SHexCer 16:0;2O/22:2;O

SHexCer 16:0;2O/22:2;O

C44H83NO12S (849.5636)


   

SHexCer 17:2;2O/21:0;O

SHexCer 17:2;2O/21:0;O

C44H83NO12S (849.5636)


   

SHexCer 16:1;2O/22:1;O

SHexCer 16:1;2O/22:1;O

C44H83NO12S (849.5636)


   

SHexCer 24:2;2O/14:0;O

SHexCer 24:2;2O/14:0;O

C44H83NO12S (849.5636)


   

SHexCer 25:1;2O/13:1;O

SHexCer 25:1;2O/13:1;O

C44H83NO12S (849.5636)


   

SHexCer 12:0;2O/26:2;O

SHexCer 12:0;2O/26:2;O

C44H83NO12S (849.5636)


   

SHexCer 18:0;2O/20:2;O

SHexCer 18:0;2O/20:2;O

C44H83NO12S (849.5636)


   

SHexCer 20:2;2O/18:0;O

SHexCer 20:2;2O/18:0;O

C44H83NO12S (849.5636)


   

SHexCer 23:2;2O/15:0;O

SHexCer 23:2;2O/15:0;O

C44H83NO12S (849.5636)


   

SHexCer 24:1;2O/14:1;O

SHexCer 24:1;2O/14:1;O

C44H83NO12S (849.5636)


   

SHexCer 14:2;2O/24:0;O

SHexCer 14:2;2O/24:0;O

C44H83NO12S (849.5636)


   

SHexCer 12:1;2O/26:1;O

SHexCer 12:1;2O/26:1;O

C44H83NO12S (849.5636)


   

SHexCer 19:1;2O/19:1;O

SHexCer 19:1;2O/19:1;O

C44H83NO12S (849.5636)


   

SHexCer 18:2;2O/20:0;O

SHexCer 18:2;2O/20:0;O

C44H83NO12S (849.5636)


   

SHexCer 18:1;2O/20:1;O

SHexCer 18:1;2O/20:1;O

C44H83NO12S (849.5636)


   

SHexCer 25:2;2O/13:0;O

SHexCer 25:2;2O/13:0;O

C44H83NO12S (849.5636)


   

SHexCer 26:1;2O/12:1;O

SHexCer 26:1;2O/12:1;O

C44H83NO12S (849.5636)


   

SHexCer 22:2;2O/16:0;O

SHexCer 22:2;2O/16:0;O

C44H83NO12S (849.5636)


   

PI-Cer 15:1;2O/23:1;O

PI-Cer 15:1;2O/23:1;O

C44H84NO12P (849.5731)


   

PI-Cer 12:0;2O/26:2;O

PI-Cer 12:0;2O/26:2;O

C44H84NO12P (849.5731)


   

PI-Cer 26:1;2O/12:1;O

PI-Cer 26:1;2O/12:1;O

C44H84NO12P (849.5731)


   

PI-Cer 22:0;2O/16:2;O

PI-Cer 22:0;2O/16:2;O

C44H84NO12P (849.5731)


   

PI-Cer 18:1;2O/20:1;O

PI-Cer 18:1;2O/20:1;O

C44H84NO12P (849.5731)


   

PI-Cer 18:2;2O/20:0;O

PI-Cer 18:2;2O/20:0;O

C44H84NO12P (849.5731)


   

PI-Cer 14:2;2O/24:0;O

PI-Cer 14:2;2O/24:0;O

C44H84NO12P (849.5731)


   

PI-Cer 20:2;2O/18:0;O

PI-Cer 20:2;2O/18:0;O

C44H84NO12P (849.5731)


   

PI-Cer 16:2;2O/22:0;O

PI-Cer 16:2;2O/22:0;O

C44H84NO12P (849.5731)


   

PI-Cer 13:2;2O/25:0;O

PI-Cer 13:2;2O/25:0;O

C44H84NO12P (849.5731)


   

PI-Cer 12:2;2O/26:0;O

PI-Cer 12:2;2O/26:0;O

C44H84NO12P (849.5731)


   

PI-Cer 15:2;2O/23:0;O

PI-Cer 15:2;2O/23:0;O

C44H84NO12P (849.5731)


   

PI-Cer 17:1;2O/21:1;O

PI-Cer 17:1;2O/21:1;O

C44H84NO12P (849.5731)


   

PI-Cer 24:2;2O/14:0;O

PI-Cer 24:2;2O/14:0;O

C44H84NO12P (849.5731)


   

PI-Cer 19:2;2O/19:0;O

PI-Cer 19:2;2O/19:0;O

C44H84NO12P (849.5731)


   

PI-Cer 20:1;2O/18:1;O

PI-Cer 20:1;2O/18:1;O

C44H84NO12P (849.5731)


   

PI-Cer 16:1;2O/22:1;O

PI-Cer 16:1;2O/22:1;O

C44H84NO12P (849.5731)


   

PI-Cer 12:1;2O/26:1;O

PI-Cer 12:1;2O/26:1;O

C44H84NO12P (849.5731)


   

PI-Cer 23:2;2O/15:0;O

PI-Cer 23:2;2O/15:0;O

C44H84NO12P (849.5731)


   

PI-Cer 23:1;2O/15:1;O

PI-Cer 23:1;2O/15:1;O

C44H84NO12P (849.5731)


   

PI-Cer 19:1;2O/19:1;O

PI-Cer 19:1;2O/19:1;O

C44H84NO12P (849.5731)


   

PI-Cer 16:0;2O/22:2;O

PI-Cer 16:0;2O/22:2;O

C44H84NO12P (849.5731)


   

PI-Cer 22:1;2O/16:1;O

PI-Cer 22:1;2O/16:1;O

C44H84NO12P (849.5731)


   

PI-Cer 21:2;2O/17:0;O

PI-Cer 21:2;2O/17:0;O

C44H84NO12P (849.5731)


   

PI-Cer 13:1;2O/25:1;O

PI-Cer 13:1;2O/25:1;O

C44H84NO12P (849.5731)


   

PI-Cer 24:1;2O/14:1;O

PI-Cer 24:1;2O/14:1;O

C44H84NO12P (849.5731)


   

PI-Cer 25:2;2O/13:0;O

PI-Cer 25:2;2O/13:0;O

C44H84NO12P (849.5731)


   

PI-Cer 25:1;2O/13:1;O

PI-Cer 25:1;2O/13:1;O

C44H84NO12P (849.5731)


   

PI-Cer 17:2;2O/21:0;O

PI-Cer 17:2;2O/21:0;O

C44H84NO12P (849.5731)


   

PI-Cer 14:0;2O/24:2;O

PI-Cer 14:0;2O/24:2;O

C44H84NO12P (849.5731)


   

PI-Cer 14:1;2O/24:1;O

PI-Cer 14:1;2O/24:1;O

C44H84NO12P (849.5731)


   

PI-Cer 20:0;2O/18:2;O

PI-Cer 20:0;2O/18:2;O

C44H84NO12P (849.5731)


   

PI-Cer 26:2;2O/12:0;O

PI-Cer 26:2;2O/12:0;O

C44H84NO12P (849.5731)


   

PI-Cer 18:0;2O/20:2;O

PI-Cer 18:0;2O/20:2;O

C44H84NO12P (849.5731)


   

PI-Cer 22:2;2O/16:0;O

PI-Cer 22:2;2O/16:0;O

C44H84NO12P (849.5731)


   

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propan-2-yl] (7Z,10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-7,10,13,16,19,22,25-heptaenoate

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propan-2-yl] (7Z,10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-7,10,13,16,19,22,25-heptaenoate

C51H80NO7P (849.5672)


   

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(7Z,10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-7,10,13,16,19,22,25-heptaenoxy]propan-2-yl] (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(7Z,10Z,13Z,16Z,19Z,22Z,25Z)-octacosa-7,10,13,16,19,22,25-heptaenoxy]propan-2-yl] (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate

C51H80NO7P (849.5672)


   

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoxy]propan-2-yl] (5Z,8Z,11Z,14Z,17Z,20Z,23Z)-hexacosa-5,8,11,14,17,20,23-heptaenoate

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoxy]propan-2-yl] (5Z,8Z,11Z,14Z,17Z,20Z,23Z)-hexacosa-5,8,11,14,17,20,23-heptaenoate

C51H80NO7P (849.5672)


   

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]propan-2-yl] (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoate

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]propan-2-yl] (6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoate

C51H80NO7P (849.5672)


   

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoxy]propan-2-yl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoxy]propan-2-yl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

C51H80NO7P (849.5672)


   

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(5Z,8Z,11Z,14Z,17Z,20Z,23Z)-hexacosa-5,8,11,14,17,20,23-heptaenoxy]propan-2-yl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(5Z,8Z,11Z,14Z,17Z,20Z,23Z)-hexacosa-5,8,11,14,17,20,23-heptaenoxy]propan-2-yl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate

C51H80NO7P (849.5672)


   

ST(38:2)

ST(d18:1_20:1(1+O))

C44H83NO12S (849.5636)


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IPC 14:1;O2/24:1;O

IPC 14:1;O2/24:1;O

C44H84NO12P (849.5731)


   

IPC 14:2;O2/24:0;O

IPC 14:2;O2/24:0;O

C44H84NO12P (849.5731)


   

IPC 15:2;O2/23:0;O

IPC 15:2;O2/23:0;O

C44H84NO12P (849.5731)


   

IPC 16:1;O2/22:1;O

IPC 16:1;O2/22:1;O

C44H84NO12P (849.5731)


   

IPC 16:2;O2/22:0;O

IPC 16:2;O2/22:0;O

C44H84NO12P (849.5731)


   

IPC 17:2;O2/21:0;O

IPC 17:2;O2/21:0;O

C44H84NO12P (849.5731)


   

IPC 18:1;O2/20:1;O

IPC 18:1;O2/20:1;O

C44H84NO12P (849.5731)


   

IPC 18:2;O2/20:0;O

IPC 18:2;O2/20:0;O

C44H84NO12P (849.5731)


   

IPC 19:2;O2/19:0;O

IPC 19:2;O2/19:0;O

C44H84NO12P (849.5731)


   

IPC 20:1;O2/18:1;O

IPC 20:1;O2/18:1;O

C44H84NO12P (849.5731)


   

IPC 20:2;O2/18:0;O

IPC 20:2;O2/18:0;O

C44H84NO12P (849.5731)


   

IPC 21:2;O2/17:0;O

IPC 21:2;O2/17:0;O

C44H84NO12P (849.5731)


   

IPC 22:2;O2/16:0;O

IPC 22:2;O2/16:0;O

C44H84NO12P (849.5731)