Exact Mass: 1164.5844958

Exact Mass Matches: 1164.5844958

Found 27 metabolites which its exact mass value is equals to given mass value 1164.5844958, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

CDP-DG(18:0/LTE4)

(5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-amino-3-{[(2R)-1-({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3-(octadecanoyloxy)propan-2-yl]oxy}-3-oxopropyl]sulphanyl}-5-hydroxyicosa-7,9,11,14-tetraenoic acid

C53H90N4O18P2S (1164.544578)


CDP-DG(18:0/LTE4) is an oxidized CDP-diacylglycerol (CDP-DG). Oxidized CDP-diacylglycerols are glycerophospholipids in which a cytidine diphosphate moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized CDP-diacylglycerols 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, CDP-diacylglycerols 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. CDP-DG(18:0/LTE4), in particular, consists of one chain of one octadecanoyl at the C-1 position and one chain of Leukotriene E4 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 CDP-DGs can be synthesized via three different routes. In one route, the oxidized CDP-DG is synthetized de novo following the same mechanisms as for CDP-DGs 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 CDP-DG backbone, mainly through the action of LOX (PMID: 33329396).

   

CDP-DG(LTE4/18:0)

(5S,6R,7E,9E,11Z,14Z)-6-{[(2R)-2-amino-3-[(2R)-3-({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-(octadecanoyloxy)propoxy]-3-oxopropyl]sulphanyl}-5-hydroxyicosa-7,9,11,14-tetraenoic acid

C53H90N4O18P2S (1164.544578)


CDP-DG(LTE4/18:0) is an oxidized CDP-diacylglycerol (CDP-DG). Oxidized CDP-diacylglycerols are glycerophospholipids in which a cytidine diphosphate moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized CDP-diacylglycerols 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, CDP-diacylglycerols 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. CDP-DG(LTE4/18:0), in particular, consists of one chain of one Leukotriene E4 at the C-1 position and one chain of octadecanoyl 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 CDP-DGs can be synthesized via three different routes. In one route, the oxidized CDP-DG is synthetized de novo following the same mechanisms as for CDP-DGs 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 CDP-DG backbone, mainly through the action of LOX (PMID: 33329396).

   

CDP-DG(i-18:0/LTE4)

(5S,6R,7E,11Z,14Z)-6-{[(2R)-2-amino-3-{[(2R)-1-({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-3-[(16-methylheptadecanoyl)oxy]propan-2-yl]oxy}-3-oxopropyl]sulphanyl}-5-hydroxyicosa-7,9,11,14-tetraenoic acid

C53H90N4O18P2S (1164.544578)


CDP-DG(i-18:0/LTE4) is an oxidized CDP-diacylglycerol (CDP-DG). Oxidized CDP-diacylglycerols are glycerophospholipids in which a cytidine diphosphate moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized CDP-diacylglycerols 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, CDP-diacylglycerols 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. CDP-DG(i-18:0/LTE4), in particular, consists of one chain of one 16-methylheptadecanoyl at the C-1 position and one chain of Leukotriene E4 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 CDP-DGs can be synthesized via three different routes. In one route, the oxidized CDP-DG is synthetized de novo following the same mechanisms as for CDP-DGs 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 CDP-DG backbone, mainly through the action of LOX (PMID: 33329396).

   

CDP-DG(LTE4/i-18:0)

(5S,6R,7E,11Z,14Z)-6-{[(2R)-2-amino-3-[(2R)-3-({[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-[(16-methylheptadecanoyl)oxy]propoxy]-3-oxopropyl]sulphanyl}-5-hydroxyicosa-7,9,11,14-tetraenoic acid

C53H90N4O18P2S (1164.544578)


CDP-DG(LTE4/i-18:0) is an oxidized CDP-diacylglycerol (CDP-DG). Oxidized CDP-diacylglycerols are glycerophospholipids in which a cytidine diphosphate moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized CDP-diacylglycerols 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, CDP-diacylglycerols 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. CDP-DG(LTE4/i-18:0), in particular, consists of one chain of one Leukotriene E4 at the C-1 position and one chain of 16-methylheptadecanoyl 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 CDP-DGs can be synthesized via three different routes. In one route, the oxidized CDP-DG is synthetized de novo following the same mechanisms as for CDP-DGs 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 CDP-DG backbone, mainly through the action of LOX (PMID: 33329396).

   

20-O-[(beta-D-glucopyranosyl-(1->6)-beta-glucopyranosyl-(1->2)-beta-D-digitalopyranosyl)oxy]pregn-5-en-16alpha-ol-3beta-yl O-(2-O-acetyl-beta-D-digitalopyranosyl)-(1->4)-beta-D-cymaropyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-<2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside> 20-O- 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-[2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside] 20-O-[beta-D-glucopyranosyl-(1 -> 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|glycoside H2

20-O-[(beta-D-glucopyranosyl-(1->6)-beta-glucopyranosyl-(1->2)-beta-D-digitalopyranosyl)oxy]pregn-5-en-16alpha-ol-3beta-yl O-(2-O-acetyl-beta-D-digitalopyranosyl)-(1->4)-beta-D-cymaropyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-<2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside> 20-O- 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|Delta5-pregnene-3beta,16alpha,20(S)-triol 3-O-[2-O-acetyl-beta-D-digitalopyranosyl(1 -> 4)-beta-D-cymaropyranoside] 20-O-[beta-D-glucopyranosyl-(1 -> 6)-beta-D-glucopyranosyl(1 -> 2)-beta-D-digitalopyranoside|glycoside H2

C56H92O25 (1164.5927382)


   

phytolaccagenic acid 3-O-(beta-D-glucopyranosyl-(1-4)-beta-D-glucopyranosyl-beta-D-glucopyranosyl)28-O-beta-D-glucopyranoside

phytolaccagenic acid 3-O-(beta-D-glucopyranosyl-(1-4)-beta-D-glucopyranosyl-beta-D-glucopyranosyl)28-O-beta-D-glucopyranoside

C55H88O26 (1164.5563548)


   

malonyl-ginsenoside Rb2

malonyl-ginsenoside Rb2

C56H92O25 (1164.5927382)


   
   

agabrittonoside B|diosgenin-3-O-beta-D-xylopyranosyl-(1->3)-[beta-D-xylopyranosyl-(1->3)-beta-D-glucopyranosyl-(1->2)]-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranoside

agabrittonoside B|diosgenin-3-O-beta-D-xylopyranosyl-(1->3)-[beta-D-xylopyranosyl-(1->3)-beta-D-glucopyranosyl-(1->2)]-beta-D-glucopyranosyl-(1->4)-beta-D-galactopyranoside

C55H88O26 (1164.5563548)


   

(3beta,4beta,21beta,22alpha)-22-(acetyloxy)-3-{{O-alpha-L-arabinopyranosyl-(1->4)-O-[beta-D-glucopyranosyl-(1->2)]-beta-D-glucopyranosyl}oxy}-23-hydroxy-21-{[(2Z,4E,6E)-8-methyl-1-oxodeca-2,4,6-trien-1-yl]oxy}-olean-12-en-28-oic acid|22-O-acetyl-3-O-{O-alpha-L-arabinopyranosyl-(1->4)-O-[beta-D-glucopyranosyl-(1->2)]-beta-D-glucopyranosyl}-24-hydroxy-21-O-[(2Z,4E,6E)-8-methyldeca-2,4,6-trienoyl]acerogenic acid|dipteroside D

(3beta,4beta,21beta,22alpha)-22-(acetyloxy)-3-{{O-alpha-L-arabinopyranosyl-(1->4)-O-[beta-D-glucopyranosyl-(1->2)]-beta-D-glucopyranosyl}oxy}-23-hydroxy-21-{[(2Z,4E,6E)-8-methyl-1-oxodeca-2,4,6-trien-1-yl]oxy}-olean-12-en-28-oic acid|22-O-acetyl-3-O-{O-alpha-L-arabinopyranosyl-(1->4)-O-[beta-D-glucopyranosyl-(1->2)]-beta-D-glucopyranosyl}-24-hydroxy-21-O-[(2Z,4E,6E)-8-methyldeca-2,4,6-trienoyl]acerogenic acid|dipteroside D

C60H92O22 (1164.6079932)


   

Malonylginsenoside Rc

Malonylginsenoside Rc

C56H92O25 (1164.5927382)


Malonylginsenoside Rc is a natural product found in Panax quinquefolius with data available.

   

26-[(beta-D-glucopyranosyl)oxy]-3beta-hydroxy-22alpha-methoxyfurosta-5,25(27)-diene-1beta-yl O-beta-D-apiofuranosyl-(1->3)-alpha-L-rhamnopyranosyl-(1->2)-O-[beta-D-xylopyranosyl-(1->3)]-alpha-L-arabinopyranoside

26-[(beta-D-glucopyranosyl)oxy]-3beta-hydroxy-22alpha-methoxyfurosta-5,25(27)-diene-1beta-yl O-beta-D-apiofuranosyl-(1->3)-alpha-L-rhamnopyranosyl-(1->2)-O-[beta-D-xylopyranosyl-(1->3)]-alpha-L-arabinopyranoside

C55H88O26 (1164.5563548)


   
   

(25R)-3beta-[(O-alpha-L-arabinopyranosyl-(1 ? 2)-O-[beta-D-xylopyranosyl-(1 ? 3)]-O-beta-D-glucopyranosyl-(1 ? 4)-O-[alpha-L-rhamnopyranosyl-(1 ? 2)]-beta-D-galactopyranosyl)oxy]-5alpha-spirostan-12-one

(25R)-3beta-[(O-alpha-L-arabinopyranosyl-(1 ? 2)-O-[beta-D-xylopyranosyl-(1 ? 3)]-O-beta-D-glucopyranosyl-(1 ? 4)-O-[alpha-L-rhamnopyranosyl-(1 ? 2)]-beta-D-galactopyranosyl)oxy]-5alpha-spirostan-12-one

C55H88O26 (1164.5563548)


   
   

N-[5-[2-[benzyl-[1-(4-methoxyphenyl)propan-2-yl]amino]-1-hydroxyethyl]-2-phenylmethoxyphenyl]formamide,(Z)-but-2-enedioic acid

N-[5-[2-[benzyl-[1-(4-methoxyphenyl)propan-2-yl]amino]-1-hydroxyethyl]-2-phenylmethoxyphenyl]formamide,(Z)-but-2-enedioic acid

C70H76N4O12 (1164.5459455999999)


   
   
   
   
   
   
   
   

5-hydroxy-2-({6-[(2-hydroxy-1-{1-[(5-hydroxy-4-methoxy-6-methyl-3-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl)oxy]ethyl}-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl)oxy]-4-methoxy-2-methyloxan-3-yl}oxy)-4-methoxy-6-methyloxan-3-yl acetate

5-hydroxy-2-({6-[(2-hydroxy-1-{1-[(5-hydroxy-4-methoxy-6-methyl-3-{[3,4,5-trihydroxy-6-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl)oxy]ethyl}-9a,11a-dimethyl-1h,2h,3h,3ah,3bh,4h,6h,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-7-yl)oxy]-4-methoxy-2-methyloxan-3-yl}oxy)-4-methoxy-6-methyloxan-3-yl acetate

C56H92O25 (1164.5927382)


   

3-({6-[(2-{[1-(2-{[6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl)-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-oxopropanoic acid

3-({6-[(2-{[1-(2-{[6-({[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6-methylhept-5-en-2-yl)-11-hydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-3,4,5-trihydroxyoxan-2-yl}methoxy)-3-oxopropanoic acid

C56H92O25 (1164.5927382)