Exact Mass: 744.4204

Exact Mass Matches: 744.4204

Found 51 metabolites which its exact mass value is equals to given mass value 744.4204, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

PG(i-12:0/PGJ2)

[(2S)-2,3-dihydroxypropoxy][(2R)-2-{[(5Z)-7-[(1S,5R)-5-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-4-oxocyclopent-2-en-1-yl]hept-5-enoyl]oxy}-3-[(10-methylundecanoyl)oxy]propoxy]phosphinic acid

C38H65O12P (744.4213)


PG(i-12:0/PGJ2) is an oxidized phosphatidylglycerol (PG). Oxidized phosphatidylglycerols are glycerophospholipids in which a phosphoglycerol moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized phosphatidylglycerols 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, phosphatidylglycerols 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. PG(i-12:0/PGJ2), in particular, consists of one chain of one 10-methylundecanoyl at the C-1 position and one chain of Prostaglandin J2 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 PGs can be synthesized via three different routes. In one route, the oxidized PG is synthetized de novo following the same mechanisms as for PGs 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 PG backbone, mainly through the action of LOX (PMID: 33329396).

   

PG(PGJ2/i-12:0)

[(2S)-2,3-dihydroxypropoxy][(2R)-3-{[(5Z)-7-[(1S,5R)-5-[(1E,3S)-3-hydroxyoct-1-en-1-yl]-4-oxocyclopent-2-en-1-yl]hept-5-enoyl]oxy}-2-[(10-methylundecanoyl)oxy]propoxy]phosphinic acid

C38H65O12P (744.4213)


PG(PGJ2/i-12:0) is an oxidized phosphatidylglycerol (PG). Oxidized phosphatidylglycerols are glycerophospholipids in which a phosphoglycerol moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized phosphatidylglycerols 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, phosphatidylglycerols 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. PG(PGJ2/i-12:0), in particular, consists of one chain of one Prostaglandin J2 at the C-1 position and one chain of 10-methylundecanoyl 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 PGs can be synthesized via three different routes. In one route, the oxidized PG is synthetized de novo following the same mechanisms as for PGs 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 PG backbone, mainly through the action of LOX (PMID: 33329396).

   

(22S)-Cholest-5-en-1??,3??,16??,22,25-pentaol 1-O-??-D-glucopyranosyl-16-O-??-D-apiofuranoside

(22S)-Cholest-5-en-1??,3??,16??,22,25-pentaol 1-O-??-D-glucopyranosyl-16-O-??-D-apiofuranoside

C38H64O14 (744.4296)


   

(6S,13S)-cleroda-3,14-diene-6,13-diol 13-O-alpha-L-fucopyranosyl-(1-2)-(a-L-rhamnopyranosyl-(1-3))-alpha-L-rhamnopyranoside|(6S,13S)-cleroda-3,14-diene-6,13-diol 13-O-alpha-L-fucopyranosyl-(1-2)--alpha-L-rhamnopyranoside

(6S,13S)-cleroda-3,14-diene-6,13-diol 13-O-alpha-L-fucopyranosyl-(1-2)-(a-L-rhamnopyranosyl-(1-3))-alpha-L-rhamnopyranoside|(6S,13S)-cleroda-3,14-diene-6,13-diol 13-O-alpha-L-fucopyranosyl-(1-2)--alpha-L-rhamnopyranoside

C38H64O14 (744.4296)


   

asteriidoside G

asteriidoside G

C38H64O14 (744.4296)


   

Anemarrhenasaponin I

Anemarrhenasaponin I

C38H64O14 (744.4296)


   

(20R,24R)-3-O-(2-O-methyl-beta-D-xylopyranosyl)-24-ethylcholest-5-ene-3beta,6beta,8beta,15alpha,16beta,29-pentanol 15-sulfate sodium salt|granulatoside A

(20R,24R)-3-O-(2-O-methyl-beta-D-xylopyranosyl)-24-ethylcholest-5-ene-3beta,6beta,8beta,15alpha,16beta,29-pentanol 15-sulfate sodium salt|granulatoside A

C38H64O14 (744.4296)


   

methyl(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silylene dimyristate

methyl(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silylene dimyristate

C35H61F9O4Si (744.4195)


   

Demethyllactenocin(1+)

Demethyllactenocin(1+)

C37H62NO14+ (744.417)


An organic cation that is the conjugate acid of demethyllactenocin, obtained by protonation of the tertiary amino group; major species at pH 7.3.

   

PG(i-12:0/PGJ2)

PG(i-12:0/PGJ2)

C38H65O12P (744.4213)


   

PG(PGJ2/i-12:0)

PG(PGJ2/i-12:0)

C38H65O12P (744.4213)


   

Scytonemide A

Scytonemide A

C36H56N8O9 (744.417)


A natural product found in Scytonema hofmanni.

   

Smgdg O-22:5_7:0

Smgdg O-22:5_7:0

C38H64O12S (744.4118)


   

Smgdg O-20:5_9:0

Smgdg O-20:5_9:0

C38H64O12S (744.4118)


   

Smgdg O-9:0_20:5

Smgdg O-9:0_20:5

C38H64O12S (744.4118)


   

Smgdg O-24:5_5:0

Smgdg O-24:5_5:0

C38H64O12S (744.4118)


   

Smgdg O-26:5_3:0

Smgdg O-26:5_3:0

C38H64O12S (744.4118)


   

Dgdg O-18:4_5:0

Dgdg O-18:4_5:0

C38H64O14 (744.4296)


   

Dgdg O-20:4_3:0

Dgdg O-20:4_3:0

C38H64O14 (744.4296)


   

Dgdg O-16:4_7:0

Dgdg O-16:4_7:0

C38H64O14 (744.4296)


   

Smgdg O-13:1_16:4

Smgdg O-13:1_16:4

C38H64O12S (744.4118)


   

Smgdg O-11:0_18:5

Smgdg O-11:0_18:5

C38H64O12S (744.4118)


   

Smgdg O-18:5_11:0

Smgdg O-18:5_11:0

C38H64O12S (744.4118)


   

Smgdg O-16:4_13:1

Smgdg O-16:4_13:1

C38H64O12S (744.4118)


   

[1-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (Z)-tridec-9-enoate

[1-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (Z)-tridec-9-enoate

C38H65O12P (744.4213)


   

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-undecoxypropan-2-yl] (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-undecoxypropan-2-yl] (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate

C38H65O12P (744.4213)


   

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-[(Z)-tridec-9-enoxy]propan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-[(Z)-tridec-9-enoxy]propan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate

C38H65O12P (744.4213)


   

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propan-2-yl] undecanoate

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propan-2-yl] undecanoate

C38H65O12P (744.4213)


   

[6-[2-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxy-3-[(Z)-tridec-9-enoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[6-[2-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxy-3-[(Z)-tridec-9-enoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   

[6-[2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxy-3-tridecanoyloxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[6-[2-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxy-3-tridecanoyloxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-2-[(9E,11E,13E,15E)-octadeca-9,11,13,15-tetraenoyl]oxy-3-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-2-[(9E,11E,13E,15E)-octadeca-9,11,13,15-tetraenoyl]oxy-3-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   

[(2S,3S,6S)-6-[2-[(9E,11E,13E)-hexadeca-9,11,13-trienoyl]oxy-3-[(E)-tridec-8-enoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-6-[2-[(9E,11E,13E)-hexadeca-9,11,13-trienoyl]oxy-3-[(E)-tridec-8-enoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   

[(2S,3S,6S)-6-[2-[(7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoyl]oxy-3-tridecanoyloxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-6-[2-[(7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoyl]oxy-3-tridecanoyloxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-3-[(9E,11E,13E,15E)-octadeca-9,11,13,15-tetraenoyl]oxy-2-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-3-[(9E,11E,13E,15E)-octadeca-9,11,13,15-tetraenoyl]oxy-2-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-2-[(6E,9E,12E,15E)-octadeca-6,9,12,15-tetraenoyl]oxy-3-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-2-[(6E,9E,12E,15E)-octadeca-6,9,12,15-tetraenoyl]oxy-3-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-3-[(6E,9E,12E,15E)-octadeca-6,9,12,15-tetraenoyl]oxy-2-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-3,4,5-trihydroxy-6-[(2S)-3-[(6E,9E,12E,15E)-octadeca-6,9,12,15-tetraenoyl]oxy-2-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid

C38H64O12S (744.4118)


   
   
   
   
   
   

PG 20:2/12:3;O2

PG 20:2/12:3;O2

C38H65O12P (744.4213)


   

PG 20:3/12:2;O2

PG 20:3/12:2;O2

C38H65O12P (744.4213)


   
   

β-Amyloid (35-42)

β-Amyloid (35-42)

C33H60N8O9S (744.4204)


β-Amyloid (35-42) is a peptide consisting of amino acid of 35 to 42 of beta amyloid protein.

   

(22s)-cholest-5-en-1β,3β,16β,22,25-pentaol 1-o-β-d-glucopyranosyl-16-o-β-d-apiofuranoside

NA

C38H64O14 (744.4296)


{"Ingredient_id": "HBIN003778","Ingredient_name": "(22s)-cholest-5-en-1\u03b2,3\u03b2,16\u03b2,22,25-pentaol 1-o-\u03b2-d-glucopyranosyl-16-o-\u03b2-d-apiofuranoside","Alias": "NA","Ingredient_formula": "C38H64O14","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3584","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(3r,4s,6s,8s,10r,12r,14r,15s,16r,17e,19e,21e,23e,25e,27s,28r)-16-[(2r)-2,3-dihydroxypropoxy]-4,6,8,10,12,14,15,27-octahydroxy-3-[(1r)-1-hydroxyhexyl]-17,28-dimethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one

(3r,4s,6s,8s,10r,12r,14r,15s,16r,17e,19e,21e,23e,25e,27s,28r)-16-[(2r)-2,3-dihydroxypropoxy]-4,6,8,10,12,14,15,27-octahydroxy-3-[(1r)-1-hydroxyhexyl]-17,28-dimethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one

C38H64O14 (744.4296)


   

16-(2,3-dihydroxypropoxy)-4,6,8,10,12,14,15,27-octahydroxy-3-(1-hydroxyhexyl)-17,28-dimethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one

16-(2,3-dihydroxypropoxy)-4,6,8,10,12,14,15,27-octahydroxy-3-(1-hydroxyhexyl)-17,28-dimethyl-1-oxacyclooctacosa-17,19,21,23,25-pentaen-2-one

C38H64O14 (744.4296)


   

3-[3,6,9,12,18,21-hexahydroxy-8-(hydroxymethyl)-17-[(4-hydroxyphenyl)methyl]-11-isopropyl-14-(2-methylpropyl)-5-(sec-butyl)-1,4,7,10,13,16,19-heptaazacyclohenicosa-1(21),3,6,9,12,15,18-heptaen-2-yl]propanimidic acid

3-[3,6,9,12,18,21-hexahydroxy-8-(hydroxymethyl)-17-[(4-hydroxyphenyl)methyl]-11-isopropyl-14-(2-methylpropyl)-5-(sec-butyl)-1,4,7,10,13,16,19-heptaazacyclohenicosa-1(21),3,6,9,12,15,18-heptaen-2-yl]propanimidic acid

C36H56N8O9 (744.417)


   

3-[(2r,5s,8s,11s,14s,17s)-5-[(2s)-butan-2-yl]-3,6,9,12,18,21-hexahydroxy-8-(hydroxymethyl)-17-[(4-hydroxyphenyl)methyl]-11-isopropyl-14-(2-methylpropyl)-1,4,7,10,13,16,19-heptaazacyclohenicosa-1(21),3,6,9,12,15,18-heptaen-2-yl]propanimidic acid

3-[(2r,5s,8s,11s,14s,17s)-5-[(2s)-butan-2-yl]-3,6,9,12,18,21-hexahydroxy-8-(hydroxymethyl)-17-[(4-hydroxyphenyl)methyl]-11-isopropyl-14-(2-methylpropyl)-1,4,7,10,13,16,19-heptaazacyclohenicosa-1(21),3,6,9,12,15,18-heptaen-2-yl]propanimidic acid

C36H56N8O9 (744.417)