Exact Mass: 744.3849585999999
Exact Mass Matches: 744.3849585999999
Found 107 metabolites which its exact mass value is equals to given mass value 744.3849585999999
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Lisinopril, epsilon-biotinamidocaproyl-
C37H56N6O8S (744.3880136000001)
PG(i-12:0/PGJ2)
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)
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).
Jatrophane 4
Jatrophane 4 is a natural product found in Euphorbia peplus with data available.
(22S)-Cholest-5-en-1??,3??,16??,22,25-pentaol 1-O-??-D-glucopyranosyl-16-O-??-D-apiofuranoside
(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
(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
5-[4-carboxy-2-[[1,3-dioxo-3-[4-[(1-oxooctadecyl)-amino]phenyl]propyl] amino]phenoxy]isophthalic acid
C42H52N2O10 (744.3621772000001)
methyl(3,3,4,4,5,5,6,6,6-nonafluorohexyl)silylene dimyristate
C35H61F9O4Si (744.4195173999999)
Lisinopril, epsilon-biotinamidocaproyl-
C37H56N6O8S (744.3880136000001)
Demethyllactenocin(1+)
C37H62NO14+ (744.4170091999999)
An organic cation that is the conjugate acid of demethyllactenocin, obtained by protonation of the tertiary amino group; major species at pH 7.3.
[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-[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-[(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-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propan-2-yl] undecanoate
[1-hexanoyloxy-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
[1-acetyloxy-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropan-2-yl] (8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoate
[1-butanoyloxy-3-[3,4,5-trihydroxy-6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxan-2-yl]oxypropan-2-yl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
[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-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxy-3-tridecanoyloxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid
[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-octanoyloxypropan-2-yl] (5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoate
C37H61O13P (744.3849585999999)
[1-decanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate
C37H61O13P (744.3849585999999)
[1-hexanoyloxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (7Z,10Z,13Z,16Z,19Z)-docosa-7,10,13,16,19-pentaenoate
C37H61O13P (744.3849585999999)
[3-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxy-2-[(5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoyl]oxypropyl] (4E,7E,10E,13E,16E)-nonadeca-4,7,10,13,16-pentaenoate
2-amino-5-[[(Z)-5-[2-amino-5-[[(Z)-5-[2-amino-5-[hydroxy-[(Z)-5-hydroxy-3-methylpent-2-enoyl]amino]pentanoyl]oxy-3-methylpent-2-enoyl]-hydroxyamino]pentanoyl]oxy-3-methylpent-2-enoyl]-hydroxyamino]pentanoic acid
C33H56N6O13 (744.3905166000001)
[(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
[1-[(E)-dodec-5-enoyl]oxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoate
C37H61O13P (744.3849585999999)
[(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-[(7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoyl]oxy-3-tridecanoyloxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid
[1-[(3E,6E,9E)-dodeca-3,6,9-trienoyl]oxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (4E,7E)-hexadeca-4,7-dienoate
C37H61O13P (744.3849585999999)
[1-dodecanoyloxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate
C37H61O13P (744.3849585999999)
[(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)-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)-3-[(6E,9E,12E,15E)-octadeca-6,9,12,15-tetraenoyl]oxy-2-undecanoyloxypropoxy]oxan-2-yl]methanesulfonic acid
[1-[(6E,9E)-dodeca-6,9-dienoyl]oxy-3-[hydroxy-[(5R)-2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropan-2-yl] (9E,11E,13E)-hexadeca-9,11,13-trienoate
C37H61O13P (744.3849585999999)
β-Amyloid (35-42)
β-Amyloid (35-42) is a peptide consisting of amino acid of 35 to 42 of beta amyloid protein.
[(1r,2r,6s,7s,8r,10s,11s,12r,14s,16s,17s,18r)-6,7-dihydroxy-8-(hydroxymethyl)-4-methyl-17-[(3-methylbutanoyl)oxy]-16-[(2s)-2-methyloxiran-2-yl]-14-[(1e,3e)-nona-1,3-dien-1-yl]-5-oxo-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-18-yl]methyl 3-methylbutanoate
(22s)-cholest-5-en-1β,3β,16β,22,25-pentaol 1-o-β-d-glucopyranosyl-16-o-β-d-apiofuranoside
{"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"}
[(1r,2r,6s,7s,8r,10s,11s,12r,14s,16s,17s,18r)-6,7-dihydroxy-8-(hydroxymethyl)-4-methyl-17-[(3-methylbutanoyl)oxy]-16-[(2r)-2-methyloxiran-2-yl]-14-[(1e,3e)-nona-1,3-dien-1-yl]-5-oxo-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-18-yl]methyl 3-methylbutanoate
(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
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
n-(3-{3,6,9,12,15,18,21-heptahydroxy-17,20-bis[3-(n-hydroxyacetamido)propyl]-1,4,7,10,13,16,19-heptaazacyclohenicosa-1(21),3,6,9,12,15,18-heptaen-2-yl}propyl)-n-hydroxyacetamide
20-hydroxy-12,28-bis(3-hydroxy-2-methylhex-4-en-2-yl)-7,13,17,29,33-pentaoxa-34,35-diazatetracyclo[29.2.1.1¹⁵,¹⁸.0⁶,⁸]pentatriaconta-1(34),2,4,9,15,18(35),21,23,25,31-decaene-14,30-dione
C42H52N2O10 (744.3621772000001)
[6,7-dihydroxy-8-(hydroxymethyl)-4-methyl-17-[(3-methylbutanoyl)oxy]-16-(2-methyloxiran-2-yl)-14-(nona-1,3-dien-1-yl)-5-oxo-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-18-yl]methyl 3-methylbutanoate
2-[(2-{[2-amino-5-(n,5-dihydroxy-3-methylpent-2-enamido)-1-hydroxypentylidene]amino}-5-(n,5-dihydroxy-3-methylpent-2-enamido)-1-hydroxypentylidene)amino]-5-(n,5-dihydroxy-3-methylpent-2-enamido)pentanoic acid
C33H56N6O13 (744.3905166000001)
(2z,4e,6r,8s,9z,12s,20r,21e,23z,25z,28r)-20-hydroxy-12,28-bis[(3s,4e)-3-hydroxy-2-methylhex-4-en-2-yl]-7,13,17,29,33-pentaoxa-34,35-diazatetracyclo[29.2.1.1¹⁵,¹⁸.0⁶,⁸]pentatriaconta-1(34),2,4,9,15,18(35),21,23,25,31-decaene-14,30-dione
C42H52N2O10 (744.3621772000001)
(1r,2r,3ar,4s,5s,9s,10s,11s,13r,13as)-2,4,9,13-tetrakis(acetyloxy)-3a,10-dihydroxy-2,5,8,8-tetramethyl-12-methylidene-11-[(2-methylpropanoyl)oxy]-1h,3h,4h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-1-yl benzoate
2,4,9,13-tetrakis(acetyloxy)-3a,10-dihydroxy-2,5,8,8-tetramethyl-12-methylidene-11-[(2-methylpropanoyl)oxy]-1h,3h,4h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-1-yl benzoate
[(2r,7s,8r,10s,11s,12r,14s,16s,17s,18r)-6,7-dihydroxy-8-(hydroxymethyl)-4-methyl-17-[(3-methylbutanoyl)oxy]-16-[(2r)-2-methyloxiran-2-yl]-14-[(1e,3e)-nona-1,3-dien-1-yl]-5-oxo-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-18-yl]methyl 3-methylbutanoate
(1s,2r,3r,5r,7s,9s,10r,11s,12s,14s,15r,16s,17s,22s,23s,24r,25r)-3,14,25-tris(acetyloxy)-5,22-dihydroxy-11,15,17,22,23-pentamethyl-4,21-dioxo-8,20-dioxaheptacyclo[13.10.0.0²,¹².0⁵,¹¹.0⁷,⁹.0¹⁶,²⁴.0¹⁹,²³]pentacos-18-en-10-yl 3-methylbutanoate
(2s)-2-{[(2s)-2-{[(2s)-2-amino-5-[(2z)-n,5-dihydroxy-3-methylpent-2-enamido]-1-hydroxypentylidene]amino}-5-[(2z)-n,5-dihydroxy-3-methylpent-2-enamido]-1-hydroxypentylidene]amino}-5-[(2z)-n,5-dihydroxy-3-methylpent-2-enamido]pentanoic acid
C33H56N6O13 (744.3905166000001)
(2z,4z,9z,21z,23z,25z)-20-hydroxy-12,28-bis[(4e)-3-hydroxy-2-methylhex-4-en-2-yl]-7,13,17,29,33-pentaoxa-34,35-diazatetracyclo[29.2.1.1¹⁵,¹⁸.0⁶,⁸]pentatriaconta-1(34),2,4,9,15,18(35),21,23,25,31-decaene-14,30-dione
C42H52N2O10 (744.3621772000001)
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-[(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
2-methoxy-5-[(6-methoxy-2-methyl-7-{2,3,4-trimethoxy-5-[(5,6,7-trimethoxy-2-methyl-3,4-dihydro-1h-isoquinolin-1-yl)methyl]phenoxy}-3,4-dihydro-1h-isoquinolin-1-yl)methyl]phenol
C42H52N2O10 (744.3621772000001)
[(1s,2r,6s,7s,8r,10s,11s,12r,14s,16s,17s,18r)-6,7-dihydroxy-8-(hydroxymethyl)-4-methyl-17-[(3-methylbutanoyl)oxy]-16-[(2r)-2-methyloxiran-2-yl]-14-[(1e,3e)-nona-1,3-dien-1-yl]-5-oxo-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-18-yl]methyl 3-methylbutanoate
2-methoxy-5-{[(1s)-6-methoxy-2-methyl-7-(2,3,4-trimethoxy-5-{[(1s)-5,6,7-trimethoxy-2-methyl-3,4-dihydro-1h-isoquinolin-1-yl]methyl}phenoxy)-3,4-dihydro-1h-isoquinolin-1-yl]methyl}phenol
C42H52N2O10 (744.3621772000001)