Exact Mass: 595.3666

Exact Mass Matches: 595.3666

Found 204 metabolites which its exact mass value is equals to given mass value 595.3666, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Jurubine

2-(4-{16-amino-6-hydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan-6-yl}-2-methylbutoxy)-6-(hydroxymethyl)oxane-3,4,5-triol

C33H57NO8 (595.4084)

Jurubine is found in fruits. Jurubine is an alkaloid from Solanum torvum (pea eggplant). Alkaloid from Solanum torvum (pea eggplant). Jurubine is found in fruits.

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

(2-{[(2R)-3-(acetyloxy)-2-{[(9S,10S,12Z)-9,10-dihydroxyoctadec-12-enoyl]oxy}propyl phosphono]oxy}ethyl)trimethylazanium

C28H54NO10P (595.3485)

PC(2:0/18:1(12Z)-2OH(9,10)) is an oxidized phosphatidylcholine (PC or GPCho). Oxidized phosphatidylcholines are glycerophospholipids in which a phosphorylcholine moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized phosphatidylcholines 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, glycerophosphocholines 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. PC(2:0/18:1(12Z)-2OH(9,10)), in particular, consists of one chain of one acetyl 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 PCs can be synthesized via three different routes. In one route, the oxidized PC is synthetized de novo following the same mechanisms as for PCs but incorporating oxidized acyl chains (PMID: 33329396). An alternative is the transacylation of one of the non-oxidated acyl chains with an oxidated acylCoA (PMID: 33329396). The third pathway results from the oxidation of the acyl chain while still attached to the PC backbone, mainely through the action of LOX (PMID: 33329396).

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

(2-{[(2R)-2-(acetyloxy)-3-{[(9R,10R,12Z)-9,10-dihydroxyoctadec-12-enoyl]oxy}propyl phosphono]oxy}ethyl)trimethylazanium

C28H54NO10P (595.3485)

PC(18:1(12Z)-2OH(9,10)/2:0) is an oxidized phosphatidylcholine (PC or GPCho). Oxidized phosphatidylcholines are glycerophospholipids in which a phosphorylcholine moiety occupies a glycerol substitution site and at least one of the fatty acyl chains has undergone oxidation. As all oxidized lipids, oxidized phosphatidylcholines 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, glycerophosphocholines 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. PC(18:1(12Z)-2OH(9,10)/2:0), in particular, consists of one chain of one 9,10-hydroxy-octadecenoyl at the C-1 position and one chain of acetyl 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 PCs can be synthesized via three different routes. In one route, the oxidized PC is synthetized de novo following the same mechanisms as for PCs but incorporating oxidized acyl chains (PMID: 33329396). An alternative is the transacylation of one of the non-oxidated acyl chains with an oxidated acylCoA (PMID: 33329396). The third pathway results from the oxidation of the acyl chain while still attached to the PC backbone, mainely through the action of LOX (PMID: 33329396).

6alpha,12beta-diacetoxy-3beta-(dimethylamino)-11alpha-phenylaceoxypregnan-20-one|pachysamine Q

C35H49NO7 (595.3509)

Arg His Gln Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanamido]-5-carbamimidamidopentanoic acid

C23H41N13O6 (595.3303)

Arg Lys His Arg

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-5-carbamimidamidopentanamido]hexanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanoic acid

C24H45N13O5 (595.3666)

His Lys Arg Arg

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]hexanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C24H45N13O5 (595.3666)

His Gln Arg Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C23H41N13O6 (595.3303)

His Arg Lys Arg

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]hexanamido]-5-carbamimidamidopentanoic acid

C24H45N13O5 (595.3666)

His Arg Gln Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-5-carbamimidamidopentanoic acid

C23H41N13O6 (595.3303)

His Arg Arg Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]hexanoic acid

C24H45N13O5 (595.3666)

His Arg Arg Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanoic acid

C23H41N13O6 (595.3303)

Lys His Arg Arg

(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-imidazol-4-yl)propanamido]pentanamido]pentanoic acid

C24H45N13O5 (595.3666)

Lys Arg His Arg

(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]-3-(1H-imidazol-4-yl)propanamido]pentanoic acid

C24H45N13O5 (595.3666)

Lys Arg Arg His

(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]pentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C24H45N13O5 (595.3666)

Gln His Arg Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C23H41N13O6 (595.3303)

Gln Arg His Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanoic acid

C23H41N13O6 (595.3303)

Gln Arg Arg His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C23H41N13O6 (595.3303)

Arg His Lys Arg

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]hexanamido]-5-carbamimidamidopentanoic acid

C24H45N13O5 (595.3666)

Arg His Arg Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]hexanoic acid

C24H45N13O5 (595.3666)

Arg His Arg Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanoic acid

C23H41N13O6 (595.3303)

Arg Lys Arg His

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-5-carbamimidamidopentanamido]hexanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C24H45N13O5 (595.3666)

Arg Gln His Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanoic acid

C23H41N13O6 (595.3303)

Arg Gln Arg His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C23H41N13O6 (595.3303)

Arg Arg His Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]hexanoic acid

C24H45N13O5 (595.3666)

Arg Arg His Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]-4-carbamoylbutanoic acid

C23H41N13O6 (595.3303)

Arg Arg Lys His

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]hexanamido]-3-(1H-imidazol-4-yl)propanoic acid

C24H45N13O5 (595.3666)

Arg Arg Gln His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]-4-carbamoylbutanamido]-3-(1H-imidazol-4-yl)propanoic acid

C23H41N13O6 (595.3303)

YTVTL

Tyr Thr Val Thr Leu

C28H45N5O9 (595.3217)

TLVTY

Thr Leu Val Thr Tyr

C28H45N5O9 (595.3217)

PS-PC

1-hexadecanoyl-2-succinyl-sn-glycero-phosphocholine

C28H54NO10P (595.3485)

Jurubine

3beta-amino-26-O-[beta-D-glucopyranosyl]-25R-furostan-22alpha,26-diol

C33H57NO8 (595.4084)

BA-delta5-3beta,7beta-diol 7betaGlcNAc

3beta-Hydroxy-7beta-N-acetylglucosaminylchol-5-en-24-oic acid

C31H49NO10 (595.3356)

N-(4-Amino-1-benzyl-3-hydroxy-5-phenyl-pentyl)-3-methyl-2-(2-oxo-tetrahydro-pyrimidin-1-yl)-butyramide 5-oxopyrrolidine-2-carboxylic acid

C32H45N5O6 (595.337)

Loxicodegol

C31H49NO10 (595.3356)

D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent

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

C28H54NO10P (595.3485)

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

C28H54NO10P (595.3485)

1-Palmitoyl-2-(5-hydroxyvaleroyl)-sn-glycero-3-phosphocholine

C29H58NO9P (595.3849)

A 1-palmitoyl-2-acyl-sn-glycero-3-phosphocholine in which the 2-acyl group is specified as 5-hydroxypentanoyl.

emericellamide C

C30H53N5O7 (595.3945)

An emericellamide derived from N-[(2R,3R)-3-hydroxy-2-methyldecanoyl]glycyl-L-valyl-L-leucyl-L-alanyl-L-alanine by the formal intramolecular condensation of the alcoholic hydroxy group with the C-terminal carboxylic acid group.

emericellamide D

C30H53N5O7 (595.3945)

An emericellamide derived from N-[(3S,4S)-3-hydroxy-4-methyldecanoyl]glycyl-L-valyl-L-leucyl-L-alanyl-L-alanine by the formal intramolecular condensation of the alcoholic hydroxy group with the C-terminal carboxylic acid group.

(3S)-2-tert-butylsulfinyl-4-[3-[3-(dimethylamino)prop-1-ynyl]phenyl]-3-(2-hydroxyethyl)-N-[3-(4-morpholinyl)propyl]-1,3-dihydropyrrolo[3,4-c]pyridine-6-carboxamide

C32H45N5O4S (595.3192)

N-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3R,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3R,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3S,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3R,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

1-[[(2R,3S)-9-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

C32H45N5O6 (595.337)

1-[[(2S,3S)-9-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

C32H45N5O6 (595.337)

N-[[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

1-[[(2S,3R)-9-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

C32H45N5O6 (595.337)

1-[[(2R,3R)-9-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

C32H45N5O6 (595.337)

N-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3S,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

1-[[(2R,3R)-9-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

C32H45N5O6 (595.337)

N-[(3R,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3S,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3S,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3R,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

1-[[(2S,3S)-9-[[(cyclohexylamino)-oxomethyl]amino]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-3-(4-methoxyphenyl)-1-methylurea

C32H45N5O6 (595.337)

N-[[(3S,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3R,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(methylsulfonyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]cyclohexanecarboxamide

C30H49N3O7S (595.3291)

N-[[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-16-(methanesulfonamido)-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-9-yl]methyl]-N-methylcyclohexanecarboxamide

C30H49N3O7S (595.3291)

1-Hexadecyl-2-glutaryl-sn-glycero-3-phosphocholine

C29H58NO9P (595.3849)

Lpc 24:6-SN1

C32H54NO7P (595.3638)

HexCer 9:1;2O/18:3

C33H57NO8 (595.4084)

HexCer 9:0;2O/18:4

C33H57NO8 (595.4084)

HexCer 14:3;2O/13:1

C33H57NO8 (595.4084)

HexCer 11:1;2O/16:3

C33H57NO8 (595.4084)

HexCer 11:0;2O/16:4

C33H57NO8 (595.4084)

2-Amino-3-[hydroxy-(2-hydroxy-3-tricosanoyloxypropoxy)phosphoryl]oxypropanoic acid

C29H58NO9P (595.3849)

Lnaps 9:0/N-13:0

C28H54NO10P (595.3485)

Lnaps 2:0/N-20:0

C28H54NO10P (595.3485)

Lnaps 16:0/N-6:0

C28H54NO10P (595.3485)

Lnape 22:6/N-4:0

C31H50NO8P (595.3274)

Lnaps 6:0/N-16:0

C28H54NO10P (595.3485)

Lnaps 15:0/N-7:0

C28H54NO10P (595.3485)

Lnaps 17:0/N-5:0

C28H54NO10P (595.3485)

Lnape 2:0/N-24:6

C31H50NO8P (595.3274)

Lnaps 19:0/N-3:0

C28H54NO10P (595.3485)

Lnape 4:0/N-22:6

C31H50NO8P (595.3274)

Lnaps 7:0/N-15:0

C28H54NO10P (595.3485)

Lnaps 8:0/N-14:0

C28H54NO10P (595.3485)

Lnaps 18:0/N-4:0

C28H54NO10P (595.3485)

Lnaps 3:0/N-19:0

C28H54NO10P (595.3485)

Lnaps 4:0/N-18:0

C28H54NO10P (595.3485)

Lnaps 20:0/N-2:0

C28H54NO10P (595.3485)

Lnaps 5:0/N-17:0

C28H54NO10P (595.3485)

Lnaps 13:0/N-9:0

C28H54NO10P (595.3485)

Lnape 24:6/N-2:0

C31H50NO8P (595.3274)

Lnaps 14:0/N-8:0

C28H54NO10P (595.3485)

Lnaps 12:0/N-10:0

C28H54NO10P (595.3485)

Lnaps 10:0/N-12:0

C28H54NO10P (595.3485)

Lnaps 11:0/N-11:0

C28H54NO10P (595.3485)

(4E,8E,12E)-3-hydroxy-2-[[(4Z,7Z)-2-hydroxyhexadeca-4,7-dienoyl]amino]heptadeca-4,8,12-triene-1-sulfonic acid

C33H57NO6S (595.3906)

(4E,8E,12E)-3-hydroxy-2-[[(10Z,12Z)-2-hydroxyoctadeca-10,12-dienoyl]amino]pentadeca-4,8,12-triene-1-sulfonic acid

C33H57NO6S (595.3906)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoxy]propan-2-yl] propanoate

C32H54NO7P (595.3638)

2-Amino-3-[(3-decoxy-2-tridecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C29H58NO9P (595.3849)

2-Amino-3-[(2-dodecanoyloxy-3-undecoxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C29H58NO9P (595.3849)

2-Amino-3-[(3-dodecoxy-2-undecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C29H58NO9P (595.3849)

2-Amino-3-[(2-decanoyloxy-3-tridecoxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C29H58NO9P (595.3849)

[2-acetyloxy-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

C32H54NO7P (595.3638)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]propan-2-yl] pentanoate

C32H54NO7P (595.3638)

2-Amino-3-[(3-butanoyloxy-2-octadecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[(3-heptanoyloxy-2-pentadecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[(2-heptadecanoyloxy-3-pentanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[hydroxy-(3-nonanoyloxy-2-tridecanoyloxypropoxy)phosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[hydroxy-(2-nonadecanoyloxy-3-propanoyloxypropoxy)phosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[hydroxy-(3-octanoyloxy-2-tetradecanoyloxypropoxy)phosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[(2-hexadecanoyloxy-3-hexanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[(3-decanoyloxy-2-dodecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

2-Amino-3-[2,3-di(undecanoyloxy)propoxy-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

(2S)-2-amino-3-[[(2R)-3-decanoyloxy-2-dodecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

(Z)-N-[(4E,8E,12E)-3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytetradeca-4,8,12-trien-2-yl]tridec-8-enamide

C33H57NO8 (595.4084)

3-[(3-Acetyloxy-2-icosanoyloxypropoxy)-hydroxyphosphoryl]oxy-2-aminopropanoic acid

C28H54NO10P (595.3485)

(Z)-N-[(4E,8E,12E)-3-hydroxy-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypentadeca-4,8,12-trien-2-yl]dodec-5-enamide

C33H57NO8 (595.4084)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-butanoyloxypropan-2-yl] (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoate

C31H50NO8P (595.3274)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyundec-4-en-2-yl]butanamide

C27H49NO13 (595.3204)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxydodec-4-en-2-yl]propanamide

C27H49NO13 (595.3204)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyoct-4-en-2-yl]heptanamide

C27H49NO13 (595.3204)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxynon-4-en-2-yl]hexanamide

C27H49NO13 (595.3204)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxytridec-4-en-2-yl]acetamide

C27H49NO13 (595.3204)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxydec-4-en-2-yl]pentanamide

C27H49NO13 (595.3204)

1-2-Di-undecanoyl-sn-glycero-3-phosphoserine

C28H54NO10P (595.3485)

(2S)-2-amino-3-[[(2R)-2-decanoyloxy-3-dodecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

C28H54NO10P (595.3485)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(E)-dec-4-enoyl]oxypropan-2-yl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate

C31H50NO8P (595.3274)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(4E,7E)-deca-4,7-dienoyl]oxypropan-2-yl] (7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoate

C31H50NO8P (595.3274)

2-[hydroxy-[(E)-3-hydroxy-2-[[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoyl]amino]non-4-enoxy]phosphoryl]oxyethyl-trimethylazanium

C32H56N2O6P+ (595.3876)

PS(22:0)

PS(16:0_6:0)

C28H54NO10P (595.3485)

DGCC 21:5;O2

C31H49NO10 (595.3356)

DGCC 22:4;O

C32H53NO9 (595.372)

DGCC 23:3

C33H57NO8 (595.4084)

DGTS 22:4;O2

C32H53NO9 (595.372)

DGTS 23:3;O

C33H57NO8 (595.4084)

LysoPC 24:6

LPC 24:6

C32H54NO7P (595.3638)

PC O-16:0/5:1;O2

C29H58NO9P (595.3849)

PC O-21:1;O2

C29H58NO9P (595.3849)

PC 16:0/4:1;O2

C28H54NO10P (595.3485)

LNAPE 24:0;O

C29H58NO9P (595.3849)

LNAPE 26:6

C31H50NO8P (595.3274)

PE O-16:0/7:2;O3

C28H54NO10P (595.3485)

PE O-16:0/8:1;O2

C29H58NO9P (595.3849)

PE O-20:0/4:1;O2

C29H58NO9P (595.3849)

PE O-23:2;O3

C28H54NO10P (595.3485)

PE O-24:1;O2

C29H58NO9P (595.3849)

PE 14:0/9:1;O2

C28H54NO10P (595.3485)

PE 18:0/5:1;O2

C28H54NO10P (595.3485)

PE 23:1;O2

C28H54NO10P (595.3485)

PE 22:5/4:1

C31H50NO8P (595.3274)

PE 22:6/4:0

C31H50NO8P (595.3274)

PE 26:6

C31H50NO8P (595.3274)

LNAPS 22:0

C28H54NO10P (595.3485)

LPS 23:0

C29H58NO9P (595.3849)

PS O-18:0/4:1;O

C28H54NO10P (595.3485)

PS O-22:1;O

C28H54NO10P (595.3485)

PS 10:0_12:0

C28H54NO10P (595.3485)

PS 11:0/11:0

C28H54NO10P (595.3485)

PS 18:0/4:0

C28H54NO10P (595.3485)

PS 20:0/2:0

C28H54NO10P (595.3485)

PS 2:0_20:0

C28H54NO10P (595.3485)

PS 22:0

C28H54NO10P (595.3485)

CerP 15:1;O2/18:4

C33H58NO6P (595.4002)

CerP 15:2;O2/18:3

C33H58NO6P (595.4002)

CerP 33:5;O2

C33H58NO6P (595.4002)

ST 23:2;O5;HexNAc

C31H49NO10 (595.3356)

ST 24:1;O4;HexNAc

C32H53NO9 (595.372)

ST 25:0;O3;HexNAc

C33H57NO8 (595.4084)

ST 27:6;O2;HexNAc

C35H49NO7 (595.3509)

ST 28:5;O;HexNAc

C36H53NO6 (595.3873)

ST 29:4;O5;Tau

C31H49NO8S (595.3179)

(2s)-2-({[(3r,4e)-1-[(2s)-6-carbamimidamido-2-[(1-hydroxy-3-methylbutylidene)amino]hexanoyl]-4-ethylidene-3-methylpyrrolidin-2-yl](hydroxy)methylidene}amino)-3-(1h-indol-3-yl)propanoic acid

C31H45N7O5 (595.3482)

(3s,6s,9r,12s)-19-(hexan-2-yl)-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C30H53N5O7 (595.3945)

(3s,6s,9s,16s,21as)-1,10-dihydroxy-16-[(2s)-3-hydroxy-2-methylpropyl]-3,6-diisopropyl-5,8,9-trimethyl-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-4,7,14,17-tetrone

(3s,6s,9s,16s,21as)-1,10-dihydroxy-16-[(2s)-3-hydroxy-2-methylpropyl]-3,6-diisopropyl-5,8,9-trimethyl-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-4,7,14,17-tetrone

C29H49N5O8 (595.3581)

(3r,6s,9r,12r,19s)-19-hexyl-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C30H53N5O7 (595.3945)

19-(hexan-2-yl)-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C30H53N5O7 (595.3945)

(2s)-2-({[(2s,3r,4e)-1-[(2s)-6-carbamimidamido-2-[(1-hydroxy-3-methylbutylidene)amino]hexanoyl]-4-ethylidene-3-methylpyrrolidin-2-yl](hydroxy)methylidene}amino)-3-(1h-indol-3-yl)propanoic acid

C31H45N7O5 (595.3482)

1-acetyl-5,11-bis(acetyloxy)-7-(dimethylamino)-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-10-yl 2-phenylacetate

C35H49NO7 (595.3509)

n-{3-[(3s,6s,10r,15as)-1,8-dihydroxy-10-(1h-indol-3-ylmethyl)-6-(4-methylpentyl)-4,11-dioxo-3h,6h,7h,10h,13h,14h,15h,15ah-pyrrolo[2,1-f]1-oxa-4,7,10-triazacyclotridecan-3-yl]propyl}guanidine

C31H45N7O5 (595.3482)

1,4,10-trihydroxy-16-(3-hydroxy-2-methylpropyl)-6-isopropyl-8,9-dimethyl-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-7,14,17-trione

C29H49N5O8 (595.3581)

(3s,6s,9s,21as)-1,10-dihydroxy-16-(2-hydroxypropyl)-6-isopropyl-5,8,9-trimethyl-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-4,7,14,17-tetrone

(3s,6s,9s,21as)-1,10-dihydroxy-16-(2-hydroxypropyl)-6-isopropyl-5,8,9-trimethyl-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-4,7,14,17-tetrone

C29H49N5O8 (595.3581)

(1s,3as,3bs,5r,5as,7s,9as,9bs,10s,11s,11as)-1-acetyl-5,11-bis(acetyloxy)-7-(dimethylamino)-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-10-yl 2-phenylacetate

C35H49NO7 (595.3509)

(3s,6s,9s,16r,21as)-1,4,10-trihydroxy-16-(3-hydroxy-2-methylpropyl)-6-isopropyl-8,9-dimethyl-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-7,14,17-trione

(3s,6s,9s,16r,21as)-1,4,10-trihydroxy-16-(3-hydroxy-2-methylpropyl)-6-isopropyl-8,9-dimethyl-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-7,14,17-trione

C29H49N5O8 (595.3581)

19-hexyl-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C30H53N5O7 (595.3945)

1,10-dihydroxy-16-(2-hydroxypropyl)-6-isopropyl-5,8,9-trimethyl-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-4,7,14,17-tetrone

C29H49N5O8 (595.3581)

(3s,6s,9r,12s,19s)-19-[(2s)-hexan-2-yl]-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C30H53N5O7 (595.3945)

(2s,3r,4s,5r,6r)-2-[(2s)-4-[(1r,2s,4r,6r,7s,8r,9s,12s,13s,16s,18s)-16-amino-6-hydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

(2s,3r,4s,5r,6r)-2-[(2s)-4-[(1r,2s,4r,6r,7s,8r,9s,12s,13s,16s,18s)-16-amino-6-hydroxy-7,9,13-trimethyl-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan-6-yl]-2-methylbutoxy]-6-(hydroxymethyl)oxane-3,4,5-triol

C33H57NO8 (595.4084)

1,10-dihydroxy-16-(3-hydroxy-2-methylpropyl)-3,6-diisopropyl-5,8,9-trimethyl-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-4,7,14,17-tetrone

C29H49N5O8 (595.3581)

n-{3-[1,8-dihydroxy-10-(1h-indol-3-ylmethyl)-6-(4-methylpentyl)-4,11-dioxo-3h,6h,7h,10h,13h,14h,15h,15ah-pyrrolo[2,1-f]1-oxa-4,7,10-triazacyclotridecan-3-yl]propyl}guanidine

C31H45N7O5 (595.3482)

2-{[(1-{6-carbamimidamido-2-[(1-hydroxy-3-methylbutylidene)amino]hexanoyl}-4-ethylidene-3-methylpyrrolidin-2-yl)(hydroxy)methylidene]amino}-3-(1h-indol-3-yl)propanoic acid

C31H45N7O5 (595.3482)