Exact Mass: 595.336967

Exact Mass Matches: 595.336967

Found 201 metabolites which its exact mass value is equals to given mass value 595.336967, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Kni 102

C31H41N5O7 (595.3005836)

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 (595.3485154)

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 (595.3485154)

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).

Kahalalide D

C31H45N7O5 (595.3481999999999)

alpha-MAPI

SP-Chymostatin B

C30H41N7O6 (595.3118166)

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

C35H49NO7 (595.3508844)

C34H45NO8

C34H45NO8 (595.3145010000001)

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 (595.3302606)

HAMI3379

C34H45NO8 (595.3145010000001)

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 (595.366644)

Chymostatinol A

C30H41N7O6 (595.3118166)

Phe His His Arg

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

C27H37N11O5 (595.2978992)

Phe His Arg His

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

C27H37N11O5 (595.2978992)

Phe Arg His His

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

C27H37N11O5 (595.2978992)

His Phe His Arg

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

C27H37N11O5 (595.2978992)

His Phe Arg His

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

C27H37N11O5 (595.2978992)

His His Phe Arg

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

C27H37N11O5 (595.2978992)

His His Arg Phe

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

C27H37N11O5 (595.2978992)

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 (595.366644)

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 (595.3302606)

His Arg Phe His

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

C27H37N11O5 (595.2978992)

His Arg His Phe

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

C27H37N11O5 (595.2978992)

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 (595.366644)

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 (595.3302606)

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 (595.366644)

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 (595.3302606)

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 (595.366644)

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 (595.366644)

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 (595.366644)

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 (595.3302606)

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 (595.3302606)

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 (595.3302606)

Arg Phe His His

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

C27H37N11O5 (595.2978992)

Arg His Phe His

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

C27H37N11O5 (595.2978992)

Arg His His Phe

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

C27H37N11O5 (595.2978992)

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 (595.366644)

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 (595.366644)

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 (595.3302606)

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 (595.366644)

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 (595.3302606)

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 (595.3302606)

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 (595.366644)

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 (595.3302606)

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 (595.366644)

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 (595.3302606)

YTVTL

Tyr Thr Val Thr Leu

C28H45N5O9 (595.321712)

TLVTY

Thr Leu Val Thr Tyr

C28H45N5O9 (595.321712)

PS-PC

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

C28H54NO10P (595.3485154)

POV-PS

1-hexadecanoyl-2-(5-oxo-valeroyl)-sn-glycero-3-phosphoserine

C27H50NO11P (595.312132)

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

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

C31H49NO10 (595.3356294)

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 (595.336967)

Loxicodegol

C31H49NO10 (595.3356294)

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

3-[(3-carboxycyclohexyl)carbamoyl]-4-[3-[4-(4-cyclohexyloxybutoxy)phenyl]propoxy]benzoic Acid

C34H45NO8 (595.3145010000001)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

L-Prolinamide, N2-((phenylmethoxy)carbonyl)-L-asparaginyl-(2S,3S)-2-hydroxy-4-phenyl-3-aminobutanoyl-N-(1,1-dimethylethyl)-

C31H41N5O7 (595.3005836)

acs.jmedchem.1c00409_ST.209

C31H41N5O7 (595.3005836)

COVID info from PDB, Protein Data Bank Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

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

C29H58NO9P (595.3848988)

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

(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 (595.319209)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.336967)

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 (595.336967)

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 (595.3291044)

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 (595.336967)

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 (595.336967)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.336967)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.336967)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

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 (595.3291044)

(2R)-2-hydroxy-3-{[(9Z,12Z)-octadeca-9,12-dienoyl]oxy}propyl (1S,2R,3R,4S,5S,6R)-2,3,4,5,6-pentahydroxycyclohexyl phosphate

C27H48O12P- (595.2883238)

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

C29H58NO9P (595.3848988)

Lpc 24:6-SN1

C32H54NO7P (595.3637704)

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

C29H58NO9P (595.3848988)

Lnaps 9:0/N-13:0

C28H54NO10P (595.3485154)

Lnaps 2:0/N-20:0

C28H54NO10P (595.3485154)

Lnaps 16:0/N-6:0

C28H54NO10P (595.3485154)

Lnape 22:6/N-4:0

C31H50NO8P (595.327387)

Lnaps 6:0/N-16:0

C28H54NO10P (595.3485154)

Lnaps 15:0/N-7:0

C28H54NO10P (595.3485154)

Lnaps 17:0/N-5:0

C28H54NO10P (595.3485154)

Lnape 2:0/N-24:6

C31H50NO8P (595.327387)

Lnaps 19:0/N-3:0

C28H54NO10P (595.3485154)

Lnape 4:0/N-22:6

C31H50NO8P (595.327387)

Lnaps 7:0/N-15:0

C28H54NO10P (595.3485154)

Lnaps 8:0/N-14:0

C28H54NO10P (595.3485154)

Lnaps 18:0/N-4:0

C28H54NO10P (595.3485154)

Lnaps 3:0/N-19:0

C28H54NO10P (595.3485154)

Lnaps 4:0/N-18:0

C28H54NO10P (595.3485154)

Lnaps 20:0/N-2:0

C28H54NO10P (595.3485154)

Lnaps 5:0/N-17:0

C28H54NO10P (595.3485154)

Lnaps 13:0/N-9:0

C28H54NO10P (595.3485154)

Lnape 24:6/N-2:0

C31H50NO8P (595.327387)

Lnaps 14:0/N-8:0

C28H54NO10P (595.3485154)

Lnaps 12:0/N-10:0

C28H54NO10P (595.3485154)

Lnaps 10:0/N-12:0

C28H54NO10P (595.3485154)

Lnaps 11:0/N-11:0

C28H54NO10P (595.3485154)

[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 (595.3637704)

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

C29H58NO9P (595.3848988)

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

C29H58NO9P (595.3848988)

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

C29H58NO9P (595.3848988)

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

C29H58NO9P (595.3848988)

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

C32H54NO7P (595.3637704)

[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 (595.3637704)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

[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 (595.327387)

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 (595.3203744)

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 (595.3203744)

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 (595.3203744)

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 (595.3203744)

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 (595.3203744)

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 (595.3203744)

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

C28H54NO10P (595.3485154)

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

C28H54NO10P (595.3485154)

[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 (595.327387)

[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 (595.327387)

PS(22:0)

PS(16:0_6:0)

C28H54NO10P (595.3485154)

DGCC 21:5;O2

C31H49NO10 (595.3356294)

DGCC 22:4;O

C32H53NO9 (595.3720128)

DGTS 22:4;O2

C32H53NO9 (595.3720128)

LysoPC 24:6

LPC 24:6

C32H54NO7P (595.3637704)

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

C29H58NO9P (595.3848988)

PC O-21:1;O2

C29H58NO9P (595.3848988)

PC 16:0/4:1;O2

C28H54NO10P (595.3485154)

LNAPE 24:0;O

C29H58NO9P (595.3848988)

LNAPE 25:7;O

C30H46NO9P (595.2910036)

LNAPE 26:6

C31H50NO8P (595.327387)

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

C28H54NO10P (595.3485154)

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

C29H58NO9P (595.3848988)

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

C29H58NO9P (595.3848988)

PE O-23:2;O3

C28H54NO10P (595.3485154)

PE O-24:1;O2

C29H58NO9P (595.3848988)

PE 14:0/8:2;O3

C27H50NO11P (595.312132)

PE 14:0/9:1;O2

C28H54NO10P (595.3485154)

PE 18:0/5:1;O2

C28H54NO10P (595.3485154)

PE 18:4/7:3;O

C30H46NO9P (595.2910036)

PE 22:2;O3

C27H50NO11P (595.312132)

PE 23:1;O2

C28H54NO10P (595.3485154)

PE 25:7;O

C30H46NO9P (595.2910036)

PE 22:5/4:1

C31H50NO8P (595.327387)

PE 22:6/4:0

C31H50NO8P (595.327387)

PE 26:6

C31H50NO8P (595.327387)

LNAPS 21:1;O

C27H50NO11P (595.312132)

LNAPS 22:0

C28H54NO10P (595.3485154)

LPS 23:0

C29H58NO9P (595.3848988)

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

C28H54NO10P (595.3485154)

PS O-21:2;O2

C27H50NO11P (595.312132)

PS O-22:1;O

C28H54NO10P (595.3485154)

PS P-16:0/5:1;O2

C27H50NO11P (595.312132)

PS 16:0/5:1;O

C27H50NO11P (595.312132)

PS 10:0_12:0

C28H54NO10P (595.3485154)

PS 11:0/11:0

C28H54NO10P (595.3485154)

PS 18:0/4:0

C28H54NO10P (595.3485154)

PS 20:0/2:0

C28H54NO10P (595.3485154)

PS 2:0_20:0

C28H54NO10P (595.3485154)

PS 22:0

C28H54NO10P (595.3485154)

ST 22:3;O6;HexNAc

C30H45NO11 (595.299246)

ST 23:2;O5;HexNAc

C31H49NO10 (595.3356294)

ST 24:1;O4;HexNAc

C32H53NO9 (595.3720128)

ST 26:7;O3;HexNAc

C34H45NO8 (595.3145010000001)

ST 27:6;O2;HexNAc

C35H49NO7 (595.3508844)

ST 29:4;O5;Tau

C31H49NO8S (595.3178714000001)

(2s)-2-({[(1s)-4-carbamimidamido-1-{[(1s)-2-methyl-1-{[(2s)-1-oxo-3-phenylpropan-2-yl]-c-hydroxycarbonimidoyl}propyl]-c-hydroxycarbonimidoyl}butyl]-c-hydroxycarbonimidoyl}amino)-3-phenylpropanoic acid

(2s)-2-({[(1s)-4-carbamimidamido-1-{[(1s)-2-methyl-1-{[(2s)-1-oxo-3-phenylpropan-2-yl]-c-hydroxycarbonimidoyl}propyl]-c-hydroxycarbonimidoyl}butyl]-c-hydroxycarbonimidoyl}amino)-3-phenylpropanoic acid

C30H41N7O6 (595.3118166)

(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 (595.3481999999999)