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Analysis: Reversed phase POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
5-VALEROLACTONE (M+H)+5-ValerolactoneME20735210953-2.091100.0524
3-AMINOISOBUTYRIC ACID (M+H)+[-H2O]3-Aminoisobutanoic acidME20734164956-1.836103.0633
2-HYDROXYBUTYRIC ACID (M+NA)+2-Hydroxybutyric acidME20733811266-1.631104.0474
CHOLINE M+CholineME207370305-0.604104.1071
HISTAMINE (M+NA)+HistamineME207405774-0.661111.0777
HISTAMINE (M+H)+HistamineME207404774-0.491111.0809
CREATININE (M+H)+CreatinineME207374588-0.746113.0568
CREATININE (M+NA)+CreatinineME207375588-0.719113.0598
PROLINE (M+H)+ProlineME207474145742-0.755115.0615
VALINE (M+NA)+ValineME2075076287-0.851117.0768
VALINE (M+H)+ValineME2075066287-0.863117.077
THREONINE (M+H)+[-H2O]ThreonineME2074946288-0.961119.0565
HOMOSERINE (M+NA)+HomoserineME20740912647-0.605119.0574
3-HYDROXYBENZALDEHYDE (M+H)+[-H2O]3-HydroxybenzaldehydeME207342101-4.839122.0367
NICOTINAMIDE (M+H)+NiacinamideME207454936-1.079122.0465
NICOTINIC ACID (M+H)+Nicotinic acidME207455938-0.942123.0322
N-CYCLOHEXYLFORMAMIDE (M+NA)+N-CyclohexylformamideME20745013017-7.979127.0981
N-CYCLOHEXYLFORMAMIDE (M+H)+N-CyclohexylformamideME20744913017-7.984127.0992
5-OXOPROLINE (M+H)+Pyroglutamic acidME2073517405-1.185129.0427
TRANS-4-HYDROXYPROLINE (M+H)+trans-4-HydroxyprolineME2074975810-0.665131.0568
5-AMINOLEVULINIC ACID (M+NA)+5-Amino-levulinic acidME207349137-0.663131.0573
ISOLEUCINE (M+H)+IsoleucineME2074176306-1.503131.0932
ISOLEUCINE (M+NA)+IsoleucineME2074186306-1.469131.0941
GLUTARIC ACID (M+NA)+Glutaric acidME207399743-2.062132.0427
ETHYLMALONIC ACID (M+NA)+Ethylmalonic acidME20739511756-2.888132.0428
ASPARAGINE (M+H)+AsparagineME2073626267-0.647132.0534
ORNITHINE (M+H)+OrnithineME2074646262-0.506132.0901
MALIC ACID (M+NA)+Malic acidME207433222656-0.767134.0195
HOMOCYSTEINE (M+H)+HomocysteineME20740691552-0.674135.0342
HYPOXANTHINE (M+NA)+HypoxanthineME207411790-0.99136.0365
HYPOXANTHINE (M+H)+HypoxanthineME207410790-1.084136.0386
2-AMINOETHYL DIHYDROGEN PHOSPHATE (M+H)+PhosphoethanolamineME2073361015-0.615141.0198
QUINOLIN-2-OL (M+NA)+2-HydroxyquinolineME2074806038-7.808145.053
QUINOLIN-2-OL (M+H)+2-HydroxyquinolineME2074796038-7.81145.0536
4-ACETAMIDOBUTANOIC ACID (M+NA)+4-Acetamidobutanoic acidME20734518189-1.669145.0732
SPERMIDINE (M+NA)+SpermidineME2074841102-0.522145.1563
SPERMIDINE (M+H)+SpermidineME2074831102-0.499145.1581
ADIPIC ACID (M+H)+Adipic acidME207357196-3.575146.0571
ADIPIC ACID (M+NA)+Adipic acidME207358196-3.474146.0589
GLUTAMINE (M+NA)+GlutamineME2073985961-0.605146.0692
LYSINE (M+NA)+LysineME2074325962-0.522146.1054
LYSINE (M+H)+LysineME2074315962-0.506146.1058
GLUTAMIC ACID (M+H)+Glutamic acidME20739733032-0.617147.0506
N-ACETYL-DL-SERINE (M+H)+[-H2O]N-AcetylserineME20744265249-0.893147.0514
N-METHYL-ASPARTIC ACID (M+NA)+N-Methyl-D-aspartic acidME2074514376-0.61147.0552
MEVALONIC ACID (M+NA)+Mevalonic acidME207436439230-1.608148.0734
METHIONINE (M+H)+MethionineME2074346137-0.962149.0488
GUANINE (M+H)+GuanineME207402764-0.836151.0465
ACETAMINOPHEN (TN TYLENOL) (M+H)+AcetaminophenME2073531983-2.904151.0603
ACETAMINOPHEN (TN TYLENOL) (M+NA)+AcetaminophenME2073541983-2.898151.0609
L-HISTIDINE (M+H)+HistidineME2074256274-0.619155.0668
L-HISTIDINE (M+NA)+HistidineME2074266274-0.605155.0703
ALLANTOIN (M+H)+AllantoinME207359439714-0.742158.043
PIMELIC ACID (M+NA)+Pimelic acidME207472385-5.776160.0731
N-METHYL-GLUTAMIC ACID (M+H)+[-H2O]N-Methyl-glutamic acidME207452439377-1.727161.0672
CARNITINE (M+H)+CarnitineME20736810917-0.605161.1046
PROCOLLAGEN 5-HYDROXY-L-LYSINE (M+H)+[-H2O]-ME20747383228-0.673162.1026
2-DEOXY-D-GLUCOSE (M+NA)+2-Deoxy-glucoseME207337439268-0.768164.0661
PHENYLALANINE (M+NA)+PhenylalanineME2074706140-2.614165.0764
PHENYLALANINE (M+H)+PhenylalanineME2074696140-2.355165.0775
PHTHALIC ACID (M+NA)+Phthalic acidME2074711017-4.882166.0254
1-METHYLXANTHINE (M+NA)+1-MethylxanthineME20732980220-2.464166.0468
1-METHYLXANTHINE (M+H)+1-MethylxanthineME20732880220-2.471166.0473
3-METHYLXANTHINE (M+H)+3-MethylxanthineME20734470639-2.475166.052
PYRIDOXAL (M+H)+[-H2O]PyridoxalME2074781050-0.962167.0597
HOMOGENTISIC ACID (M+H)+Homogentisic acidME207407780-2.089168.0399
HOMOGENTISIC ACID (M+H)+[-H2O]Homogentisic acidME207408780-2.095168.0415
NORADRENALINE (M+H)+[-H2O]Xi-NorepinephrineME207456951-0.575169.0711
4-QUINOLINECARBOXYLIC ACID #2 (M+H)+4-Quinolinecarboxylic acidME20734610243-4.994173.0466
N-ACETYL-L-LEUCINE (M+H)+N-AcetylleucineME20744375619-7.236173.1052
N-ACETYL-L-LEUCINE (M+NA)+N-AcetylleucineME20744475619-7.231173.108
SUBERIC ACID (M+NA)+Suberic acidME20749010457-8.344174.0906
L-ARGININE (M+NA)+ArginineME2074246322-0.579174.1118
L-ARGININE (M+H)+ArginineME2074236322-0.605174.1119
N-ACETYL-ASPARTIC ACID (M+NA)+N-Acetylaspartic acidME20743865065-0.971175.0477
INDOLE-3-ACETIC ACID (M+NA)+Indoleacetic acidME207413802-8.496175.0634
INDOLE-3-ACETIC ACID (M+H)+Indoleacetic acidME207412802-8.487175.0644
CITRULLINE (M+H)+CitrullineME2073739750-0.646175.0946
D-GLUCOSAMINE (M+H)+GlucosamineME207384439213-0.668179.0791
L-METHIONINE SULFOXIMINE (M+NA)+Methionine sulfoximineME20742789034-0.676180.0589
GLUCOSE (2M+NA)+GlucoseME2073965793-0.7180.0605
TYROSINE (M+NA)+TyrosineME2075026057-1.301181.072
TYROSINE (M+H)+TyrosineME2075016057-1.291181.0724
3-(4-HYDROXYPHENYL)LACTIC ACID (M+NA)+Hydroxyphenyllactic acidME207340440177-3.847182.0578
CHOLINE PHOSPHATE (M+H)+Choline phosphateME2073711014-0.624183.0635
CYSTEIC ACID (M+H)+Cysteic acidME20737872886-0.648187.0173
N-ALPHA-ACETYL-L-LYSINE (M+H)+N(2)-AcetyllysineME20744892907-0.648188.1126
KYNURENIC ACID (M+H)+Kynurenic acidME2074203845-4.997189.043
N-ACETYL-DL-METHIONINE (M+NA)+N-AcetylmethionineME207441448580-4.105191.0617
CITRIC ACID (M+NA)+Citric acidME207372311-1.02192.0257
METHYL BETA-D-GALACTOSIDE (M+NA)+Methyl beta-D-galactosideME20743594214-0.884194.0769
SPERMINE (M+H)+SpermineME2074851103-0.508202.2161
TRYPTOPHANAMIDE (M+H)+TryptophanamideME207500439356-2.895203.1094
TRYPTOPHAN (M+NA)+TryptophanME2074996305-3.575204.0891
TRYPTOPHAN (M+H)+TryptophanME2074986305-3.573204.0892
XANTHURENIC ACID (M+H)+Xanthurenic acidME2075085699-4.565205.0376
L-TRYPTOPHAN-15N2 [ISTD] (M+H)+TryptophanME20742816217285-3.571206.085
N-ACETYL-L-PHENYLALANINE (M+NA)+N-AcetylphenylalanineME20744674839-7.791207.0902
N-ACETYL-L-PHENYLALANINE (M+H)+N-AcetylphenylalanineME20744574839-7.79207.0923
KYNURENINE (M+NA)+KynurenineME207422161166-2.156208.0842
KYNURENINE (M+H)+KynurenineME207421161166-2.164208.0851
3-METHOXYTYROSINE (M+H)+3-MethoxytyrosineME2073439307-1.986211.0844
PROPIONYLCARNITINE (*) (M+H)+CAR 3:0ME207475107738-1.599217.1303
PANTOTHENIC ACID (M+H)+Pantothenic acidME2074676613-3.239219.111
PANTOTHENIC ACID (M+NA)+Pantothenic acidME2074686613-3.26219.1111
ZEATIN [ISTD] (M+H)+trans-ZeatinME207509449093-3.868219.1126
5-HYDROXYTRYPTOPHAN (M+H)+5-Hydroxy-tryptophanME207350439280-1.763220.0839
N-ACETYL-D-GLUCOSAMINE (M+NA)+N-Acetyl-D-glucosamineME207439446101-0.677221.0873
CYSTATHIONINE (M+H)+CystathionineME207376439258-0.634222.0651
CYSTATHIONINE (M+NA)+CystathionineME207377439258-0.646222.0719
DEOXYCYTIDINE (M+H)+DeoxycytidineME20738713711-0.921227.0886
DEOXYCYTIDINE (M+NA)+DeoxycytidineME20738813711-0.908227.0887
DEOXYCYTIDINE (2M+NA)+DeoxycytidineME20738613711-0.92227.0888
DEOXYCYTIDINE (2M+H)+DeoxycytidineME20738513711-0.921227.0898
DEOXYURIDINE (M+NA)+DeoxyuridineME20738913712-1.642228.0752
ISO-BUTYRYLCARNITINE (*) (M+H)+CAR 3:0;2MeME207416168379-2.85231.1469
CYSTINE (M+NA)+CystineME2073796857538-0.606240.0191
BETA-ALANYL-N(PAI)-METHYL-L-HISTIDINE (M+H)+AnserineME207363112072-0.662240.1259
THYMIDINE (M+H)+ThymidineME2074955789-2.758242.0893
THYMIDINE (M+NA)+ThymidineME2074965789-2.784242.0897
CYTIDINE (M+H)+CytidineME2073816175-0.825243.0811
CYTIDINE (2M+H)+CytidineME2073806175-0.82243.083
URIDINE (M+NA)+UridineME2075046029-1.367244.0679
URIDINE (M+H)+UridineME2075036029-1.355244.0701
BIOTIN (M+H)+BiotinME20736411966127-6.336244.0899
BIOTIN (M+NA)+BiotinME20736511966127-6.334244.0904
ISOVALERYLCARNITINE (*) (M+H)+CAR 4:0;3MeME207419169235-4.505245.1631
N-ACETYL-D-TRYPTOPHAN (M+NA)+N-Acetyl-D-tryptophanME207440439917-8.03246.1047
SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+sn-Glycero-3-phosphocholineME207482439285-0.611257.1073
HEXANOYLCARNITINE (*) M+CAR 6:0ME2074033246939-6.945260.1862
ADENOSINE (M+H)+AdenosineME20735560961-1.773267.0965
INOSINE (M+NA)+InosineME2074156021-1.842268.0815
INOSINE (M+H)+InosineME2074146021-1.844268.0842
GLUTARYLCARNITINE (*) (M+H)+CAR DC5:0ME20740053481622-1.873275.1374
ALPHA-LINOLENIC ACID (M+NA)+alpha-Linolenic acidME2073605280934-22.859278.2224
OLEAMIDE (M+H)+OleamideME2074585283387-22.628281.2683
OLEIC ACID (M+H)+Oleic acidME207459445639-22.534282.2547
ELAIDIC ACID (M+NA)+Elaidic acidME207392637517-22.845282.2565
OLEIC ACID (M+NA)+Oleic acidME207460445639-22.47282.2568
OCTANOYLCARNITINE (*) (M+H)+CAR 8:0ME207457123701-11.597287.2106
5'-METHYLTHIOADENOSINE (M+H)+5'-MethylthioadenosineME207347439176-4.478297.0902
5'-METHYLTHIOADENOSINE (M+NA)+5'-MethylthioadenosineME207348439176-4.478297.0914
SPHINGOSINE (M+H)+[-H2O]SphingosineME2074885280335-20.261299.2797
SPHINGOSINE (M+H)+SphingosineME2074875280335-20.254299.2825
SPHINGANINE (M+H)+SphinganineME207486644260-20.686301.2965
GLYCEROL MYRISTATE (M+NA)+MG 14:0ME20740179050-22.178302.2444
DUMP (M+H)+dUMPME20739165063-0.978308.0411
N-ACETYLNEURAMINIC ACID (M+H)+N-Acetylneuraminic acidME207447444885-0.742309.1029
SULFADIMETHOXINE (M+NA)+SulfadimethoxineME2074935323-9.412310.0745
SULFADIMETHOXINE (M+H)+SulfadimethoxineME2074925323-9.412310.075
URIDINE-5-MONOPHOSPHATE (M+H)+UMPME2075056030-0.876324.0335
LEUKOTRIENE B4 (M+H)+LTB4ME2074295280492-20.817336.2272
SUCROSE (M+NA)+SucroseME2074915988-0.684342.1163
ADENOSINE 5'-MONOPHOSPHATE (M+H)+AMPME2073566083-0.927347.0587
OLEOYL-GLYCEROL (M+H)+MG 18:1ME2074615319879-22.708356.2871
OLEOYL-GLYCEROL (M+NA)+MG 18:1ME2074625319879-22.717356.2929
MYRISTOYLCARNITINE (*) (M+H)+CAR 14:0ME2074373413344-19.74371.3007
S-ADENOSYL-L-HOMOCYSTEINE (M+H)+S-AdenosylhomocysteineME207481439155-1.482384.1217
DESMOSTEROL (M+H)+[-H2O]DesmosterolME207390439577-24.241384.339
CHOLESTEROL (M+H)+[-H2O]CholesterolME2073695997-24.68386.3557
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+NA)+bis(2-Ethylhexyl)phthalic acidME2073678343-23.112390.2781
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+H)+bis(2-Ethylhexyl)phthalic acidME2073668343-23.113390.2784
PALMITOLEYLCARNITINE (*) M+CAR 16:1ME20746571464547-20.26398.3231
PALMITOYLCARNITINE (M+H)+CAR 16:0ME20746611953816-21.174399.3328
LINOLEOYLCARNITINE (*) (M+H)+CAR 18:2ME2074306450015-20.84423.333
OLEOYLCARNITINE (*) (M+H)+CAR 18:1ME2074636441392-21.389425.3496
STEAROYLCARNITINE (*) (M+H)+CAR 18:0ME20748952922056-21.737427.3644
ALPHA-TOCOPHEROL (M+H)+alpha-TocopherolME20736114985-24.596430.3791
EPIBRASSINOLIDE [ISTD] (M+NA)+24-epi-BrassinolideME207394115196-19.977480.3461
EPIBRASSINOLIDE [ISTD] (M+H)+24-epi-BrassinolideME207393115196-19.978480.3464
18:0 LYSO-PE (M+H)+LPE 18:0ME2073349547068-22.675481.3195
18:0 LYSO-PE (M+NA)+LPE 18:0ME2073359547068-22.677481.3199
CYTIDINE 5'-DIPHOSPHOCHOLINE (M+H)+CDP-cholineME20738213804-0.561488.1024
CYTIDINE 5'-DIPHOSPHOCHOLINE (M+NA)+CDP-cholineME20738313804-0.566488.1169
16:0 LYSO PC (M+H)+LPC 16:0ME207330460602-22.287495.3333
16:0 LYSO PC (M+NA)+LPC 16:0ME207331460602-22.285495.3333
20:0 LYSO PC (M+NA)+LPC 20:0ME20733924779473-22.999551.4027
PROTOPORPHYRIN (M+H)+ProtoporphyrinME2074764971-22.999562.2593
NAD (M+H)+NAD+ME2074535893-0.988663.1031
16:0-18:0 PC (M+H)+PC 16:0_18:0ME20733218631368-25.572761.5939
16:0-18:0 PC (M+NA)+PC 16:0_18:0ME20733318631368-25.569761.6003
PUTRESCINE (M+H)+PutrescineME2074771045-0.48288.1001


Analysis: Reversed phase NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID		 PubChem
Compound_ID		 Kegg Id Retention
time/index		 m/z ratio
ALPHA-HYDROXYISOBUTYRIC ACID (M-H)-2-Hydroxyisobutyric acidME207529440873-1.631104.0473
GLYCERIC ACID (M-H)-Glyceric acidME207546439194-0.801106.0266
MALEIC ACID (M-H)-Maleic acidME207556444266-0.978116.0113
N-ACETYLGLYCINE (M-H)-N-AcetylglycineME2075651097-0.877117.0421
SUCCINIC ACID (M-H)-Succinic acidME2075821110-1.33118.0265
2-HYDROXY-3-METHYLBUTYRIC ACID (M-H)-2-Hydroxy-3-methylbutyric acidME207515853180-3.477118.0629
BENZOIC ACID (M-H)-Benzoic acidME207533243-4.944122.0366
5-OXOPROLINE (M-H)-Pyroglutamic acidME2075267405-1.182129.0424
2-METHYLMALEIC ACID #2 (M-H)-Citraconic acidME207516643798-2.429130.0267
3-METHYL-2-OXOPENTANOIC ACID (M-H)-3-Methyl-2-oxovaleric acidME207520440877-4.42130.063
4-METHYL-2-OXOPENTANOIC ACID (M-H)-KetoleucineME20752470-4.819130.0632
N-ACETYL-L-ALANINE (M-H)-N-AcetylalanineME20756288064-1.44131.0572
ISOLEUCINE (M-H)-IsoleucineME2075516306-1.515131.0941
OXALOACETIC ACID (M-H)-[-H2O]Oxaloacetic acidME207570970-0.513132.0033
GLUTARIC ACID (M-H)-Glutaric acidME207545743-2.027132.0423
3-UREIDOPROPIONIC ACID (M-H)-Ureidopropionic acidME207521111-0.881132.0516
MALIC ACID (M-H)-Malic acidME207557222656-0.81134.0214
4-HYDROXYBENZOIC ACID (M-H)-4-Hydroxybenzoic acidME207523135-4.065138.0316
SALICYLATE #2 (M-H)-Salicylic acidME207580338-8.262138.0317
L-[15N]ANTHRANILIC ACID [ISTD] (M-H)-2-Aminobenzoic acidME207553227-5.313138.0447
4-ACETAMIDOBUTANOIC ACID (M-H)-4-Acetamidobutanoic acidME20752218189-1.78145.0733
ADIPIC ACID (M-H)-Adipic acidME207528196-3.557146.0607
LYSINE (M-H)-LysineME2075555962-0.51146.1054
CITRAMALIC ACID (M-H)-Citramalic acidME207536441696-1.409148.0365
MEVALONIC ACID (M-H)-Mevalonic acidME207559439230-1.576148.0731
XANTHINE (M-H)-XanthineME2075941188-1.249152.0333
ARABITOL (M+CL)-ArabitolME20753094154-0.673152.0661
RIBITOL (M+CL)-RibitolME20757894154-0.673152.0661
OROTIC ACID (M-H)-Orotic acidME207569967-0.857156.0171
3-HYDROXY-3-METHYLGLUTARIC ACID (M-H)-3-Hydroxymethylglutaric acidME2075191662-1.528162.0521
PTERIN (M-H)-PterinME20757673000-1.474163.0522
2-DEOXY-D-GLUCOSE (M+CL)-2-Deoxy-glucoseME207514439268-0.679164.0687
PHENYLALANINE (M-H)-PhenylalanineME2075756140-2.451165.0791
URIC ACID (M-H)-Uric acidME2075901175-0.99168.0283
N-ACETYL-L-LEUCINE (M-H)-N-AcetylleucineME20756375619-7.186173.1048
TRANS-ACONITIC ACID (M-H)-trans-Aconitic acidME207586444212-1.231174.0165
CIS-ACONITIC ACID (M-H)-cis-Aconitic acidME207535643757-1.455174.0168
HIPPURIC ACID (M-H)-Hippuric acidME207548464-4.812179.058
GLUCOSE (M+CL)-GlucoseME2075445793-0.666180.064
TYROSINE (M-H)-TyrosineME2075896057-1.272181.0736
3-(4-HYDROXYPHENYL)LACTIC ACID (M-H)-Hydroxyphenyllactic acidME207518440177-3.695182.0578
AZELAIC ACID (M-H)-Azelaic acidME2075322266-10.809188.105
ISOCITRIC ACID (M-H)-Isocitric acidME2075505318532-0.797192.0273
CITRIC ACID (M-H)-Citric acidME207537311-1.03192.0276
METHYL BETA-D-GALACTOSIDE (M+CL)-Methyl beta-D-galactosideME20755894214-0.735194.0802
GLUCONIC ACID (M-H)-Gluconic acidME20754310690-0.69196.0579
TRYPTOPHAN (2M-H)-TryptophanME2075876305-3.537204.088
TRYPTOPHAN (M-H)-TryptophanME2075886305-3.538204.0923
L-TRYPTOPHAN-15N2 [ISTD] (M-H)-TryptophanME20755216217285-3.538206.0846
N-ACETYL-L-PHENYLALANINE (M-H)-N-AcetylphenylalanineME20756474839-7.738207.0883
O-SUCCINYL-L-HOMOSERINE (M-H)-o-SuccinylhomoserineME207567439406-0.96219.0713
PANTOTHENIC ACID (M+CL)-Pantothenic acidME2075736613-3.271219.1114
PANTOTHENIC ACID (M-H)-Pantothenic acidME2075746613-3.279219.1114
ZEATIN [ISTD] (M-H)-trans-ZeatinME207596449093-3.829219.1123
ZEATIN [ISTD] (M+CL)-trans-ZeatinME207595449093-3.826219.1127
N-ACETYL-D-GLUCOSAMINE (M+CL)-N-Acetyl-D-glucosamineME207561446101-0.676221.0907
DEOXYCYTIDINE (M+CL)-DeoxycytidineME20753813711-0.92227.0924
DEOXYURIDINE (M-H)-DeoxyuridineME20754013712-1.537228.0745
DEOXYURIDINE (M+CL)-DeoxyuridineME20753913712-1.579228.0753
MYRISTIC ACID (M-H)-Myristic acidME20756011005-22.447228.2089
THYMIDINE (M-H)-ThymidineME2075855789-2.74242.0906
THYMIDINE (M+CL)-ThymidineME2075845789-2.751242.0911
URIDINE (M-H)-UridineME2075926029-1.365244.0702
URIDINE (M+CL)-UridineME2075916029-1.325244.0707
BIOTIN (M-H)-BiotinME20753411966127-6.301244.0883
PALMITOLEIC ACID (M-H)-Palmitoleic acidME207572445638-22.618254.225
PALMITIC ACID (M-H)-Palmitic acidME207571985-22.838256.2408
ADENOSINE (M+CL)-AdenosineME20752760961-1.749267.0962
HEPTADECANOIC ACID (M-H)-Margaric acidME20754710465-22.993270.2561
LINOLEIC ACID (M-H)-Linoleic acidME2075545280450-22.749280.2409
1-METHYLADENOSINE (M+CL)-1-MethyladenosineME20751027476-2.992281.1132
OLEIC ACID (M-H)-Oleic acidME207568445639-22.926282.2566
STEARIC ACID (M-H)-Stearic acidME2075815281-23.185284.2724
5'-METHYLTHIOADENOSINE (M+CL)-5'-MethylthioadenosineME207525439176-4.435297.0902
ARACHIDONIC ACID (M-H)-Arachidonic acidME207531444899-22.705304.2415
N-ACETYLNEURAMINIC ACID (M-H)-N-Acetylneuraminic acidME207566444885-0.676309.1053
URIDINE-5-MONOPHOSPHATE (M-H)-UMPME2075936030-0.859324.0362
DOCOSAHEXAENOIC ACID (M-H)-Docosahexaenoic acidME207541445580-22.684328.2417
SUCROSE (M+CL)-SucroseME2075835988-0.672342.1222
S-ADENOSYL-L-HOMOCYSTEINE (M-H)-S-AdenosylhomocysteineME207579439155-1.463384.1185
HYODEOXYCHOLIC ACID (M-H)-Hyodeoxycholic acidME2075495283820-22.881392.2964
EPIBRASSINOLIDE [ISTD] (M+CL)-24-epi-BrassinolideME207542115196-19.909480.3462
18:0 LYSO-PE (M-H)-LPE 18:0ME2075139547068-22.655481.3182
16:0 LYSO PC (M+CL)-LPC 16:0ME207511460602-22.265495.3334
16:0-18:0 PC (M+CL)-PC 16:0_18:0ME20751218631368-25.507761.5963
24:0 SM (D18:1/24:0) (M+CL)-SM 18:1;O2/24:0ME20751744260127-27.911814.6963
PYRUVIC ACID (M-H)-Pyruvic acidME2075771060-0.72988.0164


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