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Analysis: HILIC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
10-Hydroxy-2-decenoic acid-ME4337765312738-1133
13-Keto-9Z,11E-octadecadienoic acid13-Oxo-ODEME4337776446027-1295
1,5-Hexadien-3-ol-ME43377479122-181
1,5-PentanediamineCadaverineME433775273-786
1-Cycloheptyl-4-piperidinamine-ME4337784778241-1180.1748_163.1482
1-Methylnicotinamide1-Methyl nicotinamideME433779457-6137
2,5-Hexanedione-ME4337808035-1115
2,6-Diaminopimelic acid2,6-Diaminopimelic acidME433781865-8191
2-Acetylpyrazine2-AcetylpyrazineME43378330914-8123
2-Amino-1-phenylethanol2-HydroxyphenethylamineME4337841000-7-
2-AminoethanethiolCysteamineME433785118985556-278
2-ArachidonoylglycerolMG 20:4ME4337865282280-7361
2-Benzothiazolesulfonic acid-ME43378730647-1233.0051_215.9784
2’-deoxyadenosineDeoxyadenosineME4337826303-4252
2'-DeoxycytidineDeoxycytidineME43378813711-6228
2-Methoxy-4-vinylphenol2-Methoxy-4-vinylphenolME433789332-9151
2'-O-Methylguanosine2'-O-MethylguanosineME433790135406950-6298
2-Pyridone2-HydroxypyridineME4337918871-296
(2R)-3-HydroxyisovaleroylcarnitineCAR 4:0;OH,MeME433771131668011-7262
2S-Amino-4E-octadecene-1,3S-diolL-threo-SphingosineME43379211130338-5-
3alpha-Galactobiose-ME43380016219440-9365
3'-alpha-Sialyl-N-acetyllactosamine-ME433801102247004-8657
(3-Carboxypropyl)trimethylammonium cation3-DehydroxycarnitineME433772134-8146
3-Dehydrocarnitine3-DehydrocarnitineME4337936991982-3116
3-HydroxybutyrylcarnitineCAR 4:0;3OHME43379490659885-8248
3-Methoxytyramine3-MethoxytyramineME4337951669-5151
3-Methylcrotonylglycine3-MethylcrotonylglycineME433796169485-3158
3-Methylcytidine3-MethylcytidineME43379714237477-7258
3-Methylhistidine3-MethylhistidineME43379864969-9170
3'-O-Methylguanosine3'-O-MethylguanosineME433799135742509-6298
4-Acetylbutyric acid5-Ketocaproic acidME43380218407-1131
4-Aminobenzoic acidp-Aminobenzoic acidME433803978-7138
4-Guanidinobutyric acid4-Guanidinobutanoic acidME433804500-8146
4-Hydroperoxy-2-nonenal-ME4338056435432-1155
4-Hydroxyhexenal-ME4338065283314-197
4-Hydroxymandelonitrile4-HydroxymandelonitrileME433807166768-3150
4-Hydroxynonenal alkyne-ME43380871684698-1135
4-Imidazoleacrylic acidUrocanic acidME433809736715-4139
4-Imidazoleacrylic acid isomerUrocanic acidME433810736715-2121
5alpha-Cholest-7-en-3beta-olLathosterolME43381565728-1369
5beta-Androstane-3alpha,17beta-diol-ME433816134494-1275
5.beta.-Dihydrotestosterone5beta-DihydrotestosteroneME43381115-1291
5-Methoxytryptophol5-MethoxytryptopholME43381212835-1192
5'-Methylthioadenosine5'-MethylthioadenosineME433813439176-2298
5'-Methylthioadenosine isomer5'-MethylthioadenosineME433814439176-3298
9(10)-Epoxy-12Z-octadecenoic acid9(10)-EpOMEME43381712097313-1297
9-Oxo-10E,12Z-octadecadienoic acid9-OxoODEME4338189839084-1295
Abietic acidAbietic acidME43381910569-1257
Acetyl-cholineAcetylcholineME433820187-3146
AdenosineAdenosineME43382160961-5268
Adenosine isomerAdenosineME43382260961-5268
Adenosine monophosphateAMPME4338236083-9348
Ala-GlnAla-GlnME433824123935-9218
Ala-IleAla-IleME4338257408078-8203
AlanineAlanineME4338267311724-890
Ala-SerAla-SerME4338271549432-9177
alpha-Galactosamine-1-phosphate-ME434005493587-7260
alpha-Lonone or beta-Damasconealpha-IononeME4340065282108-1-
AminophenolAminophenolME4338285801-2110
Androstane-3,17-diol3alpha-AndrostanediolME43382911301-1293
Arg-AlaArg-AlaME4338307020333-10246
Arg-AspArg-AspME4338317009612-10290
Arg-GluArg-GluME4338326995004-10304
Arginine isomerArginineME43383328782-10175
Argininosuccinic acidArgininosuccinic acidME433834136664755-10291
Arg-ThrArg-ThrME43383525109623-10276
Arg-ValArg-ValME4338366992654-9274
Asn-ArgAsn-ArgME43383714299174-10289
AsparagineAsparagineME4338386267-9133
Benzyl alcoholBenzyl alcoholME433839244-191
BetaineBetaineME433840247-7-
beta-Nicotinamide adenine dinucleotideNAD+ME434007127255362-10664
Butyrylcarnitine or IsobutyrylcarnitineCAR 4:0ME433841213144-6232
CarnitineCarnitineME43384210917-8162
CarnosineCarnosineME4338436992100-10-
Carnosine isomer BCarnosineME4338446992100-9227
CholineCholineME433845305-5104
CitrullineCitrullineME4338469750-9-
CreatineCreatineME433847586-8-
Creatine isomerCreatineME433848586-8-
CyclohexanamineCyclohexylamineME4338497965-5100
Cys-AsnCys-AsnME43385010328966-8236
Cys-ProCys-ProME4338513037777-3219
Cysteine-glutathione disulfideS-Glutathionyl-cysteineME4338524247235-10427
Cytidine 5'-diphosphate ethanolamineCDP-EthanolamineME433853123727-10447
Cytidine 5'-diphosphocholineCDP-cholineME43385411583971-10489
Cytidine-5'-monophosphateCMPME4338556131-10324
DexpanthenolPantothenolME4338564678-2206
DiethanolamineDiethanolamineME433857--7106
DMSODimethyl sulfoxideME433858679-279
DopamineDopamineME433859681-6154
EpigallocatechinEpigallocatechinME43386072277-10307
ErgothioneineErgothioneineME43386157509571-8230
Erythro-SphinganineSphinganineME43386291486-5302
Erythro-Sphinganine-1-phosphateSphinganine 1-phosphateME433863644260-6382
Erythro-Sphingosine-1-phosphateSphingosine 1-phosphateME4338645283560-6380
Ethyldiethanolamine-ME43386513418631-6134
.gamma.-Aminobutyric acidgamma-Aminobutyric acidME433773119-886
gamma-Aminobutyric Acid (GABA)gamma-Aminobutyric acidME433866119-8-
gamma-Glutamylglutamine isomer Bgamma-GlutamylglutamineME433867150914-9276
gamma-Glutamylleucinegamma-GlutamylleucineME433868151023-8261
Gln-AlaGln-AlaME4338699813211-9218
Gln-GlnGln-GlnME4338707010588-9275
Gln-GlyGln-GlyME4338716992691-9204
Glutamic acid isomer AGlutamic acidME43387244272391-9148
Glutamic acid isomer BGlutamic acidME43387357397101-10148
GlutamineGlutamineME4338745961-9-
Glutamine isomerGlutamineME4338756992096-9147
Glutathione (oxidized)GlutathioneME43387665359-10613
Glutathione (reduced)GlutathioneME433877124886-9308
Gly-ArgGly-ArgME4338786426706-10232
Glycerol tricaprylate-ME43387910850-1488
Glycerophosphocholine isomer Asn-Glycero-3-phosphocholineME433880657272-9-
Glycerophosphocholine isomer Bsn-Glycero-3-phosphocholineME433881657272-8258
GlycineGlycineME4338825257127-876
Gly-LysGly-LysME4338833080576-10204
Guanosine 5'-monophosphateGMPME433884135398631-10-
Hexanoyl-carnitineCAR 6:0ME4338853246938-5260
Hexose phosphate isomer AHexose 6-phosphateME43388665127-10283
Hexose phosphate isomer BHexose 6-phosphateME43388765127-10243
Hexose phosphate isomer DHexose 6-phosphateME4338885958-10261
H-gamma-glutamyl-glutaminegamma-GlutamylglutamineME433889150914-10276
His-GlyHis-GlyME433890101179-10213
His-ProHis-ProME433891152322-6235
HistamineHistamineME433892774-8-
Histidine isomer AHistidineME4338936274-10156
Histidine isomer BHistidineME4338946274-10156
His-ValHis-ValME4338957021870-9255
HomoarginineHomoarginineME4338969085-9189
HomocysteineHomocysteineME4338976971015-8136
Ile-ArgIle-ArgME4338987021814-9288
Ile-Pro-ArgIle-Pro-ArgME43389918221866-9385
Inosine 5'-monophosphate isomerIMPME433900135398640-9-
IsoleucineIsoleucineME4339016306-7132
Isovaleryl-carnitineCAR 4:0;3MeME433902169235-5246
Lacto-N-biose-ME433903440994-9384
Laminine-ME433904159659-9189
Leu-LeuLeu-LeuME4339056992072-6245
LidocaineLidocaineME4339063676-2235
Lys-AlaLys-AlaME4339077010504-10218
Lys-GlnLys-GlnME433908196305-10275
Lys-GluLys-GluME4339097010501-10276
Lys-IleLys-IleME4339107010499-9260
LysineLysineME433911122198194-10-
Malonyl-carnitineCAR DC3:0ME433912131770465-9248
Methacholine cationMethacholineME4339131993-6160
MethionineMethionineME4339146992087-7-
MethylhistamineMethylhistamineME4339153614-7-
N8-AcetylspermidineN8-AcetylspermidineME433919123689-9188
N-Acetylaspartylglutamic acidN-Acetyl-Asp-GluME4339205255-8-
N-Acetyl-glucosamineN-Acetyl-D-glucosamineME43392182313-10-
N-Acetyl-lactosamineN-AcetyllactosamineME433922119547-8406
N-AcetylmethionineN-AcetylmethionineME4339236180-3192
(-)-N-Acetylneuraminic acidN-Acetylneuraminic acidME43377014017587-8274
N.alpha.-Acetyl-lysineN(2)-AcetyllysineME43391792907-8189
N-alpha-Acetyl-ornithineN-AcetylornithineME433936439232-8175
N-alpha-Methyl-lysineN(2)-Methyl-lysineME4339377010497-7144
N-CyclohexylformamideN-CyclohexylformamideME43392413017-1128
Neoabietic acidNeoabietic acidME433925221118-1257
N.epsilon.-Methyl-lysineN(6)-MethyllysineME433918541646-9-
NicotinamideNiacinamideME433926936-2123
Nicotinamide riboside cationNicotinamide ribosideME433927439924-7255
NicotineNicotineME43392889594-5163
N-MethylalanineN-MethylalanineME433929119-8-
N-Methylanthranilic acid2-(Methylamino)benzoic acidME43393067069-1152
N-Methylglutamic acidN-Methyl-glutamic acidME433931268779-8162
N-MethylhistidineN-MethylhistidineME43393290638-9170
N-MethylvalineN-Methyl-valineME4339334378-7132
N,N-DimethylarginineDimethylarginineME43391617801140-9203
n-OctadecylamineOctadecylamineME43393415793-2270
N-omega-AcetylhistamineN-AcetylglutamineME43393569602-6154
Oleamide isomerOleamideME4339395283387-1282
Oleoyl ethylamideOleoyl-EAME43394044270319-1310
O,O-Diethyl phosphateDiethylphosphateME433938654-1155
o-PhosphocolaminePhosphoethanolamineME4339411015-9142
OrnithineOrnithineME43394288747248-10133
Palmitamide isomer APalmitamideME43394369421-1256
Palmitamide isomer BPalmitamideME43394469421-2256
Palmitoyl ethanolamidePalmitoyl-EAME4339454671-1300
Pantothenic acidPantothenic acidME4339466613-4220
Pantothenic acid isomer APantothenic acidME433947988-3-
Pantothenic acid isomer BPantothenic acidME433948988-4220
Phe-ArgPhe-ArgME433949150903-9322
Phe-LysPhe-LysME43395015607820-9294
PhencyclidinePhencyclidineME4339516468-1244
PhenethylaminePhenylethylamineME4339521001-2122
PhosphocholineCholine phosphateME433953135437-9184
Phosphocholine isomerCholine phosphateME433954135437-9367
Pro-AlaPro-AlaME4339556347578-8187
Pro-AsnPro-AsnME4339567408193-9230
Pro-GlnPro-GlnME4339577408109-9244
Prolinamide isomer A-ME433958111306-7115
Prolinamide isomer B-ME433959111306-10115
ProlineProlineME4339606971047-8116
Proline betaineProline betaineME433961554-7144
Pro-MetPro-MetME4339627408173-7247
PropionylcarnitineCAR 3:0ME433963107738-6218
P-Toluenesulfonic acid-ME43396420307553-9173
PutrescinePutrescineME4339651045-9-
PyridoxaminePyridoxamineME4339661052-8169
Pyroglutamic acid isomerPyroglutamic acidME4339677405-9-
S-Adenosyl-homocysteineS-AdenosylhomocysteineME43396825246222-9385
S-Adenosyl-methionineS-AdenosylmethionineME43396934755-10399
Ser-AlaSer-AlaME4339707009579-9177
Ser-ArgSer-ArgME43397125216635-10262
SerineSerineME4339726857581-9106
Ser-LysSer-LysME43397316122513-10234
sn-Glycero-3-phosphocholinesn-Glycero-3-phosphocholineME433974439285-9258
SpermidineSpermidineME4339751102-7146
Stachydrine isomerStachydrineME433976554-10144
Stearamide isomer AStearamideME43397731292-1284
Stearamide isomer BStearamideME43397831292-2284
Stearoyl ethanolamideStearoyl-EAME43397927902-1328
Sucrose isomer ASucroseME4339805988-8365
Sucrose isomer BSucroseME4339815988-9365
Swainsonine-ME43398251683-6174
TarginineTarginineME433983132862-9189
TaurineTaurineME4339844068592-8126
Thiamine cationThiamineME4339851130-7265
Thr-GlnThr-GlnME43398688297548-9248
Thr-Pro-ArgThr-Pro-ArgME43398718224444-9373
Thr-ThrThr-ThrME43398811321969-9221
ThymolThymolME4339896989-1151
TMAOTrimethylamine N-oxideME4339901145-576
trans-Nicotine-1'-oxide isomer A-ME43399171751018-6179
TributylamineTributylamineME4339927622-2186
TriethanolamineTriethanolamineME4339937618-6150
Triethyl citrate-ME4339946506-1299.1101_277.1284
Tripropylamine-ME4339957616-2144
Tryptophan isomerTryptophanME4339964099458-7188
Turanose isomer BTuranoseME4339975460935-8-
Tyr-LeuTyr-LeuME43399887071-7295
UMPUMPME4339996030-9325
Uridine-5-diphosphoacetylgalactosamineUDP-N-acetylgalactosamineME43400023700-10608
Val-ArgVal-ArgME434001444523-9274
Val-GlnVal-GlnME43400254493101-8246
Val-HisVal-HisME4340037408625-9255
XanthineXanthineME4340041188-6153


Analysis: HILIC NEGATIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
10-Hydroxydecanoic acid10-Hydroxydecanoic acidME43401174300-1187
1,11-Undecanedicarboxylic acidTridecanedioic acidME43401010458-1243
12(13)-Epoxy-9Z-octadecenoic acid12(13)-EpOMEME4340125356421-1295
13,14-Dihydro-15-ketoprostaglandin E213,14-Dihydro-15-keto-PGE2ME4340135280711-1333
2-DeoxyuridineDeoxyuridineME43401413712-3-
2-Hydroxyglutaric acid isomer A2-Hydroxyglutaric acidME434015439939-8129
2-Hydroxyglutaric acid isomer B2-Hydroxyglutaric acidME434016439391-9129
2-Hydroxyisobutyric acid2-Hydroxyisobutyric acidME43401711671-3103
2-hydroxystearic acid2-Hydroxystearic acidME434018439885-1299
2-Isopropylmalic acid2-Isopropylmalic acidME43401977-2157
2-Phosphoglyceric acid2-Phosphoglyceric acidME434020439278-10185
3-Furancarboxylic acid, tetrahydro-4-methylene-2-o...-ME4340226482234-1289.1241_253.1469
3-Hydroxydodecanoic acid3-Hydroxydodecanoic acidME43402394216-1215
3-(Hydroxymethyl)phenol3-Hydroxybenzyl alcoholME434021102-2123
3-Hydroxyphenylacetic acid3-Hydroxyphenylacetic acidME43402412122-1151
3-Hydroxyvaleric acid3-Hydroxyvaleric acidME434025107802-2117
3-Methyladipic acid3-Methyladipic acidME43402612292-2159
4-(Decan-4-Yl)Benzenesulfonic Acid-ME43402714921167-1297
4-Hydroxy-6-methyl-2-pyrone-ME43402854675757-1125
4-Hydroxybenzoic acid4-Hydroxybenzoic acidME434029135-2137
4-Hydroxyphenyllactic acid4-Hydroxyphenyllactic acidME4340309378-4181
4-Hydroxyphenyllactic acid isomer4-Hydroxyphenyllactic acidME4340319378-4181
4-Ketopimelic acid isomer A-ME43403295084-3173
4-Nitrophenol4-NitrophenolME434033980-1138
5-Hydroxy-6E,8Z,11Z,14Z-eicosatetraenoic acid5-HETEME4340355280733-1319
5-Hydroxyisophthalic acid-ME43403469257-1181
6-Hydroxycaproic acid6-Hydroxycaproic acidME43403614490-1131
9-Hydroperoxy-10E,12Z-octadecadienoic acid-ME4340376439847-1293
Acetylenedicarboxylic acidAcetylenedicarboxylateME434038371-8113
AdenineAdenineME434039190-5134
Adenosine-3-monophosphate3'-AMPME43404141211-9346
Adenosine 5'-diphosphoriboseADP-riboseME43404033576-10558
Adipic acidAdipic acidME43404222494954-2145
Ala-AlaAla-AlaME4340435460362-8159
Ala-AspAla-AspME43404499719-9203
Ala-GluAla-GluME434045128841-9217
Ala-ThrAla-ThrME4340466427004-9189
AllantoinAllantoinME434047204-6-
AnserineAnserineME4340486992114-9239
Arabinonic acid isomer AArabinonic acidME434049122045-10165
ArabitolArabitolME43405094154-7151
ArginineArginineME43405128782-9173
Aspartic acidAspartic acidME434052139060126-9132
Asp-AspAsp-AspME434053471583-10247
Azelaic acid isomer AAzelaic acidME43405419347555-1-
Benzoic acidBenzoic acidME434055243-1121
Benzylacetate-ME4340568785-9149
beta-Fucose 1-phosphate-ME43417065369-9243
beta-Nicotinamide adenine dinucleotideNAD+ME434057134720244-10662
Carnosine isomer ACarnosineME4340586992100-10225
CellobioseCellobioseME43405910712-9341
Cholesterol 3-sulfateCholesterol sulfateME43406065076-1465
cis-4,7,10,13,16,19-Docosahexaenoic acidDHAME434061445580-1327
Citramalic acidCitramalic acidME4340621081-9147
CreatinineCreatinineME434063588-5112
CystathionineCystathionineME434064439258-10221
Cysteic AcidCysteic acidME43406572886-9168
CystineCystineME4340666992103-10239
CytidineCytidineME4340676175-7242
Dehydro-(+)-ascorbic acid dimerDehydroascorbic acid dimerME4340684613280-4173
Dichloroacetic acidDichloroacetic acidME4340696597-2127
Diethyloxalpropionate4-Heptenal diethyl acetalME43407080070-2201
Dinorprostaglandin E12,3-Dinor-PGE1ME43407116061101-1325
Dodecanedioic acidDodecanedioic acidME43407212736-1229
Ethylmalonic acidEthylmalonic acidME43407311756-2131
FA 16:0 (Palmitic acid)Palmitic acidME434074985-1255
Ferulic acidtrans-Ferulic acidME434075445858-1193
.gamma.-Glutamyl-glutamic acidgamma-Glutamylglutamic acidME43400992865-9275
gamma-Glutamylglutamine isomer Agamma-GlutamylglutamineME434076150914-10274
gamma-Glutamyltyrosinegamma-GlutamyltyrosineME43407794340-8309
Glucuronic acidGlucuronic acidME43407894715-9193
Glutamic acidGlutamic acidME43407944272391-9146
Glu-ThrGlu-ThrME4340806998031-9247
Gly-AspGly-AspME43408197363-9189
GlyceraldehydeGlyceraldehydeME434082751-889
Glyceric acidGlyceric acidME434083752-9105
Gly-ValGly-ValME43408497417-8173
GuanineGuanineME434085135398634-6150
GuanosineGuanosineME434086135398635-7-
Hexadecanedioic acidHexadecanedioic acidME43408710459-1285
HexanoylglycineHexanoylglycineME43408899463-2172
Hexose phosphate isomer CHexose 6-phosphateME43408965533-10259
HistidineHistidineME4340906274-9154
Homogentisic acidHomogentisic acidME434091780-3167
Homovanillic acidHomovanillic acidME4340921738-1181
Hydroxypalmitic acidHydroxypalmitic acidME434093301590-1271
HypotaurineHypotaurineME43409425244088-8108
HypoxanthineHypoxanthineME434095790-5135
Ile-LeuIle-LeuME4340967019083-6243
Indoxyl sulfateIndoxyl sulfateME43409710258-1212
InosineInosineME434098135398641-6-
InositolInositolME434099892-9179
LactitolLactitolME434100157355-9343
Leu-GlnLeu-GlnME4341011574949-8258
Maleic acidMaleic acidME434102444266-2115
MannoseMannoseME43410318950-8179
MethioninesulfoxideMethionine sulfoxideME4341041548907-8164
MethylcatecholMethylcatecholME4341059958-1123
Mucic acidGalactaric acidME4341063037582-10209
myo-InositolMyo-inositolME434107892-9225
(N-(-2-Acetamido))-2-aminoethanesulfonic acid-ME4340086993708-9181
N-Acetylaspartic acidN-Acetylaspartic acidME43410865065-8174
N-Acetylaspartic acid isomer BN-Acetylaspartic acidME43410965065-8174
N-Acetyl-carnosineN-AcetylcarnosineME4341109903482-8267
N-AcetylcysteineN-AcetylcysteineME43411112035-5162
N-Acetyl-galactosaminitolN-Acetyl-D-galactosaminitolME434112165880-7258
N-Acetyl-glucosamine 6-phosphateN-Acetyl-glucosamine 6-phosphateME434113440996-9300
N-AcetylglucosaminylasparagineAspartylglycosamineME43411491746260-10334
N-Acetylglutamic acidN-Acetylglutamic acidME43411570914-8188
N-AcetylhistidineN-AcetylhistidineME43411675619-8196
N-Acetylneuraminic acidN-Acetylneuraminic acidME434117439197-9308
N-epsilon-AcetyllysineN6-AcetyllysineME4341186991978-8187
N-IsobutyrylglycineIsobutyrylglycineME43411910855600-4144
N-Lauroylsarcosine-ME4341207348-1306.1877_270.2106
N-Methylalanine isomerN-MethylalanineME4341215288725-9102
NorleucineNorleucineME4341226991974-7130
O-Acetylsalicylic acidAspirinME4341232244-1179
Octadecanedioic acidOctadecanedioic acidME43412470095-1313
Oleic acidOleic acidME434125445639-1281
Orotic acidOrotic acidME434126967-7155
PhenylalaninePhenylalanineME4341276140-7-
PhosphotyrosineO-PhosphotyrosineME4341284589477-10260
Pimelic acidPimelic acidME434129385-2159
Propionic acid isomer APropionic acidME4341301032-173
Propionic acid isomer BPropionic acidME4341311032-273
Pro-SerPro-SerME4341327408258-9201
Prostaglandin F2betaPGF2betaME4341335280506-1353
PseudouridinePseudouridineME43413415047-7243
Psicose isomerPsicoseME43413590008-8161
PurinePurineME4341361044-2119
Pyroglutamic acidPyroglutamic acidME4341377405-9128
Pyruvic acidPyruvic acidME4341381060-587
rac-Glycerol 3-phosphoate-ME434139439276-9171
SaccharopineSaccharopineME434140160556-10275
Salicylic acidSalicylic acidME434141118212070-1137
Salicylic alcohol2-Hydroxybenzyl alcoholME4341425146-3123
Sebacic acidSebacic acidME4341435192-1201
Ser-GlySer-GlyME4341447009643-9161
Ser-ThrSer-ThrME43414554027404-9205
Ser-ValSer-ValME4341467020158-8203
SorbitolSorbitolME4341475780-8181
SorboseSorboseME4341486904-7179
S-SulfocysteineCysteine-S-sulfateME434149115015-8200
Suberic acidSuberic acidME43415022494956-2173
Sulfoacetic acidSulfoacetic acidME43415131257-8139
Tetradecanedioic acidTetradecanedioic acidME43415213185-1257
Thr-AlaThr-AlaME4341537010577-8189
Thr-AspThr-AspME4341547016067-9233
ThymidineThymidineME4341555789-3241
trans-Traumatic acidTraumatic acidME4341565283028-1227
Trehalose isomer BTrehaloseME4341577427-8387
TryptophanTryptophanME4341586923516-7203
Undecanedioic acidUndecanedioic acidME43415915816-1215
UracilUracilME4341601174-2111
UridineUridineME4341616029-5-
Uridine-5-diphosphoacetylglucosamineUDP-N-acetylglucosamineME434164643981-10606
Uridine 5'-monophosphateUMPME4341626030-9323
Uridine diphosphate glucoseUDP-glucoseME4341638629-10565
Val-AsnVal-AsnME4341657020201-9230
Val-GluVal-GluME43416640520340-8245
Val-SerVal-SerME4341676992640-8203
Val-ThrVal-ThrME4341689815826-8217
Vitamin C isomer BVitamin CME43416954670067-1175


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
ACar 10:0;CAR 10:0ME43417110245190-1316
ACar 12:0;CAR 12:0ME434172168381-1344
ACar 14:0;CAR 14:0ME4341733413344-1372
ACar 14:1;CAR 14:1ME434174138116408-1370
ACar 15:2;CAR 15:2ME434175138259172-1382
ACar 16:0;CAR 16:0ME434176--2400
ACar 16:1;CAR 16:1ME434177--1398
ACar 17:0;CAR 17:0ME43417853477804-2414
ACar 18:0;CAR 18:0ME4341795282-2428
ACar 18:1;CAR 18:1ME434180--2426
ACar 18:2;CAR 18:2ME4341816450015-1424
ACar 20:0;CAR 20:0ME4341825236785-3456
ACar 20:1;CAR 20:1ME434183138240086-2454
ACar 20:4;CAR 20:4ME43418456846189-1448
ACar 22:4;CAR 22:4ME434185138149190-2476
ACar 22:6;CAR 22:6ME43418653477843-1472
BMP 40:7; BMP 18:1_22:6;BMP 40:7ME434187138314294-4-
BMP 40:8; BMP 20:4_20:4;BMP 40:8ME434188138120710-4837
BMP 44:12; BMP 22:6_22:6;BMP 44:12ME434189138153413-4-
CE 18:1;CE 18:1ME4341905283632-11-
CE 18:2;CE 18:2ME4341915287939-10-
CE 18:4;CE 18:4ME434192101602521-7663
CE 20:4;CE 20:4ME4341936479222-10-
CE 20:5; ACE 20:5ME43419453477889-10-
CE 22:6;CE 22:6ME43419514274978-10-
Ceramide d34:1Cer 34:1;O2ME4341965283564-6-
Ceramide d40:1; ACer 40:1;O2ME4341975283567-8-
Ceramide d41:1;Cer 41:1;O2ME43419852931115-8-
Ceramide d42:1; ACer 42:1;O2ME4341995283571-8-
Cer-NDS d36:0; Cer-NDS d18:0/18:0;Cer 18:0;O2/18:0ME4342004255985-6569
Cer-NDS d40:0; Cer-NDS d18:0/22:0;Cer 18:0;O2/22:0ME4342019895360-8-
Cer-NDS d41:0; Cer-NDS d18:0/23:0;Cer 18:0;O2/23:0ME43420253817918-8-
Cer-NDS d42:0; Cer-NDS d18:0/24:0;Cer 18:0;O2/24:0ME4342035017602-8653
Cer-NDS d42:1; Cer-NDS d18:0/24:1;Cer 18:0;O2/24:1ME434204138167203-7651
Cer-NS d34:1; Cer-NS d18:1/16:0;Cer 18:1;O2/16:0ME4342055353456-6539
Cer-NS d36:1; Cer-NS d18:1/18:0;Cer 18:1;O2/18:0ME4342066372196-6567
Cer-NS d36:2; Cer-NS d18:2/18:0;Cer 18:2;O2/18:0ME43420715870105-6-
Cer-NS d37:1;Cer 37:1;O2ME434208138266303-7581
Cer-NS d38:1; Cer-NS d20:1/18:0;Cer 20:1;O2/18:0ME434209138125208-7595
Cer-NS d38:2; Cer-NS d18:2/20:0;Cer 18:2;O2/20:0ME43421015870106-6593
Cer-NS d39:1; Cer-NS d18:1/21:0;Cer 18:1;O2/21:0ME43421157713716-7609
Cer-NS d39:2; Cer-NS d18:2/21:0;Cer 18:2;O2/21:0ME434212138247674-7607
Cer-NS d40:1; Cer-NS d18:1/22:0;Cer 18:1;O2/22:0ME43421311399392-7623
Cer-NS d41:1; Cer-NS d18:1/23:0;Cer 18:1;O2/23:0ME43421459982723-7637
Cer-NS d42:1; Cer-NS d18:1/24:0;Cer 18:1;O2/24:0ME4342155789754-8651
Cer-NS d42:2; Cer-NS d18:1/24:1; ACer 18:1;O2/24:1ME434216101264395-8649
Cer-NS d42:2; Cer-NS d18:1/24:1; BCer 18:1;O2/24:1ME434217101264396-7649
Cer-NS d42:2; Cer-NS d18:2/24:0;Cer 18:2;O2/24:0ME434218138311445-8649
Cer-NS d42:3; Cer-NS d18:2/24:1;Cer 18:2;O2/24:1ME434219138116066-7647
Cer-NS d42:4; Cer-NS d18:1/24:3;Cer 18:1;O2/24:3ME434220138245482-6645
Cer-NS d44:1; Cer-NS d18:1/26:0;Cer 18:1;O2/26:0ME43422157704324-9-
Cer-NS d44:2; Cer-NS d20:1/24:1;Cer 20:1;O2/24:1ME434222138117265-8677
CholesterolCholesterolME4342235997-5-
CL 68:2; CL 32:0_36:2;CL 68:2ME434224138266104-10-
CL 70:3; CL 34:1_36:2;CL 70:3ME434225138301113-10-
DAG 32:0; DAG 16:0_16:0;DG 16:0_16:0ME43422699931-7587
DAG 32:1;DG 32:1ME434227138116950-6585
DAG 34:0; DAG 16:0_18:0;DG 16:0_18:0ME4342283086206-8615
DAG 34:1;DG 34:1ME4342295282283-7-
DAG 34:1; DAG 16:0_18:1;DG 16:0_18:1ME4342306440177-7613
DAG 34:2;DG 34:2ME4342319543695-6-
DAG 34:2; DAG 16:0_18:2;DG 16:0_18:2ME43423214275381-6611
DAG 35:1; DAG 17:0_18:1;DG 17:0_18:1ME434233138137658-7-
DAG 36:0; DAG 18:0_18:0;DG 18:0_18:0ME434234102615-8-
DAG 36:1; DAG 18:0_18:1;DG 18:0_18:1ME4342356443547-8-
DAG 36:2; DAG 18:0_18:2;DG 18:0_18:2ME4342369543716-7-
DAG 36:2; DAG 18:1_18:1;DG 18:1_18:1ME4342375497164-7639
DAG 36:3; DAG 16:0_20:3;DG 16:0_20:3ME434238138167166-7637
DAG 36:3; DAG 18:1_18:2;DG 18:1_18:2ME4342399543722-6-
DAG 36:4; DAG 16:0_20:4;DG 16:0_20:4ME434240138165576-6635
DAG 36:4; DAG 18:2_18:2;DG 18:2_18:2ME4342416438297-6-
DAG 37:4; DAG 17:0_20:4;DG 17:0_20:4ME434242138117221-7649
DAG 38:1; DAG 18:0_20:1;DG 18:0_20:1ME434243138195346-8-
DAG 38:2; DAG 18:1_20:1;DG 18:1_20:1ME434244138119023-8-
DAG 38:3; DAG 18:0_20:3;DG 18:0_20:3ME434245138170331-7-
DAG 38:4; DAG 16:0_22:4;DG 16:0_22:4ME434246138208842-7663
DAG 38:4; DAG 18:0_20:4;DG 18:0_20:4ME434247138129723-7-
DAG 38:5; DAG 18:1_20:4;DG 18:1_20:4ME4342489543784-6-
DAG 38:6; DAG 16:0_22:6;DG 16:0_22:6ME43424914747024-6659
DAG 38:6; DAG 18:2_20:4;DG 18:2_20:4ME4342509543795-6-
DAG 40:1; DAG 22:0_18:1;DG 18:1_22:0ME43425192037101-9-
DAG 40:2; DAG 18:1_22:1;DG 18:1_22:1ME434252138160449-8-
DAG 40:4; DAG 18:0_22:4;DG 18:0_22:4ME434253138178972-7691
DAG 40:4; DAG 20:0_20:4;DG 20:0_20:4ME434254138192489-8-
DAG 40:5; DAG 18:1_22:4;DG 18:1_22:4ME434255138296689-7689
DAG 40:5; DAG 20:1_20:4;DG 20:1_20:4ME434256138117006-7689
DAG 40:6; DAG 18:0_22:6;DG 18:0_22:6ME43425714747030-7687
DAG 41:1; DAG 23:0_18:1;DG 18:1_23:0ME434258138246438-9711
DAG 42:1; DAG 24:0_18:1;DG 18:1_24:0ME434259138136850-9-
DAG 42:2; DAG 18:1_24:1;DG 18:1_24:1ME434260138131016-9-
DAG 44:2; DAG 18:1_26:1;DG 18:1_26:1ME434261138306694-9-
GlcCer d42:1;GlcCer 42:1;O2ME4342626321367-8-
GlcCer d42:2; AGlcCer 42:2;O2ME4342636321360-7-
Hex2Cer d36:1; Hex2Cer d18:1/18:0;Hex2Cer 36:1;O2ME4342646450208-5891
HexCer-AP t37:0+1O;-ME434265138201907-6777
HexCer-AP t39:1+O; HexCer-AP t18:0/21:1+O;-ME434266138139279-7807.6063_802.6506
HexCer-AP t41:1+O; HexCer-AP t17:1/24:0+O;-ME434267138211392-8831
HexCer-NDS d36:0; HexCer-NDS d18:0/18:0;HexCer 18:0;O2/18:0ME4342683710785-6731
HexCer-NDS d38:0; HexCer-NDS d18:0/20:0;HexCer 18:0;O2/20:0ME43426918781911-7759
HexCer-NDS d40:0; HexCer-NDS d18:0/22:0;HexCer 18:0;O2/22:0ME43427018781903-7-
HexCer-NDS d40:1; HexCer-NDS d18:0/22:1;HexCer 18:0;O2/22:1ME434271134731477-7-
HexCer-NDS d40:2; HexCer-NDS d24:0/16:2;HexCer 24:0;O2/16:2*ME434272138155537-6783
HexCer-NDS d41:0; HexCer-NDS d18:0/23:0;HexCer 18:0;O2/23:0ME434273133016772-8-
HexCer-NDS d41:2;HexCer 41:2;O2ME434274138151919-10797
HexCer-NDS d42:0; HexCer-NDS d18:0/24:0;HexCer 18:0;O2/24:0ME4342754558205-7815
HexCer-NDS d42:1; HexCer-NDS d18:0/24:1;HexCer 18:0;O2/24:1ME434276138121489-7-
HexCer-NDS d42:2; HexCer-NDS d18:0/24:2;HexCer 18:0;O2/24:2*ME434277138122435-7811
HexCer-NDS d42:3; AHexCer 42:3;O2ME434278--6809
HexCer-NDS d44:1; HexCer-NDS d18:0/26:1;HexCer 18:0;O2/26:1ME434279138138624-8841
HexCer-NDS d44:2;HexCer 44:2;O2ME434280138156699-8839
HexCer-NDS d46:4;HexCer 46:4;O2ME434281--8863
HexCer-NS d34:1; HexCer-NS d18:1/16:0;HexCer 18:1;O2/16:0ME43428214035028-5701
HexCer-NS d36:1; HexCer-NS d18:1/18:0;HexCer 18:1;O2/18:0ME4342836138330-5729
HexCer-NS d36:2; HexCer-NS d18:2/18:0;HexCer 18:2;O2/18:0ME434284138257407-5727
HexCer-NS d37:1; HexCer-NS d18:1/19:0;HexCer 18:1;O2/19:0ME434285138152162-6743
HexCer-NS d38:1; HexCer-NS d18:1/20:0;HexCer 18:1;O2/20:0ME434286138142655-6-
HexCer-NS d38:2; HexCer-NS d18:2/20:0;HexCer 18:2;O2/20:0ME434287138155677-6755
HexCer-NS d40:1; HexCer-NS d18:1/22:0;HexCer 18:1;O2/22:0ME43428814795577-7785
HexCer-NS d40:2; HexCer-NS d18:1/22:1; AHexCer 18:1;O2/22:1ME434289138116171-6783
HexCer-NS d40:2; HexCer-NS d18:1/22:1; BHexCer 18:1;O2/22:1ME434290138131360-11783
HexCer-NS d40:2; HexCer-NS d18:1/22:1; CHexCer 18:1;O2/22:1ME434291138138980-10783
HexCer-NS d40:2; HexCer-NS d18:2/22:0;HexCer 18:2;O2/22:0ME434292138206856-6783
HexCer-NS d41:1; HexCer-NS d18:1/23:0;HexCer 18:1;O2/23:0ME434293138261261-7799
HexCer-NS d41:2;HexCer 41:2;O2ME434294138131469-7797
HexCer-NS d41:2; HexCer-NS d18:2/23:0;HexCer 18:2;O2/23:0ME434295138202241-7797
HexCer-NS d42:1; HexCer-NS d18:1/24:0;HexCer 18:1;O2/24:0ME43429612304803-7813
HexCer-NS d42:2; HexCer-NS d18:1/24:1;HexCer 18:1;O2/24:1ME434297138120493-11811
HexCer-NS d42:2; HexCer-NS d18:1/24:1; BHexCer 18:1;O2/24:1ME434298138120493-6811
HexCer-NS d42:3; HexCer-NS d18:1/24:2;HexCer 18:1;O2/24:2ME434299138119713-7809
HexCer-NS d42:3; HexCer-NS d18:2/24:1;HexCer 18:2;O2/24:1ME434300138123709-6809
HexCer-NS d43:1; HexCer-NS d18:1/25:0;HexCer 18:1;O2/25:0ME434301138252448-8-
HexCer-NS d43:2; HexCer-NS d19:1/24:1;HexCer 19:1;O2/24:1ME434302138116457-7825
HexCer-NS d43:2; HexCer-NS d19:2/24:0;HexCer 19:2;O2/24:0ME434303138293504-8825
HexCer-NS d43:3;HexCer 43:3;O2ME434304138116814-7823
HexCer-NS d44:1; HexCer-NS d18:1/26:0;HexCer 18:1;O2/26:0ME434305138145653-8-
HexCer-NS d44:2; HexCer-NS d18:1/26:1;HexCer 18:1;O2/26:1ME434306138124864-8-
HexCer-NS d44:6; HexCer-NS d18:1/26:5;HexCer 18:1;O2/26:5*ME434307138307174-6831
LPC 14:0-SN1;LPC 14:0ME434308460604-1468
LPC 15:0-SN1;LPC 15:0ME43430924779458-1482
LPC 16:0;LPC 16:0ME43431086554-1-
LPC 16:0-SN1;LPC 16:0ME43431186554-1-
LPC 16:1eLPC O-16:1ME43431210480367-2482
LPC 16:1-SN1;LPC 16:1ME43431324779461-1494
LPC 18:0;LPC 18:0ME434314497299-2546
LPC 18:1; ALPC 18:1ME4343156449974-1522
LPC 18:1; BLPC 18:1ME4343166449974-2-
LPC 18:2-SN1;LPC 18:2ME43431711005824-1-
LPC 18:2-SN2;LPC 18:2ME43431811988421-1520
LPC 19:0-SN1;LPC 19:0/0:0ME43431913648279-3538
LPC 20:0-SN1;LPC 20:0ME43432024779474-3552
LPC 20:1-SN1;LPC 20:1ME434321138310124-2550
LPC 20:2-SN1;LPC 20:2ME434322138310096-2548
LPC 20:3-SN1;LPC 20:3ME434323138300357-1546
LPC 20:4-SN1;LPC 20:4ME434324138162370-1-
LPC 22:0-SN1;LPC 22:0ME43432524779480-4580
LPC 22:1-SN1;LPC 22:1ME434326138233030-3578
LPC 22:4-SN1;LPC 22:4ME434327138165132-1572
LPC 22:6-SN1;LPC 22:6ME43432814552259-1-
LPC 23:0-SN1;-ME434329133017446-4594
LPC 24:0-SN1;LPC 24:0ME43433024779482-4-
LPC 24:1-SN1;-ME434331138198787-4606
LPC 24:6;LPC 24:6ME43433210579392-1596.3627_618.3444
LPC 26:0-SN1;LPC 26:0ME434333138291249-5637
LPC 26:1-SN1;-ME434334138229309-4634
LPC O-18:0;LPC O-18:0ME4343353985-3510
LPC O-18:1;LPC O-18:1ME43433624779512-2508
LPC O-18:2;LPC O-18:2ME43433724779514-2506
LPE 16:0;LPE 16:0ME43433889229-1454
LPE 16:1;LPE 16:1ME43433925244429-1452
LPE 17:0;LPE 17:0ME434340138186684-2-
LPE 18:0;LPE 18:0ME43434145479288-2482
LPE 18:1;LPE 18:1ME4343429547072-2-
LPE 18:2;LPE 18:2ME434343138141392-1478
LPE 20:0;LPE 20:0ME43434475958060-3510
LPE 20:1;LPE 20:1ME434345138184141-2508
LPE 20:2;LPE 20:2ME434346138244438-2506
LPE 20:3;LPE 20:3ME434347138270216-1504
LPE 20:4;LPE 20:4ME434348138187816-1502
LPE 21:0;LPE 21:0ME434349138196547-3560
LPE 22:1;LPE 22:1ME434350138296181-3536
LPE 22:2;LPE 22:2ME434351138301591-2534
LPE 22:3;LPE 22:3ME434352138232596-2532
LPE 22:6;LPE 22:6ME434353138295358-1526
LPE 24:4;LPE 24:4ME434354138183832-2558
LPE 24:5;LPE 24:5ME434355--2556
LPE 24:6;LPE 24:6*ME434356--1554
LPE 26:6;LPE 26:6ME434357--2582
LPE O-16:1; or LPE P-16:0LPE P-16:0 or LPE O-16:1ME434358--2-
LPE O-18:1; or LPE P-18:0LPE P-18:0 or LPE O-18:1ME434359--3-
LPE O-18:2;LPE O-18:2ME434360--2-
PC 16:0_9:0 CHO;-ME43436146907874-2650.4484_672.4307
PC 17:0;PC 17:0ME434362138263169-2-
PC 28:0; PC 14:0_14:0;PC 14:0/14:0ME43436326197-4-
PC 29:0;PC 29:0ME43436424778553-5-
PC 30:0; PC 14:0_16:0;PC 14:0_16:0ME43436510169024-5-
PC 30:1; PC 14:0_16:1;PC 14:0_16:1ME43436624778616-4-
PC 31:0; PC 15:0_16:0;PC 15:0_16:0ME43436714818904-5721
PC 31:1; APC 31:1ME43436824778657-5719
PC 31:1; BPC 31:1ME434369138180362-5719
PC 32:0;PC 32:0ME434370138168062-6757
PC 32:0; PC 16:0_16:0;PC 16:0/16:0ME4343716138-5735
PC 32:1; PC 16:0_16:1;PC 16:0_16:1ME4343726443090-5733
PC 32:2;PC 32:2ME43437310462648-4-
PC 32:3;PC 32:3ME434374138146635-4729
PC 33:0; PC 16:0_17:0;PC 16:0_17:0ME43437524778683-6749
PC 33:1;PC 33:1ME434376138168777-5747
PC 33:1; PC 16:0_17:1;PC 16:0_17:1ME43437724778685-5747
PC 33:2; PC 15:0_18:2;PC 15:0_18:2ME43437824778665-5745
PC 34:0;PC 34:0ME434379129269-7763
PC 34:0; PC 16:0_18:0;PC 16:0_18:0ME43438010147142-6-
PC 34:1; PC 16:0_18:1;PC 16:0_18:1ME4343816506401-5761
PC 34:2; PC 16:0_18:2;PC 16:0_18:2ME43438216213884-5-
PC 34:3;PC 34:3ME43438315151379-5757
PC 34:3; PC 16:0_18:3;PC 16:0_18:3ME43438410771393-5-
PC 34:4; PC 14:0_20:4;PC 14:0_20:4ME434385138131886-4-
PC 35:0;PC 35:0ME43438624778708-6777
PC 35:1; PC 17:0_18:1;PC 17:0_18:1ME434387138182152-6-
PC 35:2; APC 35:2ME43438814818910-5773
PC 35:2; BPC 35:2ME434389138145733-5795
PC 35:2; CPC 35:2ME43439052922721-5795
PC 35:2; PC 17:1_18:1;PC 17:1_18:1ME43439114818913-5773
PC 35:3;PC 35:3ME43439252924614-5793
PC 35:3; PC 17:1_18:2;PC 17:1_18:2ME434393138271945-5771
PC 35:4;PC 35:4ME434394138260887-5791
PC 35:4; PC 15:0_20:4;PC 15:0_20:4ME434395138188911-5769
PC 35:5;PC 35:5ME434396138198098-4767
PC 36:0;PC 36:0ME43439794190-6813
PC 36:0; PC 18:0_18:0;PC 18:0/18:0ME43439865146-7791
PC 36:1; APC 36:1ME43439924778713-7789
PC 36:1; BPC 36:1ME4344006436018-6811
PC 36:2; APC 36:2ME43440114818936-6787
PC 36:2; PC 18:1_18:1;PC 18:1/18:1ME4344026437081-6787
PC 36:3; PC 16:0_20:3;PC 16:0_20:3ME43440316759365-5-
PC 36:3; PC 18:1_18:2;PC 18:1_18:2ME43440415151374-5785
PC 36:4;PC 36:4ME43440552922783-5805
PC 36:4; PC 18:2_18:2;PC 18:2/18:2ME4344066440944-5783
PC 36:5; CPC 36:5ME43440724778724-5781
PC 36:5; PC 16:1_20:4;PC 16:1_20:4ME434408138219333-4-
PC 36:6; PC 14:0_22:6;PC 14:0_22:6ME43440924778640-4-
PC 37:0; APC 37:0ME43441024778561-6805
PC 37:0; BPC 37:0ME43441124778791-6805
PC 37:1;PC 37:1ME43441249801987-6803
PC 37:2; APC 37:2ME434413138204233-6801
PC 37:2; BPC 37:2ME434414138159257-6801
PC 37:3;PC 37:3ME434415138280227-5799
PC 37:4;PC 37:4ME43441652923169-5819
PC 37:4; PC 17:0_20:4;PC 17:0_20:4ME434417138172174-5797
PC 37:5; APC 37:5ME43441852923345-5795
PC 37:5; BPC 37:5ME434419138274558-4795
PC 37:6;PC 37:6ME43442052923679-5793
PC 37:7;PC 37:7ME434421138162993-6791
PC 38:0; PC 16:0_22:0;PC 16:0_22:0ME43442224778727-7-
PC 38:1; APC 38:1ME434423138121379-7817
PC 38:1; BPC 38:1ME43442452923497-7839
PC 38:1; PC 18:0_20:1;PC 18:0_20:1ME434425138233987-7817
PC 38:2; APC 38:2ME43442614818952-6815
PC 38:2; BPC 38:2ME43442752923171-6837
PC 38:2; PC 18:1_20:1;PC 18:1_20:1ME434428138186336-6815
PC 38:3; APC 38:3ME434429138210186-6813
PC 38:3; BPC 38:3ME43443053478919-6835
PC 38:3; PC 18:0_20:3;PC 18:0_20:3ME434431138203340-6813
PC 38:4; BPC 38:4ME43443252923119-5833
PC 38:4; PC 16:0_22:4;PC 16:0_22:4ME434433138172457-5811
PC 38:4; PC 18:0_20:4;PC 18:0_20:4ME434434138166196-6811
PC 38:4; PC 18:1_20:3;PC 18:1_20:3ME434435138187111-5811
PC 38:5; APC 38:5ME43443624778861-4809
PC 38:5; BPC 38:5ME43443752923177-5831
PC 38:5; PC 16:0_22:5;PC 16:0_22:5ME43443824778738-5809
PC 38:5; PC 18:1_20:4;PC 18:1_20:4ME434439138265660-5-
PC 38:6; PC 16:0_22:6;PC 16:0_22:6ME4344409940652-5807
PC 38:6; PC 18:2_20:4;PC 18:2_20:4ME434441138256331-5-
PC 38:7; PC 16:1_22:6;PC 16:1_22:6ME43444224778774-4-
PC 39:1; PC 21:0_18:1;PC 18:1_21:0ME434443138227612-7-
PC 39:2;PC 39:2ME434444138175524-6829
PC 39:4;PC 39:4ME434445138207528-6825
PC 39:5;PC 39:5ME434446138297127-5823
PC 39:6; PC 17:0_22:6;PC 17:0_22:6ME434447134744996-5-
PC 39:7;PC 39:7ME43444852923687-5819
PC 40:0; PC 16:0_24:0;PC 16:0_24:0ME434449138270315-8-
PC 40:1; PC 22:0_18:1;PC 18:1_22:0ME434450138123157-7-
PC 40:2; PC 20:1_20:1;PC 20:1/20:1ME43445124779064-7843
PC 40:2; PC 22:0_18:2;PC 18:2_22:0ME43445225245110-7843
PC 40:3;PC 40:3ME43445352923189-6841
PC 40:3; PC 22:1_18:2;PC 18:2_22:1ME434454138244254-6841
PC 40:4; BPC 40:4ME43445552923513-6861
PC 40:4; PC 16:0_24:4;PC 16:0_24:4ME434456138131518-6839
PC 40:4; PC 18:0_22:4;PC 18:0_22:4ME434457138291977-6839
PC 40:4; PC 20:0_20:4;PC 20:0_20:4ME434458138142053-6839
PC 40:5; PC 18:0_22:5;PC 18:0_22:5ME43445924778874-6837
PC 40:5; PC 20:1_20:4;PC 20:1_20:4ME434460138260124-6837
PC 40:6; PC 18:0_22:6;PC 18:0_22:6ME43446124778877-5835
PC 40:6; PC 20:2_20:4;PC 20:2_20:4ME434462138148242-5835
PC 40:7; APC 40:7ME43446352923197-5833
PC 40:7; BPC 40:7ME43446424778901-5855
PC 40:7; PC 18:1_22:6;PC 18:1_22:6ME43446524778956-5833
PC 40:8;PC 40:8ME43446624778984-4831
PC 40:8; PC 20:4_20:4;PC 20:4/20:4ME434467138125770-4-
PC 41:0;PC 41:0ME43446852923461-8861
PC 41:1; PC 23:0_18:1;PC 18:1_23:0ME434469138274590-8-
PC 41:2; APC 41:2ME434470138248759-7857
PC 41:2; BPC 41:2ME434471138260645-7-
PC 41:3;PC 41:3ME434472138257546-6855
PC 41:5; APC 41:5ME434473138147333-6851
PC 41:5; BPC 41:5ME43447452923377-7851
PC 41:6;PC 41:6ME434475134748913-6849
PC 41:7;PC 41:7ME434476138212819-5847
PC 42:0;PC 42:0ME43447724779094-9875
PC 42:10; PC 20:4_22:6;PC 20:4_22:6ME434479138217019-4855
PC 42:1; PC 24:0_18:1;PC 18:1_24:0ME434478138254718-8-
PC 42:2; PC 18:1_24:1;PC 18:1_24:1ME434480138305555-7871
PC 42:2; PC 24:0_18:2;PC 18:2_24:0ME434481138177089-8-
PC 42:3; PC 22:0_20:3;PC 20:3_22:0ME434482138258620-7869
PC 42:3; PC 24:1_18:2;PC 18:2_24:1ME434483138196538-7869
PC 42:4;PC 42:4ME434484138232057-7867
PC 42:4; PC 18:0_24:4;PC 18:0_24:4ME434485138261055-7867
PC 42:4; PC 22:0_20:4;PC 20:4_22:0ME434486138130605-7-
PC 42:5; APC 42:5ME43448752923531-6865
PC 42:5; BPC 42:5ME43448852923145-6865
PC 42:5; PC 22:1_20:4;PC 20:4_22:1ME434489138286947-6865
PC 42:6;PC 42:6ME43449024779054-6863
PC 42:6; PC 18:0_24:6;PC 18:0_24:6ME43449152923207-6863
PC 42:7; APC 42:7ME43449252923147-5861
PC 42:7; BPC 42:7ME434493138157361-5861
PC 42:9;PC 42:9ME434494138273334-5-
PC 43:0;PC 43:0ME43449524778799-9889
PC 43:1;PC 43:1ME434496138306763-8-
PC 43:2;PC 43:2ME434497138142474-8-
PC 43:4;PC 43:4ME43449852923659-7881
PC 43:5;PC 43:5ME434499138221239-7879
PC 43:6;PC 43:6ME43450052923719-6877
PC 44:0;PC 44:0ME434501154391-9903
PC 44:1;PC 44:1ME434502138249333-9-
PC 44:12; PC 22:6_22:6;PC 22:6/22:6ME43450313754721-4879
PC 44:2;PC 44:2ME434504138123320-8-
PC 44:4; PC 24:0_20:4;PC 20:4_24:0ME434505138159787-7-
PC 44:5; PC 24:1_20:4;PC 20:4_24:1ME434506138130873-7893
PC 44:6;PC 44:6ME434507138202108-7891
PC 44:7;PC 44:7ME434508138268288-6889
PC 44:8;PC 44:8ME434509138231822-5887
PC 44:9;PC 44:9ME434510--5885
PC 45:5;PC 45:5ME434511--7907
PC 45:7;PC 45:7ME434512--6903
PC 46:1;PC 46:1ME43451324779122-9929
PC 46:10;PC 46:10ME434514138227054-5911
PC 46:12;PC 46:12ME434515--5907
PC 46:2;PC 46:2ME43451624779154-9927
PC 46:4;PC 46:4ME434517138176601-8923
PC 46:5; PC 26:1_20:4;PC 20:4_26:1ME434518138227224-7921
PC 46:7;PC 46:7ME434519--7917
PC 48:1;PC 48:1ME434520--10957
PC 52:4;PC 52:4ME434521138284547-9-
PC 52:5;PC 52:5ME434522138175439-91005
PC 52:6;PC 52:6ME434523138301338-8-
PC 54:5;PC 54:5ME434524--9-
PC 54:7;PC 54:7ME434525--81029
PC 56:10;PC 56:10*ME434526--81051
PC 56:4;PC 56:4ME434527--101063
PC 56:6;PC 56:6ME434528--91059
PC 56:7;PC 56:7*ME434529--91057
PC 56:8; PC 28:4_28:4;PC 28:4/28:4*ME434530134812277-91055
PC 58:10;PC 58:10*ME434531--91079
PC 58:11;PC 58:11*ME434532--81077
PC 58:12;PC 58:12*ME434533--81075
PC 58:6;PC 58:6ME434534--101087
PC 60:12;PC 60:12*ME434535--81103
PC 60:6;PC 60:6ME434536--101115
PC 60:7;PC 60:7*ME434537--101113
PC 86:13;PC 86:13*ME434538--51465
PC O-25:6; or PC P-25:5;-ME434539138260581-1610
PC O-29:6; or PC P-29:5PC P-29:5 or PC O-29:6ME434540138142575-2-
PC O-30:0;PC O-30:0ME434541--5693
PC O-30:7; or PC P-30:6;-ME434542--3678
PC O-31:6; or PC P-31:5PC P-31:5 or PC O-31:6ME434543--3-
PC O-32:0PC O-32:0ME434544138207889-6721
PC O-32:0;PC O-32:0ME434545--6721
PC O-32:1; or PC P-32:0;PC P-32:0 or PC O-32:1ME434546--5719
PC O-34:0PC O-34:0ME43454714389470-6749
PC O-34:0;PC O-34:0ME43454824779361-6749
PC O-34:1; or PC P-34:0;PC P34:0 or PC O34:1ME434549--6747
PC O-34:2; or PC P-34:1;PC P-34:1 or PC O-34:2ME434550--5745
PC O-35:7; or PC P-35:6PC P-35:6 or PC O-35:7ME434551--7749
PC O-36:0;PC O-36:0ME43455224779351-7777
PC O-36:1; or PC P-36:0PC P-36:0 or PC O-36:1ME43455352923988-7775
PC O-36:2; or PC P-36:1PC P-36:1 or PC O-36:2ME43455453480739-6773
PC O-36:3; or PC P-36:2PC P-36:2 or PC O-36:3ME43455553481721-6771
PC O-36:4; or PC P-36:3PC P36:3 or PC O36:4ME43455670698779-5-
PC O-36:6; or PC P-36:5;PC P-36:5 or PC O-36:6ME434557--6765
PC O-38:0;PC O-38:0ME43455852923828-8805
PC O-38:1; or PC P-38:0PC P-38:0 or PC O-38:1ME43455952923998-7803
PC O-38:1; or PC P-38:0; BPC P-38:0 or PC O-38:1ME43456052925120-8803
PC O-38:2; or PC P-38:1PC P-38:1 or PC O-38:2ME43456152924000-7801
PC O-38:3; or PC P-38:2PC P-38:2 or PC O-38:3ME43456252924002-6799
PC O-38:4; or PC P-38:3PC P-38:3 or PC O-38:4ME43456353480757-6-
PC O-38:5; or PC P-38:4PC P-38:4 or PC O-38:5ME43456452924008-5-
PC O-39:2; or PC P-39:1PC P-39:1 or PC O-39:2ME43456552924012-7815
PC O-39:7; or PC P-39:6PC P-39:6 or PC O-39:7ME434566--7805
PC O-40:4; or PC P-40:3PC P-40:3 or PC O-40:4ME43456770698783-6825
PC O-40:5; or PC P-40:4PC P-40:4 or PC O-40:5ME43456870698777-6-
PC O-40:7; or PC P-40:6PC P-40:6 or PC O-40:7ME43456942607430-5819
PC O-42:2; or PC P-42:1PC P-42:1 or PC O-42:2ME43457053480783-8857
PC O-42:4; or PC P-42:3 isomer APC P-42:3 or PC O-42:4ME43457152923862-7853
PC O-42:4; or PC P-42:3 isomer BPC P-42:3 or PC O-42:4ME43457252923862-7853
PC O-44:5; or PC P-44:4PC P-44:4 or PC O-44:5ME43457353481767-7879
PC O-55:6; or PC P-55:5-ME434574--91031
PC P-32:0; or PC O-32:1;PC P-32:0 or PC O-32:1ME434575--6719
PC P-34:2; or PC O-34:3;PC P-34:2 or PC O-34:3ME43457624779293-5-
PC P-36:5; or PC O-36:6;PC P-36:5 or PC O-36:6ME43457752923910-5765
PC P-38:4; or PC O-38:5;PC P-38:4 or PC O-38:5ME43457853480759-6795
PC P-38:5; or PC O-38:6;PC P-38:5 or PC O-38:6ME43457953480695-5793
PC P-38:6; or PC O-38:7;PC P-38:6 or PC O-38:7ME434580--5791
PC P-40:7; or PC O-40:8;PC P-40:7 or PC O-40:8ME43458153480839-5817
PE 21:1;PE 21:1ME434582138277954-2-
PE 23:1;PE 23:1ME434583138127586-3564
PE 34:2; PE 16:1_18:1;PE 16:1_18:1ME434584138249942-5-
PE 35:1; PE 17:0_18:1;PE 17:0_18:1ME43458511636258-6733
PE 36:0; APE 36:0ME434586102547-7749
PE 36:2; PE 18:1_18:1;PE 18:1/18:1ME43458752924279-6-
PE 36:3; PE 16:0_20:3;PE 16:0_20:3ME434588138179768-5743
PE 36:3; PE 18:1_18:2;PE 18:1_18:2ME43458925245362-5-
PE 36:4;PE 36:4ME434590138221545-5-
PE 36:5;PE 36:5ME434591138193610-5739
PE 36:5; PE 16:1_20:4;PE 16:1_20:4ME43459252924915-5-
PE 37:1;PE 37:1ME434593138198220-7761
PE 37:1; PE 19:0_18:1;PE 18:1_19:0ME434594138176046-7761
PE 37:4; PE 17:0_20:4; APE 17:0_20:4ME434595138136039-5755
PE 38:1; PE 18:0_20:1;PE 18:0_20:1ME4345969546841-7-
PE 38:2; PE 18:1_20:1;PE 18:1_20:1ME4345979546826-6773
PE 38:3; PE 18:0_20:3;PE 18:0_20:3ME434598138214139-6771
PE 38:4; PE 18:1_20:3;PE 18:1_20:3ME434599138151921-5769
PE 38:5; PE 16:0_22:5;PE 16:0_22:5ME434600138131789-5767
PE 38:6;PE 38:6ME4346016426738-5-
PE 38:7;PE 38:7ME434602138285296-5763
PE 38:7; PE 16:1_22:6;PE 16:1_22:6ME434603138237126-4763
PE 40:1; PE 22:0_18:1;PE 18:1_22:0ME4346049546852-8803
PE 40:2; PE 18:1_22:1;PE 18:1_22:1ME43460552924753-7801
PE 40:3;PE 40:3ME43460652924592-7799
PE 40:4; PE 18:0_22:4;PE 18:0_22:4ME43460752924814-6797
PE 40:5; PE 18:0-22:5;PE 18:0_22:5ME43460853479612-6795
PE 40:6;PE 40:6ME43460952924595-5793
PE 40:6; PE 16:1_24:5;PE(16:1_24:5)*ME434610--6814.54602_792.56482
PE 40:7;PE 40:7ME43461152924596-5791
PE 41:6;PE 41:6ME43461252924849-6807
PE 41:7;PE 41:7ME43461352924850-5805
PE 42:10;PE 42:10ME434614138203689-4813
PE 42:4; PE 18:0_24:4;PE 18:0_24:4ME434615--7825
PE 42:5;PE 42:5ME434616138249995-6823
PE 42:7;PE 42:7ME434617138299684-6819
PE 42:9;PE 42:9ME43461852924854-5815
PE 44:11;PE 44:11ME434619--4-
PE 44:12;PE 44:12ME4346209546797-4-
PE 46:10;PE 46:10ME434621--5869
PE 46:12;PE 46:12*ME434622--5865
PE O-22:4; or PE P-22:3PE P22:3 or PE O22:4ME434623--2-
PE O-32:0;PE O-32:0ME43462452924996-6679
PE O-33:1; or PE P-33:0PE P-33:0 or PE O-33:1ME43462552925096-5691
PE O-34:0;PE O-34:0ME434626138215780-7707
PE O-34:1; or PE P-34:0;PE P-34:0 or PE O-34:1ME434627138144759-6705
PE O-35:2; or PE P-35:1PE P-35:1 or PE O-35:2ME43462852925100-5717
PE O-36:0;PE O-36:0ME434629138249104-7735
PE O-36:1; or PE P-36:0;PE P-36:0 or PE O-36:1ME434630138134166-7733
PE O-36:4; or PE P-36:3;PE P-36:3 or PE O-36:4ME434631138310935-7727
PE O-37:1; or PE P-37:0; APE P-37:0 or PE O-37:1ME43463252925103-6747
PE O-37:2; or PE P-37:1;PE P-37:1 or PE O-37:2ME43463352925084-6745
PE O-38:0;PE O-38:0ME434634138222477-8763
PE O-38:5; or PE P-38:4PE P-38:4 or PE O-38:5ME43463552925111-5753
PE O-38:6; or PE P-38:5;PE P-38:5 or PE O-38:6ME43463652925089-5751
PE O-38:6; PE O-18:2_20:4; or PE P-38:5; PE P-18:1...PE P-18:1/20:4 or PE O-18:2/20:4ME434637138244210-5749
PE O-39:1; or PE P-39:0;PE P-39:0 or PE O-39:1ME43463852925112-7775
PE O-39:5; or PE P-39:4;PE P-39:4 or PE O-39:5ME434639--5767
PE O-40:10; or PE P-40:9;PE P-40:9 or PE O-40:10ME434640138123376-5771
PE O-40:4; or PE P-40:3;PE P-40:3 or PE O-40:4ME434641138117444-7783
PE O-40:5; or PE P-40:4PE P-40:4 or PE O-40:5ME434642138199093-6781
PE O-40:5; PE O-18:1_22:4; or PE P-40:4; PE P-18:0...PE P-18:0/22:4 or PE O-18:1/22:4ME434643138123291-6781
PE O-40:6; or PE O-40:7;PE P-40:5 or PE O-40:6ME434644138165425-7779
PE O-40:8; or PE P-40:7;PE P-40:7 or PE O-40:8ME434645138178502-6775
PE O-40:9; or PE P-40:8;PE P-40:8 or PE O-40:9ME434646138124036-5773
PE O-42:10; or PE P-42:9;PE P-42:9 or PE O-42:10ME434647138117332-6799
PE O-42:11; or PE P-42:10;PE P-42:10 or PE O-42:11ME434648138193930-5797
PE O-42:9; or PE P-42:8;PE P-42:8 or PE O-42:9ME434649--6801
PE P-32:1; PE P-16:0_16:1;PE P-16:0/16:1 or PE O-16:1/16:1ME434650138207183-5675
PE P-34:1; PE P-18:1_16:0; or PE O-34:2; PE O-18:2...PE O-18:2/16:0ME434651138147152-6703
PE P-36:1; or PE O-36:2;PE P-36:1 or PE O-36:2ME43465252924968-7731
PE P-36:2; or PE O-36:3; APE P-36:2 or PE O-36:3ME43465353480897-6729
PE P-36:3; PE P-18:2_18:1; or PE O-36:4; PE O-18:3...PE O-18:3/18:1ME434654138286435-6727
PE P-36:4; or PE O-36:5;PE P-36:4 or PE O-36:5ME43465553480870-5-
PE P-37:1; or PE O-37:2;PE P-37:1 or PE O-37:2ME43465652925104-7745
PE P-38:0; or PE O-38:1;PE P-38:0 or PE O-38:1ME434657138244292-7761
PE P-38:2; PE P-18:1_20:1; or PE O-38:3; PE O-18:2...PE O-18:2/20:1ME434658138277495-7757
PE P-38:3; PE P-18:1_20:2; or PE O-38:4; PE O-18:2...PE O-18:2/20:2ME434659138146369-6755
PE P-38:4; or PE O-38:5;PE P-38:4 or PE O-38:5ME43466053480855-6753
PE P-38:4; PE P-18:1_20:3; or PE O-38:5; PE O-18:2...PE O-18:2/20:3ME434661138192347-6753
PE P-38:5; or PE O-38:6PE P-38:5 or PE O-38:6ME434662138194244-6751
PE P-39:1; or PE O-39:2; isomer APE P-39:1 or PE O-39:2ME434663138116190-8773
PE P-39:2; or PE O-39:3;PE P-39:2 or PE O-39:3ME434664138285577-7771
PE P-40:0; PE P-18:0_22:0; or PE O-40:1; PE O-18:1...PE O-18:1/22:0ME434665138214166-8-
PE P-40:1; or PE O-40:2;PE P-40:1 or PE O-40:2ME434666138167400-8787
PE P-40:2; PE P-18:1_22:1; or PE O-40:3; PE O-18:2...PE O-18:2/22:1ME434667138175506-7785
PE P-40:3; or PE O-40:4;PE P-40:3 or PE O-40:4ME434668138239066-7783
PE P-40:4; PE P-16:0_24:4; or PE O-40:5; PE O-16:1...PE O-16:1/24:4ME434669138215169-6781
PE P-40:4; PE P-20:0_20:4; or PE O-40:5; PE O-20:1...PE O-20:1/20:4ME43467052925118-7781
PE P-40:5; PE P-18:1_22:4; or PE O-40:6; PE O-18:2...PE O-18:2/22:4ME434671138202739-6779
PE P-40:6; PE P-18:1_22:5; or PE O-40:7; PE O-18:2...PE O-18:2/22:5ME434672138312513-5777
PE P-42:2; PE P-18:1_24:1; or PE O-42:3; PE O-18:2...PE O-18:2/24:1ME434673138164549-8813
PE P-42:5; PE P-18:0_24:5; or PE O-42:6; PE O-18:1...PE O-18:1/24:5ME434674--7807
PG 32:0; PG 16:0_16:0;PG 16:0/16:0ME434675--5741
PG 34:1; PG 16:0_18:1; BPG 16:0_18:1ME434676--5767
PG 36:4; PG 18:2_18:2;PG 18:2/18:2ME43467749792064-5789
PG 38:5;PG 38:5ME434678--5815
PG 38:6;PG 38:6ME434679--4813
PI 34:0;PI 34:0ME434680138200239-5857
PI 36:1;PI 36:1ME434681--5883
PI 36:2; API 36:2ME434682138257864-5881
PI 36:4;PI 36:4ME434683--4877
PI 36:5;PI 36:5ME434684138207622-4875
PI 37:4;PI 37:4ME434685--5891
PI 38:1;PI 38:1ME434686138261916-6911
PI 38:3;PI 38:3ME434687138308912-5907
PI 38:4;PI 38:4ME434688138138933-5-
PI 38:6;PI 38:6ME434689--4-
PI 40:4;PI 40:4ME434690138174169-5-
PI 40:6; API 40:6ME434691138192788-5-
PI 40:7;PI 40:7ME434692--4927
PI 40:8;PI 40:8ME434693--4925
PI-Cer d38:4+1O;-ME434694--5847
PI-Cer d40:0+1O;IPC 40:0;O2;OME434695--6883
PS 34:2;PS 34:2ME434696138214181-4761
PS 36:2; PS 18:1_18:1; BPS 18:1/18:1ME434697--5789
PS 36:3;PS 36:3ME434698138152459-5787
PS 38:1; PS 18:0_20:1; BPS 18:0_20:1ME434699--6819
PS 38:2;PS 38:2ME434700138193378-6817
PS 38:3;PS 38:3ME434701138163991-5815
PS 38:4; PS 19:2_19:2;PS 19:2/19:2ME434702--5813
PS 38:5; APS 38:5ME43470325244543-4811
PS 38:5; BPS 38:5ME434704138160864-5-
PS 38:6;PS 38:6ME43470571585836-4831
PS 39:6;PS 39:6ME434706138296939-5823
PS 40:1;PS 40:1ME43470725244006-7847
PS 40:2;PS 40:2ME434708138154510-6845
PS 40:4; PS 18:0_22:4;PS 18:0_22:4ME434709138202734-5841
PS 40:6; PS 20:3_20:3;PS 20:3/20:3ME434710--5-
PS 40:7; APS 40:7ME434711138206714-5835
PS 40:7; BPS 40:7ME434712138278057-4857
PS 41:1;PS 41:1ME434713138137463-7861
PS 42:1;PS 42:1ME434714138123624-8875
PS 42:10;PS 42:10ME434716--4857
PS 42:1; PS 24:0_18:1; APS 18:1_24:0ME43471525245395-8-
PS 42:2;PS 42:2ME434717138186769-7873
PS 42:4;PS 42:4ME434718138171507-6869
PS 42:5;PS 42:5ME434719138260838-6867
PS 42:6;PS 42:6ME434720138310066-5865
PS 44:10; PS 22:4_22:6; BPS 22:4_22:6ME434721--4885
PS 44:12;PS 44:12ME434722--4903
PS 44:12; PS 22:6_22:6; BPS 22:6/22:6ME434723--4881
PS 44:9;PS 44:9ME434724138306397-5887
SHexCer d34:1; SHexCer d18:1/16:0;SHexCer 18:1;O2/16:0ME434725138135555-4781
SHexCer d36:1+O; SHexCer d18:1/18:0+O;-ME434726--5825
SHexCer d36:2;SHexCer 36:2;O2ME434727138288726-4807
SHexCer d38:1+O; SHexCer d18:1/20:0+O;-ME434728--5853
SHexCer d40:1; SHexCer d18:1/22:0;SHexCer 18:1;O2/22:0ME434729138268836-6865
SHexCer d40:2+O; SHexCer d18:1/22:1+O;-ME434731--6879
SHexCer d40:2; SHexCer d18:1/22:1;-ME434730138237030-5863
SHexCer d41:1; SHexCer d18:1/23:0;-ME434732138120276-6879
SHexCer d41:2; SHexCer d18:1/23:1;-ME434733138195623-6877
SHexCer d42:0; SHexCer d18:0/24:0;-ME43473421888963-7895
SHexCer d42:1+O; SHexCer d18:1/24:0+O;-ME434737--6909
SHexCer d42:1; SHexCer d18:0/24:1;-ME434735138268882-6893
SHexCer d42:1; SHexCer d18:1/24:0;SHexCer 18:1;O2/24:0ME43473618943326-7893
SHexCer d42:2+O; SHexCer d18:1/24:1+O;-ME434739--6907
SHexCer d42:2; SHexCer d18:1/24:1;SHexCer 18:1;O2/24:1ME434738138249200-6891
SHexCer d42:3; SHexCer d18:1/24:2;-ME434740138273161-5889
SHexCer d43:2; SHexCer d18:1/25:1;-ME434741138299620-6905
SHexCer d44:2; SHexCer d18:1/26:1;-ME434742138147001-6919
SM d32:1;SM 32:1;O2ME434743--4-
SM d33:1;SM 33:1;O2ME434744--4-
SM d34:0;SM 34:0;O2ME434745--5-
SM d34:1; SM d18:1/16:0;SM 18:1;O2/16:0ME43474612049462-5-
SM d34:2; SM d18:2/16:0;SM 18:2;O2/16:0ME434747138257782-4-
SM d36:0; SM d15:0_21:0;SM 15:0;O2/21:0ME434748--6-
SM d36:1;SM 36:1;O2ME434749--6732
SM d36:1; SM d18:1/18:0;SM 18:1;O2/18:0ME4347505353953-5-
SM d36:2; SM d18:2_18:0;SM 18:2;O2/18:0ME434751--5730
SM d36:3; SM d25:3/11:0;SM 25:3;O2/11:0*ME434752--4728
SM d37:1; SM d8:1_29:0;SM 8:1;O2/29:0ME434753--6746
SM d38:0;SM 38:0;O2ME434754--6762
SM d38:1; SM d20:1_18:0;SM 20:1;O2/18:0ME434755--6-
SM d38:2; SM d18:2/20:0;SM 18:2;O2/20:0ME434756138252563-5758
SM d39:1;SM 39:1;O2ME434757--6774
SM d40:0; SM d8:0/32:0;SM 8:0;O2/32:0ME434758--7790
SM d40:1; SM d18:1_22:0;SM 18:1;O2/22:0ME434759--7788
SM d40:2;SM 40:2;O2ME434760--6-
SM d41:0; SM d18:0/23:0;SM 18:0;O2/23:0ME43476176043687-7804
SM d41:1; SM d18:1/23:0;SM 18:1;O2/23:0ME434762138266111-7-
SM d41:2; ASM 41:2;O2ME434763--7800
SM d42:0;SM 42:0;O2ME43476474978598-8818
SM d42:1; ASM 42:1;O2ME434765--7838
SM d42:1; BSM 42:1;O2ME43476613832235-7816
SM d42:2;SM 42:2;O2ME434767--7836
SM d42:2; BSM 42:2;O2ME434768138220591-7814
SM d42:4;SM 42:4;O2ME434769--6832
SM d43:2;SM 43:2;O2ME434770138147692-7828
SM d44:2; SM d24:2/20:0;SM 24:2;O2/20:0*ME434771138164278-7842
SM d48:7;SM 48:7;O2*ME434772--9882.7465_887.7017
SM t34:1;SM 34:1;O3ME434773--5-
SM t36:2;SM 36:2;O3ME434774--5746
SM t38:0;SM 38:0;O3ME434775--6778
SM t40:0;SM 40:0;O3ME434776--6806
SM t40:4;SM 40:4;O3ME434777--6798
SM t42:0;SM 42:0;O3ME434778--7834
SM t42:1;SM 42:1;O3ME434779--6832
Sphinganine 18:0;SphinganineME4347803126-1302
Sphinganine 20:0;-ME43478114048931-2330
Sphinganine 24:0;-ME434782--4386
Sphinganine 25:0;-ME434783--4400
Sphingosine 18:1;SphingosineME4347845353955-1300
Sphingosine 20:1;C20 SphingosineME4347859862210-2328
TAG 26:0; TAG 8:0_8:0_10:0;TG 8:0_8:0_10:0ME43478610278570-5-
TAG 32:0; TAG 8:0_12:0_12:0;TG 8:0_12:0_12:0ME43478715904520-6-
TAG 36:0;TG 36:0ME434788101095269-8-
TAG 40:0;TG 40:0ME434789131778438-9-
TAG 40:1;TG 40:1ME43479056936435-8711
TAG 42:0;TG 42:0ME43479192036844-9-
TAG 42:1;TG 42:1ME43479256936439-9-
TAG 44:0;TG 44:0ME434793138315726-10-
TAG 44:1;TG 44:1ME43479456937112-10-
TAG 44:2;TG 44:2ME43479556937008-9-
TAG 45:0; TAG 14:0_15:0_16:0;TG 14:0_15:0_16:0ME434796138252395-10788
TAG 46:1;TG 46:1ME43479756937116-10-
TAG 46:2;TG 46:2ME43479856937117-10-
TAG 47:0;TG 47:0ME43479991866325-11-
TAG 48:0; TAG 14:0_16:0_18:0;TG 14:0_16:0_18:0ME43480014122775-11-
TAG 48:1; TAG 14:0_16:0_18:1;TG 14:0_16:0_18:1ME43480156938015-10-
TAG 48:2; TAG 14:0_16:0_18:2;TG 14:0_16:0_18:2ME43480256938016-10-
TAG 48:3;TG 48:3ME43480356937252-10-
TAG 49:1;TG 49:1ME43480456938799-11-
TAG 49:2; TAG 15:0_16:0_18:2;TG 15:0_16:0_18:2ME43480556938800-10-
TAG 49:3; TAG 15:0_16:1_18:2;TG 15:0_16:1_18:2ME43480656938822-10-
TAG 50:0;TG 50:0ME43480791865524-11-
TAG 50:1; TAG 16:0_16:0_18:1;TG 16:0_16:0_18:1ME4348085283475-11-
TAG 50:2; TAG 16:0_16:1_18:1;TG 16:0_16:1_18:1ME43480925241106-10-
TAG 50:3;TG 50:3ME434810131750350-10852
TAG 50:5; TAG 14:0_16:1_20:4;TG 14:0_16:1_20:4ME434811131753468-9848
TAG 51:0; TAG 16:0_17:0_18:0;TG 16:0_17:0_18:0ME434812138309104-11-
TAG 51:1; TAG 16:0_17:0_18:1;TG 16:0_17:0_18:1ME4348139544019-11-
TAG 51:2; TAG 16:0_17:1_18:1;TG 16:0_17:1_18:1ME4348149544029-11-
TAG 51:3;TG 51:3ME434815131750646-10-
TAG 51:4; TAG 15:0_18:2_18:2;TG 15:0_18:2_18:2ME43481653481043-10-
TAG 52:1; TAG 16:0_18:0_18:1;TG 16:0_18:0_18:1ME4348175365005-11-
TAG 52:2; TAG 16:0_18:1_18:1;TG 16:0_18:1_18:1ME43481825240174-11-
TAG 52:3; TAG 16:0_18:1_18:2;TG 16:0_18:1_18:2ME4348199544086-10-
TAG 52:4; TAG 16:0_16:0_20:4;TG 16:0_16:0_20:4ME434820131755009-10-
TAG 52:4; TAG 16:0_18:2_18:2;TG 16:0_18:2_18:2ME4348219544106-10-
TAG 52:5;TG 52:5ME434822131755155-10-
TAG 52:5; TAG 16:0_18:2_18:3;TG 16:0_18:2_18:3ME4348239544132-10-
TAG 53:1;TG 53:1ME4348249544084-11-
TAG 53:2; TAG 17:0_18:1_18:1;TG 17:0_18:1_18:1ME434825101709783-11-
TAG 54:0; TAG 16:0_18:0_20:0;TG 16:0_18:0_20:0ME434826138143294-12-
TAG 54:1; TAG 16:0_18:0_20:1;TG 16:0_18:0_20:1ME434827138120490-12-
TAG 54:2; TAG 18:0_18:1_18:1;TG 18:0_18:1_18:1ME4348289544182-11-
TAG 54:3; TAG 18:0_18:1_18:2;TG 18:0_18:1_18:2ME43482925241521-11-
TAG 54:4; TAG 16:0_18:0_20:4;TG 16:0_18:0_20:4ME434830131755028-11-
TAG 54:4; TAG 18:1_18:1_18:2;TG 18:1_18:1_18:2ME4348319544252-11-
TAG 54:5; TAG 16:0_18:1_20:4;TG 16:0_18:1_20:4ME434832131755202-10-
TAG 54:5; TAG 18:1_18:2_18:2;TG 18:1_18:2_18:2ME4348339544291-10-
TAG 54:6; TAG 16:0_16:0_22:6;TG 16:0_16:0_22:6ME43483492036136-10-
TAG 54:6; TAG 16:0_18:2_20:4;TG 16:0_18:2_20:4ME434835131755332-10-
TAG 54:6; TAG 18:1_18:2_18:3;TG 18:1_18:2_18:3ME43483625241101-10-
TAG 54:7; TAG 16:0_18:2_20:5;TG 16:0_18:2_20:5ME4348379544414-10-
TAG 56:0;TG 56:0ME434838138265992-12-
TAG 56:1; TAG 16:0_22:0_18:1;TG 16:0_18:1_22:0ME434839101080197-12-
TAG 56:2; TAG 18:0_18:1_20:1;TG 18:0_18:1_20:1ME4348409544397-12-
TAG 56:4;TG 56:4ME43484125240379-11950
TAG 56:4; TAG 18:0_18:0_20:4;TG 18:0_18:0_20:4ME434842131755799-11-
TAG 56:4; TAG 18:0_18:1_20:3;TG 18:0_18:1_20:3ME434843131755939-11-
TAG 56:5; BTG 56:5ME43484425240380-10927
TAG 56:5; TAG 16:0_18:1_22:4; ATG 16:0_18:1_22:4ME434845131755178-11932
TAG 56:5; TAG 18:0_18:1_20:4;TG 18:0_18:1_20:4ME434846131755973-11-
TAG 56:6; TAG 16:0_18:0_22:6;TG 16:0_18:0_22:6ME434847138157001-11-
TAG 56:6; TAG 16:0_18:1_22:5;TG 16:0_18:1_22:5ME4348489544810-10-
TAG 56:7; ATG 56:7ME434849131760773-10-
TAG 56:7; CTG 56:7ME4348509544695-10923
TAG 56:7; TAG 16:0_18:1_22:6;TG 16:0_18:1_22:6ME4348519544886-10-
TAG 56:8; TAG 16:0_18:2_22:6;TG 16:0_18:2_22:6ME4348529544960-10-
TAG 58:1;TG 58:1ME43485391868804-12-
TAG 58:10; TAG 16:0_20:4_22:6;TG 16:0_20:4_22:6ME434854131755608-10-
TAG 58:2; TAG 22:0_18:1_18:1;TG 18:1_18:1_22:0ME43485591869845-12-
TAG 58:3; TAG 22:0_18:1_18:2;TG 18:1_18:2_22:0ME4348569544930-12-
TAG 58:4;TG 58:4ME4348579544835-11978
TAG 58:6; TAG 18:0_18:0_22:6;TG 18:0_18:0_22:6ME434858102476097-11-
TAG 58:6; TAG 18:1_18:1_22:4;TG 18:1_18:1_22:4ME434859131750574-11-
TAG 58:7; TAG 18:0_18:1_22:6;TG 18:0_18:1_22:6ME4348609545272-11-
TAG 58:8; TAG 18:0_20:4_20:4;TG 18:0_20:4_20:4ME434861131756368-10-
TAG 58:8; TAG 18:1_18:1_22:6;TG 18:1_18:1_22:6ME4348629545350-10-
TAG 58:9; TAG 18:1_18:2_22:6;TG 18:1_18:2_22:6ME4348639545428-10-
TAG 60:10; TAG 16:0_22:4_22:6;TG 16:0_22:4_22:6ME434864138290291-10-
TAG 60:11; TAG 18:1_20:4_22:6;TG 18:1_20:4_22:6ME434865131760972-10-
TAG 60:12; TAG 16:0_22:6_22:6;TG 16:0_22:6_22:6ME43486659878636-9-
TAG 60:2; TAG 24:0_18:1_18:1;TG 18:1_18:1_24:0ME434867131758092-12-
TAG 62:12; TAG 18:0_22:6_22:6;TG 18:0_22:6_22:6ME434868132977472-10-
TAG 62:13; TAG 18:1_22:6_22:6;TG 18:1_22:6_22:6ME4348699546358-9-
TAG O-56:13; TAG O-20:5_18:4_18:4; or TAG P-56:12;...-ME434870131766023-9902


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
Ceramide d32:1;Cer 32:1;O2ME4348715282310-5-
Ceramide d33:1;Cer 33:1;O2ME43487252931112-5-
Ceramide d34:0;Cer 34:0;O2ME4348735283572-6-
Ceramide d34:1;Cer 34:1;O2ME4348745283564-6-
Ceramide d34:2;Cer 34:2;O2ME43487552931118-5-
Ceramide d36:1;Cer 36:1;O2ME4348766442676-6-
Ceramide d38:1;Cer 38:1;O2ME4348775283566-7-
Ceramide d40:0;Cer 40:0;O2ME4348785283575-8683
Ceramide d40:1; BCer 40:1;O2ME4348795283567-7681
Ceramide d40:2;Cer 40:2;O2ME43488052931123-7-
Ceramide d42:1; BCer 42:1;O2ME4348815283571-8-
Ceramide d42:2;Cer 42:2;O2ME4348825283568-8-
CholesterolSulfateCholesterol sulfateME43488365076-3465
FA 10:0; (capric acid)Capric acidME4348842969-1171
FA 11:0;Undecylic acidME4348858180-1185
FA 12:0; (lauric acid)Lauric acidME4348863893-1199
FA 13:0;Tridecylic acidME43488712530-1213
FA 14:1; (physeteric acid)Physeteric acidME4348885312400-1225
FA 15:0;Pentadecylic acidME43488913849-2241
FA 15:0; (pentadecylic acid)Pentadecylic acidME43489013849-2241
FA 15:1;Pentadecenoic acidME4348916365140-1239
FA 16:1; (palmitoleic acid)Palmitoleic acidME434892445638-2253
FA 16:2;Hexadecadienoic acidME4348935312427-1251
FA 16:3;Hexadecatrienoic acidME4348945312428-1249
FA 16:4;Hexadecatetraenoic acidME4348955312433-1247
FA 17:0; (margaric acid)Margaric acidME43489610465-3269
FA 17:1;Heptadecenoic acidME4348975282748-2267
FA 18:0; (stearic acid)Stearic acidME4348985281-3283
FA 18:2;Octadecadienoic acidME4348995280450-2279
FA 18:2; (linoleic acid)Linoleic acidME4349005282796-2-
FA 18:3; (linolenic acid)Octadecatrienoic acidME4349015280934-2277
FA 18:5;Octadecapentaenoic acidME4349025312511-1273
FA 19:0;Nonadecylic acidME43490312591-3297
FA 19:1;Nonadecenoic acidME43490414275216-3295
FA 20:0; (arachidic acid)Arachidic acidME43490510467-4311
FA 20:1; (eicosenoic acid)Eicosenoic acidME4349065282768-3-
FA 20:2;Eicosadienoic acidME4349076439848-3307
FA 20:3; (eicosatrienoic acid)Eicosatrienoic acidME4349085312529-2305
FA 20:3; (homo-gamma-linolenic acid)Dihomo-gamma-linolenic acidME4349095280581-2305
FA 20:4; (arachidonic acid)Arachidonic acidME434910444899-2-
FA 20:5; (eicosapentaenoic acid)Eicosapentaenoic acidME434911446284-1301
FA 21:0;Heneicosylic acidME43491216898-4325
FA 21:1;Heneicosenoic acidME43491387993978-4323
FA 22:0; (behenic acid)Behenic acidME4349148215-4339
FA 22:1; (erucic acid)cis-Erucic acidME4349155281116-4337
FA 22:2; (docosadienoic acid)Docosadienoic acidME4349165282807-3335
FA 22:3;Docosatrienoic acidME43491786289995-3333
FA 22:4;Docosatetraenoic acidME434918101924176-3331
FA 22:5;Docosapentaenoic acidME4349195497182-2329
FA 22:6; (docosahexaenoic acid)Docosahexaenoic acidME434920445580-2-
FA 23:0;Tricosylic acidME43492117085-5353
FA 24:0;Lignoceric acidME43492211197-5-
FA 24:1; (nervonic acid)Nervonic acidME4349235281120-4-
FA 24:2;Tetracosadienoic acidME4349245312566-4363
FA 24:4;Tetracosatetraenoic acidME4349256440264-3359
FA 24:5;Tetracosapentaenoic acidME43492652921801-3357
FA 24:6;Tetracosahexaenoic acidME43492711792612-2355
FA 25:0;Hyenic acidME43492810468-5381
FA 26:0; (cerotic acid)Cerotic acidME43492910469-6395
FA 26:1;Hexacosenoic acidME434930139653024-5393
FA 28:0; (montanic acid)Montanic acidME43493110470-7423
FA 30:8;FA 30:8ME434932--4435
FA 34:9;FA(34:9)*ME434933--5489
FA 36:0;Hexatriacontylic acidME4349345282596-9536
FA 36:4;Hexatriacontatetraenoic acidME43493552921805-7527
FA 38:6;Octatriacontahexaenoic acidME43493652921819-7551
FA 44:10;FA 44:10ME434937--7628
FA 9:0;Pelargonic acidME4349388158-1157
FAHFA 18:0; FAHFA 16:0/2:0;FAHFA 18:0;OME43493996877-1313
FAHFA 18:0; FAHFA 9:0/9:0;FAHFA 18:0;OME434940138195754-1313
FAHFA 20:0; FAHFA 18:0/2:0;FAHFA 20:0;OME43494179834-2341
GlcCer d34:2; GlcCer (d14:1(4E)/20:0(2OH))GlcCer 14:1;O2(4E)/20:0;OME43494270699246-5-
GlcCer d38:1;GlcCer 38:1;O2ME43494320057356-6-
GlcCer d40:1;GlcCer 40:1;O2ME4349446321359-7-
GlcCer d41:1;GlcCer 41:1;O2ME43494552931253-7857
GlcCer d42:2; BGlcCer 42:2;O2ME4349466321360-7-
GM3 d36:1;GM3 36:1;O2ME434947138175074-41180
LPC 18:0; ALPC 18:0ME434948497299-2-
LPE 14:0;LPE 14:0ME43494924802348-1424
LPE 20:4;LPE 20:4ME434950138187816-1500
LPE 22:4;LPE 22:4ME434951138255864-2528
LPE 22:5;LPE 22:5ME434952138230638-1526
LPG 18:1;LPG 18:1ME43495325244390-1509
LPG 22:6;LPG 22:6ME434954138209914-1555
LPI 16:0;LPI 16:0ME43495574819149-1571
LPI 18:0;LPI 18:0ME43495674819151-1599
LPI 20:4;LPI 20:4ME434957138124432-1619
LPI 22:6;LPI 22:6ME434958138132704-1643
LPS 18:0;LPS 18:0ME43495974819135-1524
LPS 18:1;LPS 18:1ME434960138191247-1522
LPS 22:6;LPS 22:6ME434961138157662-1568
OxPE 38:4+1O; OxPE 18:1_20:3+1O;-ME434962138182665-6783
OxPS 38:5+3O; OxPS 18:0_20:5+3O;-ME434963138243659-5856.5108_856.512
PA 34:1; PA 16:0_18:1;PA 16:0_18:1ME4349645282296-5673
PA 36:4; PA 16:0_20:4;PA 16:0_20:4ME434965138293603-4695
PC 34:1;PC 34:1ME4349665497103-6819
PC 34:2;PC 34:2ME4349675287971-5817
PC 36:2; BPC 36:2ME43496810350317-6845
PC 36:4; APC 36:4ME43496910747814-5841
PC 36:4; BPC 36:4ME43497010747814-5841
PC 38:2; CPC 38:2ME43497124779263-6873
PC 38:3; CPC 38:3ME43497252922741-6-
PC 38:4; CPC 38:4ME43497316219824-6869
PC 38:6;PC 38:6ME43497452923295-5865
PC 40:4; APC 40:4ME43497552923573-6897
PC P-34:0; or PC O-34:1;PC P-34:0 or PC O-34:1ME43497653481719-6805
PC P-34:1; or PC O-34:2; APC P-34:1 or PC O-34:2ME43497753480735-5-
PC P-34:1; or PC O-34:2; BPC P-34:1 or PC O-34:2ME43497853480735-6803
PC P-36:2; or PC O-36:3;PC P-36:2 or PC O-36:3ME43497953480801-6829
PC P-36:3; or PC O-36:4;PC P-36:3 or PC O-36:4ME43498053481701-5827
PC P-36:4; or PC O-36:5;PC P-36:4 or PC O-36:5ME43498124779388-5-
PE 32:0; PE 16:0_16:0;PE 16:0/16:0ME43498265109-6691
PE 32:1; PE 16:0_16:1;PE 16:0_16:1ME43498371627298-5688
PE 34:1; PE 16:0_18:1;PE 16:0_18:1ME4349845283496-6717
PE 34:2; BPE 34:2ME43498546891780-5715
PE 34:3;PE 34:3ME43498610556777-5712
PE 35:2; PE 17:1_18:1;PE 17:1_18:1ME434987138211775-5729
PE 36:0; BPE 36:0ME434988102547-6747
PE 36:1; PE 18:0_18:1; APE 18:0_18:1ME4349899546734-6745
PE 36:1; PE 18:0_18:1; BPE 18:0_18:1ME43499025244969-6745
PE 36:2; PE 18:1_18:1;PE 18:1/18:1ME4349916437392-6743
PE 36:4; PE 18:1_18:3;PE 18:1_18:3ME43499225245911-5739
PE 36:6; PE 14:0_22:6;PE 14:0_22:6ME434993134779452-4734
PE 37:2; PE 18:1_19:1;PE 18:1_19:1ME434994138284978-6757
PE 37:5; PE 17:1_20:4; BPE 17:1_20:4ME434995138155745-5751
PE 38:0; PE 18:0_20:0;PE 18:0_20:0ME4349969546833-8775
PE 38:1; PE 18:0_20:1;PE 18:0_20:1ME4349979546842-7773
PE 38:2; PE 18:0_20:2;PE 18:0_20:2ME4349989546828-7771
PE 38:2; PE 18:1_20:1;PE 18:1_20:1ME4349999546827-6771
PE 38:3; PE 18:1_20:2; or PE 20:1_18:2;PE 18:1_20:2ME435000138136467-6769
PE 38:4; PE 16:0_22:4;PE 16:0_22:4ME435001138175392-6767
PE 38:4; PE 18:0_20:4;PE 18:0_20:4ME4350025289133-6767
PE 38:5; PE 18:1_20:4;PE 18:1_20:4ME435003138318539-5765
PE 38:6; PE 18:2_20:4;PE 18:2_20:4ME435004138278823-5763
PE 39:4; PE 19:0_20:4;PE 19:0_20:4ME435005138226315-6781
PE 39:6; PE 17:0_22:6;PE 17:0_22:6ME435006134777294-5777
PE 40:1; PE 18:0_22:1;PE 18:0_22:1ME435007138197963-8801
PE 40:2; PE 18:1_22:1;PE 18:1_22:1ME4350089546845-7799
PE 40:3; PE 20:1_20:2; or PE 18:1_22:2;PE 20:1_20:2ME435009138146347-6797
PE 40:4; PE 18:0_22:4;PE 18:0_22:4ME435010138267167-6795
PE 40:4; PE 20:0_20:4;PE 20:0_20:4ME435011138210698-6795
PE 40:5; PE 18:0_22:5;PE 18:0_22:5ME435012138198992-6793
PE 40:5; PE 20:1_20:4;PE 20:1_20:4ME435013138147823-6793
PE 40:6; PE 18:0_22:6;PE 18:0_22:6ME4350146426737-6791
PE 40:7; PE 18:1_22:6;PE 18:1_22:6ME435015138191210-5789
PE 41:1; PE 23:0_18:1;PE 18:1_23:0ME435016138230861-8815
PE 42:1; PE 24:0_18:1;PE 18:1_24:0ME435017138174323-8829
PE 42:2; PE 18:1_24:1;PE 18:1_24:1ME435018138180410-8827
PE 42:6; PE 20:0_22:6;PE 20:0_22:6ME435019134775902-6819
PE 42:8; PE 20:4_22:4;PE 20:4_22:4ME435020138299549-5815
PE 44:10; PE 22:4_22:6;PE 22:4_22:6ME435021138145394-5839
PE O-32:1; PE O-16:1_16:0; or PE P-32:0; PE P-16:0...PE P-16:0/16:0 or PE O-16:1/16:0ME435022138315128-6675
PE O-32:2; PE O-18:2_14:0; or PE P-32:1; PE P-18:1...PE P-18:1/14:0ME435023138250765-5672
PE O-32:3; PE O-18:3_14:0; or PE P-32:2; PE P-18:2...PE P-18:2/14:0*ME435024138246009-5670
PE O-33:2; PE O-18:2_15:0; or PE P-33:1; PE P-18:1...PE P-18:1/15:0ME435025138298170-6687
PE O-34:0; PE O-18:0_16:0;PE O-18:0_16:0*ME4350269547045-7705
PE O-34:1; PE O-16:0_18:1;PE O-16:0/18:1ME435027138185761-6703
PE O-34:1; PE O-18:1_16:0; or PE P-34:0; PE P-18:0...PE P-18:0/16:0ME435028138194160-7703
PE O-34:3; PE O-18:2_16:1; or PE P-34:2; PE P-18:1...PE P-18:1/16:1 or PE O-18:2/16:1ME435029138237658-5699
PE O-35:2; PE O-17:1_18:1; or PE P-35:1; PE P-17:0...PE P-17:0/18:1 or PE O-17:1/18:1ME43503052925076-6715
PE O-35:3; or PE P-35:2;PE P-35:2 or PE O-35:3ME43503152925077-6713
PE O-36:1; PE O-16:1_20:0; or PE P-36:0; PE P-16:0...PE P-16:0/20:0ME435032138269528-7731
PE O-36:1; PE O-18:0_18:1;PE O-18:0/18:1ME435033138134166-7731
PE O-36:2; PE O-18:1_18:1; or PE P-36:1; PE P-18:0...PE P-18:0/18:1 or PE O-18:1/18:1ME435034138160177-6729
PE O-36:3; PE O-18:2_18:1; or PE P-36:2; PE P-18:1...PE P-18:1/18:1 or PE O-18:2/18:1ME435035138197429-6727
PE O-36:4; PE O-16:0_20:4;PE O-16:0_20:4*ME435036138199201-6725
PE O-36:4; PE O-16:1_20:3; or PE P-36:3; PE P-16:0...PE P-16:0/20:3 or PE O-16:1/20:3ME435037138260431-6725
PE O-36:5; PE O-16:1_20:4; or PE p-36:4; PE p-16:0...PE P-16:0/20:4 or PE O-16:1/20:4ME435038138302490-5723
PE O-36:6; PE O-16:2_20:4; or PE P-36:5; PE P-16:1...PE P-16:1/20:4 or PE O-16:2/20:4ME435039138312296-5720
PE O-36:7; PE O-14:1_22:6; or PE P-36:6; PE P-14:0...PE P-14:0/22:6ME435040138170400-5718
PE O-37:2; PE O-17:1_20:1; or PE P-37:1; PE P-17:0...PE P-17:0/20:1ME43504152925104-7743
PE O-37:3; PE O-18:2_19:1; or PE P-37:2; PE P-18:1...PE P-18:1/19:1ME435042138242345-6741
PE O-37:5; PE O-17:1_20:4; or PE P-37:4; PE P-17:0...PE P-17:0_20:4*ME435043--6737
PE O-37:7; PE O-15:1_22:6; or PE P-37:6; PE P-15:0...PE P-15:0/22:6ME435044--5732
PE O-38:0; PE O-18:0_20:0;PE O-18:0_20:0*ME4350459547053-8761
PE O-38:1; PE O-18:0_20:1;PE O-18:0_20:1*ME435046138293090-7759
PE O-38:1; PE O-18:1_20:0; or PE P-38:0; PE P-18:0...PE P-18:0/20:0ME435047138244292-8759
PE O-38:2; PE O-18:1_20:1; or PE P-38:1; PE P-18:0...PE P-18:0_20:1*ME435048138243031-7757
PE O-38:3; PE O-18:2_20:1; or PE P-38:2; PE P-18:1...PE P-18:1/20:1 or PE O-18:2/20:1ME435049138277495-7755
PE O-38:4; PE O-16:0_22:4;PE O-16:0/22:4ME435050138223667-6753
PE O-38:4; PE O-18:0_20:4;PE O-18:0_20:4*ME435051138257307-6753
PE O-38:4; PE O-18:1_20:3; or PE P-38:3; PE P-18:0...PE P-18:0_20:3*ME435052138171252-7753
PE O-38:5; PE O-16:1_22:4; or PE P-38:4; PE P-16:0...PE P-16:0/22:4 or PE O-16:1/22:4ME435053138232863-6751
PE O-38:5; PE O-18:1_20:4; or PE P-38:4; PE P-18:0...PE P-18:0/20:4 or PE O-18:1/20:4ME435054138280806-6751
PE O-38:5; PE O-18:2_20:3; or PE P-38:4; PE P-18:1...PE P-18:1/20:3 or PE O-18:2/20:3ME435055138192347-6751
PE O-38:6; PE O-16:1_22:5; or PE P-38:5; PE P-16:0...PE P-16:0/22:5 or PE O-16:1/22:5ME435056138139948-6749
PE O-38:6; PE O-18:2_20:4; or PE P-38:5; PE P-18:1...PE P-18:1/20:4 or PE O-18:2/20:4ME435057138243517-5749
PE O-38:7; PE O-16:1_22:6; or PE P-38:6; PE P-16:0...PE P-16:0/22:6 or PE O-16:1/22:6ME435058138193153-5747
PE O-38:7; PE O-18:3_20:4; or PE P-38:6; PE P-18:2...PE P-18:2/20:4 or PE O-18:3/20:4ME435059138244210-5747
PE O-38:8; PE O-16:2_22:6; or PE P-38:7; PE P-16:1...PE P-16:1/22:6ME435060138214757-5744
PE O-39:5; PE O-17:1_22:4; or PE P-39:4; PE P-17:0...PE P-17:0/22:4 or PE O-17:1/22:4ME435061--6765
PE O-39:5; PE O-19:1_20:4; or PE P-39:4; PE P-19:0...PE P-19:0_20:4*ME435062--6765
PE O-39:6; PE O-17:0_22:6;PE O-17:0_22:6*ME435063--6763
PE O-39:7; PE O-17:1_22:6; PE P-39:6; PE P-17:0_22...PE P-17:0/22:6ME435064--6761
PE O-40:1; PE O-18:0_22:1;PE O-18:0_22:1*ME435065138295698-8787
PE O-40:1; PE O-18:1_22:0; or PE P-40:0; PE P-18:0...PE P-18:0/22:0ME435066138214166-8787
PE O-40:2; PE O-18:1_22:1; or PE P-40:1; PE P-18:0...PE P-18:0/22:1ME435067138167400-8785
PE O-40:3; PE O-18:2_22:1; or PE P-40:2; PE P-18:1...PE P-18:1/22:1ME435068138175506-7783
PE O-40:4; PE O-18:0_22:4;PE O-18:0/22:4ME435069138285161-7781
PE O-40:4; PE O-18:1_22:3; or PE P-40:3; PE P-18:0...PE P-18:0/22:3 or PE O-18:1/22:3ME435070138239066-7781
PE O-40:5; PE O-16:1_24:4; or PE P-40:4; PE P-16:0...PE P-16:0/24:4ME435071138215169-6779
PE O-40:6; PE O-18:2_22:4; or PE P-40:5; PE P-18:1...PE P-18:1/22:4 or PE O-18:2/22:4ME435072138202739-6777
PE O-40:7; PE O-18:2_22:5; or PE P-40:6; PE P-18:1...PE P-18:1/22:5 or PE O-18:2/22:5ME435073138312513-5775
PE O-40:8; PE O-18:2_22:6; or PE P-40:7; PE P-18:1...PE P-18:1/22:6 or PE O-18:2/22:6ME435074138283942-5773
PE O-40:9; PE O-18:3_22:6; or PE P-40:8; PE P-18:2...PE P-18:2/22:6ME435075138188115-5771
PE O-41:2; PE O-21:1_20:1; or PE P-41:1; PE P-21:0...PE P-21:0_20:1*ME435076--7798.6462_858.6674
PE O-42:2; PE O-18:1_24:1; or PE P-42:1; PE P-18:0...PE P-18:0/24:1ME435077138193004-8813
PE O-42:3; PE O-18:2_24:1; or PE P-42:2; PE P-18:1...PE P-18:1/24:1ME435078138164549-8811
PE O-42:4; PE O-18:2_24:2; or PE P-42:3; PE P-18:1...PE P-18:1/24:2ME435079138237975-7809
PE O-42:5; PE O-18:1_24:4; or PE P-42:4; PE P-18:0...PE P-18:0/24:4ME435080138219964-7807
PE O-42:5; PE O-20:1_22:4; or PE P-42:4; PE P-20:0...PE P-20:0/22:4 or PE O-20:1/22:4ME43508152925124-7807
PE O-42:6; PE O-18:1_24:5; or PE P-42:5; PE P-18:0...PE P-18:0/24:5ME43508252925024-7805
PE O-42:6; PE O-18:2_24:4; or PE P-42:5; PE P-18:1...PE P-18:1/24:4ME435083138227934-6805
PE O-42:7; PE O-18:1_24:6; or PE P-42:6; PE P-18:0...PE P-18:0_24:6*ME43508452925125-6803
PE O-42:7; PE O-20:1_22:6; or PE P-42:6; PE P-20:0...PE P-20:0/22:6ME435085--6803
PE O-42:8; PE O-18:2_24:6; or PE P-42:7; PE P-18:1...PE P-18:1_24:6*ME435086--6801
PE O-42:8; PE O-20:2_22:6; or PE P-42:7; PE P-20:1...PE P-20:1/22:6 or PE O-20:2/22:6ME435087--6801
PE O-44:6; PE O-22:2_22:4; or PE P-44:5; PE P-22:1...PE P-22:1/22:4ME435088--7833
PE P-34:1; or PE O-34:2;PE P-34:1 or PE O-34:2ME43508953480893-6701
PE P-36:1; or PE O-36:2;PE P-36:1 or PE O-36:2ME43509053480895-7729
PE P-38:3; or PE O-38:4;PE P-38:3 or PE O-38:4ME43509152924972-6753
PE P-38:4; or PE O-38:5;PE P-38:4 or PE O-38:5ME4350929547058-6751
PE P-39:1; or PE O-39:2; isomer BPE P-39:1 or PE O-39:2ME435093138116190-8771
PE P-40:4; or PE O-40:5;PE P-40:4 or PE O-40:5ME43509452925118-7779
PE P-40:5; or PE O-40:6;PE P-40:5 or PE O-40:6ME43509553480884-6777
PE P-40:6; PE O-18:1/22:6; or PE O-40:7; PE P-18:0...PE P-18:0/22:6ME435096--6775
PG 32:0; PG 16:0_16:0;PG 16:0/16:0ME43509765144-5722
PG 33:0; PG 16:0_17:0;PG 16:0_17:0ME43509875960075-5736
PG 34:1; PG 16:0_18:1; APG 16:0_18:1ME4350995282293-5748
PG 34:2; PG 16:1_18:1;PG 16:1_18:1ME435100138278052-4746
PG 35:1; PG 17:0_18:1;PG 17:0_18:1ME435101138264532-5762
PG 36:1; PG 18:0_18:1;PG 18:0_18:1ME43510271767679-5776
PG 36:2; PG 18:1_18:1;PG 18:1/18:1ME43510313921353-5774
PG 36:3; PG 18:1_18:2;PG 18:1_18:2ME435104138155445-4772
PG 36:4; PG 16:0_20:4;PG 16:0_20:4ME435105138230554-4770
PG 38:4; PG 18:0_20:4;PG 18:0_20:4ME435106138183909-5798
PG 38:5; PG 18:1_20:4;PG 18:1_20:4ME435107138225719-4796
PG 38:6; PG 16:0_22:6;PG 16:0_22:6ME435108138172530-4794
PG 40:6; PG 18:0_22:6;PG 18:0_22:6ME435109134724320-5822
PG 40:7; PG 18:1_22:6;PG 18:1_22:6ME435110138157532-4820
PG 40:8; PG 20:4_20:4;PG 20:4/20:4ME435111138304869-4818
PG 42:10; PG 20:4_22:6;PG 20:4_22:6ME435112138219622-4842
PG 44:10; PG 22:4_22:6;PG 22:4_22:6ME435113138220450-4870
PG 44:11; PG 22:5_22:6;PG 22:5_22:6ME435114138297554-4868
PG 44:12; PG 22:6_22:6;PG 22:6/22:6ME435115134777753-3866
PI 28:0; PI 14:0_14:0;PI 14:0/14:0ME43511622016352-4753
PI 30:0; PI 14:0_16:0;PI 14:0_16:0ME43511775961273-4781
PI 32:0; PI 16:0_16:0;PI 16:0/16:0ME43511814185941-4810
PI 32:1; PI 16:0_16:1;PI 16:0_16:1ME435119138241787-4807
PI 34:1; PI 16:0_18:1;PI 16:0_18:1ME435120138234040-5836
PI 34:2; PI 16:0_18:2;PI 16:0_18:2ME435121138130059-4834
PI 36:1; PI 16:0_20:1;PI 16:0_20:1ME435122138262549-5864
PI 36:2; PI 18:0_18:2;PI 18:0_18:2ME435123138199526-4862
PI 36:3; PI 16:0_20:3;PI 16:0_20:3ME435124138271538-4860
PI 36:4; PI 16:0_20:4;PI 16:0_20:4ME435125138284476-4858
PI 36:5; PI 16:0_20:5;PI 16:0_20:5ME435126138154651-4856
PI 37:4; PI 17:0_20:4;PI 17:0_20:4ME435127138218607-4872
PI 38:1; PI 18:0_20:1;PI 18:0_20:1ME435128138205678-6892
PI 38:4; PI 18:0_20:4;PI 18:0_20:4ME435129138227586-5886
PI 38:5; PI 18:1_20:4;PI 18:1_20:4ME435130138296016-4884
PI 38:6; PI 16:0_22:6;PI 16:0_22:6ME435131138154339-4882
PI 38:6; PI 18:2_20:4;PI 18:2_20:4ME435132138175443-4882
PI 39:4; PI 19:0_20:4;PI 19:0_20:4ME435133138300906-5900
PI 39:6; PI 17:0_22:6;PI 17:0_22:6ME435134138315011-4896
PI 40:4; PI 18:0_22:4;PI 18:0_22:4ME435135138283546-5914
PI 40:5; PI 18:0_22:5;PI 18:0_22:5ME435136138244996-5912
PI 40:5; PI 20:1_20:4;PI 20:1_20:4ME435137138247874-5912
PI 40:6; PI 18:0_22:6;PI 18:0_22:6ME435138138144195-4910
PI 40:7; PI 18:1_22:6;PI 18:1_22:6ME435139138243885-4908
PI 40:7; PI 20:3_20:4;PI 20:3_20:4ME435140138280344-4908
PI 40:8; PI 20:4_20:4;PI 20:4/20:4ME435141138302649-4906
PI 42:10; PI 20:4_22:6;PI 20:4_22:6ME435142138285349-4930
PI O-36:4; PI O-16:0_20:4;PI O-16:0_20:4*ME43514352928505-4844
PI O-38:4; PI O-18:0_20:4;PI O-18:0_20:4*ME43514452928486-5872
PI O-38:5; PI O-18:1_20:4; or PI P-38:4; PI P-18:0...PI P-18:0/20:4ME43514552928598-4870
PI O-38:6; PI O-16:0_22:6;PI O-16:0_22:6*ME43514652928503-4868
PI O-38:6; PI O-18:2_20:4; or PI P-38:5; PI P-18:1...PI P-18:1/20:4ME43514752928558-4868
PMeOH 32:0; PMeOH 16:0_16:0;PM 32:0ME43514875228712-5661
PMeOH 32:1; PMeOH 16:0_16:1;PM 32:1ME435149138238676-4659
PMeOH 34:1; PMeOH 16:0_18:1;PM 34:1ME43515091844613-5687
PMeOH 34:2; PMeOH 16:0_18:2;PM 34:2ME435151138240731-4685
PMeOH 36:1; PMeOH 18:0_18:1;PM 36:1ME435152138268658-5716
PMeOH 36:2; PMeOH 18:1_18:1;PM 36:2ME43515310010064-5714
PMeOH 36:4; PMeOH 16:0_20:4;PM 36:4ME435154138161235-4709
PMeOH 38:4; PMeOH 18:0_20:4;PM 38:4ME435155138282465-5738
PMeOH 38:5; PMeOH 18:1_20:4;PM 38:5ME435156138173577-4735
PMeOH 38:6; PMeOH 16:0_22:6;PM 38:6ME435157138126121-4733
PMeOH 40:6; PMeOH 18:0_22:6;PM 40:6ME435158138150012-5762
PS 33:2; PS 15:1_18:1;PS 15:1_18:1ME435159138307380-5744
PS 34:1; PS 16:0_18:1;PS 16:0_18:1ME4351609853619-5761
PS 35:1; PS 17:0_18:1;PS 17:0_18:1ME435161138272964-5775
PS 35:2; PS 17:1_18:1;PS 17:1_18:1ME435162138128954-5773
PS 36:1; PS 18:0_18:1;PS 18:0_18:1ME4351639962404-5789
PS 36:2; PS 18:1_18:1; APS 18:1/18:1ME43516458556791-5787
PS 36:4; PS 16:0_20:4;PS 16:0_20:4ME435165138153806-4782
PS 38:1; PS 18:0_20:1; APS 18:0_20:1ME435166138198087-6817
PS 38:2; PS 18:1_20:1;PS 18:1_20:1ME435167138177226-5815
PS 38:3; PS 18:0_20:3;PS 18:0_20:3ME435168138288011-5813
PS 38:4; PS 18:0_20:4;PS 18:0_20:4ME435169138181120-5811
PS 38:5; PS 16:0_22:5;PS 16:0_22:5ME435170138238706-4809
PS 40:1; PS 22:0_18:1;PS 18:1_22:0ME43517125244006-6845
PS 40:2; PS 18:1_22:1;PS 18:1_22:1ME435172138154510-6843
PS 40:5; PS 18:0_22:5;PS 18:0_22:5ME435173138241231-5837
PS 40:6; PS 18:0_22:6;PS 18:0_22:6ME43517491746251-4835
PS 40:7; CPS 40:7ME435175138220287-5833
PS 40:8; PS 20:4_20:4;PS 20:4/20:4ME435176138235596-4830
PS 41:6;PS 41:6ME435177134744799-5849
PS 42:10; PS 20:4_22:6;PS 20:4_22:6ME435178138292917-4854
PS 42:2; PS 18:1_24:1;PS 18:1_24:1ME435179138318267-6-
PS 42:7; PS 20:1_22:6;PS 20:1_22:6ME435180138214813-4861
PS 44:10; PS 22:4_22:6; APS 22:4_22:6ME435181138260419-4883
PS 44:11; PS 22:5_22:6;PS 22:5_22:6ME435182138202261-4881
PS 44:12; PS 22:6_22:6; APS 22:6/22:6ME4351839832667-4878
PS O-34:2; PS O-16:1_18:1; or PS P-34:1; PS P-16:0...PS P-16:0/18:1ME43518452926270-5745
PS O-37:1; PS O-19:0_18:1;PS O-19:0_18:1*ME43518552926226-5789
PS O-38:7; PS O-16:1_22:6; or PS P-38:6; PS P-16:0...PS P-16:0/22:6ME43518652926274-4790.5039_790.504
PS O-40:7; PS O-18:1_22:6; or PS P-40:6; PS P-18:0...PS P-18:0/22:6ME43518752926271-5819
SM d36:0;SM 36:0;O2ME43518844260130-6792
SM d36:2;SM 36:2;O2ME4351896443882-5788
SM d38:1;SM 38:1;O2ME43519044260124-6818
SM d40:1;SM 40:1;O2ME43519113832233-7846
SM d42:2; ASM 42:2;O2ME43519252931217-7872
SM d42:3;SM 42:3;O2ME43519352931215-6870


Analysis: GC POSITIVE ION MODE

SelectMetabolite Name RefMet Name/Standardized Name* WorkBench
Metabolite_ID
PubChem
Compound_ID
Kegg Id Retention
time/index
m/z ratio
1,2,4-Benzenetriol1,2,4-TrihydroxybenzeneME43519410787-521803239
1,2-anhydro-myo-inositol1,2-Anhydro-myo-inositolME435195119054-651472318
1,5-Anhydroglucitol1,5-AnhydrosorbitolME43519664960-632918217
1-Methylgalactose-ME4351972108-664807204
1-MonopalmitinMG 16:0/0:0/0:0ME43519814900-900644371
1-MonostearinMG 18:0/0:0/0:0ME43519924699-959214203
2,5-dihydroxypyrazine2,5-DihydroxypyrazineME43520023368901-397526241
2-Deoxypentitol2-Deoxy-D-ribitolME435201249377-521785231
2-Hydroxyglutaric acid2-Hydroxyglutaric acidME43520243-508940247
2-Hydroxyvaleric acid2-Hydroxyvaleric acidME43520398009-309587131
2-Ketoglucose dimethylacetalD-GlucosoneME435204159630-456913234
2-MonooleinMG 0:0/18:1(9Z)/0:0ME4352055319879-941794129
3,4-Dihydroxyphenylacetic acid3,4-Dihydroxybenzeneacetic acidME435207547-625046179
3-(4-Hydroxyphenyl)propionic acidDesaminotyrosineME43520610394-598147179
3-Phosphoglycerate3-Phosphoglyceric acidME435208724-610734227
4-Hydroxybutyric acid4-Hydroxybutyric acidME43520910413-325027233
5'-Deoxy-5'-methylthioadenosine5'-MethylthioadenosineME435210439176-967036236
5-Hydroxy-3-indoleacetic acid5-Hydroxyindoleacetic acidME4352111826-777606290
6-DeoxyglucoseQuinovoseME435212441480-573663117
Aconitic acidcis-Aconitic acidME435213643757-586815229
Adenosine-5-monophosphateAMPME4352146083-1041375315
Alloxanoic acidAlloxanoic acidME43521594146-584472331
alpha-Aminoadipic acidalpha-Aminoadipic acidME43531559066632-574115260
alpha-Ketoglutarate2-Oxoglutaric acidME43531651-507392198
AminomalonateAminomalonic acidME4352165245668-455754218
Ascorbic acid (Vitamin C)Vitamin CME43521754670067-672898332
Azelaic acidAzelaic acidME43521819347555-610551317
Beta-Alaninebeta-AlanineME4352194755801-435564248
Beta-Glutamic acidIsoglutamic acidME43522073064-525547232
Beta-Glycerolphosphatesn-Glycero-2-phosphateME4352212526-574470243
Bisphosphoglycerol-ME435222102018-764660299
ButylamineButylamineME4352238007-245240174
Butyrolactam2-PyrrolidinoneME43522412025-277199142
Caprylic acidCaprylic acidME435225135372298-343457201
Cis-Gondoic acidcis-Gondoic acidME4352265282768-847372367
Citric acidCitric acidME43522719782904-617342273
Conduritol-beta-epoxideConduritol epoxideME4352289989541-675635318
CysteineCysteineME4352296419722-500158220
CytosinCytosineME435230597-486724254
Dehydroascorbic acidL-Dehydroascorbic acidME435231440667-633423173
DodecanolDodecanolME4352328193-507619243
ErythritolErythritolME435233222285-471922217
Erythronic acid lactoneErythrono-1,4-lactoneME4352345325915-407495247
EthanolamineEthanolamineME435235700-342561174
FructoseFructoseME435236439709-639442307
Fructose-1,6-bisphosphateFructose 1,6-bisphosphateME43523710267-939046315
Fructose-1-phosphateFructose 1-phosphateME435238439394-803180387
Fructose-6-phosphateFructose 6-phosphateME435239440641-804279315
FucoseFucoseME435240439650-578299160
Fumaric acidFumaric acidME435241444972-392338245
Galactose-6-phosphateGalactose 6-phosphateME435242439404-828102387
Gluconic acidGluconic acidME4352436857417-693148333
GlucoseGlucoseME43524464689-659798319
Glucose-1-phosphateGlucose 1-phosphateME43524565533-594647217
Glucose-6-phosphateGlucose 6-phosphateME4352465958-808788387
Glutaric acidGlutaric acidME435247743-421596261
GlutathioneGlutathioneME435248124886-761296213
Glyceraldehyde-3-phosphateGlyceraldehyde 3-phosphateME435249729-573670211
GlycerolGlycerolME435250753-344466205
Glycerol-3-galactosideGalactosylglycerolME43525116048618-805227204
Glycerol-alpha-phosphatesn-Glycero-3-phosphateME435252754-590747357
Glycolic acidGlycolic acidME4352533698251-227636177
GuanidinosuccinateGuanidinosuccinic acidME435254439918-557299328
HomoserineHomoserineME43525512647-443878218
HydroquinoneHydroquinoneME435256785-422583239
Inosine-5'-monophosphateIMPME435257135398640-1018687169
Inositol-4-monophosphateInositol 4-phosphateME435258440043-846510315
Isopentadecanoic acidIsopentadecylic acidME435259151014-663518117
Isothreonic acidD-Threonic acidME435260151152-489385292
LactamideLactamideME43526194220-265698232
Lactic acidLactic acidME43526219789253-215238191
LeucineLeucineME4352637045798-345845158
LevoglucosanGlucosanME4352642724705-569637204
Levoinositol-ME435265892-651238432
LyxitolL-ArabitolME435266439255-573587217
LyxoseLyxoseME435267439240-541086217
MaleimideMaleimideME43526810935-245118154
Malic acidMalic acidME43526920130941-463180233
MaltoseMaltoseME435270439186-946601204
Mannose-6-phosphateMannose 6-phosphateME43527165127-822643387
MethanolphosphateMethanolphosphateME43527213130-289520241
Methylmalonic acidMethylmalonic acidME435273487-311617147
Myristic acidMyristic acidME43527411005-634414285
N-AcetylmannosamineN-Acetyl-mannosamineME435275439281-722897319
Nicotinic acidNicotinic acidME435276938-353428180
NoradrenalineXi-NorepinephrineME435277439260-754841174
OctadecanolStearyl alcoholME4352788221-755409327
OleamideOleamideME4352795283387-849710144
o-PhosphoserineDL-O-PhosphoserineME43528057689797-624356356
Oxalic acidOxalic acidME435281971-260513190
OxoprolineOxoprolineME4352827405-485935156
Parabanic acidParabanic acidME43528367126-464991100
Pelargonic acidPelargonic acidME4352848158-399229215
PhenolPhenolME43528520488062-218927151
PhosphatePhosphoric acidME4352861004-346324314
PhosphoenolpyruvatePhosphoenolpyruvic acidME43528759658623-518184211
Phthalic AcidPhthalic acidME43528818183610-567345147
p-Hydroxylphenyllactic acid4-Hydroxyphenyllactic acidME4352899378-654036308
Propylamine-ME4352907852-198386174
PyrophosphatePyrophosphateME4352911023-327517110
RibitolRibitolME4352926912-575497217
Ribonic acidRibonic acidME4352935460677-597646292
RiboseRiboseME43529410975657-553071217
Ribose-5-phosphateRibose 5-phosphateME435295439167-731096315
Ribulose-5-phosphateRibulose 5-phosphateME435296439184-735908357
Saccharic acidGlucaric acidME43529733037-699211333
Salicylaldehyde2-HydroxybenzaldehydeME4352986998-405583193
SerotoninSerotoninME4352995202-863824174
Shikimic acidShikimic acidME4353008742-611100204
SpermineSpermineME4353011103-926727174
SqualeneSqualeneME435302638072-97623795
Succinic acidSuccinic acidME43530321952380-370608247
SucroseSucroseME4353045988-915139271
TetracosaneLignoceraneME43530512592-84461285
Threonic acidThreonic acidME4353065460407-497572292
ThreoseThreoseME435307441031-446119205
TyrosineTyrosineME4353086057-671252218
UreaUreaME4353091176-326574189
ValineValineME4353106971018-313502144
XylitolXylitolME4353116912-567437217
XylonolactoneD-Xylono-1,5-lactoneME435312439692-535176217
XyloseXyloseME435313135191-543267103
XyluloseXyluloseME435314439205-553450173


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