Data for Pilot experiment looking for the existence of certain molecules in pancreatic cancer cells (Study ST000044)
(Analysis AN000068)Values for each metabolite have been scaled by dividing by the mean across all factors Run Hierarchial cluster analysis on this study | Run Heatmap cluster analysis on this study| Metabolite | F1 | F2 | F3 |
|---|---|---|---|
| 10-HYDROXYDECANOATE | 1.5933 | 0.6931 | 0.8936 |
| 11-BETA-HYDROXYANDROST-4-ENE-3,17-DIONE | 0.8216 | NA | 1.0892 |
| 11-DEHYDROCORTICOSTERONE (*) | 1.0000 | NA | NA |
| 1,2-DIDECANOYL-SN-GLYCERO-3-PHOSPHOCHOLINE | 1.0000 | NA | NA |
| 1,2-DIPALMITOYL-SN-GLYCEROL | NA | 1.0000 | NA |
| 12-HYDROXY-DODECANOIC ACID | 1.0778 | 0.8306 | 1.0493 |
| [13C]-ARGININE | 1.8666 | 0.0632 | 1.0703 |
| [13C]-ASPARTIC ACID | 1.3223 | 0.3042 | 1.3735 |
| [13C]-GLUTAMATE | 1.5845 | 0.0269 | 0.9021 |
| [13C]-HISTIDINE | NA | NA | 1.0000 |
| [13C]-ISOLEUCINE | 1.2320 | 0.1450 | 1.1955 |
| [13C]-LEUCINE | 1.4396 | 0.1649 | 1.3956 |
| [13C]-LYSINE | 1.4737 | 0.2425 | 0.9051 |
| [13C]-METHIONINE | 1.0542 | 0.2003 | 1.3186 |
| [13C]-PHENYLALANINE | 1.4035 | 0.1896 | 1.4070 |
| [13C]-PROLINE | 1.7134 | 0.0682 | 1.2183 |
| [13C]-THREONINE | 1.5759 | 0.0433 | 0.9025 |
| [13C]-TYROSINE | 1.5279 | 0.1012 | 1.3709 |
| [13C]-VALINE | 1.5722 | 0.1157 | 1.3120 |
| 1-METHYLADENOSINE | NA | 1.8808 | 0.1192 |
| 1-METHYLNICOTINAMIDE | 1.1426 | 0.4193 | 1.4382 |
| 1-NAPHTHYLAMINE | NA | NA | 1.0000 |
| 1-OLEOYL-RAC-GLYCEROL | 0.6301 | 2.2851 | 0.0848 |
| 2`,4`-DIHYDROXYACETOPHENONE | 1.0983 | NA | 0.9017 |
| 25-HYDROXYCHOLESTEROL | NA | 1.0000 | NA |
| 2,6-DIHYDROXYPYRIDINE | 0.8761 | NA | 1.2478 |
| 2-AMINO-2-DEOXYHEXOPYRANOSE | 1.0669 | 0.7428 | 1.3808 |
| 2-AMINOPHENOL | 1.0000 | NA | NA |
| 2`-DEOXYADENOSINE | 0.2874 | 0.1855 | 1.7466 |
| 2`-DEOXYADENOSINE 5`-MONOPHOSPHATE | NA | 1.0000 | NA |
| 2`-DEOXYCYTIDINE | 0.1138 | 3.0546 | 0.2747 |
| 2`-DEOXYCYTIDINE 5`-DIPHOSPHATE | NA | 1.0000 | NA |
| 2-DEOXY-D-GLUCOSE | 0.6115 | 0.4616 | 1.9268 |
| 2-DEOXY-GLUCOSE / 6-DEOXY-GALACTOSE | NA | 1.0000 | NA |
| 2`-DEOXYGUANOSINE | 0.4148 | 1.9556 | 0.6296 |
| 2`-DEOXYGUANOSINE 5`-DIPHOSPHATE | 0.2628 | 1.4264 | 1.3108 |
| 2`-DEOXYGUANOSINE 5`-MONOPHOSPHATE | 0.0487 | 2.0120 | 0.4333 |
| 2-HYDROXYBUTYRIC ACID | 1.1233 | NA | 0.8943 |
| 2-HYDROXYPHENYLACETIC ACID | 1.1376 | NA | 0.8624 |
| 2-METHYLGLUTARIC ACID | 0.8216 | NA | 1.1784 |
| 2-METHYLMALEATE | 1.1905 | NA | 0.8095 |
| 2-OXOADIPATE | NA | 1.0000 | NA |
| 2-QUINOLINECARBOXYLIC ACID | NA | NA | 1.0000 |
| 3-(2-HYDROXYPHENYL)PROPANOATE | 0.6159 | NA | 1.1920 |
| 3,3`,5-TRIIODO-L-THYRONINE | NA | 0.9274 | 1.0726 |
| 3,3`-DITHIODIVALINE | NA | NA | 1.0000 |
| 3,4-DIHYDROXYBENZOATE | 0.9726 | NA | 1.0411 |
| 3,4-DIHYDROXY-L-PHENYLALANINE | 0.8278 | 0.6315 | 1.1802 |
| 3,4-DIHYDROXYMANDELIC ACID | NA | NA | 1.0000 |
| 3,4-DIHYDROXYPHENYLACETATE | NA | NA | 1.0000 |
| 3-(4-HYDROXYPHENYL)LACTATE | NA | NA | 1.0000 |
| 3,5-DIIODO-L-THYRONINE | 1.0856 | NA | 0.9144 |
| 3ALPHA-HYDROXY-5BETA-CHOLANATE | 0.2280 | NA | 1.3860 |
| 3BETA-HYDROXY-5ALPHA-PREGNAN-20-ONE | NA | 1.0432 | 0.9568 |
| 3`-CMP | 0.2117 | 2.6089 | 0.3845 |
| 3-(CYSTEIN-S-YL)ACETAMINOPHEN (*) | NA | NA | 1.0000 |
| 3-DEHYDROSHIKIMATE | NA | NA | 1.0000 |
| 3-HYDROXY-3-METHYLGLUTARATE | NA | NA | 1.0000 |
| 3-HYDROXY-DL-KYNURENINE | 0.3599 | 0.9100 | 1.2434 |
| 3-METHOXY-L-TYROSINE | 0.2492 | NA | 1.3754 |
| 3-METHYLADENINE | 1.0000 | NA | NA |
| 3-METHYLHISTAMINE | 0.2074 | 1.9998 | 0.7928 |
| 3-NITRO-L-TYROSINE | 1.0000 | NA | NA |
| 3-UREIDOPROPIONIC ACID | 0.6839 | 0.3207 | 1.4372 |
| 4-ACETAMIDOBUTANOATE | 0.5053 | 0.4345 | 1.6244 |
| 4-AMINOBENZOYLGLUTAMIC ACID | NA | NA | 1.0000 |
| 4-AMINOBUTANOATE | 1.0000 | NA | NA |
| 4-COUMARATE | NA | NA | 1.0000 |
| 4-GUANIDINOBUTANOIC ACID | 1.3629 | NA | 0.8185 |
| 4-HYDROXY-3-METHOXY-BENZENEMETHANOL | 1.0574 | NA | 0.9426 |
| 4-HYDROXY-3-METHOXYMANDELIC | NA | 1.0000 | NA |
| 4-HYDROXY-3-METHOXYMANDELIC ACID | NA | 1.0000 | NA |
| 4-HYDROXY-3-METHOXYPHENYLGLYCOL | 1.0603 | NA | 0.9397 |
| 4-HYDROXYBENZALDEHYDE | 0.8364 | NA | 1.1636 |
| 4-IMIDAZOLEACETIC ACID | NA | 1.0000 | NA |
| 4-METHYL-2-OXOPENTANOATE | 1.2095 | NA | 0.7905 |
| 4-METHYLCATECHOL | 1.5188 | NA | 0.4812 |
| 4-QUINOLINECARBOXYLIC ACID | NA | 1.0000 | NA |
| 5-AMINOIMIDAZOLE-4-CARBOXAMIDE-1-BETA-D-RIBOFURANOSYL 5`-MONOPHOSPHATE | NA | 1.0000 | NA |
| 5-Aminoimidazole ribotide (*) | 0.1048 | 2.5890 | 0.3062 |
| 5-AMINOLEVULINIC ACID | 1.0000 | NA | NA |
| 5`-DEOXYADENOSINE | 0.1473 | 5.3257 | 0.4759 |
| 5-HYDROXY-L-TRYPTOPHAN | 0.0794 | 2.2906 | 0.4449 |
| 5-HYDROXYMETHYLURACIL | 1.0000 | NA | NA |
| 5-HYDROXYPENTANOIC ACID | 0.9179 | NA | 1.1232 |
| 5`-METHYLTHIOADENOSINE | 0.0976 | 1.7161 | 1.3188 |
| 5-OXO-PROLINE | 1.0000 | NA | NA |
| 5-VALEROLACTONE | NA | NA | 1.0000 |
| 6,7-DIHYDROBIOPTERIN | NA | 1.9106 | 0.0894 |
| 6-HYDROXYDOPAMINE | NA | NA | 1.0000 |
| 6-HYDROXYNICOTINATE | 0.9698 | 1.0680 | 0.9244 |
| 6-PHOSPHOGLUCONIC ACID | 1.0000 | NA | NA |
| ACETYLCHOLINE | 0.4228 | 1.8328 | 0.7443 |
| ADENINE | 0.2104 | 2.2832 | 0.5064 |
| ADENOSINE | 0.0774 | 2.5240 | 0.3986 |
| ADENOSINE 2`,3`-CYCLIC MONOPHOSPHATE | NA | 1.0000 | NA |
| ADENOSINE 3`,5`-CYCLIC MONOPHOSPHATE | 0.4149 | 1.5232 | 0.7694 |
| ADENOSINE 5`-MONOPHOSPHATE | 0.0321 | 2.8830 | 0.0850 |
| ADENOSINE 5`-MONOPHOSPHATE (*) | 0.1637 | 2.5196 | 0.2657 |
| ADENOSINE DIPHOSPHATE | 0.2603 | 1.7397 | NA |
| ALANINE | 0.3066 | 2.1691 | 0.5244 |
| ALLANTOIN | NA | 0.9429 | 1.0571 |
| ALPHA-KETO-GLUTARATE | NA | 1.0000 | NA |
| ALPHA-LIPOAMIDE | 0.9628 | NA | 1.0745 |
| ALPHA-TOCOPHEROL | 1.6273 | 0.1234 | 1.5629 |
| AMINOHYDROXYBENZOIC ACID | NA | 1.0000 | NA |
| AMINOHYDROXYBUTANOIC ACID | 0.9530 | 0.2919 | 1.5781 |
| ANANDAMIDE | NA | NA | 1.0000 |
| ANTHRANILATE | 0.9963 | NA | 1.0037 |
| ARG-VAL-TRP | 1.2419 | 0.2714 | 1.4867 |
| ASCORBATE | 0.6761 | 1.2312 | 0.3991 |
| ASCORBATE (-H) | 0.3947 | 1.4798 | 1.1255 |
| ASPARAGINE | 0.8876 | 0.4436 | 1.5208 |
| ASPARTATE | 1.2332 | NA | 0.6502 |
| AZELAIC ACID | 0.4708 | 0.4349 | 1.9441 |
| B-ALANYL-N(PAI)-METHYL-L-HISTIDINE | NA | 1.0000 | NA |
| BENZENEDICARBOXYLIC ACID | 1.0000 | NA | NA |
| BETAINE | 0.5788 | NA | 1.2106 |
| BILIVERDIN | 0.4886 | 1.0536 | 1.2873 |
| BIOPTERIN | NA | 1.6854 | 0.3146 |
| BIOTIN | NA | 0.6127 | 1.3873 |
| BIS(2-ETHYLHEXYL)PHTHALATE | 1.0562 | 1.0302 | 0.9424 |
| BISPHOSPHOGLYCERATE | 1.0000 | NA | NA |
| BOC-ALA-OH | 1.1226 | 0.2106 | 1.0748 |
| BOC-ASN | 0.9463 | NA | 1.0537 |
| BOC-ASP-OH | 1.0795 | NA | 0.9364 |
| BOC-GLY-OH | 1.0000 | NA | NA |
| BOC-HIS-OH | 0.7083 | NA | 1.1945 |
| BOC-PHE-OH | 1.1881 | 0.5337 | 1.2781 |
| BOC-PRO-OH | 1.0000 | NA | NA |
| BOC-SER-OH | 0.7900 | 0.9692 | 1.2407 |
| BRADYKININ (*) | 0.4039 | 3.0111 | 0.7270 |
| BRADYKININ DES-ARG(9) (*) | 0.4959 | NA | 1.8401 |
| BRADYKININ HYDROXY-PRO(3) (*) | 0.0475 | 1.9787 | 0.6650 |
| CADAVERINE | 1.2950 | 0.9017 | NA |
| CALCITRIOL (*) | 1.0000 | NA | NA |
| CAPECITABINE | 0.9814 | NA | 1.0186 |
| CARNITINE | 0.6030 | 1.4589 | 0.9381 |
| CARNOSINE | NA | 1.3408 | 0.6592 |
| CERAMIDE PHOSPHOCHOLINE (*) | 0.0900 | 1.7787 | 0.5494 |
| CHOLESTA-5,7-DIEN-3BETA-OL | 0.7762 | NA | 1.1119 |
| CHOLESTEROL | 1.5421 | 0.5069 | 0.9510 |
| CHOLESTEROL (-H20) | 0.6475 | 0.9764 | 1.3760 |
| CHOLIC ACID | 1.0000 | NA | NA |
| CHOLINE | 0.2350 | 2.1982 | 0.5668 |
| CINNAMOYLGLYCINE (*) | 0.9883 | NA | 1.0117 |
| CITRAMALATE | 0.8383 | 0.5648 | 1.9202 |
| CITRATE | 0.7628 | 0.3482 | 2.4520 |
| CITRULLINE | 1.2013 | NA | 0.7987 |
| COENZYME A | 0.9587 | NA | 1.0413 |
| CORTICOSTERONE | 0.6095 | 0.9360 | 1.7138 |
| CORTISOL | 1.2034 | 0.4374 | 1.2575 |
| CORTISOL 21-ACETATE | 0.5161 | 1.4839 | NA |
| CORTISONE | 1.1386 | NA | 0.7922 |
| COTININE (*) | NA | 1.0000 | NA |
| CREATINE | 0.3278 | 2.1914 | 0.4808 |
| CREATININE | 0.6976 | 2.1895 | 0.4086 |
| CREATININE FROM COMPLEX | NA | 1.3624 | 0.2751 |
| CYCLOHEXANE-1,3-DIONE | 0.6734 | NA | 1.4899 |
| CYSTEIC ACID | 1.0000 | NA | NA |
| CYSTEINE | NA | 1.0000 | NA |
| CYSTINE | 1.1117 | 0.8258 | 1.0045 |
| CYTIDINE | 0.0467 | 1.9454 | 0.0625 |
| CYTIDINE 2`,3`-CYCLIC MONOPHOSPHATE (CCMP) | NA | 1.1587 | 0.3651 |
| CYTIDINE 5`-DIPHOSPHATE | 0.8436 | 1.2584 | 0.6396 |
| CYTIDINE 5`-DIPHOSPHOCHOLINE | 0.1362 | 0.9094 | 1.5226 |
| CYTIDINE 5`-MONOPHOSPHATE | 0.1975 | 2.3076 | 0.4950 |
| CYTOSINE | 0.2047 | NA | 1.3977 |
| DEHYDROASCORBATE | 0.3982 | 1.4732 | 1.1286 |
| DEOXYCARNITINE | NA | 1.0000 | NA |
| DEOXYCHOLATE | 2.8980 | 0.0669 | 0.6784 |
| DEOXYCORTICOSTERONE | 1.2875 | 0.3039 | 1.4086 |
| DEOXYRIBOSE | 1.3038 | NA | 0.8481 |
| DEOXYURIDINE | 0.3479 | 2.0559 | 0.2702 |
| DESMOSTEROL | 0.8431 | 0.6152 | 1.2708 |
| DETHIOBIOTIN | NA | 1.0000 | NA |
| D-GLUCONO-1,5-LACTONE | NA | NA | 1.0000 |
| DIACYL-GLYCEROPHOSPHOCHOLINE (C50H82NO8P PROBABLY) | 0.8078 | 1.1922 | NA |
| DIACYLGLYCEROPHOSPHOGLYCEROL (POSSIBLY) | NA | NA | 1.0000 |
| DIACYL-PHOSPHATIDYLCHOLINE | NA | 1.0000 | NA |
| DIETHANOLAMINE | NA | NA | 1.0000 |
| DIETHYL AMINOMALONATE | 0.6157 | 1.6638 | 0.7205 |
| DIHEXOSE | 1.4029 | NA | 0.5971 |
| DIHYDROOROTATE | NA | 0.5955 | 1.8090 |
| DIHYDROXYACETONE PHOSPHATE | NA | NA | 1.0000 |
| DIHYDROXYBENZOIC ACID | 1.2973 | NA | 0.7027 |
| DI-LINOLEOYL-3-SN-PHOSPHATIDYLCHOLINE (POSSIBLY) | 1.7925 | 0.6996 | 0.5079 |
| DIMETHYLARGININE (*) | 0.6131 | 1.1963 | 1.0925 |
| DIMETHYLBENZIMIDAZOLE | 1.0000 | NA | NA |
| DIMETHYL MALEATE | 0.5341 | NA | 1.9318 |
| DIMETHYLXANTHINE | 1.3992 | NA | 0.7006 |
| DIOLEOYLPHOSPHATIDYLCHOLINE | 2.1957 | 0.4619 | 0.9403 |
| DIPALMITOYLGLYCEROL (*) | 2.3562 | 0.1346 | 0.5092 |
| DI-TERT-BUTYL DICARBONATE | 1.2637 | NA | 0.8681 |
| DOCOSAHEXAENOIC ACID | 0.4426 | 0.8892 | 1.1809 |
| DOPAMINE | NA | 1.0000 | NA |
| EDTA | 0.4104 | NA | 1.2948 |
| EDTA (*) | 0.4431 | NA | 2.1137 |
| ENKEPHALINE, (D-ALA)2-LEU | 1.0178 | NA | 0.9644 |
| EPINEPHRINE | NA | 1.0000 | NA |
| ERYTHRITOL | 1.6456 | NA | 0.3544 |
| ESTRADIOL 17 ALPHA | NA | 1.0912 | 0.9088 |
| ESTRIOL (*) | 1.7925 | 0.8205 | 0.6486 |
| ESTRONE | 1.1950 | 0.1251 | 1.4849 |
| ETHYL 3-INDOLE ACETATE | 0.7073 | 1.0153 | 1.2621 |
| ETHYL 4-OXOCYCLOHEXANECARBOXYLATE | 1.0670 | NA | 0.8660 |
| ETHYLMALONIC ACID | 1.1298 | NA | 0.8702 |
| FERULATE | 0.8938 | NA | 1.1592 |
| FLAVIN ADENINE DINUCLEOTIDE | 0.4311 | 1.2845 | NA |
| FORMYL-L-METHIONINE | 1.0805 | NA | 0.9598 |
| FRUCTOSE 1,6-BIPHOSPHATE | 1.0852 | 0.3743 | 1.2702 |
| GAMMA-BUTYROLACTONE | 1.0508 | 0.9492 | NA |
| GDP-GLUCOSE | NA | 1.0000 | NA |
| GLUCARIC/GULARIC/SACCHARIC ACID | 0.9583 | NA | 1.0208 |
| GLUCOSAMINE 6-PHOSPHATE | NA | 1.0061 | 0.9939 |
| GLUCOSAMINE 6-SULFATE | NA | 1.3136 | 0.6864 |
| GLUCOSE-6-PHOSPHATE | 0.5315 | 0.3905 | 2.6875 |
| GLUTAMINE | 1.2044 | 0.6746 | 1.0802 |
| GLUTARATE | 1.0151 | NA | 0.9849 |
| GLUTATHIONE | 0.6531 | 0.0022 | 2.0953 |
| GLUTATHIONE OXIDIZED | 0.2632 | NA | 1.7368 |
| GLYCERALDEHYDE 3-PHOSPHATE DIETHYL ACETAL | NA | NA | 1.0000 |
| GLYCERIC ACID | 0.8703 | NA | 1.0649 |
| GLYCEROL PHOSPHATE | 1.4865 | 0.5135 | NA |
| GLYCEROPHOSPHOCHOLINE (*) | NA | NA | 1.0000 |
| GLYCINE | 0.3067 | 1.3467 | NA |
| GLYCOCHOLATE | 0.6343 | 0.6958 | 1.5308 |
| GLYCOLITHOCHOLIC ACID ETHYL ESTER | 0.3529 | 1.0285 | 1.5901 |
| GTP | NA | NA | 1.0000 |
| GUANINE | 0.9376 | NA | 1.0624 |
| GUANOSINE | 0.4618 | 2.2327 | 0.5370 |
| GUANOSINE 3`,5`-CYCLIC MONOPHOSPHATE | 2.4060 | 0.2970 | NA |
| GUANOSINE 5`-DIPHOSPHATE | NA | NA | 1.0000 |
| GUANOSINE 5` MONOPHOSPHATE | NA | 1.0000 | NA |
| GULONO-1,4-LACTONE | NA | 1.0000 | NA |
| HEPTADECANOYLGLYCEROPHOSPHOCHOLINE (*) | 0.0354 | 2.1688 | 0.0166 |
| HEXITOL | NA | 1.2958 | 0.4085 |
| HEXOSE | 2.4506 | 0.1083 | 0.4411 |
| HEXOSE (M+K) | 1.4998 | 0.8285 | 0.6717 |
| HIPPURATE | 0.7230 | NA | 1.2770 |
| HISTAMINE | 1.4201 | 0.8491 | 0.7308 |
| HISTIDINE | 0.0922 | 2.8685 | 0.0393 |
| HISTIDINOL | NA | 1.0000 | NA |
| HOMOCYSTEINE | 1.0040 | 0.7608 | 1.4705 |
| HOMOCYSTINE | NA | 1.0000 | NA |
| HOMOGENTISATE | NA | 1.0000 | NA |
| HOMOSERINE | 1.0000 | NA | NA |
| HOMOVANILLATE | 0.5961 | NA | 1.4039 |
| HYDROXYBENZALDEHYDE | 0.8865 | NA | 1.1135 |
| HYPOXANTHINE | 0.3836 | 1.5941 | 1.0223 |
| INDOLE-3-ACETAMIDE | 1.2611 | NA | 0.7389 |
| INDOLE-3-ACETIC ACID | 0.6116 | 0.1164 | 1.6829 |
| INDOLEPYRUVATE (*) | 0.6285 | 1.5002 | 1.0285 |
| INDOXYL | 1.1288 | NA | 0.8712 |
| INOSINE | 0.5682 | 1.4103 | 1.0229 |
| INOSINE 5`-MONOPHOSPHATE | NA | 1.0000 | NA |
| ISOCITRIC ACID | 0.7301 | NA | 1.5397 |
| ISOLEUCINE | 0.0773 | 2.7395 | 0.1832 |
| KYNURENINE | 0.3440 | 0.8772 | 1.7788 |
| LAUROYLCARNITINE | 0.0684 | 1.9725 | 0.4933 |
| LEUCENOL | NA | NA | 1.0000 |
| LEUCINE | 0.1669 | 2.3169 | 0.5161 |
| LINOLEOYLGLYCEROPHOSPHOCHOLINE (*) | 0.1411 | 1.7188 | 0.2066 |
| LL-2,6-DIAMINOHEPTANEDIOATE | NA | 1.2305 | 0.7695 |
| L-LEUCYL-L-LEUCINE (*) | 0.9764 | 0.9900 | 1.0168 |
| LUMICHROME | 1.7805 | 2.0100 | 0.2999 |
| LYSINE | 0.3460 | 2.2478 | 0.4061 |
| MALATE | 0.8644 | 0.1016 | 2.0340 |
| MALEAMATE | NA | 1.7553 | 0.2447 |
| MANNOSE-6-PHOSPHATE | 0.7616 | 0.7035 | 1.2578 |
| MELATONIN | NA | NA | 1.0000 |
| METHIONINE | 0.2717 | 2.0407 | 0.6876 |
| METHYL ACETOACETATE | 1.2950 | NA | 0.1149 |
| METHYL BETA-D-GALACTOSIDE | 0.2755 | 2.5047 | 0.9721 |
| METHYLGUANIDINE | 1.0000 | NA | NA |
| METHYLIMIDAZOLEACETIC ACID (*) | 0.6545 | 1.2913 | 1.1084 |
| METHYL JASMONATE | 1.3460 | 0.4205 | 1.2335 |
| METHYLMALONATE | 1.0000 | NA | NA |
| METHYL PARABEN | 1.1078 | NA | 0.8922 |
| METHYL VANILLATE | 1.0950 | NA | 0.9050 |
| MEVALOLACTONE | 1.0000 | NA | NA |
| MONO-METHYL GLUTARATE | NA | 1.8583 | 0.1417 |
| MYRISTOYLGLYCEROPHOSPHOCHOLINE (*) | 0.0114 | 1.8604 | 0.0252 |
| N1-ACETYLSPERMINE | NA | 1.0000 | NA |
| N1-METHYL-2-PYRIDONE-5-CARBOXAMIDE (*) | 0.4107 | 0.0446 | 2.2701 |
| N4-(ACETYL-BETA-D-GLUCOSAMINYL)ASPARAGINE (*) | NA | NA | 1.0000 |
| N4-ACETYLCYTIDINE (*) | 0.6523 | NA | 1.3477 |
| N6-(DELTA2-ISOPENTENYL)-ADENINE | 0.0835 | 1.2674 | 1.1141 |
| N-ACETYL-D-HEXOSAMINE | 0.2719 | 1.7266 | 1.2429 |
| N-ACETYL-DL-GLUTAMIC ACID | 0.9546 | 1.1123 | 0.9779 |
| N-ACETYL-DL-METHIONINE | 0.4332 | NA | 1.5668 |
| N-ACETYL-D-TRYPTOPHAN | 1.3837 | NA | 0.6163 |
| N-ACETYL-L-ALANINE | 0.3331 | NA | 1.6669 |
| N-ACETYL-L-ASPARTIC ACID | 0.5536 | 0.7344 | 1.6456 |
| N-ACETYL-L-CYSTEINE | NA | 1.0000 | NA |
| N-ACETYL-L-LEUCINE | 0.6798 | NA | 1.4804 |
| N-ACETYL-L-PHENYLALANINE | 1.1437 | NA | 0.8563 |
| N-ACETYLNEURAMINATE | 0.7103 | 0.0967 | 1.4403 |
| N-ACETYLPUTRESCINE | NA | NA | 1.0000 |
| N-ACETYLSEROTONIN | 0.7651 | NA | 1.4698 |
| N-ALPHA-ACETYL-L-ASPARAGINE | NA | 1.5469 | 0.1796 |
| N-ALPHA-ACETYL-L-LYSINE | 0.6178 | 1.3504 | 1.0318 |
| N-AMIDINO-L-ASPARTATE | NA | 1.0000 | NA |
| N-BENZYLOXYCARBONYLGLYCINE | 1.1425 | 0.5984 | 1.2591 |
| N-CYCLOHEXYLFORMAMIDE | 1.0789 | NA | 0.9211 |
| NICOTINAMIDE | 0.2382 | 2.1950 | 0.5668 |
| NICOTINAMIDE ADENINE DINUCLEOTIDE | 0.0195 | 2.8545 | 0.1259 |
| NICOTINAMIDE ADENINE DINUCLEOTIDE PHOSPHATE | 0.1328 | 2.7344 | NA |
| NICOTINAMIDE MONONUCLEOTIDE | 0.1185 | 0.9454 | 2.8723 |
| NICOTINATE D-RIBONUCLEOSIDE (*) | 0.9715 | NA | 1.0285 |
| N-METHYLTYRAMINE (*) | NA | 0.5804 | 1.8392 |
| N,N,N-TRIMETHYLLYSINE | 0.5597 | 1.6554 | 0.7849 |
| N-OLEOYLGLYCINE | 1.2291 | NA | 0.7709 |
| NORADRENALINE | 1.1441 | NA | 0.8559 |
| NORMETANEPHRINE | 0.7574 | 1.7678 | 0.8587 |
| N(PAI)-METHYL-L-HISTIDINE | 0.1494 | 2.6107 | 0.2399 |
| O-ACETYL-L-CARNITINE | 0.4418 | 1.2565 | 1.2413 |
| OCTOPAMINE | 1.0000 | NA | NA |
| OLEAMIDE | 0.4494 | 0.0592 | 2.2685 |
| OLEOYLCARNITINE (*) | 0.0425 | 1.9172 | 0.4819 |
| OLEOYLGLYCEROPHOSPHOCHOLINE (*) | 0.0416 | 1.8567 | 0.0853 |
| O-PHOSPHO-DL-SERINE | 0.6702 | 0.7714 | 1.5584 |
| O-PHOSPHONOHEXOPYRANOSE | 0.6891 | NA | 1.3109 |
| OPHTHALMIC ACID | 0.7471 | 0.3139 | 1.5959 |
| ORNITHINE | 0.5195 | 2.8767 | 0.4220 |
| OROTIDINE 5`-MONOPHOSPHATE | 0.7162 | 0.8526 | 1.3630 |
| O-SUCCINYL-L-HOMOSERINE | 0.4295 | 0.2567 | 2.0286 |
| OXOMALONATE | NA | 1.0000 | NA |
| PALMITOLEOYLGLYCEROPHOSPHOCHOLINE (*) | 0.2225 | 1.3534 | 0.0106 |
| PALMITOYLCARNITINE (*) | 0.0345 | 2.5208 | 0.3240 |
| PALMITOYLGLYCEROPHOSPHOCHOLINE (*) | 0.2634 | 1.7812 | 0.3046 |
| PALMITOYL SPHINGOMYELIN (*) | 0.5546 | 1.2047 | 1.2407 |
| PANTOLACTONE | 1.5233 | 0.2473 | 0.8041 |
| PANTOTHENIC ACID | 0.0849 | 3.0693 | 0.3631 |
| PARAOXON-METHYL | NA | 1.8443 | 0.1557 |
| PENTADECANOYLGLYCEROPHOSPHOCHOLINE/STEAROYLGLYCEROPHOSPHOETHANOLAMINE (*) | 0.0207 | 1.9612 | 0.0569 |
| PENTITOL | 1.1968 | NA | 0.6064 |
| PENTOPYRANOSE | 1.0000 | NA | NA |
| PHENYLACETIC ACID | 1.2149 | NA | 0.7851 |
| PHENYLACETYLGLUTAMINE (*) | 0.7315 | 0.0617 | 1.3131 |
| PHENYLALANINE | 0.1825 | 3.6991 | 0.4680 |
| PHOSPHATE | 1.1303 | 0.1343 | 1.1582 |
| PHOSPHOCHOLINE | 0.2476 | 2.0873 | 1.0413 |
| PHOSPHOCREATINE | 1.3972 | 0.2499 | 0.9557 |
| PHOSPHO(ENOL)PYRUVIC ACID | 0.9571 | NA | 1.0215 |
| PHOSPHOETHANOLAMINE | NA | NA | 1.0000 |
| PHOSPHONOACETATE | NA | 1.0000 | NA |
| PHTHALATE | 1.1291 | NA | 0.7418 |
| PIMELIC ACID | 0.5328 | NA | 1.4672 |
| PIPECOLIC ACID | 0.7088 | 0.9041 | 1.3871 |
| PIPERINE (*) | 0.6267 | 0.4277 | 2.1820 |
| PREGNENOLONE | 0.8097 | NA | 1.1903 |
| PROLINE | 0.6212 | 0.9482 | 1.4307 |
| PROMETRYN | 1.0275 | 0.6005 | 1.3445 |
| PROTOPORPHYRIN | 1.6779 | NA | 0.6610 |
| PTERIN | 0.1730 | 1.3893 | 0.2698 |
| PYRIDINE CARBOXYLIC ACID | 1.0878 | NA | 0.9122 |
| PYRIDOXAL | NA | 1.6648 | 0.0027 |
| QUINATE | 1.1935 | NA | 0.6131 |
| QUINOLIN-2-OL | 0.8148 | NA | 1.1852 |
| QUINOLINE | NA | 1.4077 | 0.1847 |
| RAFFINOSE | 1.6378 | 0.0682 | 0.8282 |
| RETINAL | 0.6953 | NA | 1.3047 |
| RETINOATE | 1.1611 | 0.3554 | NA |
| RETINOL | 0.9700 | 0.1988 | 1.4156 |
| RIBOSE 5-PHOSPHATE | 0.6419 | NA | 1.1791 |
| RIBULOSE 1,5-BISPHOSPHATE | 1.0000 | NA | NA |
| S-ADENOSYL-L-HOMOCYSTEINE | 0.0517 | 2.5711 | 0.3772 |
| S-ADENOSYL METHIONINE | 0.2887 | 2.9760 | 0.5455 |
| SALICYLAMIDE | 1.0984 | NA | 0.9016 |
| SALICYLIC ACID | 0.9550 | NA | 1.0901 |
| SALSOLINOL | NA | 0.4568 | 1.3621 |
| SELENOCYSTAMINE | 1.0036 | NA | 0.9964 |
| SERINE | 0.4221 | 0.9972 | 1.5807 |
| SEROTONIN | 0.8535 | 0.9821 | 1.1824 |
| S-HEXYL-GLUTATHIONE | NA | NA | 1.0000 |
| SHIKIMATE | 1.3468 | NA | 0.6532 |
| SN-GLYCERO-3-PHOSPHOCHOLINE | NA | 1.0000 | NA |
| SORBIC ACID | 1.0000 | NA | NA |
| SPERMIDINE | 0.0152 | 2.9479 | 0.0369 |
| SPHINGANINE | 0.1622 | 1.2174 | 1.4110 |
| SPHINGOMYELIN (CATION) | 1.0000 | NA | NA |
| SPHINGOSINE (*) | 0.1038 | 2.1649 | 0.5072 |
| SQUALENE | 0.3513 | NA | 1.6487 |
| STACHYOSE | 1.0701 | 0.6066 | 1.3232 |
| STEAROYL SPHINGOMYELIN (*) | 0.8695 | 1.5123 | 0.6606 |
| SUBERIC ACID | 0.6196 | 0.0336 | 1.5758 |
| SUCCINATE | 1.0000 | NA | NA |
| SUCCINATE (*) | 1.5536 | NA | 0.4464 |
| TAURINE | 0.6602 | 0.0304 | 1.5917 |
| TAUROLITHOCHOLATE | NA | 1.0000 | NA |
| TESTOSTERONE | 0.6951 | 1.3612 | 0.5824 |
| THIAMINE | NA | 1.1429 | 0.7143 |
| THIAMINE MONOPHOSPHATE | 0.8038 | 1.1424 | 1.0539 |
| THIAMINE PYROPHOSPHATE | 0.4830 | 1.2585 | NA |
| THIOPURINE S-METHYLETHER | NA | NA | 1.0000 |
| THYMIDINE | 1.1017 | NA | 0.7965 |
| THYMIDINE-5`-DIPHOSPHO-GLUCOSE | NA | 1.0000 | NA |
| THYMINE | NA | NA | 1.0000 |
| THYROTROPIN RELEASING HORMONE | 0.0579 | 1.4710 | NA |
| THYROXINE | 0.3319 | 2.0021 | NA |
| TRANS-CYCLOHEXANE-1,2-DIOL | 0.6554 | NA | 1.3446 |
| TRIMETHYLAMINE | 0.0460 | 1.9591 | 0.0359 |
| TRYPTAMINE | 0.0436 | 1.8911 | 0.1743 |
| TRYPTOPHAN | 0.0909 | 2.6808 | 0.2284 |
| TRYPTOPHANAMIDE | NA | NA | 1.0000 |
| TRYPTOPHAN BETAINE (*) | 0.9014 | NA | 1.1255 |
| TYROSINE | 0.3140 | 1.9248 | 0.7612 |
| UDP-D-GLUCURONATE | 1.0000 | NA | NA |
| URACIL | NA | 1.0000 | NA |
| URATE | 1.1012 | 0.1626 | 1.3811 |
| URATE (*) | NA | NA | 1.0000 |
| UREA | 0.9684 | NA | 1.0316 |
| URIDINE | 1.1623 | 0.7409 | 1.0969 |
| URIDINE 5`-DIPHOSPHATE | 0.8663 | NA | 1.1337 |
| URIDINE 5`-DIPHOSPHO-N-ACETYLGALACTOSAMINE | NA | 1.0000 | NA |
| URIDINE 5`-DIPHOSPHO-N-ACETYLGLUCOSAMINE | NA | 1.0000 | NA |
| URIDINE-5-MONOPHOSPHATE | 1.0465 | NA | 0.9535 |
| UROBILIN (*) | NA | 1.3996 | 0.2008 |
| UROCANATE | 1.4392 | NA | 0.5608 |
| URSODIOL | 1.0231 | NA | 0.9769 |
| VALINE | 0.3927 | 1.7720 | 0.8353 |
| VITAMIN B12 | NA | NA | 1.0000 |
| VITAMIN D2 | NA | NA | 1.0000 |
| VITAMIN D3 | 0.6107 | 0.6452 | 2.1334 |
| XANTHINE | 0.7363 | 0.0786 | 2.1851 |
| XANTHOSINE | 0.4909 | NA | 1.2545 |
| XANTHURENIC ACID | 0.5509 | NA | 1.4491 |
Factors:
| F1 | Pancreas tissue type:Normal area of the pancreas with tumor |
| F2 | Pancreas tissue type:Normal pancreas |
| F3 | Pancreas tissue type:Pancreas tumor |
