Data for ST000841
Metabolite structure | All data | F1 | F2 | F3 | F4 |
---|---|---|---|---|---|
16:0 LYSO PC (M+H)+ | 571069.11 | 402319.12 | 641038.67 | 1479286.50 | |
16:0 LYSO PC (M+Na)+ | 263452.44 | 249990.75 | 272849.22 | 354007.50 | |
18:0 LYSO-PE (M+H)+ | 489738.11 | 399613.29 | 448142.22 | 532493.50 | |
18:0 LYSO-PE (M+Na)+ | 133211.22 | 102429.25 | 115753.38 | 91208.00 | |
3^,5^-CYCLIC AMP (M+H)+ | 36252.44 | 35257.50 | 56616.11 | 75702.50 | |
3-DEHYDROXYCARNITINE (M+H)+ | 893883.12 | 853135.00 | 804219.56 | 1036457.00 | |
3-HYDROXYLAUROYLCARNITINE (*) (M+H)+ | 514100.56 | 110432.50 | 131038.89 | 71717.00 | |
3-METHYLHISTAMINE (M+H)+ | 10432.00 | 10430.40 | 8386.38 | 6600.00 | |
5ALPHA-ANDROSTANE-3ALPHA,17BETA-DIOL (M+Na)+ | 18507.78 | 19108.50 | 19232.75 | 16652.50 | |
5-AMINOPENTANOIC ACID (M+H)+ | 1588985.62 | 1208284.00 | 954861.56 | 1207835.00 | |
5^-METHYLTHIOADENOSINE (M+H)+ | 233366.44 | 144715.00 | 182911.22 | 557517.50 | |
ACETYLCARNITINE (M+H)+ | 25082404.33 | 23504046.38 | 32498271.33 | 23115274.00 | |
ADIPIC ACID (M+Na)+ | 33649.14 | 36088.50 | 32158.00 | - | |
AZELAIC ACID (M+Na)+ | 166680.00 | 114918.88 | 162433.67 | 112899.00 | |
BETA-ALANYL-N(PAI)-METHYL-L-HISTIDINE (M+H)+ | 8547.44 | 9294.00 | 7807.78 | 9164.00 | |
BIS(2-ETHYLHEXYL)PHTHALIC ACID (M+Na)+ | 727102.75 | 440441.25 | 439640.56 | 155772.00 | |
CARNITINE (M+H)+ | 7243311.75 | 1944776.38 | 1775022.11 | 13713994.50 | |
CARNOSINE (M+H)+ | 256887.11 | 213709.12 | 120968.78 | 255909.00 | |
CARNOSINE (M+Na)+ | 99314.00 | 74735.50 | 64830.78 | 72707.50 | |
CHOLESTEROL (M+H)+[-H2O] | 408554.89 | 407744.88 | 362676.00 | 267996.00 | |
CITRULLINE (M+Na)+ | 4299.00 | 3582.50 | 2286.00 | 3575.00 | |
CORTISOL (M+Na)+ | 10938.60 | 9164.14 | 16799.43 | 12603.50 | |
CREATINE (M+H)+ | 36029429.25 | 43234542.00 | 38070101.44 | 27735362.00 | |
DESMOSTEROL (M+H)+[-H2O] | 5462.50 | 5199.00 | 11267.86 | 13831.00 | |
DIPALMITOYL-GLYCEROL (M+H)+[-H2O] | 68319.78 | 63067.75 | 62298.33 | 62988.00 | |
DIPALMITOYL-GLYCEROL (M+Na)+ | 465811.89 | 420504.50 | 383138.33 | 236543.00 | |
DODECENOYLCARNITINE (*) II M+ | 89716.56 | 146615.62 | 152087.62 | 250342.00 | |
EICOSADIENOYLCARNITINE (*) (M+H)+ | 22507.33 | 73947.14 | 51087.62 | 13990.50 | |
EICOSANOYLCARNITINE (*) (M+H)+ | 67698.38 | 99458.00 | 81519.75 | 75627.50 | |
FLUCYTOSINE (M+H)+ | 400922.57 | 450448.67 | 472947.71 | 384691.00 | |
GLUTATHIONE OXIDIZED (M+H2)+2 | 3663336.78 | 1987015.00 | 2903258.78 | 7944807.50 | |
GLYCEROL MYRISTATE (M+Na)+ | 33456.33 | 58706.25 | 39626.62 | 13225.50 | |
GUANINE (M+H)+ | 41291.78 | 20594.86 | 27735.62 | 9492.50 | |
GUANOSINE (M+H)+ | 19288.86 | 39255.50 | 15270.12 | 11736.50 | |
HEXANOYLCARNITINE (*) M+ | 1447649.56 | 2163595.88 | 2766116.56 | 3973446.50 | |
HISTAMINE (M+H)+ | 324702.78 | 194743.38 | 238110.00 | 285045.00 | |
HISTAMINE (M+Na)+ | 6491.38 | 5522.62 | 6192.71 | 6431.00 | |
HYPOXANTHINE (M+H)+ | 2528481.00 | 3863705.00 | 4301975.89 | 553736.00 | |
INOSINE 5^-PHOSPHATE (M+H)+ | 2177349.00 | 5045632.38 | 5408989.78 | - | |
INOSINE 5^-PHOSPHATE (M+Na)+ | 86657.60 | 107277.88 | 116977.33 | - | |
INOSINE (M+Na)+ | 198106.22 | 312833.88 | 190893.44 | 40951.50 | |
ISO-BUTYRYLCARNITINE (*) (M+H)+ | 2420641.78 | 1824401.12 | 2523847.33 | 2968230.00 | |
ISOVALERYLCARNITINE (*) (M+H)+ | 1072355.00 | 153946.75 | 654193.33 | 1255481.50 | |
KYNURENINE (M+H)+ | 173701.25 | 166576.38 | 218971.33 | 289277.50 | |
LEUCINE (M+H)+ | 25458898.89 | 17697099.75 | 22286926.78 | 30132974.00 | |
L-HISTIDINE (M+H)+ | 28769.67 | 28733.38 | 25188.67 | 31179.00 | |
L-HISTIDINE (M+Na)+ | 7363.67 | 6109.75 | 6435.88 | 9093.00 | |
L-TRYPTOPHAN-15N2 [ISTD] (M+H)+ | 22631360.22 | 25306489.25 | 24628560.67 | 21712420.00 | |
LYSINE (M+H)+ | 74440.33 | 75276.25 | 85638.89 | 120628.00 | |
METHIONINE (M+H)+ | 1994668.25 | 1462166.50 | 1565453.88 | 2593216.50 | |
N-ACETYL-DL-SERINE (M+H)+[-H2O] | 726554.25 | 461180.00 | 609817.00 | 1057780.50 | |
NAD (M+H)+ | 181567.00 | 114438.75 | 134175.44 | 384151.00 | |
N-ALPHA-ACETYL-L-LYSINE (M+H)+ | 9062.12 | 8091.25 | 10865.14 | 11882.00 | |
NAPROXEN (M+H)+ | 2704.00 | - | 77573.00 | 187993.00 | |
N-CYCLOHEXYLFORMAMIDE (M+H)+ | 152090.33 | 178046.43 | 205569.44 | 125527.00 | |
NICOTINAMIDE (M+H)+ | 13985517.11 | 13202409.25 | 15743006.33 | 14592445.00 | |
NORADRENALINE (M+H)+[-H2O] | 7084.25 | 4425.80 | 6274.50 | 10260.00 | |
OCTENOYLCARNITINE (*) M+ | 435739.11 | 270650.75 | 475061.56 | 904477.50 | |
OLEAMIDE (M+H)+ | 87196.67 | 73593.88 | 87269.11 | 51450.50 | |
OLEAMIDE (M+Na)+ | 296512.50 | - | - | - | |
OLEOYL-GLYCEROL (M+H)+ | 22395.44 | 15221.75 | 14765.12 | 11597.50 | |
OLEOYL-GLYCEROL (M+Na)+ | 431233.78 | 281773.62 | 227262.33 | 101278.50 | |
OPHTHALMIC ACID (M+H)+ | 193345.44 | 137335.50 | 171027.44 | 346345.50 | |
PANTOTHENIC ACID (M+H)+ | 2198782.67 | 1333714.12 | 2131225.78 | 3521528.00 | |
PHENYLALANINE (M+H)+ | 390435.00 | 383120.62 | 364105.22 | 499998.50 | |
PHOSPHOCREATINE (M+H)+ | 1804073.25 | 471905.50 | 401526.88 | 4089881.00 | |
PROLINE (M+H)+ | 1789548.78 | 1527578.50 | 1456265.22 | 1448374.50 | |
PROPIONYLCARNITINE (*) (M+H)+ | 1574131.78 | 1424575.00 | 1489365.78 | 2141234.50 | |
S-ADENOSYL-L-HOMOCYSTEINE (M+H)+ | 22665.57 | 22748.71 | 48484.67 | 50728.50 | |
SN-GLYCERO-3-PHOSPHOCHOLINE (M+H)+ | 768266.67 | 616834.14 | 504388.11 | 646783.00 | |
SUBERIC ACID (M+Na)+ | 50533.78 | 30014.71 | 39964.56 | 28523.50 | |
TETRADECENOYLCARNITINE (*) M+ | 520904.78 | 1215609.50 | 1203948.56 | 1589772.00 | |
THEOBROMINE (M+H)+ | 344221.88 | 309177.29 | 534729.50 | 530946.00 | |
TRIMETHYLAMINE (M+H)+ | 24235.38 | 25992.62 | 28224.75 | 21908.50 | |
TYROSINE (M+H)+ | 2392452.33 | 1836465.75 | 2275946.44 | 3351133.50 | |
VALINE (M+H)+ | 3238461.67 | 2123584.25 | 2611564.22 | 3710924.50 | |
ZEATIN [ISTD] (M+H)+ | 2455082.67 | 2527297.00 | 2538336.44 | 2375084.50 |
Factors:
F1 | Subject group:HIGH-FA |
F2 | Subject group:LOW-FA |
F3 | Subject group:MID-FA |
F4 | Subject group:N/A |