Metabolomics Workbench : NIH Data Repository

Analysis	Metabolite Name	Measured Value	Units	Patient group
ESI Positive/Negative ion mode	Serine	1616450.732	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	1733030.418	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	1781127.8	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	1784151.581	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	1796144.751	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	1812648.383	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	1812849.573	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	1863850.447	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	1875895.467	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	1890794.236	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	1930490.742	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	1940281.629	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	1981240.714	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	1990829.778	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2005189.9	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2027754.982	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2039444.898	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2062773.275	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2065191.869	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2092094.377	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2097152	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2103980.1	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2114112	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2115341.569	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2123701	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2128489.721	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2135843.419	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2148344.169	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2149828.282	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2159394.76	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2165296.078	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2170891.205	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2189566	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2192628.918	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2197227.78	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2205341.187	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2205924.624	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2206433.824	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2209010.476	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2214469.415	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2230119.168	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2252843.644	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2256169	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2274143	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2275849.984	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2277520.964	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2278467.739	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2294188	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2295814.373	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2308918.148	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2317300.288	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2318951.903	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2320529.611	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2328743.262	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2348726.082	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2348740	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2352416	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2353982.784	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2358536.142	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2358807	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2365564.984	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2365954.817	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2373856.443	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2384396.135	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2396119.663	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2405118.562	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2413162.501	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2422616.085	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2426084.357	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2428533	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2443548	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2444399.824	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2447688.884	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2448111.552	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2450314.195	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2459060.454	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2462522.741	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2467050.884	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2471224.428	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2476852.115	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2478615.235	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2482593.03	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2494086	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2499275.056	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2501702.618	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2504356.801	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2514001.727	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2532493.464	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2533622.15	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2535572.465	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2536499.799	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2563022.377	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2564264	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2584184.227	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2595918.948	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2597743.85	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2603938.036	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2606858.676	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2607057.783	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2620279.576	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2620748.88	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2622803.631	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2623428	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2631263.282	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2634875.922	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2640596.861	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2642452	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2656380.744	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2656565.545	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2677566.29	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2684316.092	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2687436.11	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2700044.617	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2710325.677	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2718207.365	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2724368.509	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2726884.952	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2728693	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2734459.379	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2742144	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2750918	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2752788.83	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2753311	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2756307.264	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2759208.705	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2760369.639	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2769823.025	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2778836.527	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2784227	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2791704.954	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2810232.573	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2820301.36	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2825488.18	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2827531.708	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2827701.046	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2828578	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2831037.627	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2835830.466	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2843427.954	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2847854.557	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2850923	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2854889.508	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2855974	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2870082.78	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2871985.188	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2874050.432	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2882993.826	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2891827.903	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2896479.793	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2896807.421	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2901124.437	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2919074.509	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2920705.117	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2922888.722	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2929530.653	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2932327	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2938357.662	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2944944.402	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2953384.765	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2963550.572	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2965844.958	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	2966545.842	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2969712.36	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	2984628.182	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2988454	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	2999940.061	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3000318	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3003940	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3005922	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	3012676.604	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3022613.533	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	3023123.344	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3050957	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	3057248.131	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3068321.958	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3068916	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	3069633	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	3070018.643	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3072207.07	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3076790.955	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3087685.56	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3101786.112	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3103444.859	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	3117995.622	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3119542	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3120535.894	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3140065.355	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3145337.916	Counts per second	CRC
ESI Positive/Negative ion mode	Serine	3162489.277	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3184224.839	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3205667.475	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3222831.221	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3257777	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3264621.041	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3265598.601	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3271900.743	Counts per second	Polyp
ESI Positive/Negative ion mode	Serine	3275528	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3281751.952	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3299469.994	Counts per second	Healthy
ESI Positive/Negative ion mode	Serine	3311204	Counts per second	CRC

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