Name	00D_1	00D_2	00D_3	07D_1	07D_2	07D_3	16D_1	16D_2	16D_3	30D_1	30D_2	30D_3	50D_1	50D_2	50D_3	55D_1	55D_2	55D_3	60D_1	60D_2	60D_3
(+/-)-C75	2328435.153	2698359.39	1423818.012	511722.5299	1209505.715	1335990.81	1164401.162	1403492.827	1965721.749	4655819.66	5044860.216	4178101.345	5215818.876	4490974.135	7416386.03	4352038.371	4774761.071	6053114.861	2555613.19	3942994.632	2602865.332
(-)-Caryophyllene oxide	164385094.3	150971879.4	153867660.8	84035748.58	72613349.45	86652331.51	19462654.88	25742565.09	15366069.01	7094576.8	7041729.113	8583745.581	2720165.227	4126383.158	6039011.215	8134035.982	2868261.797	1879456.717	16263546.83	19920550.46	17834385.1
(1R,2S,3R,4R)-3-[(Cyclopentylmethyl)amino]-4-phenyl-1,2-cyclopentanediol	15648483.38	16959660.42	19147019.77	74443405.52	64844023.97	73468023.08	68134090.25	66553257.28	94264958.21	51205168.07	77518931.62	59914637.3	1331854.597	3604714.379	1474834.292	12867450.75	11362645.87	3737829.295	14461052.94	2549558.395	749687.1279
(1R,4aS,5R,8aS)-5-(5-hydroxy-3-methylpentyl)-1,4a-dimethyl-6-methylidene-decahydronaphthalene-1-carboxylic acid	11694644.73	11787169.79	10518469.86	23337343.28	27298377.68	25013181.48	6965505.825	9073465.301	5702783.357	472472.6903	898676.1882	486193.1933	394751.5305	1249524.013	399947.4532	392004.948	615864.9948	393212.1001	446479.2002	516170.7519	462471.2736
(1S,3R,4R,5R)-1,3,4-trihydroxy-5-{[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxy}cyclohexane-1-carboxylic acid	16789378.78	14471370.84	15803136.6	13323726.19	15929837.72	10529617.91	18993032.13	12152582.82	14550551.67	4224064.07	6270303.649	4659618.073	3274228.948	4265600.24	5015977.208	3602734.87	3996653.216	1951436.3	2972090.387	4487862.995	13871030.9
(1S,4S,5R,10S,13S,17S,19S,20R)-10-hydroxy-4,5,9,9,13,19,20-heptamethyl-24-oxahexacyclo[15.5.2.0Âa,Âa⁸.0⁴,Âa⁷.0⁵,Âa⁴.0⁸,ÂaÂl]tetracos-15-en-23-one	171269.138	194182.0575	209608.0599	177888.4899	232761.3358	212160.8414	174914.3892	185150.6003	186134.4896	1006296.853	718176.7227	1540523.195	3339165.442	7935900.438	6330304.525	3337265.399	6496687.982	1008535.535	8974440.78	3936463.867	13543449.85
(1S,4S,5R,9R,13S)-5,9-dimethyl-14-methylidenetetracyclo[11.2.1.0Âa,Âa⁰.0⁴,âa]hexadec-10-ene-5-carboxylic acid	745594988.2	702946005.7	687190912.7	840490190.7	835056222.2	862264613.3	879396206.3	993954296.1	748403588.2	150977878.6	154242083.2	112957170.5	40644975.67	36566382.13	47170958.39	36818762.03	40402370.25	40040987.05	137718708.5	283438128.5	176464248.0
(1S,6R,11aR,13R,14aS)-1,13-dihydroxy-6-methyl-1H,4H,6H,7H,8H,9H,11aH,12H,13H,14H,14aH-cyclopenta[f]oxacyclotridecan-4-one	18470243.75	21284764.22	20205301.96	9689574.943	9099938.394	11076620.7	1186587.814	1933637.355	2868972.874	1029294.403	616145.391	1089466.151	676015.2124	635282.2341	493864.355	567991.086	514488.8923	506400.2774	780234.6519	547911.8531	472577.518
(1aR,2E,4aR,6S,7S,7aR,8R,11aS)-1,1,3,6-Tetramethyl-9-methylene-4-oxo-1,1a,4,5,6,7,7a,8,9,10,11,11a-dodecahydro-4aH-cyclopenta[a]cyclopropa[f][11]annulene-4a,7,8-triyl triacetate	1607326.519	5151842.781	7927328.392	1109051.521	1495571.765	1592904.269	3353640.267	2264455.793	2212977.142	144032649.5	98829185.17	231190399.6	189544288.9	274680251.6	311778337.6	281757413.8	277051792.4	209887666.7	214360670.3	155663865.5	140164779.1
(1r,3R,4s,5S)-4-{[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}-1,3,5-trihydroxycyclohexane-1-carboxylic acid	1441518257.0	1386497742.0	1417323558.0	1403249222.0	1205775316.0	1037631112.0	2532842192.0	3033065399.0	1978246652.0	1075972779.0	1355337576.0	892528687.9	385171056.0	641840221.6	537782224.2	638938811.2	387240321.4	295864811.0	427441512.9	385161776.1	408975073.4
(2E)-3-(4-Hydroxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]acrylamide	1669475151.0	1670709081.0	1713033682.0	5853506.013	5677399.974	11026292.48	1681511.697	1658568.408	752207.5271	1305253.026	1856256.445	10285045.64	464085.5921	370728.0008	681974.5403	730322.929	425025.9454	544971.4	534255.0038	519155.689	503446.0885
(2E)-5-{(1R,4aS,5S,6R,8aS)-5-[(β-D-Glucopyranosyloxy)methyl]-6-hydroxy-5,8a-dimethyl-2-methylenedecahydro-1-naphthalenyl}-3-methyl-2-penten-1-yl β-D-glucopyranoside	43086785.53	46277991.41	40816004.86	11795308.01	9687163.923	10227040.82	11066603.23	13398240.63	9717982.649	3562561.335	6069714.449	3666520.772	617989.6201	632066.2507	619571.4077	749072.9541	702471.0723	675711.193	1425115.476	751905.5591	1297461.617
(2E,2'E)-N,N'-1,4-Butanediylbis[3-(4-hydroxyphenyl)acrylamide]	643384217.5	639122049.3	631064385.5	940374.7722	1324677.884	2611392.234	716250.3341	653341.3214	725806.2831	690019.7304	620291.6729	5682699.682	554183.0014	532294.0713	566993.3311	624613.5934	595446.2006	574072.1314	596763.8363	482554.1675	458588.0175
(2E,4E)-N-(2-methylpropyl)deca-2,4-dienamide	87930.49696	101990.2704	104532.0525	231091.0141	211599.0875	278502.3884	167715.9193	288983.4269	182577.8155	792554.9919	1414441.203	638412.2267	1680347.184	1153463.5	1468242.285	1380880.502	2469904.175	354098.2324	1695854.93	1431013.843	2172452.989
(2E,4E)-N-(2-methylpropyl)dodeca-2,4-dienamide	1889485.36	1766661.192	1477192.67	754022.7079	2293837.969	2454694.767	22688922.42	19293062.63	21209345.9	123168173.1	167551636.2	169726522.9	147771585.7	81487934.97	141522773.6	92989237.51	118321824.9	112219344.0	76457708.18	95304507.92	82558553.99
(2R,3R)-3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-3,4-dihydro-2H-1-benzopyran-4-one	227041467.6	238202001.7	241112207.6	660648.4424	590099.1122	1046973.892	362945.7124	394000.3927	489619.9445	413366.9162	472137.0822	2514056.084	510496.6875	473760.3814	519781.046	596300.9675	690102.8106	584470.2643	652501.3973	619307.7799	588148.1301
(2R,3R,4S,5S,6R)-2-{[(2E,6R)-6-hydroxy-2,6-dimethylocta-2,7-dien-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol	48393519.73	52564108.16	54335365.36	181955584.2	189270614.6	190890027.9	130615606.0	134279657.2	166196250.8	149804645.3	165985362.2	111233515.5	50870118.09	68187606.48	44205787.73	84963877.75	72922372.36	63023537.49	120195686.4	73623516.45	68775361.4
(2R,3R,4S,5S,6R)-2-{[4-(4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl)butan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol	294723.5521	426425.181	305000.9095	249055.5541	303765.859	309683.174	7671128.12	6740009.196	6824783.341	1723250.586	3001481.112	2108497.65	964701.3934	1338921.045	897109.894	372023.4668	470814.0938	496139.6585	1440536.035	1372753.863	1394597.302
(2S,3R,4S,5S,6R)-2-[4-hydroxy-2-methyl-5-(propan-2-yl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	547444.2606	512923.5083	473132.3686	12199585.21	13510363.66	8548568.689	8146348.345	7758408.814	7040110.657	1589723.024	2450602.24	1353426.394	263988.3578	245815.7726	242548.3957	287263.66	249380.7115	246510.8686	359405.0531	369829.991	329392.0165
(3R,4S)-4-[2-(Cyclopropylamino)-2-oxoethyl]-3-ethyl-N-[3-(trifluoromethyl)phenyl]-1-piperidinecarboxamide	3556601.525	3895514.945	3910994.889	286144.4358	230379.8218	217182.0013	201189.2836	257460.0152	202620.3868	136931.3642	149831.8701	152455.7718	107207.5795	118761.5167	141221.9184	127515.2448	122878.8428	212266.8191	2671149.502	842643.168	789490.2379
(3S)-3-Methyl-5-[(1S,8aR)-2,5,5,8a-tetramethyl-4-oxo-1,4,4a,5,6,7,8,8a-octahydro-1-naphthalenyl]pentanoic acid	57679810.87	60539281.4	58799793.97	9063880.181	11305862.4	10788948.57	5532831.388	10168474.88	5660087.016	1455896.69	555874.6493	602266.7829	346187.2194	1268113.104	818099.6946	253712.6013	453080.7994	235960.3468	401406.756	865734.6205	466190.0344
(6E)-4,5,8-Trihydroxy-10-(2-hydroxypentyl)-3,3-dimethyl-3,4,5,8,9,10-hexahydro-2H-oxecin-2-one	13636960.37	12932979.35	12280528.33	4369615.573	4589615.34	4582275.785	1650394.984	1860560.24	2841354.127	5132172.82	5189389.378	5090359.602	2275311.3	5057107.244	2639225.069	2036722.819	2493769.918	1655529.69	2076135.087	1201351.897	2859310.574
(9cis)-Retinal	51476432.98	57885766.49	55193317.58	46322229.56	48086179.21	48093571.05	55606371.39	58427709.86	59782919.39	55617885.85	55206209.35	50898074.91	34714806.67	43807781.59	34071643.08	36245312.75	35443093.5	32119027.02	41707033.31	29635173.74	28072824.02
(S)-N-α-benzoylarginine ethyl ester	14042223.65	18128430.0	17609080.59	20088567.64	42094130.02	25082996.7	1822887.348	22838807.25	23165110.82	22619210.9	23564242.29	11226586.22	30806386.24	16106699.42	28114400.68	27043265.9	14650132.3	15725781.42	7956393.545	16485565.6	20029062.56
(S)-Nicotine	7269104.341	3903058.225	6377907.189	32549924.97	28292369.59	37686117.17	28283535.92	61266870.98	33414409.46	77300085.1	36301188.66	29179108.15	83263028.28	61573844.93	87986840.16	64398985.82	41010678.69	41790656.79	31885929.51	7104349.723	10758907.22
1,2-dihydroxyheptadec-16-yn-4-yl acetate	87089.03614	224167.0953	180952.5447	112041.3703	176209.2733	199699.029	18642179.82	22669007.74	34259173.66	47134345.31	41146764.13	49135620.5	28515365.2	41780623.59	27237149.71	21889004.17	28114815.75	21256002.29	19128517.95	11864172.62	11406312.65
1,3-Dimethylbutylamine	7883145.076	9000273.208	9178998.792	310542.0075	1275490.905	1387405.05	21160740.4	5907348.494	17939541.5	254815724.5	253969756.1	307676906.0	269958241.3	182632714.9	195756589.3	174147134.0	221299778.0	229169624.7	134664429.0	207492292.2	269635705.2
1,4-dihydroxyheptadec-16-en-2-yl acetate	840658.1409	928301.127	806150.1257	337571.8163	245346.2148	296267.4369	130908080.0	87497697.66	195946468.9	23977315.04	49563439.24	29077321.88	1454890.023	1022266.188	1716926.414	855960.3536	1361030.929	1441798.119	6157661.491	4984486.518	6116495.423
1,4a-Dimethyl-6-methylene-5-[2-(2-oxo-2,5-dihydro-3-furanyl)ethyl]decahydro-1-naphthalenecarboxylic acid	6744621.724	5608901.791	5498999.196	535027.1239	671232.7457	537389.0932	510498.0662	505145.7921	456953.6973	3579302.555	2862414.754	4352477.477	6419220.721	7440102.327	5044471.81	11605181.2	12219901.97	8493342.583	21438103.62	21633910.88	18610254.39
1,5-Anhydro-1-[5,7-dihydroxy-3-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]hexitol	8858570.722	9231712.785	8481554.965	5752766.515	7019297.855	5855654.309	4690158.542	5607430.341	4024248.643	6879654.664	6293489.017	5603753.362	1388437.721	1481590.199	1239150.861	1660397.109	893733.8664	1428287.58	1632992.101	2394874.38	2245762.81
1,5-Isoquinolinediol	14001148.66	18698951.91	11090090.66	16712529.66	21329299.86	22683695.63	13176952.31	17034993.95	15359883.69	133491.8949	383571.9178	449425.2694	148771.8175	124575.7603	229347.6241	184351.5226	301314.5777	432581.3278	346096.7317	573704.8658	337124.4906
1,5-Naphthalenediamine	41495588.52	37429292.68	33405688.19	3710410.504	1840246.859	4276792.105	12939006.51	16651897.47	11329082.5	19148547.09	13251220.57	20646087.12	10439687.32	10137260.7	10978787.32	22925726.01	21331961.0	25889300.04	28360386.29	27665659.37	30194666.86
1-(4-benzhydrylpiperazino)-3-[4-(1,2,3-thiadiazol-4-yl)phenoxy]-2-propanol	6261345.523	6675679.439	7162078.22	6101717.227	6456030.562	4394139.633	4273259.622	4111850.407	6382998.64	11430544.49	9096978.878	10289137.55	14991229.38	14714256.66	10320579.03	16047500.88	16450208.63	15747480.67	17359078.91	14564214.31	13177438.26
1-Dodecyl-2-pyrrolidinone	29344788.71	30783992.46	29553999.09	44701961.6	43739395.04	48011362.97	268722666.1	259624352.9	238566970.1	1162761737.0	1429327020.0	2042392033.0	2793175789.0	1548297742.0	2304706399.0	1731457149.0	2089868339.0	1559104686.0	1250227949.0	1536469171.0	2224079980.0
1-Linoleoyl glycerol	502844513.7	468460179.2	433628309.5	357342995.9	259036744.6	366503763.7	94782631.54	81664184.35	73321767.14	35960194.67	33760749.48	39770765.66	35345748.81	25023090.44	35250066.46	29273431.03	26277658.36	39067565.18	414959466.1	345204788.0	336065120.6
1-Methyladenine	83583603.02	80963630.43	68444602.15	40689302.32	56599044.42	43614906.7	6384272.338	29581818.86	30075804.32	23478305.58	34261649.24	30012883.82	7467344.073	9482780.21	8027199.363	3119662.072	2387011.066	3670478.827	5098698.053	2681059.207	2319002.21
1-Methylguanine	8377708.782	8781669.824	8243137.28	5361437.779	4083692.994	4752077.552	939920.7484	892757.0873	1027777.033	1799292.963	1237828.265	1187302.609	1797061.934	1217313.472	1556151.326	1142964.786	1087620.746	1368071.655	1135453.866	645707.3017	1250748.906
1-Nitrosopiperidine (NPIP)	6942838.495	8067358.777	3697127.757	43966077.43	47533713.96	60443604.22	29071404.87	25546427.95	31031163.14	1161770.781	980689.4182	1156036.132	185371.604	193353.4979	224002.9809	211083.7185	162001.2323	180728.3253	292390.9828	291488.4464	332994.0444
1-Stearoyl-sn-glycero-3-phosphocholine	717707250.7	759978160.8	729122267.6	131469817.8	105747278.9	152821598.7	61649594.94	54494869.1	51866006.14	57486422.32	50377319.1	72056648.48	48637031.22	47324730.92	44083872.03	46112163.33	62811516.26	56819317.34	253048380.7	76480341.67	173774012.9
1-Stearoylglycerol	11198532.62	10394819.97	9209369.018	3865207.673	3074221.824	4211980.64	1076329.315	656304.9589	1510116.24	928626.6292	1218187.559	1200906.156	760216.9219	797687.5129	693518.9505	898666.4844	456912.7441	1002807.719	6792180.894	7153306.414	9621682.066
1-Tetradecylamine	288820.1784	284927.1579	276510.0538	270604.1543	273418.9606	259794.8044	323013.4786	266077.5937	325388.0346	2352508.419	757630.7647	841849.0289	5865681.864	3094177.954	4404483.728	17427021.88	7880089.005	6362058.603	9069379.463	16878367.8	12249127.82
1-[(2R,4S,5R)-5-(3-Cyclohexyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]-N-(4-methoxybenzyl)methanamine	17605403.76	17410496.11	16748411.69	524216.437	296453.6781	537949.6418	328272.2024	209836.6607	164495.1724	178752.148	180784.5206	177281.8841	223113.6761	206627.1898	238500.4832	197705.8534	188337.6121	193028.6258	694138.3276	763813.0787	1157402.905
1-heptadecanoyl-2-hydroxy-sn-glycero-3-phosphocholine	47347318.09	51505370.6	47275099.69	4715488.082	4262128.221	5329196.979	4568928.761	3132124.324	3309887.293	5902797.692	5394172.013	7299101.575	4665277.602	5094307.274	4735378.302	3389894.944	4938532.1	4531295.601	9371585.048	3138561.573	6909750.14
1-palmitoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine	228596641.9	217229237.9	218914524.9	119790682.1	107804406.9	122916086.9	157660519.4	147091327.6	123310744.1	103020559.3	100121407.3	121980773.5	59571528.32	55271398.94	51546760.58	35328302.23	45394403.41	41870178.46	82442820.17	25983132.65	54740928.67
1-pentadecanoyl-2-hydroxy-sn-glycero-3-phosphocholine	6454957.904	6889676.389	7029015.616	2020747.352	775924.2959	2001348.421	1823120.679	1563295.412	1380389.414	1321954.275	1441043.678	2039513.802	492512.3217	425472.0528	191517.42	539229.3173	609720.1067	473774.6236	3143046.936	1061078.039	2223719.039
10-Nitrolinoleate	1791240.07	1665302.357	1687801.735	4325731.824	3099698.27	3684706.734	133948.1316	124008.121	213830.9703	124603.2315	310321.486	178725.4309	138571.5817	117369.895	468853.8081	152646.718	119395.1879	184911.0696	701746.7008	788021.9504	1499481.423
12-Oxo phytodienoic acid	71750235.12	61306623.86	62223056.46	212943186.2	163332988.0	201948103.9	16400339.33	9094039.818	15992528.66	25634122.52	23204781.21	32430063.47	2618742.741	2605136.614	2704159.174	2482871.394	3704840.439	5216180.063	14166725.96	32132793.46	58106843.14
13(S)-HOTrE	42913556.52	37139235.32	36092966.47	138656829.8	103497786.2	120808320.6	2905848.096	2896287.637	2824310.652	792957.2338	730431.6622	764057.0858	228063.3779	480175.5936	540287.1803	330501.5037	180767.1095	260737.3953	1601851.042	3578981.573	6703877.62
17α-Methyl-androstan-3-hydroxyimine-17β-ol	10517191.63	9747968.193	9682183.592	2304276.479	1977767.267	2732957.084	412280.5954	279487.9102	231458.2665	870045.1016	545989.0789	941398.5861	674859.3579	325562.48	801195.9521	829106.4885	779981.6931	980786.0286	2285135.926	1919748.718	1154881.966
19-Norandrostenedione	1747984.083	2128130.313	2210081.597	15355417.64	16499094.59	15080875.63	8042574.503	7937095.434	9673119.134	6570499.163	6237338.526	5101910.894	4670030.028	3985207.989	4876169.215	8896887.921	7210302.199	10810739.51	11248366.41	13612831.03	12663734.19
2'-Deoxyadenosine	153056255.9	152152422.6	138320692.1	54913303.98	40143786.65	44385756.85	5226550.16	5587632.922	6866556.573	2705694.548	1892226.833	2405804.258	538465.7573	982787.04	987680.1736	601336.8573	648730.2499	782434.8322	1890046.905	2562902.661	3484609.316
2,2,6,6-Tetramethyl-1-piperidinol (TEMPO)	2604348.052	2366949.139	2302755.437	2165996.085	2220607.339	16915559.2	1712005.296	6192862.939	8640744.184	27297407.45	33737162.12	32480894.97	34877722.12	19474279.58	30905931.41	29886903.67	20050892.04	33399620.9	26427712.69	52231364.2	50278743.18
2,4-difluorophenyl 4-{[(5-{[(dimethylamino)methylidene]amino}-1,3,4-thiadiazol-2-yl)thio]methyl}benzoate	2301250.262	2027599.937	1741875.682	1800215.895	3275579.133	658301.1411	17307529.97	19019597.63	13940203.22	34043058.6	31325660.08	29436480.3	3980341.614	3119617.263	6697596.917	1351223.232	1642604.949	2749553.599	759960.0246	584629.1577	617493.0606
2,4-dihydroxyheptadec-16-en-1-yl acetate	345125.3656	303763.9444	257016.2331	209948.3616	214177.2341	168232.2576	945148.8722	1144212.636	1596767.209	2726770.883	2913619.269	2152748.875	1318409.581	1495083.87	811506.3234	1068655.179	928073.0677	792920.2639	997979.3596	707424.9739	225425.878
2-(2-amino-3-methylbutanamido)-3-phenylpropanoic acid	1351692190.0	1341172746.0	1341520909.0	52853205.76	55751708.91	62940440.09	42312228.11	34596019.42	1241243.112	21506937.91	21583902.58	1817272.584	8344568.655	7520567.739	8463018.761	15690469.78	15967289.43	17142455.55	248954147.5	213813860.4	172004361.6
2-(2-thienyl)-4H-chromen-4-one	1360598.529	1307340.386	1089692.982	2984284.148	3223940.377	3528019.193	2091641.2	2502765.669	2042966.893	2267246.025	2281279.075	2005433.87	10148316.87	10475716.67	11727593.81	20230093.69	19356137.06	18698133.74	17582907.09	21058908.54	17190446.12
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one	19451887.8	20779306.42	22202927.39	453638.2031	451117.8046	533169.8282	424671.7769	414679.8284	415583.8388	1068197.185	1638855.955	733683.2602	473663.0371	311751.2482	450842.5752	366146.0884	338535.3203	596281.2594	433297.0677	631051.9956	813171.8117
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-4-one	95251614.51	114731453.6	92963912.52	302038622.8	206205583.0	128027238.4	1540325413.0	1872511429.0	1199518275.0	1224461698.0	1194277813.0	846498184.8	262139121.1	272449457.7	199377870.3	307134669.1	208724100.1	186954452.9	242364699.8	235993407.9	194960300.1
2-(benzylamino)-6-methyl-5-(2-methyl-1,3-thiazol-4-yl)nicotinonitrile	18363491.62	17739254.28	21303566.75	15795691.34	16211484.41	14820016.65	24946304.39	23833153.54	23420474.42	41510792.76	39957758.14	39640203.09	31396020.73	24455217.78	25101837.48	31351723.15	32118556.58	37144961.57	34357874.42	3310481.113	3647695.733
2-(hydroxymethyl)-6-{5-[3-(hydroxymethyl)-5-(3-hydroxypropyl)-7-methoxy-2,3-dihydro-1-benzofuran-2-yl]-2-methoxyphenoxy}oxane-3,4,5-triol	1086721.961	1050444.582	1032704.148	763820.1421	940132.1765	975870.6461	6292216.336	5433343.874	6770220.033	197111626.7	149466961.7	194527862.3	149299759.7	237210788.5	173623972.3	105081124.3	134959369.2	114501150.2	93360684.89	72700463.77	87758507.69
2-(tert-butyl)-1,3-thiazolane-4-carboxylic acid	1457956.498	1360775.813	1303476.945	528424.2507	607290.1028	554605.3404	442982.6953	478749.4228	478528.1472	717687.2149	543206.8446	461250.3168	6452555.086	4300007.996	5661655.426	27307408.82	20611704.86	23905436.59	11375592.38	6861830.902	4800209.382
2-Amino-1,3,4-octadecanetriol	1348666166.0	1412197374.0	1321757190.0	599291263.0	707543222.9	829842436.2	202271010.2	232359223.7	224973056.6	77413600.61	68146061.8	51739202.21	64380778.53	65150325.75	55099723.31	257175077.1	221106824.3	229877809.5	204839880.8	219766640.0	225889487.9
2-Aminooctadec-4-yne-1,3-diol	1030626206.0	1006505464.0	988892947.7	138130407.9	101486699.1	143930825.4	6947195.078	6495542.115	6152004.186	4487518.109	4322661.128	4483575.688	1469117.889	1501879.134	1266812.764	1715263.042	2111344.851	1423841.819	16143401.96	10237229.58	18635193.34
2-Furoic acid	10333420.01	11110792.89	8798152.819	27096252.67	31842273.15	24217444.51	41405167.57	41038051.68	40935585.94	37012643.02	36902919.66	38766615.49	54733207.96	53852540.37	51768428.05	56972228.39	51248992.97	52299233.6	48406735.1	56062043.15	49004755.82
2-Isobutyl-3-methoxypyrazine	234630.335	338326.6892	302455.7199	1358090.355	1654982.932	1404109.266	1892358.022	2488528.666	2759037.924	2080463.157	2657012.178	1061985.482	717072.6829	588285.8331	614007.8193	701135.9649	544639.125	746607.2064	505878.7325	1159489.417	1175002.253
2-Isopropyl-5-thieno[3,2-b]thiophen-2-yl-1,3,4-oxadiazole	16434643.24	16926250.37	15388358.98	3157777.118	4037820.68	3845615.263	3516884.153	3104797.092	4697074.355	11527307.27	9284149.837	13621796.73	58674788.82	20410545.8	23002220.95	31851039.01	38765649.45	42692389.42	28798099.74	33679471.93	49124314.96
2-Methoxy-N-[(3S,3aS,8S,9S,9aS,9bS)-3,5a,9-trimethyl-2-oxododecahydronaphtho[1,2-b]furan-8-yl]acetamide	323435107.7	291877833.1	293377503.0	209817310.0	144870531.9	226450851.0	77599258.31	78448704.9	73448089.73	51646307.53	75060549.03	59825462.66	19919121.77	36004541.98	30333376.06	20433625.25	13925401.42	15440116.77	206386286.9	89092524.36	121518086.8
2-Oxindole	25180841.72	27043508.23	26586099.0	111970133.8	108785927.3	102525033.1	10291153.4	13028276.81	23106462.76	2254888.587	2440954.461	2859919.157	434878.8654	2965010.145	559610.8052	1948635.237	653166.0409	465214.9268	2773114.701	875282.0922	704670.7919
2-Palmitoylglycerol	401383.3893	357592.8623	209674.8673	237823.9713	248556.2658	209954.2162	4613623.259	2313724.111	4457730.55	7650915.443	11945986.52	9776785.669	269557.5952	690318.3002	356646.084	241354.7978	322939.4245	208705.7694	291717.1478	355024.7239	415973.9702
2-[4a-methyl-8-methylidene-4-(3-methylpentanoyloxy)-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid	159156.8303	234204.1316	257114.2434	969423.4209	1327541.779	693764.0186	10983664.34	4097842.271	8323644.103	31805751.54	30668055.13	29536496.64	17138690.59	14446498.07	18869265.78	20940378.05	18020319.27	26257377.95	19093986.35	25211222.14	29094436.33
2-benzyl-6-hydroxy-2-azabicyclo[2.2.2]octan-3-one	323867843.1	283435531.0	322088742.2	318162939.5	347040611.1	439525185.9	598910448.1	540943064.4	294494249.1	615580946.6	702930633.2	598765811.7	260893612.2	256633119.3	280563462.5	393166141.1	260109897.7	295789670.0	336149876.0	391067762.8	391180049.2
2-{3-[(4E)-6-Acetoxy-2-hydroxy-6-methyl-3-oxo-4-hepten-2-yl]-6-(carboxymethyl)-2-hydroxy-3a,5a,9b-trimethyl-5-oxo-2,3,3a,4,5,5a,6,9,9a,9b-decahydro-1H-cyclopenta[a]naphthalen-7-yl}-2-methylpropanoic acid	255618697.6	324429921.8	305976639.7	339936581.3	335757633.6	319238851.3	225606907.8	164294370.2	199135559.4	131082366.9	134279620.5	108693136.2	49274128.76	53348449.18	48305444.09	50902896.79	48871872.6	52868033.4	58098953.25	10927933.07	52977055.55
3',5,7-Trihydroxy-4'-methoxyflavanone	3083364.228	2981963.461	3298982.565	819235.2015	895910.0101	925073.3844	765504.2254	812012.8427	855684.6117	3618733.507	4544464.782	3570701.172	2349676.041	2269129.065	2984282.954	2695625.9	1970532.141	3557502.29	2596727.194	3359822.989	5759272.1
3,14-dihydro-15-keto-tetranor Prostaglandin E2	350752.111	325144.0039	298857.353	1512875.144	2370646.795	740478.8705	935742.9116	836824.1472	479927.7146	321850.3009	328591.7697	262303.3065	540420.7351	976095.1577	1230140.012	178958.9454	167141.0361	180357.9613	3988440.005	4373087.753	5797468.513
3,4-EDMA	872965329.2	1005746654.0	1025705284.0	592670453.8	761947585.9	750644591.1	255491574.6	206297368.6	201090489.3	29858052.3	34860015.83	46560249.59	31781082.29	13931390.37	40790075.15	44146496.1	31608717.53	68218989.3	38065944.11	89335407.65	75524037.75
3,4-Methylenedioxy-α-pyrrolidinopropiophenone	134465917.8	139419992.6	134498054.0	123681352.7	88758132.69	111955066.5	132131930.2	113230986.1	94937795.32	8806600.342	15592045.45	12727406.76	2907165.214	3695981.088	4036018.047	1780168.621	558088.0331	559581.3211	621847.4494	378453.4282	2191349.368
3,5,7-trihydroxy-2-(3-hydroxy-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-4H-chromen-4-one	1467557.174	1377544.711	1247984.132	940038.5973	872557.6676	774028.4007	8741057.941	13150918.16	4044840.041	12182002.35	9704864.857	7770983.92	6413485.896	6331812.663	3851814.53	7611139.191	3487343.9	7272584.04	8241283.644	11849222.49	8316610.632
3,5-Dimethoxy-4-hydroxybenzaldehyde 丁香醛	2475944.438	2692771.937	2619269.959	9546019.681	9940027.053	11303597.76	12079488.43	9206955.799	14361302.97	8407293.802	8743534.847	9393736.767	4234967.532	5464384.742	3028585.571	6930641.266	5893320.448	8623111.455	4150626.924	8743075.338	12155887.48
3,6,9,12-Tetraoxatetracosan-1-ol	1824222.847	1937730.207	2909225.618	4035709.314	3284363.471	7578256.932	2924850.68	3531759.891	8390995.822	17753094.16	7701927.088	5201702.151	2780921.572	3490210.866	3314502.253	9233212.446	3696802.974	3001333.132	7065346.838	2875401.112	2298896.818
3-Methoxy prostaglandin F1α	451010.3694	481072.9396	505011.3321	513040.6206	569652.1327	553906.6988	6601177.958	4677398.014	7004850.766	13447384.35	8894318.462	8000236.787	2454532.125	5091399.774	4386915.215	291306.5325	770126.967	1034817.051	260626.0044	846873.7219	886607.044
3-[(2-chloro-1,3-thiazol-5-yl)methyl]-5-methyl-1,3,5-oxadiazinan-4-ylideneamin	37053128.06	34184441.79	35199676.77	512503697.8	430227532.7	291233255.8	1155533094.0	1025366231.0	791204113.9	1245040237.0	1018237995.0	920369454.2	298724282.0	298520115.3	328895294.3	158378132.5	173520699.6	195841034.1	113085364.1	126980323.9	116235306.0
3-{2-[(1R,4aS,5R,6R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-decahydronaphthalen-1-yl]-1-hydroxyethyl}-2,5-dihydrofuran-2-one	1124065.727	1421176.65	1504186.637	623535.6555	520011.9153	509359.1797	343715.5627	334441.6112	503700.5554	3507013.046	2748631.202	3456153.242	7741749.076	6937390.972	6999710.371	20123406.92	24507644.21	15627365.85	26777590.98	21221560.11	18447742.6
3-{2-[(1R,4aS,5R,8aS)-5,8a-dimethyl-2-methylidene-5-({[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-decahydronaphthalen-1-yl]ethyl}-2,5-dihydrofuran-2-one	173299150.3	174976893.5	168209204.1	60933117.92	69151457.15	64682041.33	54947309.63	60660303.09	54417992.85	93585263.37	53982704.2	35993831.89	29948371.41	27839940.01	34016486.72	42336711.7	54453029.63	44118582.45	14281230.19	91843809.57	59530713.44
3-{2-[(1R,4aS,5R,8aS)-6-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-decahydronaphthalen-1-yl]ethyl}-2,5-dihydrofuran-2-one	41283048.01	46615634.54	36535282.96	3870052.721	3873504.789	3757950.991	1190184.934	892027.6357	1803531.347	2302489.486	2605008.606	7269703.114	5250512.73	2816721.395	4329309.672	6850179.77	7284988.4	7956204.293	13293046.19	19760620.46	22670522.25
3-{[(2R,3S,4S,5R,6S)-6-{[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methoxy}-3-oxopropanoic acid	688144.246	716724.4358	677669.5241	928848.2783	842751.8277	927979.2999	9120808.313	12087694.55	5274316.786	13762454.28	12727050.39	9775455.814	3958368.185	4633581.944	2510038.408	4798229.581	1704888.861	2984158.399	3306915.804	4273793.225	2894973.739
4'-Methoxyacetophenone	15240502.89	15540569.28	18422911.42	5710767.288	5649662.644	9275177.987	4744096.136	3701624.599	4973601.54	7445022.323	7214910.128	6426099.843	13191320.25	11577125.19	17185225.83	15377894.52	15379141.42	19777216.57	19928946.46	25606609.13	26813335.23
4-(5,7-Dihydroxy-4-oxo-4H-chromen-2-yl)-2-(β-D-glucopyranosyloxy)phenyl β-D-glucopyranoside	11279436.69	21151174.2	23719892.59	2194320.799	973867.8846	2021136.252	451694.8061	503543.2528	455933.8229	383682.4979	381837.7405	384705.4654	3021929.18	1717155.212	2091487.476	3421296.18	1769318.692	2798408.452	3672660.585	498706.6134	473772.1094
4-(trifluoromethyl)nicotinic acid	338207629.3	328729730.8	342513641.6	368870.1018	366736.0507	935695.624	430396.1688	275892.1316	289371.081	300899.2686	299594.6068	331780.9204	344788.907	369355.9591	381931.2771	461916.7245	438077.1216	407017.7999	633620.1636	558150.9401	613378.2285
4-AMINOBUTANOATE	856651941.8	902297684.9	800060168.5	769486463.7	525430151.1	601407181.8	215804290.1	175072817.4	252693184.5	341080753.0	290263879.0	280031568.2	370426544.3	218640081.8	258248044.1	231655780.9	248434905.2	233639931.9	930121145.0	965098637.4	1016056900.0
4-Acetamidobutanoic acid	14441885916.0	14712811755.0	13084167793.0	6472731806.0	6677855557.0	5754848343.0	5939279096.0	5694561366.0	4548354595.0	5458453121.0	6455411024.0	5219131224.0	3515209421.0	4185314379.0	2984990957.0	4129130383.0	4205351406.0	2781296605.0	5211687861.0	2523680669.0	2019519418.0
4-Coumaric acid	12763015.89	16444982.74	13057380.8	5807866.107	4119265.381	6717015.901	35231189.83	40140740.66	55251245.74	51350522.11	45942007.79	40668700.75	9034025.487	7499937.114	14661407.6	15657269.88	17935402.74	22809592.09	25499146.1	21933698.49	28935832.49
4-Cyano-N-[(1R,9S)-11-(4-fluorobenzoyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-3-yl]benzamide	963831.7277	1047836.569	951699.6065	1998615.142	3148860.493	2083617.991	2400291.438	3801299.837	2160206.415	3069195.071	2300140.164	1908363.326	3438197.286	1952670.474	2575635.792	2161687.159	2103671.271	2645800.06	2616624.971	2417023.758	1283899.275
4-Hydroxybenzaldehyde	85876647.02	88872849.3	81388135.38	7798339.915	6335191.273	7191072.219	7424861.575	7109572.187	6693402.258	19176588.61	13359708.82	19784211.53	13808555.58	9762513.532	9449475.325	19342161.81	18157366.62	20811943.81	34535948.75	29276122.07	31637803.45
4-Hydroxycoumarin	519613384.8	479175045.4	476175628.6	829507112.3	573419402.3	753358348.0	40767187.86	44784757.79	36586756.64	45704386.06	34664098.71	34383041.93	46209819.81	46645447.95	41761523.78	44082060.31	39283529.31	41215104.98	482969868.8	594437508.0	629534050.4
4-Hydroxyindole	8153417.094	8295865.903	9822767.855	9249724.071	13307904.57	11808809.67	5033785.938	5320641.811	11045802.65	1724982.354	1783106.138	1276379.604	446701.0664	666911.2702	503916.6137	825868.9024	1016326.18	642224.2378	630371.5587	765961.9664	677122.6791
4-Methoxy PV8	177603.4503	173139.0736	162699.4325	219632.4201	151935.4952	614302.1732	590082.4442	221344.4287	443857.053	14702705.49	13565609.61	16878400.6	32274364.9	24756081.93	25240953.58	29755020.32	37545512.49	32527217.47	36311500.99	28487124.57	36945198.26
4-Methoxybenzaldehyde	2029082.542	4093305.596	8528851.849	3998623.391	14880802.06	41590055.32	452512369.0	158097946.5	254739211.0	2274236693.0	3362326408.0	2855591712.0	3014091099.0	1770730339.0	2639308524.0	1882736577.0	2097580108.0	3234452638.0	2091076193.0	3599426758.0	4117176732.0
4-Methoxycinnamic acid	1482729.874	1323178.478	594340.0079	4217243.325	2823969.218	3561069.717	14671441.77	8746593.137	7187173.811	5861123.039	4154125.738	14269227.51	16689982.0	17849385.93	16298782.76	19416200.67	6882731.881	13507476.39	2858083.659	4402225.338	3864630.751
4-Methyl PV8	148627.0101	155401.4394	131264.9853	231011.7567	174458.8296	178614.7985	861113.2847	386667.8803	434881.3484	7699863.668	10916858.52	12880783.84	12199832.44	6947428.903	10396431.77	9802772.902	10810876.5	8652978.337	7675844.23	11750944.78	16598173.74
4-Methylumbelliferyl-α-D-glucopyranoside	3783359.668	3020248.954	2874422.983	969808.8642	1023366.668	1249906.068	538046.269	520836.3601	477483.2754	1471494.778	1179974.788	3593945.771	26181463.73	14276704.18	24546287.17	17804574.81	27041162.34	22604235.11	15109964.49	15650599.82	16352479.15
4-OHE2-1-N3Ade	702664.9677	727617.8837	699561.1603	9706590.205	22075669.22	8504691.003	3317556.605	2006058.467	2971459.853	868827.0517	314497.0746	411263.9686	358490.2944	434522.1516	443421.5777	429782.8016	496563.7777	423306.5694	490019.1299	391850.6036	458241.8996
4-Pyridineacetic acid	3680278.984	3766155.232	5305101.584	25490119.51	20784143.93	19719255.76	12834058.2	15996319.01	15284258.96	5279246.616	4975512.251	5342390.804	4104244.745	2668188.86	5482670.859	4279562.539	3988180.628	5046690.746	5416512.522	7941892.298	8245767.622
4-chloro-5-morpholino-2-quinoxalin-2-ylpyridazin-3(2H)-one	1630072.978	1337560.726	1214409.247	8629855.379	8399699.579	6967553.154	8149627.899	8482078.401	6336743.452	17286469.09	14994430.4	16087721.43	30024565.12	32912370.26	35081992.05	41089865.04	36175269.26	34206835.86	24736849.81	26573446.76	23499135.27
4-{5-[(3S)-1-(3,4-Difluorobenzyl)-3-pyrrolidinyl]-1,3,4-oxadiazol-2-yl}-N,N-dimethylaniline	25686801.24	17305441.46	24769853.99	1707222.889	2751259.585	3828976.637	3110429.914	1968345.874	1151226.37	3829947.369	1599600.797	2229249.294	7268091.546	4249053.861	2682512.827	4423176.6	3734702.348	5172125.385	8432276.416	2833326.03	5157901.081
5'-S-Methyl-5'-thioadenosine	72370068.83	76163029.28	69755804.86	301230959.5	289808673.9	288268623.4	193005547.8	183900478.4	212877363.2	100631590.6	136236094.0	114500082.3	132565770.3	160978516.2	120218304.9	52905462.28	54515199.59	60434903.17	50072462.28	41934123.56	34574562.76
5,7-Dihydroxy-2-(4-hydroxyphenyl)-6,8-bis[3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]-4H-chromen-4-one	21348294.16	22976315.55	21801705.18	17588830.58	22811148.36	18923816.08	20985450.74	36945041.54	14856821.51	38270053.76	30883135.95	21898194.55	8175930.938	9972682.545	8461690.643	10861016.91	8470077.983	10049097.63	11044349.65	14838898.63	11487961.09
5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one	18286214.85	17368592.54	16933676.56	4619068.262	3983907.634	2897801.493	23274260.3	29173708.99	18817910.57	27332511.12	22840136.49	17933034.84	4897983.14	4086738.288	3422103.171	4791904.471	2510023.645	2885971.621	3914837.995	5388496.071	3744552.651
5,7-dihydroxy-2-(4-hydroxyphenyl)-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-4H-chromen-4-one	2594240112.0	2506667500.0	2510731738.0	1175388432.0	1179910003.0	990105922.8	727906756.8	927652015.7	512557315.6	190620930.4	210441403.9	151548185.4	86303414.73	51821886.68	51233224.8	58073816.22	48291287.29	47123067.94	239598588.2	546310605.8	469894294.1
5,7-dihydroxy-2-(4-hydroxyphenyl)-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]-4H-chromen-4-one	1036728.54	921728.4821	932960.4116	1275447.236	1439817.094	1326626.167	2058562.726	2874231.844	1541524.784	4608721.761	4671062.528	3105202.522	660439.8584	1009638.436	778457.4263	1610017.931	776695.1536	573747.1214	996371.7438	1743002.521	1134331.622
5,8-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-4H-chromen-4-one	1522279.512	1746129.437	1465920.636	6590453.186	4787848.986	3418277.556	38963248.74	47609755.21	31664345.2	44138703.38	40085016.43	35265727.03	11958298.19	10526960.15	8666652.732	8468897.663	8640131.232	5476191.468	6266427.453	5360048.113	5039643.929
5-Fluoro-3,5-AB-PFUPPYCA	3662326.844	24529526.6	2634412.938	94234431.13	9745828.332	17185757.86	2677184.717	1939081.575	27527485.23	1420192.272	71769299.9	37184124.74	618047.6322	8444481.773	1463521.392	4251702.023	40078893.46	1193956.37	3875696.305	1574419.885	539727.9118
5-[(2R,5S,10R,11S,14S,15R)-5-{[(2R,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-11-hydroxy-2,15-dimethyltetracyclo[8.7.0.0Â?,⁷.0ÂaÂa,Âa⁵]heptadec-6-en-14-yl]-2H-pyran-2-one	332670.8522	295497.9557	285055.3982	363553.5118	275214.9499	262773.951	440354.1258	203803.8441	175497.9896	1210690.918	1233972.893	1440059.737	2856171.493	382754.0362	1279426.404	902598.7549	932835.2114	1737980.86	475820.2508	3011568.548	3706328.291
5-[5-hydroxy-3-(hydroxymethyl)pentyl]-8a-(hydroxymethyl)-5,6-dimethyl-3,4,4a,5,6,7,8,8a-octahydronaphthalene-1-carboxylic acid	9175234.004	10184899.93	11487877.34	3424575.27	2313925.866	6608511.029	702448.0047	643919.0386	744540.1018	1841556.144	358679.992	556295.2271	6530435.554	11851546.57	15433447.96	186763.2878	480939.7651	589330.1868	2055335.275	1357447.043	1902420.382
5α-Dihydrotestosterone	91102.24508	100482.2655	144791.0062	147152.7142	101261.3903	218675.6739	3653213.093	4264240.881	5912274.09	9812062.737	10242498.24	11084717.44	5936938.935	6726288.136	5252385.958	4665192.556	3569931.307	3218453.862	3348726.086	2272110.886	1607276.628
6-Gingerol	5401949.733	6379583.248	5948813.265	472289.7648	411938.3879	414788.5869	184590.0184	164515.0673	159388.4809	182803.1946	198055.6174	175028.1561	156732.7208	115648.8015	136659.1126	155318.2871	111029.0391	128178.3416	1027557.793	932478.6062	1029321.645
6-Methoxyquinoline	560948006.6	575826118.7	687787569.4	5596526.546	6865602.066	7120532.463	6276169.318	10213888.33	6061860.782	9515794.495	14153686.0	7894105.423	3482665.977	6669642.545	9698483.516	9551771.557	4779005.248	5896645.87	13109386.68	7173079.332	6437566.393
6-Methylquinoline	235641786.0	242827783.9	283953092.2	2155887.194	7996806.423	5575329.6	2938944.725	1454891.347	1377873.853	928573.1768	704121.9139	712720.342	2530000.083	1883082.499	2761028.622	8231786.096	9143209.874	4977310.852	2876804.167	2426121.828	2074653.7
6β-Hydrocodol N-oxide	1089987.433	1063785.455	949999.5271	609391.1306	631405.7948	762045.6898	2449206.041	1083635.047	1297550.119	7529383.057	5496842.384	8385463.757	705517.9604	1963102.614	904428.0448	479887.2144	510814.1069	498398.9129	2022064.302	940289.7949	1617355.611
6β-Oxycodol N-oxide	987292.988	978447.6685	936608.804	2510231.681	3767434.457	1752909.382	2385537.088	3489836.027	1295411.255	5997045.545	5735051.995	6070686.746	746064.1552	1603435.466	705214.8537	671177.4508	694374.1936	832488.3058	1220563.033	712783.4792	725255.5037
7-Hydroxycoumarine	869759805.2	859395519.9	882270360.5	888364685.1	752916661.2	644609389.6	1550539219.0	1852332556.0	1229882754.0	703788125.4	871270068.9	587763509.5	260771554.0	420883864.9	357613888.2	422094479.0	259729170.2	201965204.5	275485138.4	253083787.5	268374224.0
7-Methylguanosine	27586785.27	26079556.12	24880713.14	16685384.46	13043941.64	14640536.51	3647960.451	3114109.236	2997444.425	6859300.978	5597896.495	4623744.929	7031823.173	5034485.286	4798293.311	4149000.885	4641844.938	4617255.863	4251679.423	2975248.228	3709936.321
7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-3,4-dihydro-2H-1-benzopyran-4-one	267883612.7	255025565.0	268544782.9	1061259.233	946984.2194	1091393.037	714488.814	668880.4648	689339.41	548275.4609	521714.706	5174809.745	419482.4752	379538.6935	400350.6255	499675.7779	477485.1527	447538.7805	565545.7149	481444.054	443567.4558
7-{[(2S,3R,4S,5S,6R)-6-({[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-5-hydroxy-3-(4-hydroxyphenyl)-6-methoxy-4H-chromen-4-one	82480538.63	85176950.99	76254810.36	50715245.97	45489898.18	44391201.29	27074219.53	35077669.13	9715969.716	9896690.801	8630778.78	2403830.384	2978400.972	1123940.118	1549434.343	2161079.776	1596203.398	1642823.534	10552332.13	31679953.19	26663171.96
8-{3-Oxo-2-[(2E)-2-penten-1-yl]-1-cyclopenten-1-yl}octanoic acid	109957727.5	102115202.1	107737447.3	43241237.94	31120515.92	40673945.33	3428458.293	3794838.606	3659008.46	1497587.699	4619035.02	2121927.904	718779.6311	838516.0596	546969.1036	329429.2634	194526.9422	366759.5388	11956646.3	11298564.72	11862101.57
9(Z),11(E),13(E)-Octadecatrienoic Acid methyl ester	187389121.9	191355757.5	172819569.8	6540515.094	8369070.92	13596481.89	884558.3342	926296.6719	697812.4747	438963.1325	1011408.963	698220.2447	223354.1079	186507.1252	6598978.282	248150.3544	261571.2539	855955.4126	732856.9454	515325.5697	799727.8367
9-Oxo-10(E),12(E)-octadecadienoic acid	956402561.4	911153281.3	904029371.9	255826782.4	180291193.6	243049332.5	27801993.15	33696783.38	28642844.48	18558095.43	11806586.28	14080386.22	12467260.43	17489172.07	14339466.23	7587072.631	8689129.159	11411113.35	275529392.3	175546397.1	196308849.7
9-Oxo-ODE	8855518.686	27772397.58	9451130.514	9259516.022	6273871.011	7226937.271	2240354.894	3156857.456	1827975.913	1097957.451	970339.573	1400867.624	629812.8456	464686.6119	700996.2774	571665.4933	596647.5623	787929.4718	3497231.033	1751711.903	2489571.427
9-hydroxy-2,10,10-trimethyltricyclo[6.3.0.0Âa,⁵]undec-6-ene-6-carboxylic acid	2306552.659	1769333.365	1991416.867	888220.1114	6533127.437	7734479.27	4904702.8	5943425.934	6843245.116	1067695.487	3297994.167	9286838.816	9734499.994	10008429.43	21245871.67	20594881.58	24101780.1	32455868.06	9451512.507	5455765.277	13694216.66
9S,13R-12-Oxophytodienoic acid	725640215.7	690331961.7	696916697.4	129897007.0	98394941.5	108523977.6	15465963.29	15673112.27	11863038.06	15964963.63	17313749.04	19329526.33	9540198.218	6730467.041	7750501.61	9101676.073	9410865.623	13842862.69	206525398.6	182877139.8	191748394.5
ALK	30913582.9	31151985.94	24774059.98	1414566.871	1245044.622	1940851.567	173806.6436	139580.9708	125773.5652	175074.9745	136741.5577	131229.8226	196733.2151	242004.581	318401.6224	356912.693	934846.7623	365220.0196	3700307.309	4009130.154	548878.4008
Abietic acid	102167898.1	25667887.59	95529143.36	257321355.1	276165973.5	289678603.0	431193298.6	528036142.8	455152124.3	174062240.7	210405727.3	159417822.3	82348447.87	97742718.16	93959486.93	81012038.41	75371850.28	91579567.59	78157304.76	76492261.66	71936709.84
Acetophenone	259986411.5	272735814.9	277303322.1	34091066.03	49260462.95	62363063.02	100611359.0	80692753.81	52013622.97	28544808.45	49206196.59	27249066.99	31603747.56	37707732.34	45222924.8	29088833.94	26944724.32	32406607.73	17884049.19	13796162.64	15823770.0
Acetylarginine	204808289.1	200683498.5	186804933.8	15727910.56	37784159.47	18829880.75	9306936.805	9983765.842	23952477.28	10248866.32	6270172.954	8433440.56	33152449.83	25100645.59	31956539.41	49670163.16	49175579.32	70646554.33	7347478.454	55119271.42	61678498.57
Acetylvanillin 乙酰香兰素	1789103.118	2442699.238	880379.9234	1450519.208	1716673.584	1769046.57	1246810.601	1123421.938	1121060.185	2630124.252	2598043.924	2697139.517	1737658.036	1361196.372	2175774.615	2239425.817	1935721.359	3366022.794	2279043.045	1634135.236	2426738.852
Adenine	694123349.2	695367694.9	614073162.3	375938795.0	256947692.9	296830636.2	3016944.663	5199505.21	4920856.818	1872232.265	1591175.845	2621387.876	1599668.97	1916495.221	1262758.405	1453996.469	1307396.219	2320764.071	98461145.29	70640523.32	77799617.27
Adenosine	8095310564.0	8772225489.0	8573281372.0	4576994332.0	3876234416.0	3881193347.0	652170009.6	567923695.0	993680632.0	856609941.3	569424582.9	786619887.5	225731778.8	267748944.0	220906451.2	458824450.0	480904644.3	386570547.5	4466824683.0	4309094939.0	4129840955.0
Adenosine 3'5'-cyclic monophosphate	60056953.98	53380239.46	49132455.93	39162493.9	43239419.49	49849606.88	1099587.815	1111548.487	1581448.554	559807.5967	537487.0431	1337618.018	659878.3452	545154.8185	525257.093	670304.7188	602085.7998	617022.8463	222766734.1	338652109.9	231099998.0
Adenosine 5'-monophosphate	4278714.57	2302850.914	1740793.443	28896878.99	33841384.39	17155793.82	117423634.9	95837190.84	90021071.6	106828816.5	85334566.78	102495048.3	71755972.08	77731007.71	72583485.38	76869696.78	80266850.3	89450086.58	27236685.47	38408610.15	17614391.59
Afzelin	5384406.13	4945704.78	1748760.471	2454132.959	2529408.244	2452085.013	10956690.35	10285006.31	6444144.81	2687919.371	2390162.142	1184248.508	271675.7866	438334.4162	239069.9082	424931.7914	335385.5963	326013.7043	424028.307	395927.8281	366465.8046
Agmatine	548194896.5	596490570.6	524907598.5	1501783695.0	1851618789.0	1571249381.0	878756918.1	732630018.2	765638614.6	173056544.5	212579039.4	194165997.3	105451217.2	39385688.24	71305909.6	42371932.29	57500594.58	59743743.32	17725534.99	34230127.92	35809838.24
Ala-Ile	1140871164.0	1194437621.0	1119078355.0	84776882.87	68209609.68	84520853.69	11309696.88	4171152.637	8275184.249	173774257.8	135378430.5	14783451.44	19046708.33	10913573.13	112056652.2	15933347.23	18569620.68	15194976.22	525370556.2	423189752.6	449510010.3
Ala-Leu	26589350.26	5765550.104	40372273.28	5389448.468	4612676.585	3993341.467	1458843.224	1822760.145	1829667.728	9653131.014	11254362.92	12211102.31	15996191.69	13485937.32	16277350.29	33791519.88	31115216.15	34797967.84	66466218.59	63468901.26	54868928.74
Ala-Phe	688386013.3	692454747.0	668520303.5	25285153.07	19558025.77	25218992.83	1044896.111	1177733.29	1682245.142	2171270.169	2217666.403	1657766.581	1244154.667	1572950.74	1580694.348	2158013.602	2811328.467	3139378.982	159859141.3	134282399.4	123652905.7
Ala-Val	577052680.1	580645079.0	562011474.2	60452737.27	36068002.38	60404634.95	2061479.666	1754021.124	2593255.847	2784668.961	2246274.399	2314832.783	2560830.328	1084287.433	2031344.372	3978675.797	4285066.054	5794422.018	285372664.5	247953351.7	233679715.3
Alanyltyrosine	914328265.6	954242470.0	902497356.8	33476679.9	2558909.465	32936720.74	4509985.487	4768922.972	840105.2548	4691968.476	4752334.781	4365757.297	3812787.025	2963336.617	3423313.489	8464766.481	7400247.377	7870804.685	282518687.1	219055639.0	208620444.1
All trans retinal	6785806.445	6648654.155	6348768.29	7069145.838	8844463.489	9883642.025	15950676.56	9147950.392	17919157.8	12748283.15	11891761.7	9110188.641	5327469.025	10358758.23	8115167.69	5571371.178	1756046.299	1927802.871	5293698.54	9975834.407	4772361.78
Allyl 2-(1H-benzimidazol-2-yl)-2-cyano-N-phenylethanimidothioate	1736316.381	1834014.863	1946113.576	2833748.338	3090984.382	5712933.208	15877683.18	14665426.51	12974403.98	23910086.31	24977266.88	21528897.27	13242507.09	14800428.62	12684766.69	14310582.57	15675385.19	11913979.24	4183968.21	5397485.77	2136038.175
Aminobutyl benzamide	5602104.12	4443091.901	6238470.387	5010090.821	5264886.146	4723670.777	28823583.73	21249179.92	14251084.78	39218868.27	43559687.14	33826646.46	25519439.81	19222609.58	17574140.6	27981406.09	18718252.91	24821530.93	21690750.16	36518923.79	31103420.83
Anabasine	1343593.889	1297200.037	1113570.965	829620.6375	910119.5738	1487855.431	3970191.192	5030408.312	3018327.993	45894177.47	6012295.385	241762.5264	6882672.794	5358784.656	6243743.004	8039099.307	5472505.784	5207898.27	2408079.031	1182370.393	602647.9848
Anisotropine methylbromide	85778.82843	92617.47039	98003.64707	144071.6128	139392.3646	145873.9715	90909.30123	90438.78732	98286.22868	591463.3456	571415.7999	1354883.775	1438357.31	897753.1746	1018114.57	1698200.002	1502829.316	2107787.242	1399441.713	1825975.475	2089007.116
Anthocyanidin base+3O, O-MalonylHex	877514.3743	865409.5536	806479.51	1359251.565	1318509.715	673169.6486	7243419.557	7931334.017	5928085.13	19921289.65	18317316.32	13016108.75	1689167.97	3213560.895	2200586.103	2685252.005	2321859.419	1648597.5	1985080.085	1092346.661	1387152.175
Anthranilic acid	10350579.53	11368732.2	10299035.13	27611669.38	30137061.09	30858433.45	5418057.326	5219779.215	8333671.77	730333.9663	807149.0474	1053884.944	676327.5807	2062203.573	2574557.441	970264.7899	1543039.766	2623688.617	1366243.667	1805845.064	405392.8723
Apigenin	157956079.1	145375049.1	148609616.5	512472.766	524386.0018	560677.9362	431852.5618	429218.7497	428219.231	455654.489	435663.7815	429399.5473	330585.9712	597822.4448	343526.8693	377549.2864	360503.4404	340454.3313	358324.3705	326038.9439	286825.6853
Apigetrin	129724586.6	111429113.4	123459826.5	1354114.995	1000800.522	2200562.432	808238.6713	836679.3548	754928.9592	760736.5362	678800.5559	643667.8501	649828.8083	652123.6788	625475.4611	721034.3963	687745.8249	674995.2057	768667.5237	679642.0799	636037.5279
Apocynin	13646068.93	13060101.15	7631634.41	18655524.1	19788569.61	17789540.93	27270384.89	19871728.62	21901116.43	21141324.99	21201906.9	19640749.56	14033184.87	8500428.191	9736173.263	15891894.3	15326569.0	13560439.26	12251547.25	13496969.57	9337382.16
Arecoline	1990833.817	1995104.122	1812904.327	70986184.25	56947944.37	59921719.68	19177073.36	11968226.7	17862419.31	2173501.335	2416475.418	1867017.594	1439332.084	2117520.687	1350786.042	1658775.85	407861.9883	1869268.347	803478.8184	693430.3808	1094249.941
Aspartame	472301453.5	459759256.8	471326433.4	11445479.89	9489761.051	12556511.26	539126.0581	768585.2929	342758.5847	969990.8528	905580.1014	1063205.411	1118550.988	783687.0167	1332367.817	2107092.685	2163512.832	2347176.061	273904704.2	225603125.6	206382470.2
Azithromycin	3443600.358	4564662.362	2442833.488	939261.2899	596900.353	712468.1567	281242.163	295357.8401	552364.8676	201467.5053	235587.9693	249351.5957	187421.2842	330827.7378	159256.4122	185586.3683	170956.8769	203678.3605	198192.1571	189533.4376	190491.1285
BMK methyl glycidate	1908046.1	3481813.425	2616299.865	693808.3566	2733181.794	2203131.867	1582369.577	2008805.223	1309103.864	14725279.41	16183095.92	21333217.29	19396049.57	14179840.81	20756264.81	14324750.36	14760257.96	16938548.32	11837638.68	17283712.22	13773956.52
Betaxolol	72373493.4	59081024.15	62139660.26	144858872.2	177726034.0	164134602.4	80197552.08	70993086.99	68305771.28	91570714.19	69911059.75	50331837.64	20671478.07	41894655.19	31104836.24	40802415.5	26920627.43	28146380.37	41323580.5	23260730.93	29589594.96
Biliverdin	3381052.777	3700254.863	3010694.401	2524930.788	1585678.729	1730777.767	2018795.662	2512012.433	1800422.882	2770809.338	2614891.495	2188645.506	3215535.695	4033712.119	2706655.825	2341081.732	3789351.276	3707724.888	8091568.021	7086005.279	3599126.773
Bis(2-ethylhexyl) amine	401115.7511	415036.6068	410385.7413	1235884.359	1140876.711	1226542.742	2883166.359	790304.0097	1739110.062	55613881.98	26843489.78	53975519.61	63067886.29	25969342.25	46557529.76	56941030.5	65643397.52	77508315.4	43992397.15	44827726.94	100589001.5
Bis(2-ethylhexyl) phthalate	126653738.3	117573933.9	134356704.4	392864846.6	386883310.2	384344943.1	504144664.5	156525623.0	80559814.54	80723567.47	57373639.39	72504601.66	149056796.9	129449747.8	160673348.1	99404801.43	92840997.89	127979668.9	191089163.2	309167025.4	324847119.0
Bis(4-ethylbenzylidene)sorbitol	20890603.79	18583925.63	22579772.59	23095606.6	94606112.24	31551992.89	29513729.33	32408204.76	33176364.22	25329664.49	29764394.72	25151119.16	24529085.11	36601646.78	37113046.2	39761557.41	30272913.79	35171649.38	78992015.52	50992676.35	38032614.58
Cafestol	733990.732	2232008.268	540366.3043	7758098.991	8097247.353	6828597.696	7957674.009	6013546.286	8366224.896	4941291.301	4568903.357	4227381.961	4114857.775	4063510.399	3595593.088	3107107.365	2717032.748	3112337.107	2373499.774	2269944.572	1959971.794
Caffeic acid	32526174.4	30449166.25	31420508.91	33664664.69	29917544.4	22932335.92	57020176.86	70827220.15	47485574.99	32254718.24	37172582.02	26682765.85	13084449.35	18853179.25	16997794.51	19290331.69	13996359.89	10832091.76	13196442.73	12202720.48	12376699.61
Caffeoyl putrescin (isomer of 1059)	60454172460.0	59265371526.0	58391968001.0	16346282705.0	10637334184.0	11244875115.0	17079219484.0	24971873610.0	10747645336.0	4547253742.0	7647471836.0	5402982524.0	1496439961.0	804639590.0	1472680115.0	1186624244.0	869335836.3	925855992.1	455349844.1	771628783.9	1534700814.0
Capsaicin	36562908.65	65443852.91	52407751.64	103590830.5	505037688.6	1329677669.0	17661644123.0	5868812174.0	14216880719.0	57539082618.0	63330226950.0	62579371543.0	58409287708.0	39050369659.0	49121737834.0	50535229231.0	46884025380.0	52987546466.0	45649906187.0	62634383133.0	67491843814.0
Ceratodictyol	33775065.67	31067095.12	31578317.69	20601593.96	21836002.89	21147570.19	10997250.38	10385145.93	9537901.831	2081170.912	2369627.424	2271392.234	3444744.816	2795035.874	3144651.09	4002898.249	3327292.499	3093068.16	21163404.73	14291672.82	22842375.08
Cetrimonium	5669323.145	7371533.945	4989069.044	5338766.16	7752958.988	9259776.07	2605574.57	3562485.46	74153678.41	3069349.197	2142972.678	3242746.856	3254567.244	4473656.615	7688986.106	4357360.719	5595713.564	4337154.629	72056137.9	41270858.8	106740605.4
Choline	5885481737.0	5836639952.0	4804974341.0	5134944785.0	4648001272.0	3902592178.0	3586502867.0	3405570202.0	3033117327.0	3503906814.0	3115171108.0	3349346423.0	2338219036.0	2093063887.0	2051882191.0	1681128073.0	2165233919.0	2083193047.0	3603871725.0	3137427964.0	1999395585.0
Citral	56909271.37	83483588.9	69380316.88	155144449.7	379390413.8	104874136.0	173231188.8	177905879.0	89641277.7	92845391.67	98177831.44	84126597.42	25895702.03	53273964.79	23348604.02	23001024.66	51325756.3	18344364.6	54920005.5	27715432.49	44071906.13
Citroflex 4	1655500.418	1430291.5	1521276.294	8646756.688	4105362.238	2835621.705	2371237.677	1854312.72	1741454.726	1728418.892	2020120.337	1868942.942	1967373.485	2459485.513	1934264.637	2102582.966	1590937.632	1313598.23	3695746.151	4195697.635	3862729.49
Citroflex A-4	2092759.931	2267290.47	2615559.438	4529366.977	10959046.04	4777475.129	2807850.152	3091018.949	1934767.047	2153862.819	3004482.615	2535612.655	3791250.515	6478381.164	3374229.29	3763012.117	4167651.083	2239601.96	6760594.1	8202427.21	10004660.32
Clareolide 香紫苏内酯	3423056.704	2616186.893	3599418.576	2250814.972	1956160.045	1478752.947	12725557.34	10540124.29	9442232.275	15601446.14	16488338.7	17913783.85	2389566.882	3145196.232	2961428.985	1213158.767	844506.3289	999779.4661	1159551.114	1469232.542	1379030.162
Coniferylaldehyde	6703759.146	4207290.692	4270472.787	9061786.457	2369439.053	8369670.498	16171206.14	12496562.51	7440555.619	21470022.28	23336265.6	28738941.92	6602315.008	11996022.32	14624434.83	5708115.745	6072779.543	10398242.82	13154908.9	4181678.075	17790183.17
Convolvamine	1331201.236	1224942.168	1294491.545	1324448.44	1211308.52	1774132.493	795948.9798	990172.9089	1181881.04	6398094.65	8992879.582	8220215.529	2192334.065	5016520.468	2643949.439	6639586.475	2992360.867	3923839.072	7505219.473	4720168.427	5534360.189
Corymboside	32854403.81	51657950.28	62924220.92	25005741.15	24673600.2	39866035.01	28869478.8	37034076.8	21231621.58	32043727.1	29117041.32	47135351.23	10668984.14	13915760.4	13413067.54	16256457.15	11199236.71	15304466.85	13770952.46	21948292.07	22039594.08
Coumaroyl agmatine (isomer of 1297)	223107601.5	212049738.9	220252120.7	431709146.5	512094299.7	364888231.7	2768097063.0	3565698365.0	2675887658.0	46896690.7	43977198.48	9450050.57	6138990.619	3625206.077	5282733.582	6082258.149	2678915.499	5215871.377	1082909.267	4698124.389	3238523.65
Coumaroyl putrescin	3044335497.0	3249447961.0	3173554351.0	6088942993.0	7151881283.0	5931369459.0	5319275392.0	6292496490.0	3594122367.0	145384931.8	152559815.5	96207350.42	11877310.98	5407964.194	11651566.67	8424467.624	8771063.017	19122023.44	2974593.382	20306651.19	39455196.49
Crotonic acid	221404870.1	242879063.0	213996102.0	218185739.9	160126284.7	181149780.7	110263781.2	63599046.49	74834089.94	113542945.9	94359716.71	100284093.4	127814442.8	60752528.57	93321358.86	97060748.51	92582183.82	108183539.0	251263066.7	278589878.3	299521348.5
Crotonoside	4027322582.0	4022712687.0	4024739502.0	910354308.4	810880135.1	929999669.7	74794356.09	56585512.24	97534031.11	61883233.2	50587792.93	54788563.04	38364538.69	32656388.82	32973185.73	22556492.9	22457470.61	18231791.86	418667901.9	292907102.5	429475313.7
Cyclohexylamine	2033010.355	1613345.829	3058149.415	1949424.796	1767167.989	1758691.211	4227014.243	1745852.595	4493286.476	18603920.69	15857741.57	18429076.95	6809595.459	8157787.939	7512934.233	8663302.453	12212447.9	8485288.984	6167922.741	6443324.752	9013494.819
Cynaroside	235819572.9	210876513.5	223073853.7	153044841.2	115577351.9	87418036.66	50496590.44	82552266.93	15114269.64	12500797.93	7878028.433	5001922.516	1556593.96	1636542.469	462460.7236	498011.2571	1046866.23	488477.2904	3576269.472	1863629.219	1655741.035
Cytidine	577031100.7	583100798.1	497108244.7	180644559.3	145212479.7	147927862.7	2622056.211	2323290.715	3078441.895	3120965.486	1503612.794	2892271.913	2336779.75	1325039.411	1129968.463	2735517.941	3780077.446	3525811.222	84079686.78	48170403.28	51508803.72
Cytidine 5'-monophosphate (hydrate)	27204731.83	17871418.38	13308576.49	11112391.59	9812953.928	9705866.02	962094.0369	442816.2329	922758.7737	604006.6337	509790.1767	483840.4656	721704.5549	622691.8704	662094.4539	729803.0807	642539.9671	661186.984	24992538.95	20642218.11	26008758.56
Cytidine-3',5'-cyclicmonophosphate	22220132.46	19590509.63	22740359.97	20444751.62	20959582.57	22294741.08	1301538.532	1280504.899	1236771.809	1286850.09	1260488.436	1325085.256	1079636.408	1066007.893	1125060.871	1332795.752	1315933.805	1406367.268	74311975.62	96729646.37	69401198.58
Cytosine	344266502.6	338577418.5	293440527.7	121086315.9	90918383.81	96059652.98	1614233.33	1512991.477	2425761.596	1570556.661	1563851.766	1352721.783	1304160.838	1283569.434	1182735.024	1555657.304	1549738.123	1531438.997	45835749.59	31284392.56	44884450.38
D-(+)-Camphor	8875273.506	16120661.23	14724119.59	11237282.59	8237693.487	10797074.09	1535685.636	2420394.893	1824120.6	5224238.802	4795561.718	6016582.345	1484865.535	2110595.444	353446.6388	1670482.594	737997.7612	469997.9101	2679033.059	350641.1257	672898.285
D-(+)-Maltose	9234807.252	5436080.941	5925944.348	201642194.8	267045463.1	143131484.5	422661898.9	343580420.5	434238875.0	457884423.9	358785320.6	448731578.2	949755179.3	859009012.4	791391728.4	661099884.3	546402914.1	508173293.0	143803043.7	51258796.23	59300871.1
D-(-)-Quinic acid	13983138.61	12242619.67	20975882.19	248650663.3	194426803.0	214879009.7	193480540.5	210508186.1	179062311.7	77253478.51	97369884.97	78241389.38	33877218.57	24097369.75	25383103.74	22592820.51	17288385.97	19002859.25	19062173.77	18148447.23	17313545.46
D-Panthenol	1399601.744	2036443.547	617262.0364	598777.5876	724664.4505	359541.9721	795500.2071	1098365.343	616199.8395	781708.7789	397576.9629	417374.7744	1298733.036	599141.2386	1610685.435	1712625.337	427299.551	552882.8954	38158847.36	414852.7046	780727.6172
D-Sphingosine	281805331.2	284794417.4	274010990.3	36110319.52	36216887.97	42411495.09	7941548.805	8476484.512	6312691.684	2483548.036	1815524.796	1891778.828	699240.3514	1135098.991	1168784.344	451989.7443	2447571.318	2230144.245	4496579.452	5482342.202	7946479.153
DL-Arginine	1013736332.0	947886959.4	785601781.3	133210457.5	162859237.0	149975304.9	115913357.8	101049684.1	156429230.7	522346525.0	376694411.3	470853708.6	1989338333.0	575327576.2	649460659.3	1472340484.0	1551233169.0	1590817966.0	1375764736.0	1590219654.0	2216651011.0
DL-Lysine	291974095.7	291985282.7	265808677.1	40838916.61	32036019.81	35731263.87	34022079.63	35554641.09	37641870.44	91519143.63	53304991.84	100224924.2	142456625.0	56810977.33	66123912.53	99555734.13	110618779.4	147956729.6	241532487.5	205274882.3	225572645.4
DL-Stachydrine	28417123.85	42500672.47	22956665.55	228722463.2	152202373.0	185925850.5	293718366.6	173907833.6	226714016.6	274038332.5	178161996.3	270003847.0	294573345.3	180632820.4	242254491.8	314718676.2	346570253.2	236111834.3	218688175.3	321865438.5	180383915.0
DL-Tryptophan	2020743196.0	2118893904.0	2007262433.0	191559149.9	225241916.4	290458758.0	712854227.2	1007017448.0	664183894.3	952557793.3	671127783.8	1089835008.0	515958491.9	517392128.9	559326950.6	1175462882.0	1167775215.0	1279558675.0	1318425583.0	1399113244.0	1487841673.0
DLK	98999576.0	95480037.74	92278048.98	6846468.632	4833795.535	5189117.329	539152.9625	425853.5217	404972.913	314269.7324	252359.3251	245490.7199	241690.0845	182750.9101	187043.0883	466777.8626	315344.7856	235299.5162	9628102.428	9780374.741	10221532.76
DNH	2844305.799	9601700.894	6836680.105	19862023.78	25105002.6	24163997.01	78534294.42	78410029.33	56740771.97	105114309.7	69827155.88	58428854.52	51231132.68	59324049.11	49200676.6	34668679.39	21423824.54	34430157.2	50159589.92	43141553.78	43421802.07
Decanamide	647017.3052	3747981.004	4847488.821	1217916.845	3818011.946	6264032.714	27247543.42	10648337.73	22781007.81	145650648.7	175079470.7	161622083.9	159205829.6	114076302.4	164558487.1	159776708.8	139805500.9	206944358.8	145901701.6	251638322.2	267305635.5
Dehydroepiandrosterone (DHEA)	1430298.611	1515429.555	1337238.115	828884.9431	612775.9724	614202.151	398334.5747	372849.9611	529169.883	3653779.384	880946.3252	5496161.627	11380951.29	18662586.61	18554445.4	9969472.46	13636671.69	10073074.08	15185286.99	5379131.447	13073790.08
Demethylwedelolactone 去甲蟛蜞菊内酯	1185165.289	1324923.218	1260127.13	3673134.65	1408432.456	1797108.461	14820398.75	17259534.95	13128262.1	12444356.51	12936264.91	10004888.04	2384218.02	2861896.163	1485257.947	2337232.51	982340.6153	1397712.346	1830028.545	2198434.352	1508684.251
Desthiobiotin	19630307.65	19656407.68	20001269.81	5756912.027	4866879.861	5891649.036	2808786.814	1805103.173	1858093.544	315808.3313	470407.6167	397753.0706	279802.1087	260934.1381	284886.2435	353676.6064	537447.6675	775007.9556	3872514.702	4000752.54	4527053.05
Diacetalol	1580671.789	1639652.051	1670334.407	12288139.41	16676218.38	17194770.78	9198631.855	7615181.9	8269925.113	10377922.1	12061835.64	13719842.79	4884254.698	6243695.067	6600630.633	8637995.276	6079429.614	5282576.618	2597161.856	4669507.39	6139023.582
Dibutylone	1020309.927	1146213.406	990751.318	1083894.711	2741136.115	2642191.116	3993283.355	5043255.942	4743190.82	10159098.6	9635204.412	10085810.81	6985517.098	8262469.972	6506509.755	10622696.34	8169455.427	7605382.696	9034676.463	7196949.075	6772617.375
Dicoumaroyl Spermidine	700305016.2	683249452.4	715234265.7	565927.2119	703277.5517	1020803.758	328463.2376	359464.2896	324312.5699	469296.1683	442299.4112	1265246.202	410294.121	606146.2616	517380.7872	512227.1704	583321.805	543309.8976	502200.8399	536015.2244	522602.8236
Didecyldimethylammonium	109500.1054	206691.086	113515.9753	267694.8041	269471.046	244173.0618	672616.1939	132594.8603	1669156.47	123224.1701	128107.3161	483395.4765	974441.0026	212985.3089	2312388.43	886983.1333	1629720.248	117235.2505	55631349.96	290417.3372	3344755.009
Dihydrocapsaicin	19114202.07	32533867.01	24912735.92	47784767.01	246674261.9	662476444.0	7533189368.0	2601073816.0	5619178211.0	32967475375.0	37066234341.0	36858678022.0	36763159911.0	25004716965.0	29522999336.0	28633240574.0	25604074539.0	35440527423.0	26882064159.0	39767521725.0	48579626550.0
Dihydrokaempferol	36252407.9	33975933.14	37812954.66	914825.2042	1174729.394	1484687.56	611788.3671	593501.1264	577011.5514	489301.6571	487118.7499	446109.3117	451678.535	445663.9797	440577.5829	493442.9558	451637.7521	444592.8995	529051.5447	489396.0499	477822.9499
Dihydrosphingosine	115534917.5	115832378.9	108112668.7	168414576.6	197499501.8	206449073.5	32571689.15	37631316.38	34060831.88	8623542.97	12617040.39	7137632.024	3045164.842	4069892.347	3284115.265	7643007.575	6956310.388	6345199.495	12471478.48	7506948.02	7762941.974
Dimethyl phthalate	45717216.37	44474188.61	41945707.81	73805529.0	53627254.97	68291732.61	2131624.33	4991023.781	3052301.848	3422510.745	2762923.891	4319770.42	4156870.34	4518380.401	4719147.752	3583287.595	4816299.512	2999571.874	42608769.51	50080671.31	52728888.99
Dinophysistoxin-1	232331.0302	271840.0935	264723.0479	44992507.13	47899789.15	39989435.71	20317625.14	18639438.5	25461238.12	20149741.93	20468307.57	15295720.39	12329270.66	9949094.061	11572327.26	2653751.267	6311371.348	6961155.717	899314.2973	1133172.65	1240130.709
Diosgenin glucoside 延龄草苷	735462.6784	722852.741	628056.9104	783317.7035	743157.0734	733382.9908	817258.2971	751411.9582	730873.3835	11963110.99	756301.8664	24615487.12	57161352.57	110449521.5	98309335.63	5591710.384	15849814.49	13841046.43	6795892.62	442480.2442	5078731.174
Diosgenin 薯蓣皂素	504477.5175	475945.477	443880.5978	224091.7092	245761.8632	232620.612	160464.6554	164025.1183	178341.2696	1448149.15	838556.3216	968263.916	631679.4401	1655128.305	1021049.702	1037570.327	1013509.103	656474.1328	46716808.79	30594535.96	135427478.3
Diphenidine	644094.6501	607684.1305	664619.9277	153634.3063	110609.6294	521446.6757	224019.5694	410166.7695	709936.906	9583730.445	11687510.81	6083593.44	2776476.499	11723660.09	24883418.38	3149570.169	2217259.216	6379635.747	3583818.716	762007.6059	3096543.865
Diphenylphosphine oxide	7027782.763	6350413.306	8129805.943	15713437.27	13440998.1	8825238.077	2559561.406	712988.3279	521077.0323	621260.8913	412331.075	376977.9368	1920372.26	1423799.428	1682596.164	606210.6948	618516.8004	565250.6256	8028397.889	10253076.82	11608073.91
Dobutamine	109585.9562	112998.8259	108441.1316	135642.6288	706284.1295	1840571.301	35254067.02	8386586.355	30458680.25	233361074.1	255990817.5	241810520.8	192395284.2	75851827.01	124140221.8	144558880.2	116725689.5	162986585.6	107649293.0	254479369.5	294556544.2
Dodecyltrimethylammonium	262594.2491	1021315.311	1451231.356	952684.5704	2981051.639	5538081.014	19277133.68	4704004.46	7880012.363	389961128.9	332873112.7	454279814.1	916957205.2	515859115.8	749046083.0	1032138328.0	920067319.6	973791150.0	814860281.0	1551379215.0	1393848725.0
Drospirenone	48983900.58	51631244.75	45646557.42	53112913.84	40211090.77	52320155.65	44265596.1	46574416.88	42318269.9	39916476.06	45193969.43	33747506.59	17425276.31	11736698.61	12344004.66	10635536.53	12083682.78	9208790.584	33102403.65	11445579.89	17799441.0
ELK	37043314.72	36904303.5	36606396.77	2864686.134	2766411.144	3641988.434	150762.1023	165900.3112	171713.5277	137812.0757	136172.1557	128517.7605	138447.9108	118355.0817	131983.8019	268109.0194	161501.4171	170950.0111	12633976.68	10960820.21	11023896.48
Ecgonine	24229054.25	21987101.44	25106868.63	1041470.979	2420402.67	2324980.09	10396086.38	2571976.243	7391097.423	147846417.2	175935998.2	173745989.8	133432095.3	86962820.26	97742769.14	88529678.51	120067251.2	94563100.12	61534041.89	61669431.91	112569062.8
Ecgonine methyl ester	8604528.873	11824526.04	13291884.69	1059964.297	1950549.982	766242.8957	823594.8056	621824.5882	552630.0238	7745560.653	6818636.509	9346701.776	12517023.75	9394934.042	12857234.79	8047267.122	9607885.473	8662309.949	3919040.398	6927168.082	10110323.28
Eicosapentaenoic acid	116016257.2	123873188.0	108723153.3	43769711.33	37230769.73	51613965.65	28569328.05	33853826.39	34035104.87	38156900.7	32130032.19	37800268.08	61426417.5	70126521.34	73796574.88	53257844.14	46472445.58	51742475.72	64904291.47	58003598.11	48033604.84
Eicosapentaenoic acid methyl ester	10193559.83	13169512.74	11338030.66	5819498.192	5050416.416	4404030.28	570756.6922	501113.1492	173833.1779	325753.436	434868.4086	464394.2513	591652.2464	444609.0452	576617.8997	480574.9029	546623.1107	469484.3785	456589.5594	515604.7676	637825.5107
Epitestosterone	4400555.115	4453664.364	3901300.355	4317731.316	4253510.248	3940218.566	3118351.992	1325784.186	553037.4315	381670.2842	536252.5488	626222.0396	168002.8703	447338.3008	394611.2623	184524.3314	279077.7207	149407.0033	227419.805	324318.4982	184705.414
Erythrono-1,4-lactone	23082991.04	19339431.93	16932469.01	120847963.4	164907769.2	130261246.1	101961779.6	118242939.6	96337265.89	22432302.67	22373004.23	14000350.94	4750056.526	4112675.414	2874759.269	4892921.232	5306582.845	3710775.568	3154800.628	4904971.286	3465864.713
Esculetin	21190518.4	27911206.57	25793565.98	1354141.72	1018543.23	1220078.238	2301207.573	1892483.919	1278516.933	3184304.125	681453.879	398238.4237	608465.3333	884163.8879	1079745.103	787800.5043	279182.8942	267869.0566	387482.7594	299344.7044	293934.0785
Esmolol	5837789.929	5138155.199	5168773.257	24490020.52	16147081.37	40119179.81	55162954.43	92128495.05	48031040.32	59115242.25	80440805.92	69200864.17	5505846.703	12939988.91	9248563.004	17476346.34	11002637.71	11363688.64	69354189.49	34278353.87	37213199.71
Ethyl 6-[(2,4-dichlorophenyl)methylene]-5-oxo-5,6,7,8-tetrahydronaphthalene-2-carboxylate	889931.8116	849267.3395	831383.4346	913303.2113	1002412.156	628744.8148	2649962.445	2447976.86	2871223.373	5802365.611	5862711.133	4008112.923	208277.7646	461175.3295	205408.4143	356474.314	386801.6973	246616.4824	383569.1989	563133.4573	487279.2837
Ethyl oleate	4142457.665	4504501.893	5600664.101	192099.0936	190917.0372	193327.2488	181252.9736	180741.6398	430940.5199	185562.415	211749.7206	290199.3613	188315.8242	161971.9858	181849.8429	171984.0384	165303.5189	185123.0614	171589.2787	191639.6061	189879.5735
Etoxazole	10901474.89	10328621.21	11527194.27	20505282.18	21334922.99	23348984.46	30464753.16	9392376.918	5869710.815	8534298.216	6338047.531	7690944.554	16105922.84	17087179.0	18190199.87	10141182.58	10992651.12	9758578.524	21723481.29	39018119.72	43740733.45
Exemestane	26560586.66	25597349.67	25477858.62	12921230.97	11183696.89	14015996.58	1474935.703	1818137.334	2102640.101	20231404.49	7880701.096	28041875.82	15869352.8	18996186.54	14415342.31	20749222.98	20723465.04	8674533.286	25102119.36	21361522.05	748803.955
FPH	48489792.29	25950241.53	15746900.32	2420221.484	3436371.386	1981176.211	786939.664	1325211.098	1233620.697	539502.4919	531738.9263	453005.1806	543602.7091	474983.7941	582662.405	654478.8426	658871.8118	781463.2631	4844260.103	7352071.615	6207652.893
Ferulic acid	3097280.036	2272450.047	2566892.313	787486.4392	561853.8784	884402.797	5304431.679	2642215.105	5732031.743	40091443.92	27125198.95	55548056.31	56998289.73	43573909.71	62995836.86	70335103.02	62422732.62	90490148.03	36454716.53	44315375.78	45814786.82
Feruloyl O-methyldopamine	74701281.64	66330148.92	76672339.15	4265414.034	1397659.814	7734823.372	751618.6024	701848.8799	735203.3691	6043660.642	10466572.34	4688719.616	9964783.518	4299002.421	7871113.028	11090153.69	8486228.295	11776402.85	14578234.26	19698858.78	26914034.96
Feruloyl putrescine (isomer of 1173)	4717828823.0	4881415787.0	4814848394.0	1834657869.0	2471767932.0	2200545068.0	4151035674.0	3510775399.0	2327575961.0	1883933101.0	2067780834.0	1746351879.0	635481540.1	728627871.8	822068092.9	370299784.6	418439733.8	586551187.9	336442495.7	449721116.1	637432421.1
Flavone base + 4O, O-MalonylHex	57983503.23	56103937.94	61063264.54	59114850.69	61459500.54	36586545.97	75184376.29	108275919.0	18660757.7	34678923.94	33259063.08	17945514.29	4302899.898	1406399.002	741497.1364	966298.606	1904612.524	698401.8879	1027465.295	908605.0519	1989804.69
GLK	78006373.28	73845264.13	67342958.68	787381.5201	622789.8243	1013428.782	155886.9647	147768.1501	141640.9492	153959.0185	148281.075	131777.5269	166292.4262	126652.4349	134729.3328	364385.3398	245190.4023	483579.3969	51328183.43	41522280.59	41499513.49
Germacrone 吉马酮	10390344.62	11094081.85	18702517.25	5892890.181	10663679.41	10863847.75	7629459.248	8702318.553	8902094.366	6331024.723	6865218.945	7708534.663	5604202.91	6533864.332	6975823.037	7677009.718	8195693.684	11560306.53	23908652.06	9577467.806	4026927.04
Gitogenin 支脱皂苷元	1238418.398	1344634.352	1219471.327	720337.2505	545486.8623	561682.1	347425.8941	332969.214	482743.611	2621949.789	821731.964	4938269.543	12919746.51	22314229.28	21941088.14	11413650.83	15433452.42	11632202.66	16272047.82	5489586.336	14029586.64
Glu-Thr	52005342.29	56865879.2	64306793.38	5706037.411	4003504.352	5247671.316	1199046.867	1372774.633	1611778.373	1661893.032	1593563.448	1764998.438	1174477.097	1246110.234	1531737.302	1565321.595	1875214.36	3105469.546	84110739.89	100125622.0	102414872.4
Glu-Val-Phe	328320335.5	297089857.0	259932107.1	10898077.19	3925417.693	5693213.127	316533.0256	312714.3914	430853.5006	395223.0516	428656.9137	480410.4456	1611192.194	588198.3166	810117.0921	4707211.162	3328296.22	4278629.499	65364527.61	50372834.31	41345963.23
Glutamylleucine	844571250.7	853586362.6	704864637.3	53764194.16	42173037.52	56388824.96	1059628.866	1459130.486	1631582.61	2201288.235	1427952.68	1927820.294	1427574.92	1167844.015	1389844.923	4270744.917	2980291.827	3977108.064	314932540.5	258365316.5	242435135.8
Glutamylphenylalanine (isomer of 1503)	40291573.03	40280138.96	38511536.3	4386131.394	3169090.733	4437261.919	1550328.37	1180898.082	1047581.144	3386453.952	2944734.558	3148077.981	4244981.013	2339931.532	2994001.097	4971714.797	3659339.164	4185596.169	20218548.75	12331284.48	13354895.75
Glutamyltyrosine	214036607.4	207828753.3	206104424.5	8692382.723	6868223.993	8385625.293	202495.703	187941.7562	166248.1148	351715.6015	210500.003	295499.131	347344.4412	111534.5778	204246.1943	278027.3325	285662.2984	404358.5855	62683135.77	46273443.54	51496112.28
Gly-Tyr	312967913.9	306451619.3	285758454.0	14165494.27	9385876.159	13211057.18	816290.642	830888.4425	871055.0701	716582.6111	307130.2551	730619.5434	877882.9549	783733.601	934433.4391	1146455.75	1029680.081	1185454.751	76037360.68	50378403.7	60496043.59
Gly-Tyr-Ala	15495603.32	15393933.56	14947753.27	956080.7058	554999.6676	618689.9945	207435.4435	187737.8323	160688.2885	137943.4998	140122.6604	127066.3102	140048.8224	109422.1281	112995.9524	159345.2777	147067.9562	151495.5751	6816510.127	5166859.889	5355559.842
Gly-Val	84730977.16	88883101.27	90022612.39	5395065.559	4673887.648	5464418.317	968127.573	1334177.629	501540.2445	812670.4384	862835.3183	874950.331	1309343.139	863797.0117	651879.4551	1699444.756	1393076.141	1537320.081	65739535.43	51401267.91	57829763.29
Glycerophospho-N-palmitoyl ethanolamine	12512147.26	14037380.76	11076954.16	894071.2723	266274.4273	367460.1881	921991.9766	462120.3745	354474.3544	395402.2854	365324.1546	373975.6077	554274.0647	555405.0671	594504.9969	446888.8696	432111.3715	429799.8185	385990.1144	338584.3027	340270.7834
Glycyl-L-leucine	2138540361.0	2128777216.0	2054767625.0	28436361.57	27235309.53	34735702.43	7994462.702	8926176.142	9838603.514	19903418.56	19997987.48	20331610.38	53411237.34	39411683.7	46747881.39	112637626.6	95810364.68	106996985.5	878159037.8	720596444.3	666475252.6
Grossamide or its isomer (not validated)	55163948.82	50111989.69	48496248.18	35718864.48	25139916.22	64509177.92	1150533.97	3954055.509	5597944.124	11460475.38	15390352.26	12763257.19	3040352.876	6707635.979	4766081.354	7145126.793	1888889.175	4970229.444	10727810.1	2810366.673	8402363.711
Guanine	1584537632.0	1587045328.0	1587865750.0	355960784.7	314973400.4	363885628.2	30387157.59	23277915.97	38215818.61	24993219.73	18857075.24	21957526.45	15044428.57	13118333.62	14075706.82	9314350.365	9395127.44	7649726.539	161686622.6	116171835.4	169392688.5
Guanosine 5'-monophosphate	31119165.2	30246513.15	29570390.88	22592553.69	20072943.82	21656147.65	15402311.12	11904283.97	12387159.77	8055147.069	6336077.209	8094750.712	3703227.186	2694056.472	4956419.751	1642486.628	6054446.667	7016603.76	100568597.8	97886521.2	106230720.6
Guanosine cyclic monophosphate	90342766.61	84486298.1	78791736.49	40950594.4	39297413.93	42246510.11	804178.2316	795104.6147	1110668.348	630755.9148	527084.5774	550175.5456	265772.4677	255503.0312	268132.8088	629918.8658	871138.9412	554618.6151	181858629.0	249176861.2	184173329.9
Heroin-d3	17837572.47	17816255.11	18336129.76	92538121.25	122610833.3	93007738.07	22063038.05	27562830.85	32663738.21	12217410.07	8636952.157	11293435.42	11506793.73	7388063.997	7941221.348	16324117.19	9482773.829	9213181.51	10451086.86	12255572.06	11455714.83
Hexadecanamide	30534106.63	32134381.28	32160507.05	48708685.13	46373373.12	55292288.7	274912308.0	274538355.5	233484188.9	1044047824.0	1103725471.0	1707298792.0	3076770866.0	1631898036.0	2356953723.0	1693672897.0	1940553600.0	1707638181.0	1220674156.0	1588784997.0	2087654823.0
Homo-anatoxin	437844.506	409142.3253	352832.595	295515.9524	280527.7402	308153.7769	328407.3478	187811.2647	182643.4466	4076631.359	3870691.579	4202656.774	3841893.624	2095599.903	2718595.03	3286236.084	3085018.583	2638710.593	2845132.721	3927489.791	4695409.149
Homocapsaicin	542038.198	1272938.009	969851.293	2410670.405	19917716.6	65379068.78	996127180.3	307489750.5	627313744.9	4071915223.0	4461471330.0	4479728169.0	4364454996.0	2137516823.0	3066492686.0	3760973236.0	2898041508.0	3712582131.0	2724408200.0	5575310614.0	5611926381.0
HomodihydrocapsaicinI	1578555.442	3415763.238	1783356.334	3098845.409	22971523.21	56215180.15	1325846749.0	680727917.8	1081193979.0	4003934052.0	4711245128.0	4877961809.0	4975009072.0	2897830961.0	4295713593.0	4607735133.0	2946708298.0	5239634497.0	3929904660.0	7678860639.0	7310939277.0
Hydroxyacetildenafil	839301.677	853758.4775	853290.3095	406791.7043	387737.4585	392682.8649	5417934.421	4846215.644	7174812.566	17437129.64	15643589.52	19130479.12	11716565.18	8192808.742	11353704.23	3190777.225	3878178.743	2913762.204	5585894.398	6812597.295	5173429.829
Hypoxanthine	29477983.27	26554627.05	28025307.74	3924890.6	3789828.121	3330198.407	174116.7339	182360.3442	139878.4783	172256.9375	374029.4093	336325.3346	180785.1024	128954.3977	153851.619	374062.0472	226164.4874	234126.5945	1567275.746	437010.338	1559148.129
ILK	23924066.95	25469516.83	18399938.7	192399.7841	179031.8043	181537.5529	176928.1215	164013.6078	158836.9822	131183.9328	124734.3222	105577.9017	116616.1358	88271.82318	88939.6777	130568.6097	115012.0553	112257.4659	8555738.391	5685003.897	5663345.917
IPK	30419884.42	28982908.03	21128085.12	284367.0233	269479.2553	281144.5521	262368.8494	248538.273	246610.1609	190243.0022	171099.3935	160474.5105	174232.72	140951.7231	164730.117	208769.8981	183559.593	189148.5948	27105824.69	26430084.31	18823960.55
Indoline	11907740.84	14519782.59	12787365.57	606711.4827	477557.8503	561763.9362	232521.7893	283353.2817	246676.5375	520507.7961	357095.5282	334521.3249	363074.1823	511040.9008	478255.9509	522162.5576	562997.643	414130.6149	5917054.172	4984731.786	3845608.349
Isoamylamine	169174806.7	189295924.2	192463776.7	12565082.08	12328379.6	12596892.68	27232604.16	17304137.38	18613111.42	58213374.67	57796038.32	62191491.82	70308280.4	40528724.56	53271673.8	63123324.05	82769714.64	54425822.96	32264772.85	47240892.23	56579369.72
Isoleucine	12956988443.0	14806710275.0	16228975637.0	2313596911.0	2472352675.0	3016229929.0	4309807225.0	1881533900.0	1813257065.0	3272795141.0	2775150019.0	3722883033.0	2896768757.0	2232090991.0	2758849534.0	2382773968.0	2746419166.0	3032845910.0	6057647504.0	5848992839.0	6777346941.0
Isoleucylserine	1789171388.0	1880472948.0	1729387423.0	39873240.13	33267959.55	40309457.22	4543335.663	4794133.82	4617020.225	8061123.212	6588579.096	7662672.972	18650320.02	15151839.92	17099949.73	52960565.45	49055294.22	47538744.96	856393792.4	734830742.3	623927951.4
Isorhamnetin	1498607.175	1817726.933	1437886.775	8800679.53	6385987.684	3896303.846	45490522.47	60613608.93	40110587.1	52126528.66	47697153.18	43435972.05	15301611.64	13111247.88	730471.1534	11449600.54	10710069.88	7590445.585	8096718.016	6767118.538	6652710.002
Kaempferol	180632562.4	146329927.8	207929816.2	79807424.57	80669008.92	68407893.68	45813825.09	61277801.52	28646819.79	12000859.29	13123112.82	9330539.443	4978309.207	2710198.389	2433449.355	3171415.615	2763277.051	2830051.061	13119373.71	32546439.86	28590957.29
Kaurane	3203340.014	3467198.348	3043698.741	4669718.318	4715522.857	4310154.851	70057417.43	58634149.5	58286495.16	89219152.22	71539541.37	87525072.33	164571106.0	159115714.2	191433967.7	116363396.6	97920332.99	95468456.02	9445696.693	7081084.377	9766706.53
Kukoamine A 地骨皮甲素	195808450.7	132122115.8	215161199.5	318731.0432	298035.4831	254621.4812	216304.489	198126.0198	237205.8175	63799760.44	67659429.5	43243837.88	75100430.37	121853168.8	112861130.2	145972529.4	61125753.56	38074519.13	50550510.25	21233566.05	57119726.46
L(+)-Leucinol L-亮氨醇	1143224.147	1303603.954	1422446.47	402597.7549	414808.0672	481330.7881	14861463.66	3313055.804	895016.1291	71418560.45	86672146.11	94707895.26	79194383.0	25665955.43	50275808.71	40784453.46	44062660.06	75291624.21	17335857.83	58066269.94	69543489.98
L-(+)-Citrulline	49894492.57	45346336.58	38757288.57	220622229.1	380383393.2	198494460.8	144485338.0	144341969.9	183146722.9	149718831.5	166586234.4	107969740.4	106604011.9	107341052.9	82307026.87	90506614.3	78868489.72	54549202.63	29999711.46	9882048.039	16262411.84
L-5-Hydroxytryptophan	9525401.842	8701219.013	10043171.93	1982290.156	1526553.643	950037.4645	2482370.441	4382569.712	310241.8084	9760412.531	9408909.703	7864845.764	4227585.819	3855099.834	4029068.629	6696795.34	6193795.6	4716663.158	3531101.451	3007899.867	2824174.651
L-Alanyl-L-proline	242684424.9	224382918.2	230608604.2	107628420.8	81751710.59	87648619.65	81871660.57	81270003.36	59542629.31	62018338.92	48512956.66	67166494.2	50559904.83	53054739.6	55155262.47	63339110.27	63306269.68	61146727.77	123122380.9	111252445.5	96869902.59
L-Aspartic acid	47330165.05	46607326.64	25033591.27	119752248.6	118374322.5	42722113.14	54011985.57	130594795.8	143442373.1	88814186.7	117330532.0	79374181.84	113445083.7	101525878.3	108443080.1	25178814.49	44303733.72	79349550.72	87366949.4	84093199.51	100846399.0
L-Cysteine	7747470.607	9874513.71	8013737.047	3556577.518	3998856.228	4473799.807	4505746.527	5040174.761	5849969.116	2770968.79	2732115.066	2873935.736	11834963.07	6011486.496	10713076.57	36142115.15	32447075.9	37506962.8	17681787.31	10307828.25	7507478.255
L-Cystine	2799610.975	2527061.348	1617076.069	3699666.997	3606846.931	2103955.289	44812354.83	68432808.71	49815753.44	45312487.04	53163340.7	43108140.06	22814143.88	19158924.55	23656071.94	23451186.99	19145019.41	33460449.12	16415954.57	22731962.0	15657175.71
L-Glutamine	644077575.8	586154073.7	577096733.5	950097941.2	1533585386.0	479300380.8	1444258101.0	1235931106.0	1770919629.0	3336450492.0	3315724727.0	2493918941.0	3650454248.0	2544144660.0	2069132843.0	3727279225.0	3391398455.0	3143111913.0	2092083367.0	1711663110.0	2349866621.0
L-Glutathione (reduced)	1431626.364	1545695.574	1575986.733	4564660.026	7846140.524	3173005.92	5984699.126	7322050.226	10459087.6	376685354.0	420214634.4	390931505.5	1288537498.0	1303069556.0	1390388471.0	967697557.4	974741287.8	826027905.4	71093298.65	45091344.59	36614106.36
L-Glutathione oxidized	64399851.24	70443032.71	63751039.93	75256229.71	96802841.32	71132968.13	160161161.2	150451274.8	120859796.3	116312231.8	103362470.3	90954325.24	36911337.61	27811914.2	31109496.74	17849664.76	15691194.43	12117968.61	16550581.4	29183128.39	27514582.06
L-Histidine	41717994.39	35794776.12	34363468.52	4885233.858	25798337.77	22645830.38	42483786.84	45077039.85	40418523.82	82574604.84	59987903.97	60448222.91	153858715.5	76528227.51	82922969.19	151332227.1	136460895.0	177262464.1	192044546.0	193123596.1	203353622.5
L-Kynurenine	6684143.87	6393181.704	6824323.296	2987274.87	2839208.766	3065518.911	3856981.197	5340336.039	3768870.005	7862040.918	8610266.458	7620113.579	9014691.739	8989360.848	9397989.851	13794440.64	11743536.86	11396148.19	9475246.13	6956786.576	7209159.258
L-Methionine sulfoxide	233878146.5	248759935.0	293764037.8	82160978.0	87764662.26	113995154.6	99989091.93	81502994.64	128320068.2	100367654.0	84245814.7	86608665.13	99146344.26	83539624.61	162809549.1	166739297.5	156954755.9	156815971.3	145426275.1	145155172.5	127342232.1
L-Phenylalanine	13026186793.0	13457241230.0	13101563636.0	1688202757.0	1637776624.0	1953013056.0	1033973300.0	1096616594.0	918557961.5	2045022334.0	1288633255.0	2061058810.0	2253330944.0	1231511936.0	1830643538.0	4716441704.0	4300758426.0	5823420744.0	9903995996.0	10824887288.0	11058893156.0
L-Pyroglutamic acid	168068243.2	175348214.8	161267884.9	413079640.9	603978920.8	188862425.9	634072400.6	566691924.5	762479316.7	1274369565.0	1291478062.0	1009471021.0	1412322357.0	1015808001.0	851495957.5	1430420840.0	1306868804.0	1250820540.0	1289510131.0	640659408.9	888535865.2
L-Serine	64370985.78	65511321.45	26866686.02	6507205.536	13891404.6	38763368.11	15066630.25	39175292.53	33913632.13	96926510.32	70657599.29	85339274.29	139301239.1	122209589.5	177064951.0	155033931.5	110647026.5	153456830.4	42029700.51	124132876.7	123071145.2
L-Tyrosine	4972604646.0	4962833552.0	4738348458.0	406070113.6	373388465.5	395781331.8	413423659.4	394854055.9	323247343.9	1083557653.0	691672178.8	1058858361.0	540248213.0	348553951.1	434721054.4	888908511.7	820810204.9	965960478.5	2067704665.0	1598393625.0	1760882715.0
L-Tyrosine methyl ester	4428379.92	4135010.777	3874258.383	6377202.219	7121002.476	5237113.507	4832760.361	4482967.889	5307204.06	5427141.135	5225064.003	5754459.967	6933378.782	6673147.75	5445478.751	11853387.72	11098716.62	12014893.39	16808856.38	13966738.49	12016317.49
L-beta-homolysine-2HCl	5666109.275	6608132.177	6286760.026	255892.6143	126855.8656	169546.3274	122918.5753	122532.6606	112759.0805	110451.3497	120611.3422	122753.5305	876276.0182	416378.7141	823689.8625	1914739.161	1642344.978	1907250.985	34619261.65	31975480.45	25248078.88
LLK	47201799.9	53245180.92	56276333.95	811790.0555	1236742.888	812616.7098	457054.8576	594379.2136	532000.7957	438340.2489	411429.2721	577957.2853	328345.5018	325078.7438	357552.1131	547861.3451	618081.2883	694948.3767	3166992.788	2989229.621	1297838.125
LPC 18:1	52688697.92	44021327.9	38995144.55	661653491.8	611465234.0	586187345.1	78439122.42	84206167.22	73922616.13	22670991.52	28326249.2	28654282.66	18420985.46	18354760.52	16673785.28	23537804.35	24774621.62	23937340.86	12350451.61	4779687.711	10006605.29
LPC 18:2	488173726.8	496996875.4	466938716.6	4370835778.0	3928860727.0	4324780226.0	954373330.5	866672466.3	818688914.0	380573565.6	578561115.3	369049488.7	257867231.7	189159501.5	228140427.6	200680184.8	202703342.4	218208644.7	135192200.9	44843652.64	93215882.75
LPC 18:3	73069805.38	72499763.79	75400768.73	544458116.5	646732480.2	574353507.5	79463896.41	75001471.49	63324721.66	40255921.26	63454345.12	41201863.13	24367633.8	14176513.81	20798620.29	30999035.27	25888106.71	34363815.29	1196435.681	343240.3875	491855.5141
Lactamide	121759117.3	90629366.65	132975241.1	56542226.97	54445651.06	55318011.16	44099577.47	35145300.89	21613042.89	93047491.66	89873828.38	82701452.15	74478813.85	52243927.0	59269422.8	49332101.52	67873065.18	82850227.08	80236516.89	77977734.25	52807425.58
Lauric isopropanolamide	247078.2023	248306.4795	277077.7528	210413.5053	200714.0485	232342.9074	700285.8766	126753.7211	316476.6641	9917748.192	8863189.424	10861932.84	16445051.71	6413460.846	10944179.58	10071528.98	9365454.284	14302710.92	8523635.484	16639655.29	21379458.73
Laurolactam	1784588.187	1565337.407	350641.6747	1722338.268	1228533.522	2535261.462	19745684.23	11637960.12	16254479.22	57324559.24	67759988.28	68603718.43	69045099.56	42757198.88	60095807.49	66557760.04	41621645.55	73993176.53	55435885.97	104596266.1	100669285.4
Leu-Gly-Gly	105257369.3	111217861.5	104809707.2	7932875.306	6529427.538	14536593.03	454259.0617	386067.7316	394097.8788	295064.2692	255830.486	256545.4803	289462.3425	359406.36	266794.036	1948402.61	584476.2344	608185.1384	33243543.92	20669015.47	43438484.07
Leucine methyl ester	5085150.525	5255594.15	4716073.662	14539038.79	8333999.499	12694389.41	13283169.66	11664145.98	14439974.24	12826670.86	13817771.79	11411879.3	19369900.61	14836715.84	17511947.66	34119349.56	29064933.65	30908355.06	39875358.4	33398854.38	26194510.04
Leucylalanine	2137488781.0	2150079786.0	1952974828.0	76577376.21	60911617.35	76423565.96	6876751.072	7660909.273	7471735.314	11914575.02	10018330.06	9701851.55	19367630.82	15331498.97	18836630.17	59421573.37	52034460.59	56837751.87	708520997.1	615889172.2	551559657.8
Leucylleucine	2652177817.0	2618309689.0	2581297141.0	101823372.5	81416211.26	109268260.2	9023666.961	9089111.98	10662893.09	15004098.37	11946237.18	12962237.67	19992398.6	16576176.91	19794489.28	56697053.36	49343741.99	56719796.93	925402372.7	779280925.5	673072569.2
Leucylproline	2475408201.0	2360882276.0	2454004619.0	43199951.39	28662816.21	47052289.01	9818219.695	9831236.034	11178200.16	8429429.469	9651582.078	9163778.208	7293340.626	5497342.857	6009704.638	6751528.115	6804783.055	6454052.519	449471469.8	719592715.6	759000418.2
Leucylvaline	1952227823.0	2176830815.0	1986375319.0	58215487.58	41851076.43	60817170.48	4938090.938	5156432.707	5743747.622	7430300.066	6703544.896	6525792.153	9516683.697	6786960.085	7701567.521	20826941.11	18900088.08	20301632.94	711191697.4	615097400.8	560573756.4
Levallorphan	658268.1664	481918.9563	415253.7456	120938.0986	113695.928	519660.5179	179419.5424	334882.3077	679142.8403	10059330.01	11859856.58	6855947.132	2373421.977	10007748.48	20498314.9	3918007.534	2169988.371	5065832.366	3726464.119	752670.863	3531011.31
Linolenic acid ethyl ester	3715646.566	3801458.405	3224747.923	241369.8501	200393.7629	198663.741	1910457.55	1222631.486	4553304.056	4183580.032	4481620.609	4324726.001	3550288.543	2131129.093	3658806.14	3464091.697	3059147.324	4159845.132	3238539.538	3577495.726	3477951.523
Linoleoyl ethanolamide	352478268.5	368795572.9	371882882.1	24366417.92	20343092.43	28645784.37	13487543.33	22244553.7	8875140.703	7952765.98	4678798.031	9451377.828	10094808.96	15917699.58	12494518.07	9614849.6	15242310.91	12565282.33	144209106.5	154608085.9	237106401.9
Lupeol	1021663.986	706563.2171	1152279.728	1122873.408	859071.8388	1078609.866	5400363.361	5662929.659	5889129.669	4082415.227	5863346.081	5846734.088	3002931.314	3750498.217	3678504.073	1462799.118	3047801.674	3605168.995	3873625.285	4185144.273	4180102.927
Luteolin	209107124.0	185843539.4	187588012.8	6431165.502	925570.536	3268151.495	471471.5568	807117.2604	441388.0425	491561.8502	444297.475	558039.9553	336261.005	335523.9813	344007.8132	402956.9531	365679.1288	354515.3435	475492.4735	508070.2825	1180212.588
Meconin	5065566.272	3323732.881	4491631.325	470255.4099	1258801.91	956137.6698	326874.0857	327808.6394	313548.7659	715484.1985	632398.4925	1249190.589	9540969.058	3475509.338	7312009.64	5809091.873	11779047.99	5228632.28	10550316.02	8411538.933	10853471.53
Meperidine-d5	39588075.33	37826763.43	47345625.7	55816856.87	56032483.35	60391683.13	41557875.47	39864241.67	28376491.8	24491211.52	32142380.49	21237675.99	2740621.488	4218978.565	3442352.182	3224264.216	4517762.85	5572499.274	6591283.04	3529497.025	1242047.722
Mesterolone	8800710.138	8907508.457	8091319.514	10351470.4	26227568.82	11480668.83	40556690.22	26778902.41	27325133.11	27236594.31	30709377.04	23349516.45	28826991.29	53975613.18	55632633.5	5857914.956	7178395.438	6278384.863	11755630.47	5163612.747	7167439.969
Methacrylamide	286177721.7	274949824.2	244814883.2	188580201.0	138841450.2	147609015.1	38484065.13	52128982.25	50517346.21	79389993.77	69137621.45	69694358.56	98888167.72	53947879.35	61711686.55	59383037.88	54599525.52	57961429.38	200229810.6	193397834.4	203671637.3
Methanandamide	9607167.644	9089207.34	6611094.11	6012398.69	35699136.1	13133471.93	3449433.446	6405165.539	1498388.269	2283703.378	1092729.417	972484.7098	11457948.73	10564106.09	4856180.426	7245311.167	12437467.4	7220704.743	7976239.3	9410955.147	10506661.37
Methionine	1670169861.0	1711481502.0	1653915798.0	124782729.9	111327348.6	118634462.4	106587796.8	102318589.0	101916564.7	157402350.5	155334842.1	146491546.0	321371511.4	226113799.6	281743359.5	656668566.8	732976223.0	624626319.5	773880794.3	634817106.3	789882485.5
Methionine methyl ester	3357875.572	2693313.613	1235865.181	8486681.052	10395728.44	8142896.577	5836057.578	6390642.925	5728332.005	4732112.495	5297153.4	4477071.033	5147792.924	4359711.777	4408634.322	7097538.164	7332851.548	7777646.058	12548453.44	10749886.02	9899486.53
Methyl 4-hydroxy-3-methoxycinnamate 阿魏酸甲酯	12636020.51	14420535.59	13520480.39	21529035.67	26062620.85	23621412.63	24759410.46	24215321.92	25400402.74	18255837.76	21786321.05	22190480.72	9847535.446	8468763.374	10626243.47	12729875.95	9751732.497	8806533.857	7365943.807	13594590.77	10551817.78
Methyl 4-hydroxycinnamate 4-羟基肉桂酸甲酯	159907.3382	107230.8792	258493.0041	109166.2036	113603.029	141397.9594	721934.4	699366.4209	693222.5585	2414777.045	6041716.928	5270659.009	2189606.43	1788375.21	3464055.145	2853206.007	1472577.951	3689383.919	1298148.38	3788111.707	4901492.641
Methyl cinnamate	1934415.92	5609970.365	966228.4158	1392723.274	4640151.378	1703924.407	7010331.568	6472941.228	4204214.986	156243049.9	129544313.8	182100829.4	124496833.9	198864844.5	148045366.0	96235966.9	133519870.7	98894050.81	94260231.43	76193323.01	99629095.14
Mono(2-ethylhexyl) phthalate (MEHP)	6161390.455	5069881.106	5165368.247	15318723.57	14892336.15	15076727.84	19509265.57	6053156.357	3653234.185	3784148.236	2302329.179	3906037.64	6052717.671	5634116.423	7050633.584	4020982.507	4135347.935	5502125.644	8120791.579	12589350.59	13430745.04
Monoolein	27066045.27	24119237.17	24776221.39	35136247.44	29994643.21	33991724.86	32765501.46	21224384.97	38378747.82	2658592.24	12109459.63	3381135.66	4068984.207	3258587.886	3779204.14	4270759.49	3781469.621	3851362.029	22508774.64	4439381.953	7818411.99
N'-hydroxy-3-[3-(trifluoromethyl)phenoxy]pyrazine-2-carboximidamide	765767.9198	914180.7917	1071859.541	741921.4037	1418596.035	291082.5577	2142636.436	3008541.651	2641193.614	8775792.763	6532776.106	6062300.592	2360033.512	5817074.254	5068620.713	5524292.479	4663546.526	4598351.542	2319193.211	2885440.848	2136863.093
N'-{6-[(5-chloro-3-pyridyl)oxy]-3-pyridyl}-N,N-dimethyliminoformamide	29650250.54	25431652.37	31019783.61	1591582.999	1676388.756	2488048.34	407193.7754	406914.6188	450905.8511	288426.079	279206.0871	368037.4869	211789.6142	204245.9752	260975.322	250817.0027	297507.3191	461473.3257	12886324.87	9759438.421	5690770.228
N'2-{2-[(4-Chlorophenyl)thio]ethanimidoyl}-1-methyl-1H-pyrrole-2-carbohydrazide	17040396.63	15232757.33	12991655.39	29319093.43	20897590.34	18625121.86	20536526.21	20050914.35	15852696.19	33513834.63	26111213.32	22604485.65	22475742.82	22820251.36	27605226.67	35063302.38	34245220.47	33640456.09	68205989.9	59767883.15	52496083.17
N,N'-Dicyclohexylurea	11659358.39	9900879.467	13241526.06	26606515.42	32687087.31	25948162.96	58686940.66	19837937.13	9518790.168	11004876.43	8713344.785	10719945.12	26529990.62	25611580.38	29879360.81	14147943.35	15046075.14	14975525.97	31114797.37	45520573.92	57217066.78
N,N-Diethyldodecanamide	6741780.358	6030111.171	6546025.623	14593686.5	14069176.82	15368483.48	23027372.22	17056068.44	8231230.281	41742414.07	30494806.12	40772693.32	237068271.6	177175292.0	210256933.3	417732522.9	261110258.3	297117676.5	240758904.4	484991606.1	378236243.4
N,N-Dimethylsphingosine	408870.6758	560021.9488	692444.9285	697961.4466	1140712.192	1774638.324	1631831.136	770272.7048	777529.144	14841393.21	13585316.08	14088824.89	29030186.93	27563618.67	35765513.42	30986064.44	35833420.46	46838963.91	27484837.65	42868355.33	16663970.12
N-(9-oxodecyl)acetamide	1542178.741	1462814.611	1346093.788	21797473.57	34854696.5	30754251.94	23752891.57	17506103.21	25557724.57	609538.5866	545337.795	485460.9756	443958.6202	370132.8675	411196.7076	468041.2747	430583.3459	374795.9019	508624.9164	457061.8415	428338.0424
N-(p-Coumaroyl) serotonin	97499279.69	98481041.62	109439783.3	780660.4069	854347.2491	850023.238	584024.8796	535220.1058	566018.288	529036.5722	507946.7852	504861.4172	451816.2872	485605.2105	477062.9871	573944.4896	489672.6485	496597.7373	530813.0153	476453.5129	469667.8258
N-Acetylserotonin	2334465.739	2364509.613	1677256.946	4873899.814	4979604.409	4115577.007	4456785.626	5133133.622	3930505.92	3777605.518	3237848.933	3594785.02	4432594.301	3963565.571	3760230.365	6576659.1	6040541.622	6473307.91	6792854.714	5787443.569	4408408.604
N-Desethyl acetildenafil	7626000.557	10076401.96	5867393.755	217946.3917	232723.7467	316540.4186	2660738.0	3144538.05	2899909.172	3172587.522	3066146.294	3767996.091	2542319.492	2544057.055	2892167.205	1250244.505	1739544.449	2230605.024	2349039.438	5172409.31	3524078.376
N-Fructosyl isoleucine	43289960.85	43528110.88	41157120.06	5288315.008	3443437.78	5109071.306	8688786.728	9096411.661	8090437.389	15192837.28	13029655.82	15927959.78	16530927.8	14577046.03	16879664.95	20702537.96	20362887.64	28165206.39	107474451.0	86871223.66	48665523.12
N-Methylcaprolactam	7777426.037	8516158.579	13871076.1	37488018.51	37966391.79	27864862.35	54033045.19	35566771.63	28140560.29	84679491.59	74488292.72	68607711.55	55171442.34	58276943.75	49165891.54	95715683.91	68379166.12	76409230.16	97409841.63	97782163.73	77083004.23
N-Methyldioctylamine	493149.7159	536779.8116	517962.7566	494308.1034	487781.1693	487981.2335	905671.6702	679788.1066	829118.4929	9082412.545	6756481.299	8843918.162	8341251.687	3711597.722	6663614.653	7961786.622	8167599.356	11875920.91	5214117.482	3738904.206	11889472.1
N-Phenylcarbamoyl 3-amino-2-[4-(trifluoromethyl)piperidino]pyridine ethanolate	8052024.999	7812867.843	7611023.745	407794.0857	687999.7404	824113.5354	199644.2127	184607.0135	213315.9721	461042.2026	404225.4989	479579.22	441958.0965	597298.8697	497215.0171	462678.2114	489972.9066	469563.7709	525189.7464	451718.8982	475185.2773
N-[3-(2-methyl-4-pyrimidinyl)phenyl]-1,3-benzothiazole-2-carboxamide	844838.2324	1024701.382	1134685.089	929596.4892	1372964.23	992260.4672	489854.1937	932749.4529	1357463.079	842133.3466	1192651.336	1138498.541	2869060.375	3877097.064	4731139.234	12234088.5	11596922.61	16249378.73	6103666.699	9011131.025	8847785.062
N-[3-(tert-butyl)-1-methyl-1H-pyrazol-5-yl]-N'-[4-(trifluoromethoxy)phenyl]urea	1177706.954	1100817.093	930161.4308	682047.4821	651046.8131	658138.4282	1170472.954	651045.2361	796375.1709	1244363.524	1200410.586	1578110.692	5065329.87	3829308.7	2992827.687	1260361.97	454128.7272	2942519.273	3075147.353	2023751.894	3815843.393
N1-(2-{2-[2-(acetylamino)phenoxy]ethoxy}phenyl)acetamide	109001050.7	104126460.7	103309958.1	5760279.678	3948045.225	5679381.556	249529.0295	248556.7411	251763.9038	283239.7466	331346.556	287958.3994	323775.8766	339680.0046	345882.2667	432732.6013	422815.925	667326.6105	33659173.06	30000601.43	26898293.26
N3,N4-Dimethyl-L-arginine	145899109.7	135440392.2	120650685.8	83248251.03	96547966.61	66571077.66	47778291.66	45129702.08	48672006.58	77467847.14	66149925.27	68593384.11	172390835.6	93866829.65	107746868.0	169481368.8	131724391.3	174324671.9	153818131.1	188948526.6	192213878.1
N6,N6,N6-Trimethyl-L-lysine	464153494.7	383448480.5	393547913.1	453323525.9	340909889.6	411577169.5	437794335.4	382100364.1	519020053.4	454048960.1	602649671.4	464157458.5	525704785.5	512503255.4	460634047.8	583545828.3	543452691.2	532786043.3	666087731.0	573827606.1	507738281.1
N6-Me-Adenosine	23383250.41	12458551.45	2240183.871	1322136.444	15668699.08	18340639.66	57274.73351	56978.99965	60354.033	50363.59401	50918.80151	62332.6259	50311.5875	41373.2044	45329.70414	57261.21667	56376.69563	60669.55714	1546313.954	97360.54048	2372740.85
N6-Threonylcarbamoyladenosine	4061636.628	3910708.141	6452615.744	3947714.149	4377960.597	4519341.308	2080167.475	3374975.578	4085594.05	5503504.552	5343568.671	5895287.269	8111456.412	7619986.467	10346370.77	8213240.304	8543202.14	9490220.547	8384566.189	11029940.13	10529227.39
NCGC00169371-02!(E)-N-[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide	14887132.21	12847708.58	16392998.73	807777.5392	840209.0586	911417.8514	581110.0975	554864.7372	508178.9243	8888798.347	26625235.62	11169426.52	27169031.69	12203205.68	23772733.25	22462606.03	19497620.36	19434917.25	29764417.44	33879503.39	57891568.3
NCGC00169550-02!(E)-3-(4-hydroxy-3-methoxyphenyl)-N-[2-(4-hydroxyphenyl)ethyl]prop-2-enamide [IIN-based: Match]	1153034547.0	1137477253.0	1152094364.0	45145891.55	44697236.42	81461233.1	23073124.31	21579722.41	10289851.61	217212337.5	479502145.7	221185837.6	159496088.2	78146788.42	100793231.7	87266593.71	49914912.91	107914656.5	77936201.42	87712527.09	129823740.5
NCGC00180410-02!3-[(2S,3R,4S,5S,6R)-6-[[(2R,3R,4R,5R,6S)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one	4710412.46	4441015.502	4508707.088	6494751.28	4305276.219	2827982.597	29172978.22	42373900.42	24941101.49	37079396.01	36845325.21	23135536.86	6213496.01	6877824.526	4731849.151	6326328.169	4832499.649	4896909.184	5316896.738	6796083.018	6141440.204
NCGC00186665-03!2,3-dihydroxypropyl hexadecanoate	21313966.48	21241345.3	20164146.79	10673797.39	9626759.824	10775607.51	43522811.48	35032740.07	64570850.91	14973295.38	29322988.28	17296889.17	1063348.638	1041327.434	1366384.148	1169853.16	928200.5983	1136243.455	16684649.63	14377861.92	14546811.02
NCGC00347859-02!2,3-dihydroxypropyl 13-methyltetradecanoate	471591.2969	487598.6905	449372.7543	178387.7959	172833.3012	169246.3551	27065810.54	24520049.97	29736230.14	11517278.58	14786587.54	15727793.02	2201118.776	3191741.359	1738516.335	679973.6784	668659.1226	1122817.26	1359229.197	1522781.49	1458606.032
NCGC00380823-01!2-(14-methylpentadecanoylamino)-3-phenylpropanoic acid [IIN-based: Match]	3036807.564	2835364.167	3661291.071	228977.6388	243887.5245	271643.1274	207973.1505	228035.3563	287606.4117	2095980.806	3737858.914	2635802.914	294948.3874	371281.8562	1198104.95	511098.3582	298203.5725	1267538.739	3597092.33	4565034.413	618230.7876
NCGC00385377-01_C19H32O7_4-(2,6,6-Trimethyl-4-oxo-2-cyclohexen-1-yl)-2-butanyl beta-D-glucopyranoside	71345037.34	54756415.16	64821060.58	7048657.898	24870649.57	19934787.66	23886762.57	22982280.13	16358826.9	49363133.34	22732007.94	24706102.09	73965902.58	69069432.52	77707084.93	68127122.38	39480002.0	62537329.5	112611901.6	148301286.8	136871393.1
NCGC00385950-01_C16H26O7_(2,6,6-Trimethyl-4-oxo-2-cyclohexen-1-yl)methyl beta-D-glucopyranoside	1665293.471	2023468.858	2088356.258	15415361.06	17481268.25	11430314.94	2791139.103	2833949.643	3636802.881	453910.1011	330772.8756	2160388.352	283085.7635	264413.5417	294468.2819	395594.8304	265368.7397	301845.7716	1255609.867	5789560.754	399043.0956
NLK	14457630.11	16138047.87	8344785.231	2341149.379	2503157.184	3611204.612	184410.7999	204238.5627	251257.7931	145406.6728	171117.9622	177723.1191	128315.4874	122061.282	150976.3693	157163.9862	166280.9636	204402.3907	7282412.377	10549500.74	11146845.7
NP-000587	1944069.355	3381133.119	3638707.027	12004327.12	10906472.35	11122298.57	1177049.006	804617.0101	11568320.37	2027401.013	5471966.35	2819028.968	5374242.055	2461766.732	1331422.455	1893809.059	1138857.075	1552203.321	919628.1328	995897.3089	876154.2492
NP-000734	20837093.71	20969341.16	20641733.46	30331853.71	33563170.36	24352120.79	20620209.65	23390910.1	24804653.37	17806563.06	18133921.6	16790420.82	5425290.159	9041702.659	4945251.939	8721260.466	7525438.086	6394382.4	24627840.54	33872623.78	30106380.65
NP-001445	14480393.79	16791971.96	13599968.74	1520132.984	540540.755	389159.8433	187561.8102	160426.806	144126.706	415451.5536	379075.9682	483799.753	385579.3386	100985.32	320101.2138	325028.9449	308346.097	119207.1229	2937132.06	3286198.295	3621499.23
NP-002322	255693300.0	229494098.3	207751961.5	126871123.9	95489438.88	80563494.52	4046879.249	4893716.448	2214957.253	4333800.874	3003224.339	3529055.47	3750544.592	2143281.352	3071234.295	2689732.417	2112102.619	3042832.128	12507040.09	7235978.192	11650520.51
NP-005821	4336978.341	5446439.709	3603357.289	14393293.28	10892018.35	14171806.8	2273806.843	2344607.177	2054681.233	590580.832	559412.7054	487885.1578	331082.4459	330598.9551	301513.0694	366931.0146	329872.8804	305568.09	345340.0068	326261.2669	301805.5711
NP-005982	440329.8432	458175.547	420929.8856	180195.252	354875.8001	136110.7088	95597.31093	87552.80696	98592.5986	118585.3036	131928.6994	5006695.393	15341496.97	16553191.17	14685493.16	15463129.37	36699738.9	17837848.85	12295571.84	3775527.637	6840999.91
NP-006989(12)	26737913.3	22648176.63	18839652.75	7859980.555	17247846.21	7106566.003	10984117.03	14477950.31	6423727.849	31615718.05	23699263.72	14751207.83	8257203.186	8298053.079	5073940.063	8772742.489	5924333.235	6658882.087	9134537.819	9964121.217	9125533.03
NP-008882	266744981.6	269934327.4	266817477.6	73918023.53	56256264.64	76067190.39	40300775.5	32868797.4	10779627.52	14604046.42	22301520.12	18822029.81	17734736.35	13146385.64	25533640.23	10053488.7	10537140.71	13704360.73	26202795.89	24122992.03	13932563.0
NP-011319	49730527.9	59410164.72	32000308.11	20285448.8	63608095.99	39507806.17	77289348.43	45004118.04	119193818.8	90208387.53	92834233.3	80745185.98	45008468.99	86841486.67	54625370.83	61267250.21	56883413.31	64983804.92	79658252.74	95906703.46	98140125.91
NP-011548	98251.2604	110612.326	123322.2314	212004.2292	321542.7966	238631.4599	171695.2801	138271.4385	232072.9092	3326963.512	789768.8488	3991748.1	2116345.342	521041.4132	1625797.354	654927.3336	1258185.304	1547111.097	555681.3708	2609964.072	2452385.731
NP-013366	18034019.52	20816561.61	19155340.04	192600899.1	115894193.4	214196314.4	318250361.7	173217186.3	239595612.2	96140590.41	68186100.71	111811154.6	30512176.13	32668639.52	37228316.42	51404216.57	52111588.07	35020760.21	34660287.1	46425392.53	20051235.18
NP-013538	3948431.963	3942409.614	4790410.404	27447309.81	36735469.41	29523451.73	31663493.15	33263562.37	35866444.63	35207644.83	32326984.19	31772972.53	16385667.22	29416127.87	23287149.28	26259676.09	28322589.43	23189762.02	18498917.85	22875574.58	20545480.53
NP-015559	743423.395	570887.2395	554695.5894	600490.442	1063890.376	546423.0026	54742433.01	19890877.0	33140308.08	40169486.74	48245923.46	29381967.85	16223869.71	11052288.67	17327680.63	16504286.52	16069470.74	30265784.39	19607247.63	21182608.55	21219202.47
NP-016455	554424798.3	561674641.7	477280707.2	33838000.38	29060928.42	31761883.08	955218.2743	1486231.065	1678153.079	1199972.313	822844.57	1345373.741	1227986.915	992848.5904	890871.4941	2536334.89	1920350.609	2602436.647	207699109.3	170410535.5	165940718.1
NP-016501	281374935.9	255752453.3	260420304.7	59597150.65	56233963.66	55511417.44	5939140.361	7432653.832	5673694.156	857556.8707	908679.036	893440.7173	577165.7244	504495.8706	509236.2699	653384.8675	856277.1849	610514.8985	1605618.68	3408915.611	4270345.611
NP-016582	1966339.643	1438415.764	3475800.461	424250.7712	1658739.85	4205461.413	5816063.728	6364653.542	6353620.137	132440771.1	114921704.4	131970991.4	181745227.8	82439930.54	131127151.5	135413147.7	134308549.9	213090515.4	120332020.0	219811127.8	203563545.0
NP-017176	590024.8612	618056.1501	655246.4522	1611618.645	1896564.281	1072608.624	5547328.675	4722548.683	4056338.025	4863581.161	4245598.376	4558480.781	4346144.993	3239341.249	3855311.726	2594205.032	2347894.939	2706771.581	406363.0236	1001765.77	1188116.78
NP-019498	2506005.071	2822029.687	2750201.119	4161749.523	2449739.316	2210813.076	6125952.637	9046907.148	5517137.108	18060380.59	18659451.73	10322607.06	5277114.589	5761728.601	2730974.197	6054701.908	4411247.726	3056057.634	4668203.381	5445718.22	4879931.325
NP-019725	1275602.828	1271487.603	1264619.879	25967983.9	28499571.81	19975807.06	14001892.11	17003576.93	13952277.51	8020950.79	9723940.004	6162359.174	5738820.089	3747735.679	5013931.864	2354003.449	3239529.462	4688321.854	841935.2462	834767.7803	1537006.7
NP-019992	5026236.567	3531947.833	3158006.119	4633962.001	7252147.812	5705834.109	1435131.808	2409117.286	1350184.901	1809440.395	2123552.258	1226864.222	993354.404	1679236.442	3915120.377	2527554.782	1265486.783	2024621.254	2006632.693	1017913.38	540060.8457
NP-020583	71803141.16	103542700.6	99199618.09	126368652.4	105152810.2	117967537.7	51977525.25	52513347.1	56401905.81	37279278.29	42095686.22	35032130.22	24120700.68	12829389.72	20136274.97	12072270.06	16533074.86	18088013.89	43264675.52	74334765.84	76460284.0
NP-020760	65028529.97	66552621.1	61199439.03	52173475.61	38977111.49	42354070.09	12834557.95	17327647.72	11279367.82	7429720.193	8278447.784	7548159.13	6953915.633	6693985.096	7530819.985	6511694.397	5471936.162	4550201.885	15346311.95	19412308.3	17431369.3
NP-021292	5558111.356	5388503.986	6449290.096	590685.2295	769464.4954	967067.3405	1175003.387	216454.4331	1114908.4	527338.6433	525441.0285	646485.4301	754197.9235	441161.0446	557431.7321	219381.2851	293864.5131	608575.2388	297414.1898	258048.9579	275012.6863
NP-021781	765230.4529	715622.3959	625517.3321	915057.8912	810699.9107	772870.9769	30484803.52	28000318.98	27409458.42	17600482.25	24433631.64	18557986.1	2824021.356	10760444.24	10326400.96	604811.7052	534736.7306	487179.3411	649952.0404	499075.471	476745.8985
NP-022405	6922558.238	9752835.738	6136069.052	171776.4229	129217.1073	117990.6401	1389339.234	3262977.553	1094905.849	11338628.05	5552566.776	5931377.43	29377877.08	13204983.49	8683127.415	13568765.26	10742458.2	16924764.39	11736977.36	14757638.31	9770049.713
NP-022531	259188.3148	513189.0576	395463.9177	324461.7419	309816.4131	329312.8335	500283.0584	542490.4224	688478.2052	752430.3407	933031.5757	989235.9074	6308757.469	11594425.3	14386251.07	6146129.55	19560622.16	8151535.913	5970136.832	3216236.057	6512960.992
Naringenin	298295885.5	311136412.7	322426803.3	766852.3232	772338.1395	753970.0373	807399.817	1674412.311	739317.5863	6136909.448	10350783.14	3692990.424	4505249.654	474088.5655	14641564.92	63595298.99	21310415.42	140702266.7	43298882.79	104573458.6	52510435.16
Nicotinamide adenine dinucleotide (NAD+)	2193700.058	2100140.066	1837693.892	42254619.08	46867711.02	29035221.28	59355919.87	59982569.22	45298873.58	20694568.83	30540747.19	26645716.34	38690339.59	30275273.16	31432227.38	46225690.61	45330700.84	51636316.63	3113792.181	1501584.254	1534210.55
Nicotinic acid	164974072.8	161228510.6	158275869.5	130926009.7	115261313.4	112004686.4	34954931.29	32858430.41	31312496.46	31817508.7	28392134.96	35239840.54	57174129.65	57503535.37	56285929.17	46976879.81	53523327.58	40634527.49	94207758.26	64511988.39	93970363.81
Nonivamide	3550189.332	10364535.28	4205339.038	14139303.73	65052816.02	138445823.1	2312090500.0	1169339933.0	1890170369.0	8224212374.0	9433999720.0	9540408289.0	10196315284.0	5927354846.0	8991734209.0	9084743496.0	6006586710.0	10176427992.0	7615603712.0	16480713849.0	15840414128.0
Norfludiazepam	615240.4248	467201.5299	584132.5222	6850604.273	7733342.903	6422708.722	10778541.09	9536821.902	11785599.37	16007979.14	15041997.18	14042715.0	18170250.42	22302078.1	19316512.24	23212622.25	22134938.65	20364424.93	42131466.17	85571040.17	67799143.37
OPEO	13557965.36	17543762.19	14338793.34	2372566.733	1967259.226	2157876.433	189357375.7	189505590.7	208440749.1	256056728.9	263295532.5	300977842.9	78394858.78	62705566.18	74612209.91	16538428.12	20337802.71	17625304.15	22942082.56	34478690.16	28638877.31
Octinoxate	726185.3592	392355.3519	691608.1655	1625622.96	1734475.24	1139455.401	7237407.42	3737559.337	3477262.734	1384058.02	1171127.176	5553591.122	5834934.084	6817054.685	5680128.124	7493669.115	1546711.636	4761856.632	829698.0762	1133966.476	998958.1275
Oleamide	59770112.0	56862794.62	63809810.39	143933378.2	137450577.7	160647129.8	236809425.0	163590510.0	99878232.4	6944070502.0	5892795011.0	9002524427.0	8470942382.0	4754031434.0	7172942651.0	6450646082.0	8728968241.0	8165608408.0	5672999573.0	8338133187.0	10047505254.0
Oleanolic acid	6263431.529	6413205.469	6188144.939	137922.7513	142075.9817	134984.6635	138661.2694	137586.6517	137162.7396	164678.8624	127481.132	125635.4033	107637.0355	100618.3401	133237.7726	124347.6104	91565.91189	126193.5591	157503.6986	149616.2719	165433.7922
Oleoyl ethanolamide	20150602.74	19888629.84	18930033.39	3904764.128	4608609.551	3215886.308	3194874.032	4070996.761	2608729.275	6179693.86	4404233.25	6031514.162	7939016.885	11589268.96	6101272.485	9105381.987	10995749.2	10016031.12	37153734.8	17774819.45	33253498.11
Orientin	78954461.06	83163295.93	76020227.8	31701603.52	44737697.16	34650842.78	51360207.86	65735067.37	42028149.17	112638965.5	97942534.81	69035144.37	25502617.69	25498403.42	19470951.05	29750867.94	19111363.76	20100177.34	23376630.27	37583737.42	33688289.05
Oxitropium	1464524.642	1307091.322	1791431.228	1827866.277	2105240.968	2313339.262	8559674.02	5980828.989	7842379.377	6486924.897	12107247.78	13688189.35	8305287.481	10659650.99	17864519.22	8934296.367	11214575.54	20610044.74	12200958.39	7492474.096	15388617.86
PC(16:0/0:0)	1068036564.0	1066604366.0	1047406600.0	394729439.2	351494668.8	390549475.6	312116691.6	290473886.7	255631573.0	186731927.7	172873755.8	234933365.8	157761431.6	158987097.2	140047077.7	115115652.1	200549213.8	142196892.7	782315931.9	223693071.5	525371391.9
PCEEA	147331.0376	219605.6244	208984.6092	378143.4755	445624.3752	441357.2949	2280325.093	1291630.202	1766894.771	8827923.168	11162748.02	12328593.5	12308458.72	5558254.351	9970795.877	6535609.575	5232581.91	8872330.631	5548585.746	14367183.64	18949958.78
PEG n5	1403862.056	6896296.631	1371930.287	292468838.3	76545829.3	294748159.4	15448211.66	3353344.387	23132716.04	3896791.875	25975871.18	20332135.1	7886258.89	4182754.496	4290856.935	6425429.85	19572151.28	2777308.516	6261994.213	2204893.556	2627516.473
PEG n6	1969616.772	12493772.33	3451861.108	189866169.9	44954050.93	165296095.8	4643713.757	3348984.272	29423099.52	757779.2334	43488459.23	39768686.21	4335042.237	4044079.066	3331234.581	5019078.841	32180346.58	3076501.076	4648059.479	2741474.623	2374038.586
PEG n7	2460217.776	15005866.85	3042436.043	106618389.0	17054318.89	49028395.08	1276529.978	916925.2135	30380271.55	1885175.01	55446989.42	45451371.57	2318286.073	2203194.989	1376060.624	2500701.284	35128651.15	1456768.355	3659227.243	2053214.043	579817.4274
PEG n8	9390316.245	6490486.067	1212058.724	33537922.2	3281934.376	9019862.347	996179.5993	775096.1056	14701071.69	387556.055	32795126.66	26862159.74	371638.4523	598976.7727	478051.0252	616195.9949	17321990.77	359880.9251	1307443.565	694423.5801	500772.6086
PHOSPHORYLCHOLINE	2816003.802	2788226.316	2500442.23	27767464.21	13314268.66	24590651.61	67916831.06	52396372.88	51981039.35	123071952.6	100166239.7	134817300.3	93729718.32	69173253.07	75900662.91	129955013.8	136054561.3	180469307.3	92898339.32	160096065.5	149904510.3
PV8	4608252.521	4324978.109	4766954.013	9086130.594	9425069.193	10226395.48	44934198.71	17297492.36	29036124.81	278752561.9	320476574.1	386670729.3	385426958.3	124661206.1	259135270.6	170101721.0	190858744.7	223179184.2	130215138.3	353186424.0	522940433.6
PV9	131270.5529	137501.7131	138935.0781	285685.6786	268206.5621	250283.6591	1435480.843	337435.8186	724071.7094	6990430.112	7185352.01	9989492.055	10668138.79	3040173.722	6867952.891	5329192.456	5139405.204	6274564.824	3595798.602	11896754.95	15978795.19
Pachymic acid 茯苓酸	9467331.646	8900650.323	10065096.55	61517739.45	64039525.92	49178980.17	85935833.61	87431226.98	82881527.21	75927435.81	68701992.42	76158557.42	102715962.4	101465852.7	102988252.4	53643371.44	62931238.31	73978346.91	27951442.48	31671492.38	20357104.85
Palmitoleic acid	764046.3587	387253.7961	990539.6619	805540.8778	1198621.608	597398.1392	7408524.142	2854362.116	4704963.849	21301806.46	25777674.63	17912651.66	12743123.99	6217727.058	10293875.74	10986507.88	9394855.664	7739441.907	7563654.459	11973088.32	10610181.84
Palmitoyl ethanolamide	23186625.36	25379318.56	25157987.92	6088297.571	5110062.711	7460743.268	2831618.555	2419190.113	2885663.734	8217206.23	6435344.567	9097069.275	9876114.85	5624953.898	7845325.457	8207641.899	7075814.717	10511885.44	16493045.24	15923147.58	20005300.68
Pantothenic acid	79853654.3	68833848.68	73198561.08	111066405.9	108243869.7	109258530.2	102069712.7	91468851.4	98336460.59	209840045.4	194267410.2	197041217.9	176254112.2	158413424.2	193590086.8	181129591.7	162732319.7	164220617.3	145516654.9	165865637.4	156816871.3
Pentadecanoyl Ethanolamide	137088.6217	142099.9011	137939.5785	183749.8232	159638.1447	299453.8072	673783.2247	149866.3626	373276.0867	14703522.44	10814339.34	21621614.92	47913044.07	28834902.52	42846132.75	42573543.09	40426767.35	43235899.2	28513510.93	53916678.23	50689859.07
Perillartine 紫苏葶	108229.9898	109938.7363	103672.7456	133666.8451	128349.0219	121108.5248	587653.785	152608.3219	430869.6836	4392429.436	4508858.789	4164520.911	3286277.954	1216615.957	2148830.104	2335558.05	1913648.078	2814694.47	1926173.528	4437870.249	5164805.301
Phenethylamine	10287846.0	11284573.76	11526432.96	5118394.382	4076882.382	4229785.072	3493092.612	2581225.592	2607814.024	4779951.966	1281259.669	3726070.371	6455415.412	5380927.492	5825692.989	8290829.621	7211479.025	8125978.532	8842278.772	13971705.08	12264564.88
Phenmetrazine	917405.9768	930116.6977	963304.6141	34012259.79	29986374.17	25971024.04	20432864.43	21679829.09	28250213.01	31545922.89	29108295.38	30360933.2	6306785.781	6897668.104	4540806.145	1625826.108	2264685.549	2236714.04	7319637.721	6124992.415	7475755.057
Phenylalanylisoleucine (isomer of 1329)	286989037.6	292601183.2	249811598.6	6840867.474	5926004.693	7753169.387	474219.7483	1725431.984	581869.4355	1194291.878	1161089.397	945235.5338	567666.9894	356400.8187	328394.068	781654.4227	879634.1244	1024208.277	100136770.7	78385129.0	79658050.55
Pheophorbide A	312009188.8	1483784723.0	209897540.1	348880617.2	9182275.662	13611758.11	2026389812.0	1848533281.0	2011028249.0	3811859017.0	4093458686.0	3177297014.0	569531422.3	339955601.2	684504224.1	170534601.0	560681893.4	305147685.3	34781753.64	52057832.03	40251767.38
Phloroglucinol	44700075.36	75057094.24	51380875.53	162391618.1	173212233.3	146563120.7	185980366.4	177029924.4	168383158.4	155823614.7	259627260.4	142534839.5	122713108.8	189884735.1	158378722.4	157465109.6	729022739.4	172478655.1	112396727.1	1037563404.0	425361224.0
Phthalic acid	1231862.361	1283509.516	1577695.749	4625937.169	4483434.461	4066729.808	6090219.201	1577546.761	718524.0947	623479.8748	471306.7028	636650.9523	1706370.803	1459234.564	1646553.285	749443.0405	866876.0589	1481075.336	2281130.194	3594930.496	3654269.178
Phthalic anhydride	14095519.57	12938883.16	14346759.81	41716863.09	41743116.44	38629940.58	54767136.35	16939149.89	9559426.402	8349859.473	7402441.828	7608556.748	17890885.23	15340975.83	17330189.89	11575457.81	10337505.93	14982428.97	22058165.45	31808931.43	35043855.8
Pipecolic acid	424075396.4	451239391.9	383112373.6	53047786.29	75924679.88	62688061.48	51719012.16	56511030.42	51006998.68	43256383.96	46010491.03	40415471.84	37403858.24	28362481.92	29643990.81	46245838.64	41909665.89	39876429.93	63284674.86	57211349.29	60942781.69
Pramocaine	30424173.18	26811597.09	27394775.14	77632180.49	88670762.55	76387296.87	22798851.03	34223809.55	35641736.42	35407694.25	33439420.15	26546437.52	24735642.01	27045780.73	22540864.06	30050194.25	22247171.74	19683010.8	34798170.15	22524841.23	24924217.01
Prespatane	341130256.1	369829091.3	401153937.4	147738831.2	205316910.6	174339968.5	38646865.37	47941192.21	71556173.8	32529857.34	33937252.68	36005182.12	12974924.61	12981928.61	13238301.58	15772373.76	12672158.79	13556479.12	20598465.78	37679977.46	22890149.44
Primobolan	1465386.934	1307161.92	1207237.654	1885318.946	1274664.375	931161.8741	1246699.895	1208079.785	1449284.402	2597976.109	1054496.902	4841724.101	29473985.29	32860452.86	37384513.95	19643125.6	23154058.86	24103612.12	32734308.33	7001241.758	19534487.02
Proline	9329929484.0	8766494561.0	7796640680.0	2362797923.0	2874019467.0	1876442771.0	355829935.7	353992523.9	419315642.5	764297560.0	457718225.1	814319483.2	1389668550.0	756105024.7	783529021.1	2657200404.0	2467167024.0	1794644442.0	3110689179.0	2896573212.0	4436092071.0
Proline-hydroxyproline	20982122.82	17216995.81	10042180.39	3264309.617	2071392.824	1798124.399	1757520.892	2105220.767	1917719.536	1113753.838	897740.7714	684964.75	460326.0071	282538.2067	389771.1798	448996.1221	304437.2483	314303.2392	6841790.553	4972400.743	4337857.653
Prolylleucine	156235890.9	121675008.0	181589648.4	27293608.56	75955333.91	30346893.87	12244169.15	16228385.08	29286062.36	61214035.16	66663107.68	95809600.54	96304754.88	89637507.7	171096897.8	126215584.9	159497264.6	105041162.9	88315492.13	91812100.23	84221358.82
Prunin	5344865.305	4616492.468	5635315.073	1351642.694	910245.6653	981098.945	19208737.97	22100667.37	19331357.4	11657743.41	10948094.23	6993317.7	300570.6671	645648.152	420727.7089	903488.2089	897071.5973	836012.8548	888678.8848	1971828.974	1334080.859
Pulegone	2912177.197	3284579.513	12090269.31	9805137.968	34988698.84	12657661.73	1775789.412	3024294.132	3729121.803	8510848.428	9846740.496	8632245.691	740195.3768	8418858.733	7734448.839	723604.5779	503186.1533	689846.5674	1001313.774	681969.2752	2038264.909
Putrescine	240962249.0	262355420.8	227921236.5	213180383.1	286383285.2	259220150.6	347805366.8	340590106.0	428242353.1	323199211.8	293038803.3	206977052.2	132762743.7	74544666.86	71695679.4	42541445.57	60358634.61	41116866.01	21397261.85	18550796.23	15970323.53
Pyridoxal-5'-phosphate monohydrate	1001738.27	1043640.856	1043641.821	9786327.8	12785930.68	10930153.56	20535306.43	23861282.75	22674418.68	3131408.361	5778382.75	4840640.235	3668942.324	3144283.315	3321672.819	810508.3697	1387585.024	960810.2824	921402.7288	983543.6628	1026569.8
Pyridoxine	67793253.33	71684387.57	71067597.62	60180870.65	66818522.48	50852496.21	79945744.48	83858171.91	83435499.41	74725457.19	79897836.95	63087237.61	40020974.85	38172671.7	45935548.34	41952878.72	38062295.17	42177805.96	61769388.52	43617912.36	58100727.61
Pyridoxine + O-Hex	109166198.2	112078581.5	116398280.6	199823582.4	204269761.1	184546984.7	326497462.4	333919935.7	313136510.4	581184181.6	642752031.9	640082011.2	1005512488.0	867113928.1	1054174697.0	1059184589.0	937398013.3	1117984886.0	646438150.0	893534010.3	858086875.9
Pyrimethanil	6595385.42	5898245.686	6356146.849	1481791.435	2745684.523	2840013.055	1593519.698	2196648.003	2313063.652	3093828.051	4064003.418	4685130.715	5414715.679	5409158.857	5919992.033	3174389.55	3321127.911	2755571.161	2973478.166	3677386.843	2649831.98
Pyriproxyfen	3445092.517	3167242.886	3497425.563	17492214.34	9306040.691	11912062.3	11968488.55	6837356.764	4386984.682	4238830.17	2632899.57	3299042.712	3226075.326	4809210.242	4028529.018	3126399.578	3638141.033	4037781.279	5932953.254	8353373.989	7876098.66
QLK	27895158.47	29824980.87	27778752.19	812540.5358	739445.7919	1225467.777	555096.9603	559279.0629	557672.1675	870793.1348	677611.23	798387.4557	823218.5031	581976.6275	700408.6851	704153.7526	686630.3942	686203.4959	76025566.37	53336130.72	56498983.27
Quercetin	119474347.3	126877851.6	113286935.3	418227702.3	282622802.3	187049657.9	2212237869.0	2635214774.0	1664296456.0	1734700354.0	1661083774.0	1206245223.0	379355817.1	415318177.4	294124425.2	446890620.8	306024287.2	271966495.8	361770839.3	348712799.5	281345758.8
Quercetin 3-O-rhamnoside-7-O-glucoside	8407198.06	10473588.06	3715334.972	5519854.305	8345193.63	2566114.103	49976027.7	56956708.19	25916955.79	64540192.89	49652854.4	49166044.62	31286073.52	33937792.09	26112782.92	35672858.68	27152085.51	45136607.25	58990326.26	81128413.45	63643441.22
Quercetin-3β-D-glucoside	73090867.55	71300304.89	69705381.04	16699872.89	15127597.19	12788543.02	63278813.24	82841497.76	33733376.55	52045754.86	44174853.36	23113631.44	4334618.845	3741107.688	1898316.329	5494829.5	1794810.398	2792956.258	2829567.958	5555556.357	2915893.764
R-Palmitoyl-(2-methyl) ethanolamide	358401.4363	377863.4273	365583.1389	201880.2315	236318.9357	224067.271	180029.5636	177798.6809	211785.132	1986726.865	2403909.742	2700814.367	2406381.031	377730.6677	1229144.143	773684.1663	1294928.001	1848087.529	576627.2792	2375215.69	2722472.331
Resibufogenin 酯蟾毒配基	52091692.61	49853534.91	44039451.26	52246737.76	52079515.89	21914198.52	47390317.39	50190418.39	17666109.55	41724344.85	43756548.74	40517992.2	11309533.95	16346172.08	10741876.04	11046657.96	11430762.11	8396901.123	18368726.69	28154987.21	22054826.19
Resiniferatoxin	23993688.6	123545762.2	12184816.05	716360014.9	5048628.507	20278994.55	610353535.7	666393537.5	657931282.1	667864205.9	656027519.0	662218622.1	542338641.7	446485002.4	573190645.7	210763083.2	737595448.8	352905511.9	28711650.24	46808580.78	36543766.75
Resorcinol monoacetate	1602892.334	1918922.159	1939371.309	2750262.821	2914254.917	3235662.209	2886705.149	2848544.034	2785989.819	4052271.731	7997564.855	2841981.027	8395375.171	10679861.79	4422263.584	8919259.101	7984224.934	9975766.934	6115450.631	8900491.504	23897128.29
Rilmenidine	744956.1047	592232.6311	614392.8262	2022369.826	5497182.498	3166545.606	8274534.933	11321770.16	9963486.789	3933852.015	3227669.165	1940000.105	285931.8026	126536.9698	138437.917	230109.4142	179349.0607	186996.0925	324251.4438	290896.8515	215191.9606
Rutin	635255.7261	1025892.358	739443.4655	867519.7959	847102.653	1022897.546	743257.9977	800429.332	682394.9485	4486434.392	2533021.252	5010038.301	8260903.785	9980813.29	7510418.175	10896530.56	6795320.24	12436621.42	12042496.98	19018273.29	15984974.18
S-Adenosylmethionine	4174251.696	3846710.687	3380896.662	23534795.13	22544768.48	17180273.58	32850796.28	31144292.47	25387241.48	20490353.49	23218494.11	20383459.67	41799177.18	28097742.72	29618911.21	21388382.86	21325047.95	22036669.06	8844758.978	9032991.492	5402687.542
SLH	17845509.92	17399867.06	27634184.39	4127045.301	4569616.025	3768091.801	3797208.749	2773752.235	3347767.443	8900569.732	7151147.375	7503660.213	7328271.945	5414428.245	4380164.465	5900291.67	5566775.991	5470994.081	13284277.63	6571763.775	7019449.113
SLK	46867437.72	61878312.32	53766000.21	2199847.332	3222566.183	5579795.246	424713.1132	422207.0521	384953.7023	575068.3417	486375.3373	462230.8885	687302.8356	594212.1504	632632.903	711900.6172	613274.0633	631872.6805	14209706.93	16644406.74	14991329.65
SPI_270.2429_14.9	776317.0806	939895.663	906046.6412	1969724.921	1944404.037	2143708.826	10874808.45	7265292.353	6378526.179	46327405.42	59384628.04	64517057.77	83971962.86	40640613.61	62273455.36	45576143.17	48742155.43	52713858.87	35608505.73	52940835.73	72525265.54
SR144190	238282.4611	266012.411	214643.9812	3264449.012	3712247.494	2837791.715	2402507.6	3136098.074	2130488.102	88238.01882	143039.1478	91565.40579	81265.91729	67031.93089	64060.52577	91041.88187	81243.77933	89490.16547	87247.27209	94433.30091	120827.3753
Sarsasapogenin 菝葜皂苷元	631809.0784	631465.6317	838510.1359	137598.8673	140998.6542	124406.149	118001.9051	118727.4383	112513.5039	119335.7286	128270.2156	123023.6984	114886.1	263491.2361	115476.6492	103888.7805	98438.48269	103095.3636	4662256.606	2486555.786	13613915.1
Schaftoside	46286329.27	28261190.08	22923376.73	15342464.07	17002948.74	16529173.02	16352093.83	15805358.53	9397011.263	47510428.88	22623327.45	15206378.96	7603603.557	15597496.64	7333520.414	11905415.7	6604441.773	8754953.231	11750294.91	13619608.56	18306191.39
Sedanolide	23003697.25	28045279.81	22823395.48	10029077.45	4041605.95	6081565.122	1966291.699	1537177.16	2432471.239	1615985.144	1759103.089	864723.0376	483379.0685	3595357.672	621496.3254	369231.0106	316656.4011	313402.5582	1105054.893	3410569.937	3576757.539
Senkyunolide A 洋川芎内酯A	4813414.546	237697.1641	6575318.665	1960628.777	13091590.6	12381906.14	5774707.334	6695495.953	200347.7752	4837145.276	165253.682	696005.1119	3425839.971	3508487.124	3147214.303	2921973.745	203393.0014	2236240.809	2847466.531	3044934.192	3048348.33
Serotonin	105724795.7	109420467.6	128130236.6	747556.1215	707568.0938	1103824.74	1020646.633	1698624.193	1088362.232	2026123.191	3048872.022	686282.6374	592072.6291	973763.4491	1592125.752	1942272.228	707598.9242	262447.6279	2647105.888	1094820.492	875711.8094
Serylleucine	1319325128.0	1352003705.0	1292445336.0	117937347.6	89767533.28	124593202.5	3243358.837	3354942.039	3986304.818	5604023.883	3992724.621	4879991.732	2551125.421	1939297.857	2350281.594	5641315.595	5024662.144	6511503.252	373391282.5	317979920.5	332175249.6
Shogaol	6518405.138	6652487.302	6298493.946	1970062.731	628277.6577	1813906.206	446552.2283	272255.273	1069176.968	236501.2755	242155.4911	360832.8375	201373.3021	219272.8155	476439.2199	191043.1394	350680.887	208711.6668	1296003.215	769536.593	1301345.587
Sinapine	52783259.23	51900525.01	51039941.57	57079311.64	78993320.18	45279553.32	12358736.4	22504564.21	12309291.32	9242036.852	6951996.066	12744662.82	81416562.2	13495869.53	57339509.1	21912041.27	26085702.61	84401642.66	15585487.22	52967300.88	45386379.71
Sinapinic acid	4542766.848	2115799.503	3680763.259	16154333.57	22370545.6	12417245.05	28786463.96	35926205.65	20958745.5	97256245.66	69724790.75	68459468.69	93369876.62	69999121.6	87834186.28	91412910.79	84316065.48	111436928.4	54558078.46	89665688.2	86427574.45
Skimmin 茵芋苷	1412155.59	1281382.87	1589326.129	386744.8267	332359.3212	448878.4944	300698.192	264540.7282	291229.0917	5389260.575	6145829.23	8051705.114	5057386.05	4318829.65	5770274.51	3677389.959	5586138.724	4374634.637	565584.5605	1785827.716	2291205.119
Sorbic acid	5057005.014	5030327.396	5213317.398	4832388.413	5294175.212	4948762.053	5831265.763	10697174.1	9067524.668	14812107.7	22122275.02	14363713.24	6084917.443	3276849.038	3299469.885	9919921.955	19936600.21	10978875.45	27966088.1	20388016.05	6104280.126
Spermidine	1025809769.0	1049069928.0	929835564.5	680004553.4	730332958.7	777781317.8	787550200.9	724982704.0	673646502.9	516768727.2	527629889.2	398876553.1	277502051.7	234058221.4	268227127.8	427905411.7	358434761.7	330344258.0	348884780.1	287053335.8	222432072.4
Spermine	898695578.9	882848864.6	715238323.5	232680493.4	216892457.9	289374981.0	429478961.0	376794160.3	287680390.3	177329160.2	179040556.1	143486400.3	267692423.5	269674053.8	188336104.3	379380279.7	396549791.0	285869769.2	378781762.7	399524878.0	235330534.7
Spiramycin	2164278.625	1062700.157	3983996.566	30911039.63	25094923.68	20425214.25	14770175.88	17631593.64	11462067.65	10245702.81	11961813.07	8468336.232	8930456.168	7717054.342	6320805.826	6222686.566	5542994.951	5957352.405	334217.3444	335010.5919	327958.8563
Stearamide	41998390.91	41598003.65	48205802.63	99991930.6	101334698.4	123883277.6	131738015.1	93804984.03	52106148.07	4326141322.0	3361695035.0	5665137165.0	6135233686.0	3090122359.0	5003818503.0	4841706396.0	5745176228.0	6788937814.0	4114687191.0	6482488020.0	7564360937.0
Stearoyl ethanolamide	23218701.58	23183620.15	23989581.64	3654569.493	2974563.431	3280907.411	2460262.972	2273966.506	1464607.706	2292362.43	2270413.453	2744813.103	3493865.589	2602878.477	2047517.496	3087099.222	3365289.435	3620681.987	16416590.01	10282009.71	14520239.23
TLK	20080265.34	22182456.14	24640121.46	1148451.347	1126257.465	1997907.638	166890.2317	172380.8489	207593.9856	163633.4032	187887.6669	187649.968	205796.6857	166979.1346	203323.1972	218240.1788	232250.2816	267267.6853	11045020.06	11051104.2	14123833.82
TQH	18137101.73	20941922.39	17802516.43	1869509.515	2586930.725	2778135.008	2562398.075	1905608.158	1505816.717	942151.5245	1061089.207	946979.414	2057253.641	3565812.758	1564840.224	1991751.726	3710211.861	884580.1565	620914.8598	880678.8994	580970.2373
Thymine	4872638.198	3656130.968	4100281.564	4944678.726	5025541.944	6688248.084	1916634.78	2582001.455	3222589.751	985235.7535	1108301.477	1129579.606	583202.5459	292631.5438	335862.287	262990.9556	863930.299	1193408.28	673068.3203	876607.8931	1234055.509
Tiaprofenic acid	4192178.753	5382695.485	4324925.428	72209074.29	69248771.88	48073571.51	192569327.8	196635379.7	159381920.4	226911007.0	211340983.3	193780034.5	87922929.13	87568118.03	104061811.4	45811410.92	48069041.52	62002564.13	19903143.34	36975395.54	36730935.69
Timosaponin A-III 知母皂苷A-Ⅲ	1654101.406	1628329.813	1674532.269	1141521.167	1608500.821	1305688.188	1289122.657	1361138.965	1223102.809	20629087.45	12195501.3	46334500.25	380386143.6	478756116.4	516953718.9	201148113.0	349344332.9	246731695.9	337267310.2	73371246.92	297190742.2
Toliprolol	198401717.6	8309325.054	176494908.6	46256010.78	50442790.84	58697328.25	5756336.266	13793400.34	13090057.97	8396756.502	10227851.48	13004342.47	12779083.39	30636389.71	21235065.69	42863117.57	25836443.29	21550446.88	68314902.55	20455905.75	55375005.0
Tolycaine	1726478746.0	1735246779.0	1782826683.0	96676059.19	87315373.81	109271475.2	9434525.765	10294563.65	12246827.31	20214550.69	15164375.18	17483468.41	30050235.51	22681850.1	30586182.25	91995535.94	82290883.06	91183799.77	649630851.6	598704253.4	451911482.5
Tricoumaroyl spermidine (isomer of 2951)	3119345368.0	3056460942.0	2904594676.0	16485233.76	14454233.51	22847699.1	1611524.2	5436820.61	5848598.753	4523935.573	4184973.372	40831387.1	2703446.165	1943224.813	5041319.91	2886873.61	588729.0336	2315337.985	3973891.614	2379653.916	2159078.257
Tridemorph	17748792.8	22242059.02	15073902.04	28944262.65	63499994.72	33626875.22	41014452.15	41649460.11	24894079.1	677101533.0	565340187.6	808560095.2	1044940792.0	544777174.5	881272252.2	1005503528.0	977345575.0	1279100159.0	839227653.0	1423576180.0	1409641161.0
Triethyl phosphate	7533018.999	1669834.761	23869832.16	1760579.15	63459421.64	35511112.0	17423683.27	19450858.07	4245613.977	16052952.51	4504437.021	9419308.706	27632017.79	26057995.98	30943391.46	20887128.11	7992749.26	23614811.47	25248896.53	14704454.4	19523712.63
Trigonelline	5282891.625	8469549.031	6044413.144	8857014.652	6393394.55	7524000.782	686043.1543	2293142.25	2320197.699	2325772.378	493307.6546	493881.1224	286455.1399	1289938.394	2644971.191	328503.4041	2181776.088	1792885.24	631141.5827	716783.6781	535294.309
Tropine	141343198.7	135603080.8	124711881.3	3994051168.0	3272560744.0	3733173877.0	4236746969.0	4011004592.0	2637058663.0	3302750572.0	3412782760.0	3213447996.0	1139448486.0	1942598331.0	1352924161.0	2177133436.0	1729292831.0	1547597355.0	2025563169.0	1261911326.0	1404446817.0
Tryptamine	95961924.93	95438253.42	111492362.6	769257.1411	3371108.8	1756805.301	1109493.954	1202710.309	1106578.75	572262.204	638259.2292	533954.4245	639653.2468	570863.1536	746658.994	2804063.687	3299906.665	1658761.034	1403120.687	643773.0905	498112.0948
Tyr-Tyr	59046175.67	59081504.83	58532296.45	3056217.624	2753653.46	3437652.249	250869.6751	207937.208	222773.731	193099.067	144979.4327	166000.2905	154709.2719	132391.2788	146674.2257	198377.3945	206198.4045	201026.1539	31128840.55	22955175.3	24248515.9
Tyramine	113376497.6	129237797.1	134844200.0	15813272.59	24425588.02	32647900.39	49034676.31	40700472.22	29012209.55	12513737.81	24214909.12	13418717.02	12886816.65	18174950.0	22367798.54	11683945.76	11562273.43	15305367.64	7663725.881	6416709.298	5971460.996
Tyrosylalanine	163131627.0	145102012.4	170205624.8	7384273.194	6195088.754	4596968.924	454829.7621	533493.924	342133.9582	575050.7745	2204860.187	735095.3711	433155.6392	468338.7172	220847.4126	410838.664	804205.96	964532.0548	61062763.41	51953104.29	54466665.11
Uracil	552454076.6	547631928.9	566212445.8	407664243.9	318656743.0	373693188.9	39313801.51	35181969.25	59226109.13	32434515.15	24678207.42	40040417.96	9489396.243	13950326.75	11295371.76	7960530.691	8352894.894	9756764.5	136261583.2	124741180.9	137946014.9
Uridine	189097335.3	194337752.1	186078676.3	126992537.7	100020576.2	114875065.4	10152173.97	8750823.638	18191093.36	8334546.774	6263628.311	10510236.26	1514064.154	2166290.449	1515447.124	1877614.426	1699760.403	1774528.504	43094037.29	37294872.75	41855079.31
VLK	73793092.97	83464118.62	75243863.21	802326.8866	1069807.425	818092.7978	280814.1092	287944.9571	274111.3818	250386.0866	236414.6534	289237.4124	197714.2286	168748.9142	200970.5907	646132.1358	528232.6794	697392.6133	18709953.31	14283549.19	13646016.57
Valine	2817936049.0	3063557728.0	2530484020.0	1315457832.0	1247363300.0	1142779618.0	1455800869.0	1295590612.0	1213767659.0	2642277586.0	2308859611.0	2255497880.0	2314333048.0	1793190459.0	1798656794.0	2136101987.0	2193427830.0	2045358410.0	2778814435.0	2444665901.0	2345994141.0
Valpromide	848253.2632	878162.9257	783299.1314	1417354.71	2204947.395	1368934.203	1258521.919	751033.8535	582980.2276	21600677.5	23395961.64	31843184.07	43187393.91	21376668.63	27193711.19	27267607.6	31515524.4	27801501.67	27369062.51	24238971.04	43890250.98
Valylproline	2089767396.0	2158225592.0	2125687686.0	49543487.78	37623007.43	49734254.74	3138400.939	3684297.868	3653675.358	4165771.585	3467852.404	3685561.087	2898419.337	2340410.107	1177058.228	2961078.662	2978026.922	3229450.523	500792892.8	408420702.0	419160835.6
Viloxazine	3430757.802	3098987.899	3462986.481	19292229.14	17203597.25	15551393.22	24418835.05	24453605.15	16456406.99	22865631.87	23070341.13	23278512.71	5506690.136	6663100.28	6890579.326	10923777.03	9344280.061	5842390.523	6703563.22	1465682.942	2299216.155
WLH	10158156.0	13128293.49	11016350.09	2517036.013	1003565.368	2263515.556	385806139.7	416727390.2	471846005.0	726339402.8	656809925.3	683917147.0	373731152.1	306772982.6	407175307.3	115094778.5	126330882.7	112676055.0	150104297.4	196660691.2	154937157.2
gamma-Decalactone	349167.6785	337016.0787	298010.0796	474027.8941	339000.5755	209487.1495	1893494.057	2642954.287	4217857.676	11799875.17	18871413.07	14171951.28	13456002.45	5833030.199	7713420.454	7832892.39	6157661.302	5300425.089	5331347.589	9524386.019	8708988.821
gamma-Glutamyltyrosine	16298038.0	16480170.3	16203577.58	1002949.873	711842.7482	1207483.78	543493.145	926391.4369	326429.8685	2864309.172	1941614.029	2480100.72	1906180.514	984745.4337	1447256.598	1547025.921	1642116.095	1702438.595	5227780.919	1256159.331	2387098.385
indole	4663595.822	2450693.866	2663078.091	259923.8816	240467.8949	267684.8145	912880.7178	1680529.239	738509.3903	2140938.342	1008180.076	1778042.594	940381.4302	873796.1111	976545.9164	1883150.59	2087291.693	1969119.069	893851.7294	1918638.711	1478311.829
methyl 2-[4-ethenyl-2,6-dihydroxy-3-(3-hydroxyprop-1-en-2-yl)-4-methylcyclohexyl]prop-2-enoate	29487993.17	35478256.1	30734939.89	21674159.11	20256892.4	22326295.94	11431248.22	11523597.19	13861389.84	24328694.22	17958454.46	27108659.31	17683626.46	21294567.86	21712346.78	16858318.58	21509517.89	17471165.82	16681230.52	17737601.76	19018519.41
nor-6α-Οxycodol	1228898.366	1340053.532	1184930.695	2747001.044	2742627.78	1844252.944	12362267.69	10044408.63	6676434.523	53936724.56	70695087.15	52187979.84	2410300.197	6112542.957	3084006.283	3402612.102	3704412.647	1164030.789	1772733.307	423975.686	904781.7256
p-Coumaraldehyde	111021868.2	107124894.9	108399571.9	13582858.67	14170738.86	15876232.94	8700963.63	9420318.853	8185351.956	17065356.99	11004348.8	17905803.58	18881310.07	10969295.49	16436844.76	39847123.87	36179507.99	47814558.02	80960169.49	91978042.05	91670052.42
p-Coumaric acid 对羟基肉桂酸	2168241.809	1415880.883	1424414.78	1035089.226	680617.6716	1498057.771	7655514.272	8408794.061	8034792.912	27778663.09	23731680.76	27495238.59	23037265.65	25593227.36	28584936.61	18848401.52	16868047.28	21053614.48	20612381.47	18836676.4	18664283.21
phenylethylamide 275	105576.8604	114177.5301	166438.8318	219875.8442	333985.667	287777.1438	547097.8813	271833.2671	271490.6605	6677359.018	9862121.598	12011392.13	14503682.91	7696837.725	11354173.58	10185619.44	10768894.9	11603004.8	8116977.22	12831986.03	18136380.23
tert-Butyl N-[1-(aminocarbonyl)-3-methylbutyl]carbamate	751572057.4	767737241.0	665529591.7	20419362.93	14591784.63	22712736.85	1878090.398	2342587.873	1832727.51	2647481.669	2092629.295	2047762.218	1828334.588	1433470.802	1272838.574	3098814.5	2788273.319	3142146.614	280130673.2	214756878.8	195711061.5
trans-3-Indoleacrylic acid	2085147183.0	2177049795.0	2047679119.0	202778384.7	232821501.0	297270799.9	763238983.2	987471433.4	690058179.0	966867551.0	688119052.5	1139507671.0	546919544.1	528793189.8	577715481.3	1208214134.0	1178316887.0	1401204978.0	1338761811.0	1428197747.0	1565677501.0
trans-Aconitic acid	18704739.09	18224511.81	16277255.94	16666423.98	16678050.63	17324966.44	9277370.951	10109726.27	8081984.731	12633939.96	14717928.1	17099443.66	50531452.58	48766810.84	61825289.27	72180775.14	67317324.86	71991316.89	60736864.26	62632323.63	65039255.74
zeta-Carotene	145786.2541	155305.4745	135963.2046	153415.4523	173711.6154	136759.7607	15266061.72	5842935.959	3490376.873	3860932.724	2621548.557	3543036.511	5040529.746	7587397.413	9270890.829	3549239.486	4177386.856	3999310.229	329146.9008	320149.4036	392354.5941
Υ-L-Glutamyl-L-glutamic acid	81145017.83	75935046.86	67862064.27	14740517.5	6155431.04	17682559.88	4755624.582	3819920.08	4956655.131	5645580.245	7039868.689	6531897.228	1693090.725	2762890.935	3128687.576	3247826.415	3726220.392	1662836.843	73095676.13	70944269.35	68865898.12
α-Aspartylphenylalanine	482431342.3	491624161.0	483559388.4	18907106.36	16143982.87	18954311.86	9426218.278	8808453.323	9247125.211	8351892.825	8143178.192	7328379.012	4149871.635	3731782.362	4231252.512	6823356.997	6803449.434	6777769.813	119303458.5	88468919.89	89307291.43
α-Eleostearic acid	980024821.6	907777417.3	896633743.7	1022218884.0	658761196.8	705664801.5	34794202.66	30840152.76	33064117.84	20234869.69	15484366.26	25249847.12	8116789.691	9839669.621	9143268.9	5768558.948	5203704.751	7837715.659	79285014.12	79233998.65	124985283.9
α-Linolenic acid	488640659.8	493708871.8	464567244.7	112604638.8	88169680.28	116461668.9	25488802.79	17047773.8	19341094.96	56382507.75	64385329.4	58889952.59	46844208.71	28002969.7	41246428.8	43101186.79	35601087.44	53826128.39	93428680.17	97954404.53	93262447.66
α-Pinene-2-oxide	6269496.752	1301666.771	5013595.718	2279562.543	7289191.739	5271294.136	18139920.65	6964750.476	14631867.61	65621333.5	73945279.41	72638043.59	66667071.32	38748290.26	55584562.2	57351405.54	54532923.82	68851496.39	49915072.59	74571664.69	80084625.25
α-Propylaminopentiophenone	1984134.571	2224085.354	2194877.572	11656989.76	12025757.29	9440807.007	22795587.64	26956784.06	22942680.57	28341453.63	18079636.35	19819280.76	2374224.163	1667723.995	1851148.003	693187.0571	632898.6915	598815.782	4848700.088	5457638.844	5642494.033
"""ADENOSINE 2',3'-CYCLIC PHOSPHATE"""	21880134.13	17264952.34	15804224.15	17054893.37	15707997.3	16596878.47	583174.6197	451725.9028	844115.9557	549302.0392	553504.84	487281.336	1290514.571	1119941.664	1128570.067	1801551.047	1584944.742	1303131.266	24421170.76	32685309.59	23039627.1
(+/-)12(13)-DiHOME	6722180.261	7259251.001	7811814.735	1417154.718	1348534.724	1544416.974	350335.8585	366585.3638	336503.6108	232239.7733	135082.2381	695360.4363	388535.7952	225228.9671	359303.0775	129951.3737	226402.2159	352788.3208	2537720.012	1464422.148	1663735.789
(+/-)13-HODE	566076744.0	555992640.7	584022940.5	1038815550.0	695097397.9	775385026.0	29208370.74	24612032.36	20760978.0	11680344.21	10874257.91	13940914.13	5470598.614	4962264.179	5078398.703	4083823.98	4550834.727	5129990.935	57915904.55	65238874.02	105586631.0
(+/-)19(20)-DiHDPA	165171.0249	162809.7891	170206.2201	144806.2473	264816.8028	152388.6572	76308.93584	75906.01971	75054.74414	76941.14038	95237.09425	4986680.681	15632838.72	17618674.36	15934768.94	15566358.5	38452479.32	18660874.43	12441955.82	4249938.54	7018028.184
(+/-)9-HpODE	369264640.8	354689986.4	376276701.7	356072890.1	340783260.5	366304497.2	18120194.7	16981445.43	15542089.45	7281237.668	7419941.732	7781007.327	3612787.213	2531719.352	2354707.345	1556671.155	1460804.349	1825933.698	23893615.8	22141421.22	16276554.38
(-)-Camphanic acid	426898.3163	412570.0325	332887.3672	848985.1578	522992.9889	1141793.65	1189066.28	1076517.281	1380959.494	541088.9072	487848.2532	1057604.009	538327.6798	250617.3888	807313.6407	1592515.771	1158209.622	1737640.661	2753078.778	5323094.809	4141965.24
(15Z)-9,12,13-Trihydroxy-15-octadecenoic acid	248051061.9	229924987.1	242713245.5	94572987.99	67695455.13	79038739.81	15483402.74	11697531.23	12075716.71	10110320.12	12351143.67	13094492.28	9310215.07	9406965.677	9194234.36	3387968.127	4150833.94	4700247.288	63789096.61	51208963.37	86431475.57
(1R,9R)-N-(3-Fluorophenyl)-5-(2-naphthyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide	1112286.692	694728.0664	1043601.331	133507.7498	86768.56757	126564.4624	70779.70749	71152.49701	72108.6072	67115.49149	78896.15473	74261.18508	61052.40697	64986.40955	73190.90968	77432.90027	80120.80177	95157.32633	5254737.091	7465273.163	9282409.447
(1S,4R,6S)-1,3,3-Trimethyl-2-oxabicyclo[2.2.2]oct-6-yl hexopyranoside	46804002.38	46556065.6	44287529.62	26524044.86	39076476.4	35169778.55	8105323.806	7751300.25	8284339.209	1101588.496	2369021.453	1620044.606	600776.9793	308392.1161	451245.034	1014864.504	442851.2068	468355.6844	2215664.698	4574032.068	3267444.595
(1ξ)-1,5-Anhydro-1-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-8-yl]-D-galactitol	104457562.2	90925611.49	26038563.2	43534208.23	57546792.0	36637330.95	67078722.84	75828426.31	42064573.04	150056101.5	151016550.7	101350704.6	41992762.16	53855801.43	29616925.24	47939365.28	37129021.16	32572822.88	56416968.22	59301072.9	47745784.63
(2-aminoethoxy)[2-hydroxy-3-(octadecanoyloxy)propoxy]phosphinic acid	54516173.75	56251590.8	57361757.46	13145791.01	11546881.17	17022345.72	10187567.51	8716453.548	7981454.641	10336997.8	9008365.543	12052015.99	6806314.721	6696693.993	6494101.351	5693763.425	7428969.646	6665561.73	12714607.03	4823131.516	8039798.261
(2E,6E,10E)-14-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-4-hydroxy-2,6,10,14-tetramethylhexadeca-2,6,10,15-tetraenoic acid	3547932624.0	3615826561.0	3421306315.0	496528320.0	385982199.5	505457065.0	230598770.4	206517959.5	249790005.6	122765535.5	110896561.8	99461543.25	76976527.06	45762822.18	75943922.48	61644734.05	70085183.83	67388013.06	252648365.0	471190431.8	391604435.2
(2R,3R)-2-(2,6-dihydroxyphenyl)-3,5,7-trihydroxy-2,3-dihydrochromen-4-one	17273670.08	16436382.22	15910134.48	379322.7179	379940.523	346479.4191	274918.1274	283653.0416	247459.4115	223368.8316	195881.411	160000.4308	163433.3502	143647.7912	138038.3835	191551.9606	168865.7746	149699.7513	220087.5703	238856.8591	217152.6718
(2R,3R)-3,5-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-2,3-dihydrochromen-4-one	233179461.9	270992711.7	284020917.7	522309.6844	917019.1987	1364619.956	213649.7893	258842.2512	441148.3429	258684.4158	180719.0891	2670414.734	189551.0324	191044.7028	196151.741	246886.791	236743.0553	209874.953	248534.6267	243061.17	227082.5754
(E)-3-[4-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]prop-2-enoic acid	23558775.66	20225358.95	6164797.153	29949741.49	24466460.25	22304272.61	505054442.2	485424895.1	548396510.8	1223395468.0	1106408833.0	1094117010.0	1358972543.0	1264515852.0	1281136394.0	985285069.4	1000095530.0	962425552.4	1141053891.0	954308155.5	654534279.8
(R)-2-hydroxystearic acid	17186531.28	19327857.81	20188956.74	3776751.773	3160501.473	4936649.695	2621968.541	2506266.609	3284894.54	2984008.441	3147795.239	3718722.276	5433946.77	5431588.439	6831638.399	5005307.624	5328297.663	6229828.875	9293552.16	4999683.689	4432687.305
(R)-3-Hydroxy myristic acid	157572.9216	194101.115	177665.1402	211896.9488	226120.8868	209062.4349	528421.869	361728.9982	602398.206	3175624.514	5266950.072	4781770.308	2073486.008	1332580.866	1854632.163	1126002.32	1845138.317	1455674.026	939828.2975	1809141.368	2208562.807
(Z)-2-octylpent-2-enedioic acid	24693877.69	79920.0975	12930163.1	192380.7611	37180351.06	35260651.15	14525381.29	21790564.52	93653.65448	40710518.29	151435.2947	148344.9466	26836459.9	18099748.83	14069492.98	16815721.85	120909.2293	15448475.65	12354614.07	30681085.5	30242085.63
(Z)-3-(4-hydroxyphenyl)-N-[4-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]amino]butyl]prop-2-enamide	242005235.0	236354133.1	247517384.8	413382.3849	502494.829	464371.4652	392168.105	424992.9474	440781.8024	383084.7635	386315.1774	605443.8925	309197.0106	347658.2134	313446.0965	336699.4389	330176.6695	301062.6276	296056.1775	217589.7175	225691.834
(±)-Abscisic acid	3938750.946	3752162.992	4180006.702	3804969.084	3157840.262	3265792.987	6376313.153	5722402.513	5941402.545	6405622.762	6734859.691	6544885.415	4776371.946	5166135.031	4706151.681	28736265.58	27577063.06	32532643.15	19425268.13	19123294.44	21736918.01
(±)9-HpODE	21886424.22	20641198.31	22263502.2	42407278.3	31887218.44	31966245.74	2248579.374	2468830.08	2312314.925	2349207.332	3925650.126	2895698.887	944819.1776	460185.7366	414931.6649	387693.829	356575.8109	295855.7916	6230082.103	9288444.501	10973045.24
1,2,3-cyclopropanetricarboxylic acid	314994917.9	201432744.6	295806011.5	237547777.4	189605414.3	218660063.5	128604735.7	115327692.6	98296235.47	169260900.5	152505930.8	166226281.1	118600192.7	100107473.5	114936031.4	149358373.7	121261190.1	115973134.7	217823196.3	276805920.7	397286166.4
1,4-Cyclohexanedicarboxylic acid	16628711.29	12356152.35	16888843.87	17950197.11	18153513.67	25468929.07	48703216.88	59121426.14	65574000.11	22040630.29	31522238.67	20875030.58	5393796.185	5289342.807	4995718.496	2665237.364	3919969.638	3325521.196	10526169.11	9508494.249	7605371.582
1-(4-hydroxyphenyl)-3-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-1-one	1439808.139	1613844.765	1515364.543	4297085.94	3283722.212	2919702.805	1908515.632	1978165.044	1405005.426	2314483.53	1216378.456	924206.4626	835443.334	1425392.077	1289211.041	1093899.294	620912.6747	736158.3726	1393490.477	770985.5888	1026886.025
1-(β-D-Glucopyranosyloxy)-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylic acid	17650616.91	12404415.73	16333444.54	7985679.216	11168853.46	8872934.007	12969392.68	14819481.58	18332298.07	7181669.798	11608257.41	8389756.718	7041030.065	5337620.73	6031313.558	24037853.34	14769780.06	25130618.89	48249099.87	100551702.5	74876914.36
1-Cyclohexyl-3-[(1S,11aS)-5,11-dioxo-7-(2-thienyl)-2,3,5,10,11,11a-hexahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-1-yl]urea	165007.5433	213438.5576	237619.17	80525.74211	90160.99039	111772.6274	86515.57003	87483.72664	103529.7788	76954.40247	90249.97474	229828.6747	2556345.452	2562781.051	3345664.319	3634489.09	7062060.726	3471563.065	2468688.922	921135.6282	1635894.206
1-Myristoyl-2-Hydroxy-sn-Glycero-3-Phosphate (Sodium Salt) Sodium Salt	829136.2994	564353.9057	899525.9426	1488072.677	888949.1302	713630.2676	851835.5972	881419.0517	366659.3776	484498.1894	294528.1311	747206.5276	925589.5172	374291.3825	678779.6262	702847.8462	468247.2236	900466.0554	5554470.054	3725718.477	2460224.903
1-O-b-D-glucopyranosyl sinapate	19707338.0	24499754.81	27347864.45	79814415.26	126746676.7	75576938.6	122683973.6	176429947.7	106696414.0	449903427.7	354469744.6	378455653.6	413498128.7	377222364.6	395699835.9	400303300.3	413770465.2	557254295.2	271157667.2	437219314.2	337592512.1
11,22-dimethyl (6E,17E)-3,14-dioxo-8,19-bis({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-4,9,15,20-tetraoxatricyclo[16.4.0.0?,??]docosa-6,10,17,21-tetraene-11,22-dicarboxylate	290149.5641	227114.4343	1103222.653	2499064.827	3899081.583	2795267.315	2526499.626	2094802.994	1774809.679	1397776.207	1192766.646	1026906.931	1067533.399	498954.3174	308675.9993	689873.4889	343020.0479	752356.8203	489194.0857	629678.1455	351324.9238
11-Deoxy prostaglandin F2β	853412.6624	981279.1714	716753.0129	220641.9974	2189949.096	128617.2501	5309575.662	4391219.244	4759720.07	3099509.074	4040806.778	11084409.26	64813499.39	69291842.92	80031509.11	87827507.02	186775951.9	86731708.94	83126806.54	27934859.98	49901843.24
13,14-dihydro Prostaglandin F1?	2214651.283	1961100.023	1877073.797	96514.4158	237508.5216	395674.7057	81087.21222	93480.89078	78362.71886	53681.73281	48515.06033	48681.17278	49635.90057	47308.6229	45990.47769	56868.33852	51061.01161	49144.18571	58191.02075	59182.4055	56309.83118
16,17-Dihydroxykauran-18-oic acid	3504229.303	4104664.605	4390250.237	9854177.214	5099184.225	10322469.34	1669283.918	2087675.321	849326.8514	588736.2684	218424.1023	151291.4389	286976.2955	211178.2577	71896.4843	80844.24029	303245.6905	100288.4227	643802.0815	490705.445	409739.502
16-(Hexopyranosyloxy)-7-hydroxy-8,9-epoxypimaran-18-oic acid	150112992.3	153924530.1	153812104.3	42412777.63	31234855.99	39487599.94	12695869.14	13473262.81	11852096.88	5811280.027	5439545.306	5821167.465	1642263.925	2968522.861	3140535.29	1862511.37	2750450.167	2065981.156	10210040.72	27089627.66	930311.4118
16-Hydroxyhexadecanoic acid	1977742444.0	2101971307.0	2072582238.0	337077986.0	291835771.4	372192440.2	130773180.6	137631509.3	123963563.6	39151848.8	49845183.04	45204349.26	17551294.05	17620359.26	18319771.77	26197512.83	30862249.92	22170877.39	78176263.49	47343642.96	86150635.17
19(R)-Hydroxy prostaglandin F2α	6005132.728	6344634.727	5501547.27	3483037.932	1590551.659	2587514.648	328555.9876	272685.7458	261310.1892	288151.5063	278586.4916	249121.1794	194084.9212	199186.6284	163985.4131	210211.1117	186436.293	160145.7828	235098.1791	181456.7199	167042.0498
2'-Deoxyguanosine 5'-monophosphate (dGMP)	1979769.403	1771972.308	1562698.643	6362401.818	9108632.125	5625432.147	23046997.61	19623652.74	21188379.24	17445912.15	16265378.55	20770599.66	5097165.595	6181422.844	6127869.246	4914845.73	5442797.8	5221099.624	4917910.739	8958576.193	3734360.816
2'-Deoxyinosine	4688381.066	4870758.727	5747541.332	80959.48517	163292.4214	75150.34147	217021.9302	290481.8229	64110.51816	75699.37998	320754.8621	171753.3653	187140.8973	139798.934	73198.54829	83648.25934	189184.7741	103031.5066	106056.7174	120419.8552	121529.7402
2'-O-Methyluridine	23555046.05	26879124.61	23981719.86	5359921.883	4063514.539	6238127.229	839889.7195	596799.1722	745441.5954	797087.8675	597742.651	547519.885	264016.6941	184588.3415	192832.688	311146.6102	129322.4045	381106.1416	2107227.05	1430760.901	1356050.553
2,2'-Methylenebis(4-methyl-6-tert-butylphenol)	457754685.6	577378168.6	276657573.4	790806835.4	3100824239.0	1343349737.0	962403912.9	1181052299.0	858199228.7	634419610.9	661521488.5	847567821.9	937203128.4	761542065.7	421741912.3	655617274.3	1217446881.0	870553113.4	638094716.8	731098189.2	619490266.6
2,3-Dihydro-1-benzofuran-2-carboxylic acid	3925869.138	4246839.124	4642008.432	5479531.723	3069312.559	3597154.688	77412724.67	78496998.25	91288796.5	199288218.5	195168583.7	183272460.5	222457691.8	212510407.5	220281691.6	160610204.2	169948563.2	88334237.36	183385151.6	159038626.3	74927690.77
2,4,6-Trihydroxy-2-(4-hydroxybenzyl)-1-benzofuran-3(2H)-one	141439393.8	138357270.2	149904463.1	477858.8463	515684.8444	469280.511	342143.0052	356770.3238	390398.2343	368987.1672	358221.2501	344269.4555	281325.0629	338154.0379	269566.5214	317771.9454	289264.2812	246758.935	295518.1592	282659.7229	273898.3789
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside	6021130.835	4680544.024	9210411.424	2914866.202	1601205.821	1223941.235	1858701.345	700926.4671	464864.5086	203943.8163	378930.0249	191334.3318	196643.77	277430.5453	197698.0585	156875.1587	185606.411	171177.1779	309420.1285	1012905.594	1053696.565
2-(4-Hydroxyphenyl)ethyl 6-O-[(2R,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside	198322.1964	272365.8729	284429.9058	139335.5052	151135.2251	163029.667	113347.6252	155085.6864	262194.6898	993285.5632	1657028.561	1014648.816	1314001.965	1366026.265	1213562.319	453596.8686	679962.1787	1487116.407	1086655.262	1427723.597	1503907.167
2-(4-Methyl-3-cyclohexen-1-yl)-2-propanyl 6-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside	24609235.94	29077060.55	28681752.6	10636676.8	13602641.49	13875530.3	1778968.058	3217770.241	2676657.268	800832.2708	3254621.205	2635984.431	3067369.364	1874838.676	4684080.801	3138031.16	3538063.053	4308461.61	4022912.529	6734709.042	3090807.248
2-(Acetylamino)hexanoic acid	52794753.23	52583697.09	46626882.98	46928035.41	25247965.07	41503140.84	25073846.08	27438544.94	16154256.9	8472551.712	8199939.183	8822520.325	12304493.24	9528274.659	9782885.596	10674398.16	10447084.5	9984961.661	12449173.55	8182867.819	11949020.27
2-(acetylamino)-4-(methylthio)butanoic acid	132219433.8	115776944.2	128530296.9	11227391.46	8378280.595	13426711.82	594464.3715	583538.2574	418284.1033	449342.9183	477806.7054	872574.5478	959404.6135	737313.4878	731829.4604	1328234.979	1426938.234	1559711.49	58483961.89	58868847.2	21388961.28
2-Aminooctanedioic acid	2638175.433	7614960.103	3046828.763	5383061.555	5954551.789	11060368.5	3777926.365	4653422.247	3051090.291	4584930.406	5069700.725	5404723.465	4621534.052	5478123.888	8106167.191	5651450.25	4179538.017	6204285.24	3658798.346	3975586.498	3642150.138
2-Hydroxy-1-(4-methoxyphenyl)propyl hexopyranoside	1408448.353	1624062.513	764706.9433	8157828.912	8709388.731	8466316.521	6585745.986	4420397.69	9171192.198	7788193.675	11903563.53	4464076.773	1650957.295	1055684.235	530164.2603	1485349.621	1623912.653	748769.9769	5570406.679	530862.4529	624088.5181
2-Hydroxy-2-methyl-3-buten-1-yl beta-D-glucopyranoside	214709.7383	216075.9605	209753.4728	798006.591	591487.804	747855.654	1809866.539	2038454.497	1723462.43	2390421.956	2664763.102	2133172.398	1074933.099	1283477.208	1125945.495	1399487.4	1265049.504	1387014.958	2024055.751	1367423.439	1320037.269
2-Hydroxymyristic acid	5278281.096	5136764.599	4857414.539	1339063.344	1057056.912	1348639.133	181310.0229	85449.73553	263907.1138	140908.2352	164227.0321	172328.791	207146.4734	179684.617	180860.417	199483.3602	190146.8688	231700.1707	547599.3004	252541.7323	265766.1079
2-Isopropylmalic acid	177351044.5	440119358.2	345008853.0	203888820.8	227468651.9	171158464.9	25777743.7	28002544.13	6451025.09	55516125.48	38489752.92	101912424.2	26862778.96	37505278.16	38080313.11	44548087.03	48192835.77	38281534.76	94866399.33	110551054.6	106553951.7
2-Methylbenzoic acid	5973526.275	6244074.646	2064973.566	6153063.363	3926400.521	4049288.651	5740970.315	8534608.083	2938406.652	3132499.378	3895799.621	2094131.173	825968.6134	497257.9536	252694.0364	585397.7662	483328.6096	388620.4436	285272.8704	252832.0852	509513.437
2-Methylbutyl beta-D-glucopyranoside	267887.0254	223368.7202	210624.5657	299449.6207	208281.5892	230785.9159	244246.2051	272685.2189	186457.798	4848840.534	5094230.762	3873075.632	8717244.247	2984771.283	3713801.415	5089307.851	3864131.415	4576828.204	1092413.612	1663542.871	2515279.594
2-Methylidene-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutanoic acid	1867618.803	1225731.055	1231032.184	3638249.962	5601690.487	4962880.173	6527704.158	8020907.839	6573690.72	17676409.99	16567157.62	11045779.5	3412608.908	6176985.521	2724192.512	6507662.795	4152829.969	4361369.619	5817571.275	4609047.146	4022204.608
2-[(3R,4S)-3-({5-[(Phenylsulfanyl)methyl]-1,2-oxazol-3-yl}methyl)-4-piperidinyl]-N-(1,3-thiazol-2-yl)acetamide	2768692.768	1434888.308	2728858.624	5554271.921	4175774.6	6028941.328	2242031.052	1959989.403	3015303.806	7105830.241	4852941.797	7039089.115	15484183.69	8762022.807	9191242.572	26089138.15	27182068.33	19984100.84	28164904.73	22275275.33	21845176.77
2-[2-[(Z)-pent-2-enyl]-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclopentyl]acetic acid	25635102.49	23082337.34	27737874.32	1746797.099	11871682.73	14533415.72	3540363.505	7903135.609	7560312.91	3298335.297	7932939.693	1535501.472	1404460.108	2673867.858	1723639.643	657237.8894	1044829.15	1225491.737	844806.0309	1216380.918	2912786.364
2-[3,8-Dihydroxy-8-(hydroxymethyl)-3-methyl-2-oxodecahydro-5-azulenyl]-2-propanyl hexopyranoside	13493038.02	13382710.45	13412028.97	2238938.262	2286808.486	2394730.607	1808512.087	1915342.117	1929288.928	7400607.041	5513786.571	6576935.255	5995649.459	8462081.58	6531938.224	3600511.157	5031372.744	5407798.287	2960310.991	2137075.698	3401185.738
2-[4-[(3S,3aR,6S,6aR)-6-[3-methoxy-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1,3,3a,4,6,6a-hexahydrofuro[3,4-c]furan-3-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	325399.3572	349885.2173	473212.8995	7052469.592	2195391.384	5167061.587	630575.9081	190356.7208	1164498.313	1359350.93	992792.9052	3181521.884	3149361.869	4270703.245	4110657.822	1365519.832	2822057.491	3487348.797	527983.3759	178276.5722	169328.5148
2-[4-[4-[hydroxy-(4-hydroxy-3-methoxyphenyl)methyl]-3-(hydroxymethyl)oxolan-2-yl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol	3592539.382	3579749.313	4291623.198	2346372.934	2467400.863	2781682.856	1891749.254	2291621.826	2389561.322	1149217.14	1216947.571	1080870.97	652233.7925	633842.7904	784927.4439	528799.2397	650917.2425	567790.89	719628.1502	610178.7061	469788.3945
2-hydroxy-6-[(8Z,11Z)-pentadeca-8,11,14-trienyl]benzoic acid	67093.43907	70280.53281	70971.73578	64626.49212	64626.23632	66576.10416	80246.52997	69249.44091	77998.66475	122489.628	151490.9018	149007.9814	2131986.837	1613384.886	1356946.675	3284854.943	5492883.704	1935337.786	4846524.878	1729564.502	3354116.181
3'-Adenosine monophosphate (3'-AMP)	61068076.4	57739177.99	58879611.28	35341122.43	35048074.87	44612593.07	9081620.533	7960183.518	12262963.74	10910072.21	7693490.324	10822041.37	3310767.728	4910671.802	3478725.764	5197589.713	4629956.958	4289553.276	54720251.2	69165038.43	63496413.63
3'-Dephosphocoenzyme A	220879.8361	183306.5791	175803.3522	74240.11795	84050.15217	67486.99174	104607.2893	109113.9648	107003.6838	986050.8746	1018235.205	1273357.848	1072060.556	1261189.847	1462330.604	958407.947	1146586.272	961994.4904	410835.0062	149251.2266	116957.5996
3,3-Dimethyl-5-oxo-5-[4-(2-pyrimidinyl)piperazino]pentanoic acid	8169904.39	4699906.216	7642040.566	3112818.251	3634138.916	2865443.273	11273941.77	12023588.15	11415799.29	16032211.12	13747059.01	12981491.69	17800347.12	13258665.35	18751842.6	14575152.91	11353868.54	13126105.95	12755567.88	18830433.29	12586452.08
3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid	26215052.88	24808517.15	24080845.32	100536237.3	101007852.1	74965132.17	114712286.1	99312345.67	110789631.7	86519704.72	89157300.94	80010781.78	64847849.8	42376804.4	34959404.02	43255597.23	47591695.0	35749254.71	25168692.25	30377072.35	23886390.97
3,4-Dihydroxy-L-phenylalanine	6308430.316	4734346.015	4089039.487	206893.6675	277700.7555	438405.7176	298906.4801	813710.7506	198249.5281	1364731.316	1151673.754	1344743.183	1344420.914	622337.486	1012925.827	723377.681	1165486.021	1728220.717	1261599.243	1592296.508	2367591.987
3-Butene-1,2,3-tricarboxylic acid	12265001.3	12987859.17	13432621.93	2809819.259	5601095.312	6286941.979	7378652.959	8797957.319	9601632.457	12807548.36	12813926.27	13884873.19	10935642.25	9895425.131	12009722.31	14999315.25	16314497.42	13695612.91	21465926.8	25034041.88	25486689.27
3-Hydroxy-3-(methoxycarbonyl)pentanedioic acid	403195323.0	439869646.1	431441151.6	132175154.9	156786753.7	169068092.4	63867966.68	67011909.85	56471923.69	56176273.26	56862331.06	54997137.47	42367746.32	42439884.17	47217638.48	73129457.74	72838322.73	53472398.69	155574711.1	146644788.4	151737173.1
3-Hydroxy-3-methylglutaric acid	108767136.6	116337672.3	114168740.5	253352516.7	247653060.4	309291947.1	288251793.6	299233785.9	319506390.7	311004307.9	475183366.9	608700742.8	209334099.8	195580848.1	209276983.4	346049255.7	314044891.0	342958426.6	352160662.3	406238241.1	365907607.9
3-Hydroxybutyric acid	3958878.463	4384744.576	5534951.603	3206193.267	4422061.188	4476075.008	13426335.62	14303309.18	16200250.09	21067161.5	22960085.02	24045774.59	18882344.31	16348346.62	15264742.9	20614064.07	20097970.91	20299374.7	11949775.46	18895155.5	20766112.44
3-Isopropylmalic acid	57117889.55	54032408.48	56838386.32	14968055.59	18053646.22	11424985.85	8462391.631	8917385.262	5922808.775	5881648.706	5913136.027	5845259.079	4293338.953	3483865.245	4745137.868	3179592.363	4392907.594	4622805.162	5592094.782	5746747.055	5191469.142
3-[3-(beta-D-Glucopyranosyloxy)-2-hydroxyphenyl]propanoic acid	2544125.831	1547042.466	2534693.41	1370544.017	6049987.124	4975376.118	3416906.423	2619035.859	1705606.356	2055730.132	2461927.702	1853585.744	2741279.706	788622.0896	2369790.367	2549653.43	1547919.476	687642.7163	1643133.793	1596915.707	1640448.051
3-[6-({6-O-[(2R,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranosyl}oxy)-1-benzofuran-5-yl]propanoic acid	1698694.503	1738425.937	1747644.569	3662043.639	3276777.75	2089393.612	1689691.601	1633531.498	1612651.833	679233.1771	479852.6016	538673.3775	649564.534	724291.1184	1141485.994	1312189.938	595616.6564	1151161.751	1492736.912	922688.8405	626098.036
3-methyl-2-oxovaleric acid	3265964.037	4708016.703	4066716.91	2415119.944	567020.0431	368682.1589	8384396.579	7916733.324	7210208.135	9813391.489	10452844.15	8574030.378	5026176.521	4435136.904	5748492.497	2263323.472	4592113.3	2891079.865	2732678.056	1675469.901	2825491.007
4-(3-Hydroxybutyl)phenyl β-D-glucopyranoside	1540567.059	1524079.078	1851419.854	61588568.74	80525195.64	59995514.12	41646486.33	37036528.1	35920522.13	8483206.526	14269522.67	6894148.895	663314.8736	800769.1096	303993.8442	849377.333	589594.637	561296.7584	1534834.654	867749.4282	198656.8664
4-Fluoro-N-{7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-4-[2-(4-methyl-1-piperidinyl)-2-oxoethyl]-4,4a,5,6,7,8,8a,9-octahydronaphtho[2,3-d][1,3]thiazol-2-yl}benzamide	8820491.018	7655832.021	8517746.41	10806283.17	6790289.404	9169266.871	1643393.722	1857326.611	1446495.089	1205501.055	1037295.871	1229845.942	3103240.602	2468609.989	3309446.525	3885318.568	3854873.962	3898622.067	108007.9665	121253.8468	108549.0987
4-Oxoproline	341297447.9	355417332.4	362768018.1	157257060.4	220160964.6	220310602.7	167021787.3	146001903.6	186059450.5	297837780.4	333494885.5	245149342.5	215867935.7	161390740.8	141210706.0	197087022.2	183775568.3	166768205.5	159776063.0	142054431.5	176850558.6
4-Pyridoxic acid	7075084.738	6995417.271	6539780.697	6165810.561	9302414.768	13509406.32	1120739.771	1308471.798	1485544.809	1517285.93	1469655.959	2067566.532	2086129.447	2342049.454	4047379.555	1516278.801	1732577.885	2003566.647	1830831.639	850967.8109	2378121.364
4-[4-(4-Hydroxy-3-methoxyphenyl)tetrahydro-1H,3H-furo[3,4-c]furan-1-yl]-2-methoxyphenyl hexopyranoside	6674410.828	6856864.612	7350848.164	2549010.379	4436121.631	4217055.034	6401242.222	3446650.469	4526478.25	5602631.951	8506341.894	9567071.313	6052644.89	6092528.562	5885228.967	3729816.088	4362262.434	4647456.515	4883687.033	3362834.841	3453630.334
4-methyl-2-oxopentanoic acid	36181220.75	38397931.23	29245947.88	20373011.1	15197655.65	17537097.01	2987774.846	1471961.101	2928591.226	6389313.96	5865348.92	6039089.588	4290128.006	1317197.782	2540192.208	1181428.68	1684779.451	1363831.444	5412042.52	5825804.957	3696536.665
5,5-Dimethylhydantoin	9202785.592	10140326.13	11545215.84	7555104.617	11389228.3	13213198.86	7835334.011	6005923.364	10804735.95	18503671.09	21761265.55	13648315.47	20106720.63	14959484.31	11941011.29	21434217.73	19304139.3	16439342.32	10526676.11	6485241.401	11069851.79
5,8-dihydroxy-2-(4-hydroxyphenyl)-7-methoxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxychromen-4-one	2236270.731	2271461.605	1882651.533	9654886.179	7907348.79	4735864.573	55240500.14	62481680.38	42921844.12	68144860.4	71285593.1	59247429.04	19107346.35	18650691.26	14997704.34	13573569.71	12865324.93	9836892.171	7568157.675	6671084.584	7038600.289
5-(4-Carboxy-3-methylbutyl)-1,4a-dimethyl-6-methylenedecahydro-1-naphthalenecarboxylic acid	74162905.95	79612900.59	76410808.71	66691361.86	31089755.41	66569009.21	2995628.074	3067412.743	2722359.083	1760989.165	1538488.049	2249588.424	446648.6553	346494.6779	699656.2372	1160975.95	289833.7108	346645.3155	2862754.874	2847424.517	3537165.473
5-Aminovaleric acid	9923837.787	8660566.799	11591643.92	4702106.075	4283309.773	4479812.56	2475490.419	2980077.586	2643706.34	2734213.191	2755944.227	2964384.272	4110402.725	2595004.623	3076573.397	3537816.853	3106021.339	4040235.007	3713404.321	2507673.142	3856560.36
5-Hydroxytryptophan	74152491.26	76589592.2	80895917.84	17083591.08	13439577.74	15045877.21	5840126.086	7532213.036	3745099.998	19276301.26	20989584.77	16571225.72	8503242.301	5182707.883	8009320.594	6877433.502	8745544.927	6872654.258	4417603.072	3732047.913	4152908.491
5-[(1S,2R,4aR)-5-(Hydroxymethyl)-1,2,4a-trimethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl]-3-methylpentanoic acid	239267.2033	255852.4154	169681.7728	162057.9003	152028.372	165137.3729	589372.5561	488088.9685	805378.08	1182112.967	1188565.998	1762755.616	504775.0531	698890.7843	475826.922	167743.3285	189802.8633	154164.258	106681.6494	115890.6399	111704.6456
5-[(3Z)-5-Hydroxy-3-methyl-3-penten-1-yl]-1,4a-dimethyl-6-methylenedecahydro-1-naphthalenecarboxylic acid	169861.7211	395561.6688	89948.1544	2816548.786	2888562.575	3037367.37	7089431.716	12226786.63	3233313.015	364808.6052	237296.3057	262303.0659	162608.2104	77618.28784	59200.08496	68339.7785	65545.1466	65460.96863	73045.50681	103678.7022	71258.4726
6-Gingerol 6-姜酚	2158953.59	1809220.495	338664.3355	1968025.905	430830.9482	345230.4625	2887437.931	614279.7686	1092702.154	6268880.861	6313155.05	5286288.017	6652311.556	4526306.408	3743248.958	5473768.146	5070460.368	4742871.346	4383741.046	5965665.229	5610959.407
6-O-[(2E)-3-(4-Hydroxyphenyl)-2-propenoyl]-1-O-(3,4,5-trihydroxybenzoyl)hexopyranose	24979290.57	26692636.66	28214602.65	7267784.804	6783072.892	5639858.793	19516669.93	23666157.59	20565167.99	22079952.27	19740698.4	16514724.03	4456708.164	4968897.207	3736418.052	2413073.053	2864502.88	3622058.592	4031225.789	6128546.587	3580782.207
6β-Prostaglandin I1	6480902.896	7856298.961	6910371.506	2500383.698	1483351.815	2558737.879	829363.8906	948197.4183	730806.1923	61939.89538	239883.2437	106458.8617	136806.6195	574755.5624	152587.9148	66663.88014	119659.919	70028.94945	208303.667	289462.1814	241051.698
7,7-dimethyl-3-spiro(4,4,-dimethyl-2,6-dioxocyclohexyl)-1,2,3,4,5,6,7,8-octahydro-5-quinolinone	296109.097	280778.2061	268822.5871	251683.562	212107.6618	226825.3665	3353072.79	722833.6088	1546108.471	21135087.74	26466592.23	23967488.18	22888539.9	11846461.6	16774942.55	16877668.99	15831811.55	18854374.01	14009824.88	25757107.84	27455901.67
7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-chromen-5-yl β-D-glucopyranoside	12287525.51	13180299.64	13505813.06	6168349.98	4798619.998	3726109.135	77268258.67	78120038.07	32110869.55	50560221.84	46653574.49	32154183.22	2308766.306	2881265.495	2295801.055	4100124.149	3376883.732	3395360.163	3739165.54	4632933.118	4072045.391
8-Iso-15-keto-prostaglandin-F2β	3785718.955	3552748.495	4411645.436	272532.1662	357411.6343	250814.6305	241127.5849	249124.0657	262428.4053	226810.996	204482.3433	775333.9219	144330.5008	156604.6854	166162.1179	155176.9863	152851.254	149935.2878	788717.3075	1052593.256	912343.1709
9-(2,3-dihydroxypropoxy)-9-oxononanoic acid	1093273.751	1632433.422	1714245.813	6006113.622	4189543.334	6006506.4	393541.5876	494391.097	1311749.83	484772.9302	420082.856	401585.4659	204644.2931	242675.3415	229352.5007	237142.2304	244515.2705	238781.6487	2214431.373	270789.7825	856540.352
9-HOTrE	377443061.9	380602894.3	382002438.0	64857665.1	48601296.57	64585946.31	6919484.791	6236952.868	6093976.537	12935437.13	13646571.1	14947054.96	8417223.561	5247777.86	6558948.345	5331762.081	6017272.356	7436149.658	17357009.52	28436365.06	35722618.36
?-Linolenic Acid	1579822.053	1630204.941	1951044.233	620932.8086	653441.4414	705976.3659	1501081.164	1539210.276	1096948.366	430219.1668	581488.5177	506584.1716	710523.3896	346358.8446	452131.6581	222605.4601	202887.8427	255072.2166	2679241.24	2465803.711	1486018.571
AB-PINACA carboxylic acid metabolite	188458.0401	180308.8483	155111.7441	11002078.55	8798053.297	12281708.2	7212806.914	6317658.456	6688379.551	78146.2976	63794.08782	58424.76614	67141.51578	55769.80921	56360.4409	85400.49778	73239.89146	71006.43892	105822.7763	100826.9761	90108.98497
ASCORBIC ACID	11118771.11	5321174.003	2739966.977	11701424.04	10597470.09	3000154.869	12702409.05	12843881.53	11009820.27	16104795.12	15278616.93	13542635.69	26974099.38	26160520.95	24242908.51	31147865.03	25270113.54	28288687.89	44109548.86	67286532.62	60615254.61
Acamprosate	185569.507	1230232.974	281306.9169	1906748.891	2723240.457	3451237.918	1140987.666	1160981.36	1866368.978	1201412.82	1080846.977	1106330.774	1169758.489	1085413.511	1102200.268	1254196.739	1326583.932	1579859.859	1190477.691	1757453.568	1494088.216
Aconitic Acid	296025588.7	289455967.3	318579368.8	243426853.8	351873559.4	272451493.6	362863655.2	96524948.98	398992155.6	401058517.3	579317599.7	589903514.1	658401501.5	696290537.0	694133468.6	695840713.1	610744038.8	808419717.5	958367740.8	1091007339.0	1216719491.0
Apiin	200002476.9	195618197.9	201887021.5	42511715.36	47583980.42	46009261.0	3609607.871	16542320.41	5162702.431	670569.2179	650064.5052	1394901.666	290208.8124	272064.243	325588.5383	497202.5049	269348.1645	279424.1357	1327798.406	3145011.674	3132568.44
Ascorbic acid	2042618.19	3743326.702	6479325.568	3391336.138	1330027.069	3076938.601	7243935.415	4501561.028	3794858.928	8117906.179	7636929.75	6954542.96	9997967.371	9163181.344	5971442.944	10237274.8	9346307.327	14916773.12	13431178.32	38068148.43	32356496.01
Asiatic acid	8492223.545	10447191.13	9878539.378	66758.48932	72674.99482	71215.36902	95033.02543	81061.16556	89625.30406	142883.0374	145729.6848	141829.2999	148750.0284	119620.8989	131534.5658	142105.3966	116141.4338	143714.4619	133224.4114	155992.772	167272.5735
Asparagine	111651270.2	128666809.5	128956034.9	80038589.82	75480683.47	65428848.45	82213363.5	71160822.68	96230411.27	245668383.1	248918008.1	259611103.3	555714287.3	400441622.6	371390449.5	517020715.3	515293811.9	580765985.8	515450496.2	497507346.7	619984041.1
Astragalin	352273220.9	398373972.8	373890633.9	1043322036.0	754147257.1	494991619.0	3665517661.0	4378487611.0	3314528468.0	3222153426.0	3099940343.0	2137894873.0	702295293.8	748190904.9	495478577.0	731822948.0	552316767.8	502069918.9	657169761.3	639737471.0	459866173.1
Avocadyne Acetate	1326395.36	261187.3399	347935.4831	250428.726	15943991.79	1839664.029	237907.5683	378291.3547	236971.3856	539781.4593	247023.7474	245984.3448	3110654.559	457898.732	242838.2631	342720.0139	264752.6175	5755855.182	3225733.109	712708.8542	4648764.525
Azelaic acid	175903227.6	175447680.9	167407341.5	62425480.27	60044673.08	72698864.8	13011221.94	10309345.21	14110526.75	9673033.89	10657443.71	9866570.601	9639442.49	7823230.909	6538886.432	6930464.644	6768103.813	8658243.469	10904383.6	9769211.501	12883626.39
Benzoic acid + 1O, 1MeO, O-Hex	8013200.34	8466160.927	7359495.027	44195663.15	54550031.67	49794283.68	216689165.7	139150852.2	210158620.5	321363973.1	413719870.8	358461085.3	64637424.84	44652754.86	48344138.38	50859728.08	41526861.3	73895667.95	41820537.05	69455717.73	85966567.33
Benzoic acid + 1O, O-Hex	257318049.6	264594526.0	263676676.9	233587773.8	225723424.1	217553411.8	149855528.2	164649323.2	117240183.5	62126920.14	72748331.49	44246444.61	21797279.9	20470676.28	18554970.65	18232785.16	17394436.36	19811105.6	15232956.91	19430627.93	19860691.09
Benzoic acid + 2O, O-Hex	5315392.275	6664461.499	5067084.458	8277509.946	7612363.217	6765833.509	36481326.98	45670164.41	23064445.01	10269408.82	16754361.64	11273746.89	677977.1892	736137.4332	951334.2645	988563.9614	698299.303	1355436.342	478209.0824	2433410.088	2709876.721
Benzyl 6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside	5015880.807	5494776.905	5743714.915	1583799.075	1985120.304	2721875.975	443294.6349	432424.7879	483319.0127	434564.5354	544660.0462	187334.0098	391793.366	325291.0633	273798.2795	392334.525	378439.8863	526985.3588	203516.9289	1067002.264	611656.3029
C12-AE1S (TENTATIVE)	41616618.21	36677650.29	40568443.19	71375405.9	64759473.45	132643897.3	42617533.39	50448930.82	148411572.3	438512586.5	100500543.5	88863129.97	50103349.51	56073434.83	79163778.71	59898613.58	62987583.54	72075822.84	137687641.1	41919517.22	50726316.65
Caffeic acid hexoside	26549030.88	29227217.75	28846075.34	55813974.42	58033227.45	46383087.42	125461267.4	111200668.5	120262257.1	267242454.4	255991559.6	316184413.4	174020300.3	176592480.2	173252192.1	69254841.45	168239137.0	139106695.4	143094795.4	106183727.9	99834207.08
Caffeoyl putrescin (isomer of 390)	1285139631.0	1176399471.0	1436907701.0	118774486.4	66945643.15	60027558.31	104923210.0	174886385.4	45581181.39	233701148.3	220686953.9	223959541.3	187660032.9	94127627.49	122904395.5	137774455.5	179497095.6	220785713.6	135211422.6	170392136.3	105787850.3
Chlorogenic acid	3739313615.0	3765155190.0	3592206136.0	3633899789.0	3235264281.0	2630477798.0	5069007394.0	5654220999.0	4126511045.0	2805218978.0	3310316449.0	2417399749.0	1422763394.0	1986996177.0	1718783250.0	1995131370.0	1393122903.0	1078485205.0	1597031401.0	1372274534.0	1345793194.0
Citraconic acid	74992558.61	74926550.78	83205356.12	53653923.97	78367893.01	71552426.09	81813245.88	53836624.18	123004969.2	110790070.9	105350605.9	102221529.2	190252725.9	182388037.1	188582389.6	256027920.5	191839453.8	235053817.2	270992195.7	298344908.6	179317241.6
Citric acid	12495145840.0	13058728579.0	12942764447.0	11013703597.0	10616513835.0	11689517364.0	7088277957.0	7396879149.0	5532114463.0	8809268961.0	9262487863.0	8020566179.0	22336604640.0	21910524728.0	23508746735.0	32982477721.0	30525345265.0	29889436244.0	31116778212.0	31241262974.0	30119039086.0
Corchorifatty acid F	222210046.9	200870695.5	210180416.8	33457847.24	25216879.38	18478423.43	7867506.28	8616414.793	7218417.594	4071386.981	2012284.036	2922774.86	4647933.523	2785779.784	1456505.15	760898.5962	780958.6206	3245827.554	41177931.42	53416727.53	84693627.98
Coumaroyl quinic acid (isomer of 758, 759)	109215333.9	109609960.8	78974735.3	298205871.7	246781534.5	180087375.7	139784547.1	89573763.86	70826304.6	32044973.04	33721009.49	18351109.39	16670650.6	36242837.18	22951731.22	20033041.14	14035518.22	16325545.42	28375918.7	18990481.2	21519868.11
Coumaroyl quinic acid (isomer of 758, 760)	606998363.3	181859622.0	266958382.9	1468269907.0	1082694868.0	1064263658.0	3610051392.0	3308383768.0	1875173665.0	75888922.6	93309483.88	53973558.94	28972954.13	29290595.72	33029192.73	42407455.68	25041503.55	24370532.92	24873687.04	29616635.64	29038075.92
Cyclopentylacetic acid	5089546.254	1479769.881	6382460.718	6480869.546	5793219.13	10696569.48	19081645.04	13712046.64	29229432.34	8006179.95	11778071.99	8270063.255	1112165.516	1247443.819	1466824.551	336338.8208	582123.0558	898600.6748	3213546.416	3372402.504	2540287.228
Cytidine-3'-monophosphate	25314770.17	26425407.74	28763814.25	5892055.98	5555268.049	8461067.247	3896250.074	4036159.375	3853082.121	2666595.815	2946155.419	3040913.747	2219447.675	2413182.59	2244129.17	2600821.593	3123644.21	3070050.114	24733118.43	24108444.04	30710394.91
D-(+)-Galactose	550224845.8	482292386.7	498608736.5	764026387.4	602623799.0	719425242.9	1684108801.0	1753375509.0	1875347900.0	1286614661.0	1253382127.0	1493364890.0	1008840404.0	1050848811.0	578982636.8	2391743374.0	2295311226.0	2824222417.0	2940938964.0	3624225921.0	2441637808.0
D-(+)-Malic acid	3076966333.0	3167281376.0	2644128886.0	7120665664.0	5643105317.0	6471453733.0	7928022483.0	4473243030.0	5773217240.0	4530948605.0	7265424939.0	12265713382.0	3033164577.0	3457040031.0	3289319520.0	3171304493.0	3330264618.0	2536210776.0	2502442105.0	1689226006.0	1984483762.0
D-(+)-Xylose	4934856.978	9223923.13	9398797.039	19326857.34	19900165.65	18482739.54	11931326.13	16798016.02	20407656.72	14769926.41	16322485.52	13326658.86	10267606.37	12759292.41	8764610.309	11754077.98	10134493.77	19122199.78	20830891.2	12816480.59	11217440.63
D-(-)-3-PHOSPHOGLYCERIC ACID	2418502.308	2570475.627	2614125.582	5558413.908	5149920.364	5725456.703	35515825.26	31222688.9	36546667.52	14150726.73	16250660.05	39018684.31	19338567.54	32140119.75	36865786.86	4961836.059	6580167.512	8675860.495	4522218.792	4865327.051	4997669.097
D-(-)-Glutamine	259473153.1	265803506.9	290301561.7	216605936.0	334096979.7	345497931.5	241752038.9	225863114.1	292818770.4	557463116.7	616798623.5	418000053.1	506168264.8	399296643.4	300502568.8	571439223.8	500306592.1	424804184.2	322086291.6	254945217.3	351359658.3
D-Glucose 6-phosphate	10692114.7	1954077.092	3182399.672	45866757.34	55566026.41	46351027.9	94514531.6	95304146.38	85368296.1	88524083.41	84987397.41	55949833.25	101118580.9	74367290.08	73177801.67	51000989.95	54882790.21	83347124.12	76982080.28	129473079.3	91007875.26
DEOXYRIBOSE	40561660.57	42094022.29	40826017.7	52063655.71	54553252.84	52762363.24	34164533.28	36998915.86	34457536.61	59957803.25	50790158.18	48281151.34	35043133.02	32046700.03	37346228.91	28813073.18	31703838.82	30502114.15	22326757.31	25496253.12	24326009.81
DL-Lactic Acid	171253073.4	157676653.0	178619182.6	103617831.4	153474329.6	250915897.9	177425391.8	190825548.6	180078022.4	350152275.5	237115781.3	400636184.5	646141902.7	549757569.1	306112851.1	651808873.4	564520470.9	648945391.9	665843897.3	780064497.9	1584002831.0
DL-β-Leucine	92017426.05	98202821.18	91607538.94	6298890.868	6085011.345	7146382.32	4570352.79	11793020.47	3977777.769	16089570.16	10669978.48	13991309.67	11629856.16	4518934.793	9013078.999	5389159.818	6205100.385	6599187.402	24679375.68	19868665.89	29271276.81
Dehydroascorbic acid	219228954.3	230200228.1	210052818.8	310835243.7	263916919.8	268467733.8	275132351.5	269979875.5	241687392.4	467159888.3	471193597.8	707378941.8	359788754.0	434217882.1	370230308.1	583045275.1	375780489.3	486732379.0	428231882.9	439638190.1	447136937.9
Deoxycorticosterone 21-glucoside	85641.15844	108368.8936	69771.43231	95493.05797	588128.7041	1061349.079	67721.09301	150404.4322	179163.8808	261173.6703	563954.4805	3768454.097	65172.47982	712318.0483	411769.4795	2197157.409	365226.9093	536099.9616	501068.4173	143618.3303	359889.9054
Deoxyguanosine diphosphate (dGDP)	3146816.833	2956649.535	2885196.58	48962540.11	63896300.14	49661856.44	109430991.4	66513426.27	69398596.6	90633948.97	81777995.28	76384290.27	87738551.29	54086467.14	42451866.25	152575702.2	147252445.1	54674697.49	5262208.202	14696250.75	4447023.75
Diacetyl	56110282.89	57131820.66	58342151.74	40502687.26	35235424.73	59741416.7	52616520.15	68748078.67	56662225.62	52367879.37	47682113.28	58808250.05	41305336.14	43592305.82	46784073.17	80821863.35	61328352.19	69710584.42	94246066.7	128459482.4	127834379.8
Dihydrobenzoic acid pentose	3728366.926	3410887.769	4733125.035	11279812.07	16123086.14	13850916.39	14861096.81	18248230.54	12126681.56	23034677.64	25273660.35	14251215.9	5697506.152	7690204.82	9171293.481	10428705.66	8004063.136	9581885.351	6872921.75	5528861.375	7465103.174
Dodecyl sulfate	152839636.3	134224068.6	159870921.7	157065965.6	149748616.1	202776946.6	112533847.9	187236738.1	255639961.0	621755581.5	168780919.0	176930982.0	114719308.2	132292161.4	180059699.1	148856396.6	173885816.7	158480641.7	282786721.1	99005272.45	110981807.7
Eriodictyol	22717192.63	23441712.17	24735642.18	373957.3877	396293.3133	411499.0188	371037.8963	390797.5439	396627.1457	819054.8592	747088.1606	490142.6644	476961.5177	318964.1893	454221.9579	259799.1103	258197.4108	633509.1556	313237.2818	448585.103	992118.9842
Esculin	640392.635	676846.5429	647145.23	2009068.99	1861932.427	1436296.323	4096224.395	3376748.876	2245377.104	1417841.395	1506452.831	796671.4496	570431.5474	434419.2936	493469.469	1096272.521	997033.6986	697833.8733	710587.7616	436677.4808	276592.7775
Ethyl 3,5-dimethyl-4-{[(2-oxo-3-azepanyl)amino]sulfonyl}-1H-pyrrole-2-carboxylate	34765822.91	35012499.75	33962411.01	9328583.292	12346205.17	12519283.3	30825214.75	34282773.88	26123516.44	525796.0765	983728.8565	509547.1153	62892.64365	55642.74995	55815.68612	80696.2371	71077.66603	71519.43873	104470.7184	104867.0482	89892.55838
Ethylmalonic acid	74248251.84	69914002.94	70035605.67	68740372.9	67816349.22	61614293.06	52472791.92	50913503.07	46572698.23	46161453.64	44815160.84	33466339.3	25425318.85	34656981.44	24078342.92	54268022.18	51394650.81	75184003.13	75024675.4	90927944.43	143878607.9
FA 18:3+2O	183371565.3	175929897.1	187432209.5	54493412.22	43465279.0	53788182.89	6683429.281	6844575.906	7229565.138	3769654.864	4339798.26	4359946.663	1343460.47	789527.8637	1084573.402	793324.4421	1000674.915	1438908.406	15627673.53	21284682.82	25212209.23
FA 18:3+3O	4421105.988	3826072.097	2626093.189	4483519.651	3077945.899	2199728.278	345350.3655	328370.4246	331591.5968	444820.9162	435208.3295	337251.6177	264117.6463	274505.2716	232750.7798	288919.9113	259671.9526	254918.3324	15931651.42	14491178.39	21291958.92
FA 18:4+2O	14928533.94	16779657.9	20365622.73	4357340.32	4857713.685	3618111.321	3846861.322	4516268.688	4632603.645	2332294.075	2863719.344	3208340.091	1950306.087	2610496.973	2738713.226	799979.0969	816959.7388	1098108.71	4811504.425	6770201.504	2316020.93
FA 9:2+1O	2561910.079	2699434.123	2566746.07	939581.8723	797550.8833	872221.9977	265698.7636	278018.441	622708.4965	235450.1733	337154.5918	185071.4749	340584.1038	140515.6512	220237.1763	106712.2826	123044.4935	83027.57859	166243.0253	109765.8513	235671.8827
Farnesyl pyrophosphate	295018.9965	345813.1813	332948.0447	278813.5362	285018.3676	330583.2264	180180.7056	189449.2631	213804.2416	1439296.599	2789752.622	4395574.831	3061892.182	1463467.403	1733113.523	3148859.042	4399977.423	3311017.623	2709409.823	7727940.812	7716502.93
Flavanone base + 4O, O-Hex, C-Pen	188086256.3	176670406.3	171567098.6	136413904.9	133803835.3	145332698.6	190004800.0	213543508.9	137042045.7	74061409.75	89033039.92	57048180.64	13756353.22	13591493.34	12275237.01	8979646.813	10430297.8	14182372.12	10884000.37	15535573.15	8788167.989
Flavin adenine dinucleotide (FAD)	3112010.421	3431396.8	3563768.11	17441413.79	16463062.84	13302243.53	17037803.82	19075667.2	17059228.61	11975128.14	12811855.5	7699503.477	13585180.94	9567319.075	10894523.98	29985121.4	21687287.09	16999873.68	32121842.33	31925889.29	19385968.4
Fumaric acid	202234275.0	208405916.7	207524954.8	459870748.5	400330136.0	503709099.9	519316184.7	463959105.4	447651173.2	625120633.8	949333578.4	640279169.2	322315293.2	389104396.6	376505184.1	374025490.5	385081878.8	381168083.9	374846146.7	379621008.9	352356422.7
Furostane base + O-Hex, O-Hex-Hex-Hex	337419.2303	464900.4503	312219.6093	210381.2312	211733.4759	230600.2902	136781.7117	156728.8448	117933.5533	278489.6188	143112.4805	436591.4877	3643395.417	8229706.418	13345057.87	1510308.144	3288475.351	3595578.603	4833591.915	1924891.739	5438975.845
Gabapentin Related Compound E	6578025.943	5100450.054	12408367.27	7782063.276	23013708.85	27171195.83	5336312.832	6499127.251	364686.1365	4707847.424	1140555.692	287920.9388	3119224.757	3468285.602	2441253.863	2762837.82	181014.0161	1735959.696	3011634.61	3990046.954	3316278.246
Gallic acid	791071.2894	338500.9936	720335.6418	1341990.393	718070.7417	1603748.235	1425773.832	1364310.516	417771.0213	2940951.992	2986744.464	1583622.095	1194455.482	1531584.985	1773326.648	1480111.005	3838434.008	2096801.016	9104803.15	4519495.583	6972860.224
Gallic acid hexoside	155729.4674	182549.2349	219999.6212	2863153.968	3277952.168	2731530.521	2657160.345	3308648.563	2406923.041	558202.2252	619629.5969	323082.7044	106997.4521	134876.313	142709.5668	60716.07473	71587.02427	70237.77353	97535.92733	106267.0694	105755.5506
Genistein	52540823.11	46680431.26	51032158.42	344175.4867	358983.808	355295.5827	322940.5286	305505.7652	321955.7881	445459.5897	426475.438	389218.9674	268415.337	304786.5071	230216.3303	329816.9258	347882.109	268123.5611	342515.4348	194503.0271	204639.841
Gluconic acid	474749501.5	474329205.1	485529770.4	795143639.1	838114326.1	750099755.4	817842234.6	778587931.1	681687550.6	718124904.5	818574133.5	805663131.1	613619744.7	689302771.9	655148420.7	581899824.3	554771174.3	586836892.7	631104375.2	604834054.9	608527946.9
Grossamide or its isomer (Not validated)	15287243.14	12220333.45	11909814.05	4868574.744	2907001.755	7305891.101	193145.3823	287576.3493	509899.2848	1288513.513	1933701.647	2584988.413	1589653.237	2810450.28	2024874.769	2449439.594	884505.3057	2129996.231	3850001.482	1240746.284	3194545.72
Guanosine	1602336130.0	1655555223.0	1615880835.0	469702180.6	407146488.4	479630674.7	38734651.15	28953981.34	54924828.48	33456360.97	26354592.49	28753536.75	19786237.56	16308382.93	16968779.23	11332470.28	11462188.25	9180965.953	237188051.7	159359442.6	230216959.2
Guanosine monophosphate (GMP)	30652984.08	29304043.6	25948757.12	20671388.1	18788882.25	19338882.31	15263541.65	11503195.99	13177025.78	1435648.302	6199563.225	7726635.759	2024589.801	2400547.441	2700777.18	2059997.7	2372196.357	1885309.868	40746471.96	11418132.03	44265825.11
Guanosine-3',5'-cyclic monophosphate	117562049.0	111641863.6	100952828.6	43734541.12	46059102.86	50331030.8	1000661.761	863480.4562	1423305.316	1117198.116	562253.0856	921991.8828	440549.9565	332958.7095	492259.9306	614635.9889	797266.57	752210.1486	200885801.1	280028962.2	205422280.8
Hexadecanedioic acid	3249447.317	3232697.642	3538992.193	611826.3878	427727.7878	610346.747	7282139.331	6591734.495	7573566.873	5358963.808	7111287.877	6458948.856	2431090.202	2825379.286	2273627.48	1802817.667	1882213.107	1829372.924	3671283.862	4035305.097	4474137.753
Hydroxysuberic acid	20987986.34	21712354.47	22435947.55	6428794.217	6287876.648	7225703.454	1017515.732	1098724.547	993484.5069	1243970.482	795472.5592	1716527.184	620651.2152	429997.2258	391173.2798	721082.541	341043.8298	240101.2635	668803.5438	1812497.708	1401077.306
Inosine	55764773.42	57554705.93	60987939.05	11454716.86	11361611.58	11500479.98	8087404.619	8945004.878	6890600.81	6067347.283	4454018.484	7887319.259	2765831.081	6809280.475	4829992.502	3397534.914	2287245.235	4958141.535	7644996.526	6893792.272	7528216.837
Isophthalic acid	10877248.52	4345445.997	4663144.73	4020202.893	22657246.45	4742624.145	8285710.476	4832499.943	10943652.71	23760909.07	69887354.19	19283862.45	32435458.55	15376983.78	17216410.97	22101466.39	16377085.97	30251004.27	40635960.6	24264270.35	18483054.32
Jasmonic acid	1537650.255	1560885.13	1590638.141	5551260.306	4563036.119	4716110.083	148923.2455	109719.9621	93231.76514	91044.54965	92452.50906	90246.31153	92292.43757	78601.7927	86419.16773	92825.82558	82596.63203	91948.63344	132609.7474	140616.2377	122436.6213
Kukoamine B 地骨皮乙素	35436745.6	28840578.15	49480411.9	149174.6731	166980.7912	126477.6398	77549.52026	84886.32578	77246.67201	32616369.41	33859192.9	23577100.22	42077352.27	64796962.86	67820825.9	67076913.9	31055607.08	22125309.65	16901802.57	6964170.956	15105783.4
L-Citrulline	6307590.663	7319149.049	7068445.145	24532186.27	54805768.46	32512658.73	16178477.98	16797162.63	25730610.78	20701117.52	23723700.43	16194565.9	17137710.39	17787816.08	13896802.14	12278746.07	12037543.27	10269281.68	4369272.041	1854524.556	3235882.119
L-Dopa	5377334.184	5891872.397	4480050.862	979036.6365	690354.5256	590764.8136	183360.0625	757629.2519	288539.5812	1238926.974	411551.3571	813824.2488	1158561.286	690341.9225	713101.2725	1530943.547	1453075.988	2772007.7	5147716.247	5280258.314	5009234.207
L-Glutamic acid	54497679.35	54977314.59	66020214.58	156861338.2	181924494.9	158090215.9	327212177.1	306913698.5	256119812.9	321860665.1	348600444.2	404106438.5	347850797.0	304323478.0	312137779.9	255922468.1	264834061.3	277324609.6	25999623.71	10483453.72	6326573.237
L-Threonic acid	70492676.99	74890707.88	79502799.62	356368371.3	227861341.8	329394045.2	78119974.53	106339141.4	56243749.95	87437858.83	102917696.4	94508224.44	69555635.65	101776135.6	71792498.34	51487226.3	48779834.39	63409962.16	38327528.87	50667498.38	43900907.95
LPE 16:0	177399453.2	181309188.3	185482549.3	93699123.62	88631175.72	104854848.3	126881067.3	120366150.6	101866363.9	82396556.77	81687697.06	95692579.8	48092661.87	45687934.34	42776576.78	28591889.25	38099104.81	35534793.49	69291710.29	22547488.05	44236794.62
LPE 18:1	4568190.764	4068970.778	3171359.237	11456524.07	10223702.69	11107099.52	18424280.92	28562374.1	25471956.59	12636512.21	15383154.83	15512720.12	9969289.215	10548566.29	6987038.592	5933963.577	5506766.1	8188120.704	2732187.141	1726484.644	3805707.838
Labdanolic acid	1755130.314	1578076.512	1733288.151	3615169.029	2250076.322	2417148.638	115507.6824	106763.4211	108016.6003	104329.1697	118974.9752	114054.8303	104224.6564	100192.1972	104318.231	107834.4747	108451.1295	118208.2163	112826.5606	128935.5094	130289.5686
Linoleic Acid	3461735.815	3905092.65	3457434.529	1965656.928	1277839.246	2064891.283	174173.8846	178166.8947	163109.8886	101337.5721	109125.3184	92167.4721	99488.05892	93455.83455	90806.29958	108598.0964	98600.87831	100329.9867	5384008.075	4747850.579	3931492.324
Linoleic acid	77973923.49	83340667.94	80039552.55	19828560.0	13322086.87	20546643.58	2192982.057	1777714.143	1115296.621	1364057.865	2033629.433	2338079.668	566784.9118	566547.4644	1106821.044	353296.0131	454318.2252	498889.0946	9619095.097	7729470.034	10191775.96
Lithosprmoside 紫草氰苷	120441850.4	134967316.1	126947782.5	336542724.2	270832045.0	230783371.2	38433401.47	62169184.51	60263548.2	17079385.31	20932075.16	16938178.66	2864574.466	12930463.06	1849560.7	13621068.44	4711404.528	4824142.665	10796868.31	5960414.081	3016171.444
MGMG 18:3	25114525.62	25106649.65	26127474.31	8274340.65	9494297.434	8773760.825	4459755.05	3321275.185	2345628.605	872931.9108	1622896.412	1226260.017	6830251.321	3225936.652	9679038.116	5384655.408	4471938.01	7726756.343	15844798.67	12112903.29	7963312.376
Maleic acid	2439795.555	4418587.99	5298212.692	4241114.541	6719927.063	4710926.938	3609842.724	4247437.035	4303448.677	25518292.41	34311225.25	32501142.98	26603537.02	22416101.87	24598419.35	21639936.51	12928862.76	5962061.788	12761864.08	23327152.81	17049557.21
Mesaconic acid	48944926.85	51236639.25	50393464.56	23150585.58	24660858.91	28917450.42	25609907.68	25050408.31	24869414.55	26597608.02	26590945.56	31277874.72	28571994.29	29509348.06	33601910.78	33925419.28	34901197.88	38623921.02	141383598.8	170804800.0	110634341.4
Methyl 4-{5-[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]-2-furyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate	755627.5123	991739.1348	1683305.789	228383.831	1116301.222	337062.0341	112758.3718	123430.8405	115152.7853	1323955.604	943974.5942	1492693.353	3114978.821	1204574.97	3909105.335	3769510.238	4314081.267	4680655.801	4666212.071	5959329.129	6145636.614
Methylmalonic acid	400137583.7	403810081.4	311355315.8	438214069.2	383418320.6	442135036.8	500316217.0	549786097.7	359616642.5	169525537.1	163099679.8	190515000.4	152594620.1	159896362.5	116226329.6	196665748.6	182322473.9	209283621.6	141047504.2	103832482.0	114157718.4
Mevalonic acid	20871518.67	19903261.28	21092219.55	32942263.52	37688405.95	38685210.58	41840458.29	47819599.87	32995464.47	18698825.95	20486077.72	17221563.61	10757219.75	10818949.33	12959340.52	14721021.8	14884694.75	12524539.4	10556328.75	12593491.5	11463344.66
Monobutyl phthalate	15336091.51	16604030.59	15603916.34	2253823.068	1382640.522	1769061.668	763630.6533	976121.2959	333561.2438	1057157.782	989845.7144	701911.8984	683789.0959	746458.1768	809226.6062	1571820.214	554223.3696	952382.4301	1189525.79	1774423.836	834881.4581
Mucic acid	24587469.52	22792544.19	26260113.44	136381002.8	136674250.8	109033088.7	185375918.5	244549722.9	268206780.8	233810315.6	241653811.0	314456406.6	300930310.6	224014550.1	244654846.7	238230736.8	254765321.9	316576948.3	255173095.6	439428801.7	401874846.1
Myricitrin	268012.9437	250309.2912	260626.2709	294722.9336	250724.3324	146053.8891	237653.0885	715677.6559	407034.0609	6435848.297	6300340.974	4229900.749	1964659.922	2720828.839	1476134.958	2205018.469	1439490.571	1894087.735	2675521.994	3183564.922	1735325.333
Myristyl sulfate	173256218.3	159428644.6	201516453.6	188976457.0	194489903.4	507809209.1	104261455.1	166051662.4	395216257.0	1328710121.0	209849217.2	203007428.1	110513973.1	139057427.7	194368810.9	148739530.2	164326385.0	154326764.1	209704728.5	119055781.0	130072809.6
N'2-[3-(trifluoromethyl)benzoyl]-5-(trifluoromethyl)pyridine-2-carbohydrazonamide	4937219.067	4393632.497	4978762.637	10763652.83	8437140.012	5812417.618	14942369.43	14929599.62	10930630.51	17903716.54	20810288.62	14038253.09	6418943.92	9252711.89	7961982.722	4859646.72	5151228.222	3695038.554	5324298.432	3668793.227	3769924.868
N'3-(2,2-dimethylpropylidene)-1-(4-isopropylphenyl)-5-methyl-1H-pyrazole-3-carbohydrazide	25305327.15	25220013.5	26119355.11	6705714.837	1119684.713	1544984.12	385172.8984	517280.6484	346788.8303	316667.4251	311350.0574	513145.6321	126929.2462	259857.0984	155819.9665	167582.2598	157000.6568	252441.6015	2932846.285	465249.9339	3351764.664
N-(1,3-benzodioxol-5-ylmethyl)-3-(tert-butyl)-1-methyl-1H-pyrazole-5-carboxamide	3692097.927	3648859.211	2346995.37	4887125.545	6240583.473	13662902.64	4097224.438	4199708.776	2923926.967	125556.1436	115676.2059	98048.63066	109064.6732	90205.67156	91907.89209	125513.0762	108274.2639	110094.8225	137719.4993	132253.4494	122723.4796
N-Acetyl-D-alloisoleucine	21350462.87	23507855.12	24039110.36	2565482.424	3576890.928	2747785.866	5877718.27	4973263.69	4748567.325	4628992.351	4992399.582	5908914.326	2089420.276	1930638.833	1726790.927	2115998.469	2439525.627	1184944.198	2411495.858	3338586.741	3548802.73
N-Acetyl-DL-glutamic acid	8953750.46	10941882.54	9723181.665	37039889.41	39419028.34	34386561.41	19918690.86	27624422.54	21406744.74	4052602.197	6641426.618	5230377.379	6263103.964	4950665.373	4897039.904	1372491.733	1759824.391	795006.3726	1883981.947	2404724.278	2358101.574
N-Acetyl-DL-norvaline	59943893.67	59643636.05	67952355.09	29875057.38	30183026.08	30083552.84	19572845.03	21590252.37	19747545.34	19136043.87	21302003.96	18352511.31	28073716.89	19662687.02	27500354.42	24755125.41	21440532.04	27572965.69	23522532.19	20788844.05	23972189.75
N-Acetylalanine	19197181.68	24320306.88	21156423.69	12517540.31	12581090.82	13584471.05	18932984.97	19571259.07	13823013.13	19241044.68	35615269.13	19873703.72	21149763.4	9926803.244	19469047.55	16558043.64	11880126.14	20721023.37	11409859.63	12397783.59	11755125.09
N-Acetylsphingosine	1213486.367	1407083.953	1424357.75	364898.4587	181035.9757	363053.6002	131179.4857	125917.8024	127006.5961	143119.3234	146161.4071	143289.1075	138803.4543	107927.4613	125039.8778	118736.0781	122178.7981	128509.4752	121632.4837	141352.7606	127539.1159
N-Feruloyloctopamine	3778468.653	4480227.592	5053995.468	1836819.0	2266897.882	270035.5464	1250018.628	1530589.419	341092.801	407501.1729	355390.7122	304770.7173	271043.0359	247778.1574	233309.0524	264930.02	244650.1557	249257.4475	291823.8551	250836.2326	3668493.178
N-Formylmethionine	27397302.29	30751286.64	32291565.13	1391050.832	1320528.167	1636568.949	551227.0076	520906.6907	454179.749	277234.8834	228451.8461	245935.4725	411938.7934	375007.9615	427620.4863	246963.8992	189439.3644	143034.9394	4710306.215	2869352.325	5636636.111
N-Isobutyrylglycine	55088950.28	38098277.63	89285993.14	33921550.19	37392627.68	39868371.15	13683317.79	11157374.57	15051263.92	21278124.27	24928478.41	21407683.36	10223953.55	12838670.67	7081860.526	5860456.618	10903732.03	3675934.132	37530778.5	3815686.559	3544558.077
N-Tigloylglycine	23594289.81	23034446.48	23494179.35	23854390.6	24317929.53	25744142.87	10900282.01	13447753.78	10024201.56	7912359.268	7665705.14	8354004.902	5613484.019	5448687.188	6324723.825	7171981.475	8259109.688	6560765.703	8090015.361	9346878.905	7437856.979
N-[(1R,9S)-11-(1-Acetyl-4-piperidinyl)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-3-yl]-2-furamide	8752977.813	8866071.722	9979256.133	52839.86892	49996.99427	59641.10686	52391.50578	49165.45673	47750.29897	49968.20157	47543.82332	48699.92327	73213.10451	46853.087	54963.3186	72274.59338	74820.4595	67884.93452	99243.27961	108044.0012	97135.86113
N-benzyl-N-isopropyl-N'-[4-(trifluoromethoxy)phenyl]urea	7741006.738	8023225.447	7690785.087	335026.8614	241673.6384	231935.059	69221.816	71864.0359	71623.17783	79057.91078	74442.7269	148688.2909	69646.17485	68477.13899	74185.43003	85720.42467	169314.5789	90152.34004	3422968.355	2043871.487	2780670.132
N-{[(2R,4S,5R)-5-(3-Cyclopentyl-1-methyl-1H-pyrazol-5-yl)-1-azabicyclo[2.2.2]oct-2-yl]methyl}-4-methoxybenzamide	1130850.675	1163387.213	1430819.697	14597466.24	9707002.835	8971531.323	78546.66122	78043.87382	77669.92537	102945.3245	109984.6826	111482.2728	116339.512	84916.64214	102453.2615	101785.6813	98138.72236	103980.2054	508556.5676	230889.3263	1445326.053
N1-[4-(3-pyrazin-2-yl-4,5-dihydro-1H-1,2,4-triazol-5-yl)phenyl]acetamide	3073229.865	4152464.433	5163165.127	4986790.744	2970556.316	1864361.356	7189383.925	10060118.37	3362669.708	1387015.953	1130710.034	878150.7513	125670.9127	200333.3553	354413.7881	227509.7916	256611.268	416393.7531	376011.9711	193244.9481	351380.3494
N2-Methylguanosine	7999995.216	7855856.534	8175593.264	4912778.344	4168881.789	4990173.48	1008196.625	979293.2072	1070451.391	1920888.618	1305481.0	1483169.813	1856142.102	1075988.491	1302979.473	1476577.491	1215727.813	1276262.508	1034014.045	775006.3094	960042.7441
NCGC00380464-01!3-[(2S,3R,4S,5R,6S)-3,4-dihydroxy-6-methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-2-(3,4-dihydroxyphenyl)-5-hydroxy-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one	6301753.722	4647371.133	2137004.086	452554.0788	317522.685	460244.2574	393963.3907	507550.1311	368758.3222	498770.7316	550047.5635	909957.175	5278531.52	5913181.569	4789547.962	4769046.564	3335438.12	8380471.879	4278624.546	10726208.77	6725664.773
NCGC00385414-01!3-[(2S,3R,4S,5R,6R)-4-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one	27939930.59	31996971.41	32968393.16	4815758.541	6326697.694	6722429.879	1696870.371	1436579.154	1437569.876	304829.154	524719.9684	681236.9985	834120.0066	225357.2114	238773.1699	437600.0621	282080.7276	303099.9671	972490.4333	1774166.492	776523.9923
NCGC00385836-01!3-[[(2R,3S,4S,5R,6S)-6-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxochromen-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-3-oxopropanoic acid	443321.5369	505602.5785	331268.0578	967354.9652	1003175.838	422459.5719	5250351.161	8464294.458	4602973.561	11298537.53	9787711.524	7598786.219	3269598.305	3445981.821	2462771.79	3572926.974	1946863.347	2653639.804	3034431.589	2625970.616	1654966.016
NP-000924	39711273.35	39745691.6	41552921.99	479635.1477	463350.3412	490615.3591	497069.8778	494500.1884	489869.2717	466571.2088	444176.8641	840236.5975	279170.86	288227.6777	279382.1104	315417.7996	292707.4184	252448.2245	300415.0038	270937.5271	254280.1433
NP-001596	8555389.613	9483143.678	9370676.885	1333476.12	390007.8627	766241.96	55697740.32	56495965.22	62080209.18	16232481.29	23498625.37	14896145.97	3155634.164	3318432.285	3264072.988	1350729.587	1727794.726	1663150.011	4983520.59	6781437.957	6991892.847
NP-002737	2405737383.0	2590657037.0	2603332210.0	1466576008.0	1781343314.0	1496991314.0	1065806079.0	143844220.5	843307560.6	253690542.4	421122168.8	261601872.2	83394379.77	114921230.0	101615636.1	113557985.7	101156167.1	93753796.01	382514498.9	832049733.6	651255207.3
NP-002943	1590398.721	1434015.997	1633460.485	1441722.494	2051590.828	1702634.998	3122733.125	2892004.895	1944223.301	7618829.731	6091816.213	3804130.068	740741.9916	2698270.454	1496513.474	2681816.54	1776238.754	1515057.827	1971572.048	2545764.901	1569567.546
NP-004596	2979328.952	2915033.207	3127400.338	929332.0898	1149435.799	873908.3482	1858565.773	2846945.489	1365010.936	1895258.661	1748596.862	995571.7041	292881.3932	201025.8826	130519.3788	179689.6325	156597.5915	127876.844	138648.571	151391.7684	161217.5576
NP-005196	29196447.41	34595415.95	34793931.35	20471826.53	15844438.47	35867518.57	26627305.36	33098585.3	37756441.42	35828470.67	39989008.39	35131063.76	11904068.71	15844322.88	11322978.26	6130182.289	6766294.305	5562646.341	8252409.993	8170263.262	8737036.144
NP-008309	80172919.23	87626671.15	82498988.38	199950332.4	136285843.6	220176994.5	32848405.92	33840340.52	27389162.64	29067342.82	23363980.15	10949467.13	31732412.66	29696535.91	29563798.35	24804049.7	25597440.13	27056377.8	33511488.96	29555127.89	38728855.25
NP-008993	2201488.792	2623573.188	2784044.512	1062370.842	736327.3716	805838.3004	11043062.49	9951550.016	13247282.13	20815966.53	25700052.81	27321577.25	4199831.457	6706207.322	5524868.544	2469587.431	2476425.613	2860502.408	4961094.907	7087992.214	6907221.549
NP-012551	34788688.73	38761130.99	36351942.85	20384167.63	25248191.07	29605236.1	42907790.03	33526292.91	44400714.95	55738022.59	75285233.4	60091476.71	13562650.11	10644132.57	11582512.5	11497049.64	9584900.654	14200488.29	12238496.75	14723703.04	19707159.34
NP-014113	116039.2415	134445.7042	115775.2958	180431.0868	522632.4887	259904.6549	208091.1363	252067.8133	191740.8563	161439.9955	166764.7373	1853287.152	6940046.9	10723929.39	11296674.51	4418591.629	11666259.12	4420102.988	5200888.378	2641080.149	4135022.177
NP-019722	14547792.17	13273446.0	12391806.49	3964526.506	5118009.11	8112071.718	3682575.851	5965657.691	4899098.472	4384502.543	6694387.007	6798625.799	10431934.57	7893066.485	7362731.812	11163629.85	10475867.18	8089947.078	12743554.6	10434492.16	10808953.72
NP-020078	152534.3393	306226.5587	124153.2842	85082.8108	52161.9642	70398.35334	88755.09617	63013.06859	67671.95641	4381805.019	5386348.872	6979956.822	3168894.895	706459.7098	1348144.25	2254126.244	2666290.919	4418048.015	2507351.261	8759205.939	22720396.79
NP-020139	2684685.772	2475532.763	2423880.461	2484570.818	1936860.694	2273097.591	2785164.41	2790816.271	2025888.478	1347985.902	1172959.518	942822.913	724220.864	455592.4186	593156.9233	560136.9495	443212.9406	289578.3285	588369.5075	3884413.172	873355.9916
NP-020205	1236665.314	341306.7618	1865036.572	111836.4109	6207905.353	4935692.291	2522698.327	2696308.187	267245.2641	3259957.315	205915.7942	190000.1008	2722558.483	1040206.168	1646271.228	2293407.674	288633.1392	1227033.29	1600961.95	1632700.622	1101400.391
NP-020534	85378.5561	89208.73671	94985.93682	91561.15092	88854.90305	94388.13105	76546.77419	74580.94641	88517.11302	82192.43529	86788.99904	89159.45704	460886.7718	458786.1491	153912.9882	1039898.273	80432.35236	2953878.772	682492.2756	9365783.18	1119123.32
NP-021050	6040516.811	6251437.241	6813266.124	99845.92565	91338.10529	104595.0421	94474.93796	86354.03857	92386.65689	111986.4381	155068.547	131353.5713	111243.5958	91483.85922	106540.0911	113461.7231	110976.356	134736.2266	109559.8269	136210.179	150488.7023
NP-021116	335506.7296	356433.0063	2364582.689	369687.4954	346037.9327	304966.3685	1367299.408	1492365.242	1945560.303	8203604.638	7664801.243	10258606.63	1436106.514	1358061.424	1341356.231	1364177.176	917662.4653	814536.7769	353656.7298	305145.1899	287492.0739
NP-022068	53772548.66	50499260.94	51799592.37	17769988.9	29153882.32	27805594.56	17215178.29	21864548.7	20813352.19	18325879.71	19323939.29	15201571.47	10434890.17	9837110.433	9992667.711	13143482.5	14480317.67	10593966.52	17601500.59	13965180.94	11866982.22
NP-022389	4108910.379	5325800.287	4455740.708	12134034.5	18969177.04	17406991.55	11949611.03	12992091.82	12929831.81	3571234.1	4005900.972	2374125.348	254900.0041	1131848.828	105780.3197	353485.4039	323502.1628	206013.0024	226610.1849	152458.6309	86753.33849
NP-022407	2724365.655	2997075.642	1899361.696	106227.9096	109481.5415	105911.9603	283237.4067	287851.9612	212672.1381	1534545.507	1167751.294	1602421.538	2570442.127	1487972.421	1999569.171	785521.0999	1134131.341	1076610.617	343029.2611	189976.1354	409749.3486
Narcissoside 水仙苷	2186228.59	2427718.053	1874265.408	1290445.21	2557064.093	1326225.756	2547973.805	3906109.894	1687401.804	10019411.33	8677368.752	4493931.328	9602605.03	5711937.843	1428315.03	6923610.86	6153702.819	7033227.772	13050044.76	10357163.24	7555221.985
Nateglinide	142271.8689	147183.6453	156043.8092	124865.0067	117307.2547	127993.6943	566120.3932	104457.0751	263802.9982	3162096.772	3793626.135	3784199.896	3266993.298	1267710.922	2288270.086	2848560.821	2016483.357	2508803.087	1959037.027	2914739.503	4275530.758
Neochlorogenic acid	3361846.255	5923862.475	4789829.946	4430392.172	4974799.303	3401631.181	1483868.59	3563616.379	3873198.971	6199550.14	7860944.41	8132353.132	7472790.553	11550150.02	11405251.72	16878368.88	10279884.95	7217379.175	16092969.73	9759947.07	14110892.05
Nitrobenzene	8503709.42	13830340.37	8999361.968	8664593.781	64639279.55	17508410.47	60104116.94	62149251.09	68476809.09	6811095.221	7050469.442	7013070.742	7108680.142	7062506.499	7510286.386	6663912.851	7696947.887	7493862.795	7624649.979	10399571.0	7701161.38
Nordihydrocapsaicin	127746.203	129694.1024	131707.6233	107485.0757	100492.5671	109511.993	2929189.598	1263440.647	1583555.759	79913359.95	105427613.0	107450998.0	137516137.1	37858827.82	71370174.22	45640057.55	43172870.04	90578812.68	40653036.13	177924925.9	220602914.8
Oleic acid alkyne	53246746.52	55838300.41	55813375.58	9699358.828	6903928.043	10335235.27	1708258.546	1045635.868	1046278.134	4090484.823	4767050.601	3673547.952	3469813.542	1608750.96	2836147.394	2919745.592	2623338.866	3399899.75	8195186.118	8750547.392	8457593.153
Oleoyl-L-α-lysophosphatidic acid	20529541.19	23119149.04	21607262.62	182473971.5	114353193.8	169743715.8	1789971.852	13800163.13	11276887.12	5475486.589	5243593.438	6164508.032	7764672.687	8618786.544	10471599.99	7066393.472	9027710.195	10354042.54	32250008.61	12151696.42	12833024.77
Ortophosphate	125104077.6	138600479.4	148092141.1	79823881.14	80919397.82	92709998.59	80050034.06	83806373.11	86658791.84	82899076.78	103306616.2	95429832.41	83180492.64	61517527.06	75061630.61	89274899.38	78986080.41	89981721.72	103743990.5	130097703.9	134792210.7
PI 34:2	20350485.07	14192817.78	19085706.62	109116684.4	95521866.03	77727342.76	78752874.82	85099412.9	74489634.74	5591566.139	58283154.83	43815302.38	56129217.25	48642297.06	49012210.46	57226468.21	46527857.31	69623142.33	7190755.647	14362705.75	5578036.965
Palmitic acid	9192000.254	8947230.145	8242151.824	2910457.626	2495406.98	2957044.853	675493.1595	456588.4804	519049.4876	1382936.943	1251524.981	1289812.922	686209.3932	713655.223	508534.5995	995804.9203	425286.6389	667833.4172	1834309.961	1831974.392	1998979.594
Panthenol	406950.7787	180185.0334	292958.7323	271426.2637	294929.4257	222219.2322	264945.7159	424968.0346	403743.2562	200606.2044	286937.2491	366176.3756	609145.3	997821.2332	1347366.664	756918.5674	256575.7326	335958.9492	1913248.035	234837.4045	372555.7381
Phenol	440904.9369	715568.1595	629202.9927	4276311.692	3977506.667	3775271.372	5295389.574	4610526.103	5432056.004	3752040.261	4283010.057	3587437.175	2096014.301	1714987.291	1735292.583	1389885.08	2111851.909	1614228.338	642667.4799	510357.1278	928506.6749
Phenylacetaldehyde	1737536.19	6505377.557	7267565.639	3055125.401	2114069.544	3270664.619	307661.9607	335372.3001	332176.8783	356535.7996	371759.247	316026.9315	249876.6387	245918.8192	241607.6019	230521.1026	266579.6411	245226.4462	465340.1748	280045.4746	1329221.822
Phenylacetylaspartic acid	2587661.838	2077839.219	778290.1989	235778.2633	243241.4723	2561584.433	181287.7401	188613.9505	150226.4159	364982.5776	336114.0979	410853.6337	350547.9549	462234.5972	363489.7529	4983714.203	4014070.418	5416230.801	3045610.117	1761630.265	2654021.364
Phloridzin 根皮苷	7930568.28	7221316.264	7707072.838	2008952.86	2208930.541	1594502.721	1699163.136	2006055.88	901010.6621	788799.878	958214.0994	359377.4683	316474.2582	318895.2837	293270.8358	325804.3	317826.6628	261323.1327	293988.1385	211027.5402	380085.9673
Pimelic acid	12332889.4	14956293.71	13026781.98	13257019.03	12664654.89	12301881.88	19173996.04	19948456.43	13868719.98	8472534.139	10667089.03	8074444.252	4499798.298	3713765.871	3216888.348	3259191.445	3432949.146	2018171.792	2460638.361	1719635.323	2189837.224
Pyruvic acid	187313468.6	190900224.7	186860193.4	189856660.3	168684289.5	186676096.2	185667107.7	191120427.0	180688217.2	186663165.2	189704683.9	184422806.9	261021155.2	211866394.9	263563663.1	314256237.2	356804668.1	421370011.8	301110450.9	154510434.6	296128166.6
Rhaponticin 土大黄苷	7824794.018	8105770.128	8667701.084	4299052.813	7019865.467	3261287.81	11260109.12	13696035.33	6143882.435	7490849.239	6735830.001	3142007.9	310916.0588	1142976.318	748618.035	497986.0981	331656.8794	304435.0773	476152.4212	928120.0648	751281.815
Riboflavin	4974303.464	7196510.617	7470889.348	6858513.907	7616455.413	8362580.659	984899.2526	1377305.47	5672799.877	712771.4147	750164.7442	1127722.265	527946.1455	624064.0612	313002.396	711457.5983	1245907.61	305675.3847	7738879.14	8830158.851	10617996.17
Salicylic acid	120129820.5	122406159.9	124413758.0	108922966.5	103729998.4	103470579.6	73039738.76	76799585.37	60138624.27	33974498.9	38120372.96	26758142.4	16262605.29	17131554.02	16324518.35	14147620.3	16020912.71	15899513.94	11833996.99	14270928.39	10799952.39
Salicylic alcohol	201893.0623	208718.5932	195525.9486	207577.5876	92844.72121	93089.59919	196760.9007	228010.2964	212181.1824	11370398.22	13784312.85	12731162.74	10516019.58	8053829.548	8205406.703	7130151.621	3546293.133	5438165.722	3892898.043	8440070.167	5804803.799
Salidroside 红景天苷	1785784.763	1431269.563	2074726.452	1397569.303	1806867.818	1034581.864	4881526.827	6268312.827	6836019.329	4092040.178	4405432.519	3550835.146	3692582.27	3627685.773	3877466.122	3899358.878	4029553.041	4008531.712	2860448.501	4102290.007	3507526.365
Scoparin	2002721.33	4438432.004	4079144.511	1373733.631	3951250.029	1581505.277	886522.102	2958376.527	3407167.225	8039781.886	5505287.028	7054153.135	3206909.686	2841330.709	2362808.457	3526282.994	2833500.302	2909172.374	2153388.856	4203837.73	4359453.634
Sec-O-Glucosylhamaudol 亥茅酚苷	1490553.163	1288369.338	392229.4227	6980730.222	2877295.18	5220542.893	14568303.19	18101759.81	11692570.68	8684279.101	8781727.638	4290049.653	3554426.208	3205862.005	3537880.717	2721842.471	2710944.589	3210031.547	2188021.932	2212900.824	1851543.864
Shikimic acid 莽草酸	12474611.84	15097725.72	20267494.99	61476484.87	67380166.38	60575856.91	55633325.7	29357496.66	65386696.14	48335153.69	35941315.0	48880886.59	22590656.62	22983172.84	25500589.87	24343683.81	23498044.56	21037886.24	6282606.491	24790057.25	19192165.17
Sibiricose A3	15258712.57	13412483.71	16438354.6	3355209.379	7040291.771	4791799.439	2427952.805	2774817.864	2257450.627	3589376.155	3256928.744	2977502.249	5237345.698	2751537.503	3621674.876	3670103.137	4045476.195	4379993.234	3753164.095	5526978.385	5969860.95
Stearic acid	1789112.512	1453842.968	1628591.287	920190.226	216915.1048	1029563.01	176998.3027	152073.3812	142140.4226	182081.9272	170804.9727	152317.9306	179901.3447	149813.6902	154356.3767	184608.8558	175640.8806	155233.9564	2666214.959	4000725.004	4163868.325
Steviolbioside 甜菊双糖苷	7773525.094	5074752.286	5732743.256	6527943.973	4270654.194	4669787.542	5105906.849	4375301.341	3221092.304	1798992.903	779256.7938	1163560.99	295847.4501	228662.6093	461216.852	451343.4313	337437.6702	342642.4979	2843759.604	3202470.886	2472546.685
Suberic acid	11442987.49	11201449.38	11317951.94	9483587.791	9367721.973	8860024.159	7501225.503	7577585.034	6191750.321	7649953.953	6608350.117	7949200.715	8865075.167	8351308.441	9390466.453	11747680.77	11177297.55	12032189.48	12122619.59	13520790.49	11045072.5
Taxifolin 二氢槲皮素	21625276.65	22236599.31	24726040.43	896045.193	806293.3813	533572.5806	1239399.706	1425836.469	491517.9765	370517.9435	341496.3493	268616.8161	209921.9633	218848.4126	283075.4416	262433.3443	246440.4945	219782.6436	410959.9303	270023.5936	240924.2694
Threonine	47398695.81	53031892.08	49966752.86	39490093.62	27053171.74	30021028.2	24150885.4	22345539.79	16362170.66	19367332.79	23506492.49	23125806.42	52703301.45	17690588.72	35628194.14	24373094.15	23221767.36	39802581.45	27501344.56	24991831.57	36146523.48
Thymidine	60465766.33	61573237.3	65369276.75	19491574.49	18051103.17	17432944.17	8221762.276	8194385.998	8541179.333	5133013.436	5547096.292	4593465.519	636055.6161	673789.0876	1191081.567	657530.3356	754720.637	646937.0058	1577893.131	1523865.12	1680467.799
Uric acid	27579203.53	28468473.83	25202672.43	405065.9959	817671.1193	519570.8572	274534.8216	273374.1277	285195.9582	338111.8671	572437.5164	351350.8377	619441.9031	510362.2265	568849.0919	582111.1917	514245.2244	657444.9843	887722.1564	671888.4555	652673.6712
Uridine 5'-diphosphogalactose	1940591.698	2187111.415	1528599.83	26868811.53	29702319.8	20218003.45	36077727.65	38518265.4	34869870.64	28372383.49	31556294.54	27718171.73	32327488.94	32475129.61	23174887.79	16920142.57	19820498.24	19389477.9	3835164.103	3950221.82	4059565.159
Uridine monophosphate (UMP)	19039273.18	14542997.72	17647510.86	26472917.51	34605133.38	31891621.92	98859038.14	71491181.16	100662445.7	70675907.19	70447324.26	71775837.7	16981421.16	26833479.38	22496642.74	10050161.0	16538824.88	13482044.19	73435495.97	79851763.0	94936050.56
Uridine-5'-monophosphate	23517250.98	22955423.63	11198948.73	24065628.98	27215487.73	25385459.31	54051089.12	47984316.86	51889067.06	35090723.01	33983380.57	48004110.58	8521348.365	13686218.43	12333579.75	5564046.732	7493952.687	7033579.738	53563555.67	58918044.5	67953693.13
Vanillic acid + O-sulfonateHex	582044.1463	650750.0689	581856.8983	752942.4169	529722.5879	509397.6599	743477.2978	781848.7254	510361.6384	8363179.533	4747148.774	6268861.591	7365593.697	7900943.836	6400932.595	4479168.779	6558168.888	3299304.531	10901142.7	4688457.988	6692484.38
Vanillin	6975618.984	5313545.657	4742259.914	1520652.846	4350710.359	4023006.83	9236083.634	2326862.267	5902849.957	29703954.88	28914788.59	20767828.9	30519657.52	18255335.59	10631806.36	22536126.05	19760776.78	18357082.37	12231317.42	26587513.7	24742764.97
Vitexin	4826962.884	4756660.398	5669076.125	4301594.513	6084871.632	5429098.386	4688638.116	5204803.807	4827220.848	7332110.481	7190574.903	5456693.273	1192658.901	6417499.352	3221566.796	9490444.68	996204.0802	1304957.967	1736359.291	2508733.885	1843634.579
Xanthine	8857366.999	7872574.492	11205694.36	175215.4064	448713.4692	298196.0624	111175.2988	109880.7197	95110.97381	167807.8602	141060.9701	131546.3113	236811.3072	204176.1468	209854.2184	339577.1555	319622.5763	281000.1938	286957.0846	318019.2969	286285.5944
Xanthosine	5062339.373	5932716.345	6087978.419	6756414.01	7517153.72	5581831.208	1862487.914	1316748.561	1322216.309	829730.0391	848704.6193	942773.3114	1096274.895	1056118.745	1206979.336	1012405.692	850459.8805	1001738.668	468219.8492	405025.3882	492504.694
[2-hydroxy-3-[hydroxy-[2,3,4,5,6-pentahydroxycyclohexyl]oxyphosphoryl]oxypropyl] octadecanoate	16307792.94	16980264.71	16206210.13	855860.7432	657433.9423	1658319.827	193902.2574	173341.6486	261698.102	169105.5387	163412.7297	170878.0724	161717.6567	170962.0212	185054.2665	197329.5446	321800.4193	305168.3356	1570294.846	1289970.935	1235872.238
[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-hydroxy-4,5-dimethoxybenzoate	10892250.02	10564409.57	9856790.164	5910947.729	7642306.954	7040759.554	2603448.975	3390344.0	2143401.596	999363.6634	1032367.648	1567166.054	1463917.797	1310542.628	1380309.48	1270967.887	974659.9148	944015.7383	230084.6524	924281.0974	501811.9028
alpha-D-Glucopyranosyl 2-O-(2-methylbutanoyl)-alpha-D-glucopyranoside	225987.5973	249353.5968	269682.3453	1200424.72	175199.8435	655539.6735	10535510.82	14696125.06	15357382.3	4884257.925	7004095.893	7611640.009	2394942.005	2824672.193	4235035.028	3979758.096	4084011.941	6181270.718	1289423.271	3341728.25	6954606.542
eriodictyol-7-O-glucoside	7872207.331	8264844.117	8678720.861	29025529.29	33785942.64	17499644.13	8328784.293	20721591.02	7636818.774	7446249.841	6819014.725	5340673.749	2687508.31	1845347.463	2084023.246	3724522.797	3555004.384	6423580.447	2040469.685	6761299.62	8247022.274
feruloyltyramine	139642676.5	137631826.0	148856658.4	2084080.091	1412637.208	4673800.424	1085581.914	970690.8763	662060.098	15343158.2	36853671.02	19129460.76	20031774.55	8419545.783	14039180.99	7904058.062	5556018.555	13524923.15	7666282.389	10587163.11	16241640.63
gamma-Glutamylleucine	634376254.0	671621106.7	641825750.5	30366547.35	5904099.837	29502880.8	606824.1591	689054.9786	1440398.45	1075553.526	843444.5547	949550.2023	818314.6482	674026.0301	663064.0323	1806764.464	1520595.102	1958105.338	166153402.0	135302990.8	109504686.2
gamma-Glutamylmethionine	57610273.71	58152880.03	54724360.42	1731787.72	1104526.888	1989009.167	76399.42432	74514.00227	69483.37787	71838.07693	68429.54249	69838.20449	98108.431	69140.72272	78764.17762	104006.6116	104412.0346	98186.17217	28233929.69	20399137.0	21056058.46
p-Coumaryl alcohol	1396739.903	821270.1788	858320.2239	139612.9285	143853.9109	126955.4689	140144.1737	138010.8254	155003.597	2023163.046	1490487.356	2510988.034	2478151.666	5153305.046	2997564.65	1833329.122	4006805.436	2116769.244	2157100.204	1198580.924	1158435.1
{(1R,2R)-2-[(2Z)-5-(Hexopyranosyloxy)-2-penten-1-yl]-3-oxocyclopentyl}acetic acid	156168955.9	170151014.9	178888277.9	29981565.18	35660316.56	38844247.06	15335034.4	17816395.09	27199557.97	12057769.87	15904609.7	16175747.99	4532575.075	16264346.44	17489648.39	6870734.131	28731171.78	10425620.07	6634873.996	17032613.13	7667502.089
α,α-Trehalose	11236216.47	10477473.88	11009530.33	124807735.6	139502447.5	122303270.4	313351596.0	347080105.5	252909686.5	341095595.7	276272148.1	582469631.6	1853917316.0	1641910869.0	1653810423.0	998147063.6	873889645.3	837885528.6	99518590.26	49725974.57	77037060.74
β-D-Glucopyranuronic acid	41126233.15	44348737.35	45571951.16	78773188.59	80804892.41	68820410.43	160398666.2	145163555.9	134006345.3	76893297.23	80752714.36	67526996.53	54520152.14	60048959.98	66733794.23	87564638.32	67423804.75	84831560.91	91827496.16	113558426.0	88873855.88
δ-Ribono-1,4-lactone	275939291.1	274790991.5	259940989.3	384433143.3	426529249.5	408782312.0	184648172.4	220986008.3	122144542.2	88043133.42	88411533.68	70151845.5	45780215.95	54499624.76	60603123.23	64188721.76	57668287.91	58385233.94	78978897.37	66021213.36	68676782.76