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Metabolite ID	External annotation	Deionized mass	Average m/z	Average RT	Adduct	Associated genes (overlap)	Associated genes (±5 kb)
P31215		966.3362672	967.3449331	16.26288457	[M+H]+	180	719
P37602	(6R)-9,10-Dihydroxy-4,7-megastigmadien-3-one-9-O-beta-D-glucopyranoside	386.1921813	387.2002426	18.69828061	[M+H]+	180	689
P41095		423.357544	424.3622389	20.55560882	[M+H]+	180	716
P49211	Bamifylline	385.2106005	386.2172802	25.93153781	[M+H]+	180	727
P06876	Lembyne A	342.002112	343.0076201	9.209359247	[M+H]+	179	640
P14986	N-(2-hydroxyhexadecanoyl)-sphinganine	555.5216623	556.5295661	11.90482628	[M+H]+	179	798
P21946		999.3355508	1000.337134	13.73809899	[M+H]+	179	632
P23960	Upunaphenol N	934.2722979	935.2841911	14.27450149	[M+H]+	179	665
P29027	Bazzanin J	492.085533	493.0948661	15.66957057	[M+H]+	179	721
P35945		475.1092784	476.1172127	17.96118317	[M+H]+	179	688
P43147	Avermectin A2b monosaccharide	746.4252033	747.4310256	21.86791976	[M+H]+	179	694
P43543	26-O-beta-D-glucopyranosyl-(25R)-furost-5,16(17),20(22)-trien-3beta,26-diol-3-O-alpha-l-rhamnopyranosyl-(1-2)-beta-D-glucopyranoside	882.4555421	883.4653122	22.12486341	[M+H]+	179	656
P43704	3'''-O-Methylfukugetin	570.1129065	571.1194488	22.24293572	[M+H]+	179	710
P53747	Methyl ent-16-methoxy-6-oxo-7,13E-labdadien-15-oate	362.2443033	363.2517185	30.30402966	[M+H]+	179	718
P02880		183.5442744	184.5518883	5.976014752	[M+H]+	178	658
P07726	Tolmetin glucuronide	433.1375017	434.1438747	9.531752553	[M+H]+	178	680
P08737	3-Isopentadienyl-3',4,5'-trihydroxystilbene	294.1272747	295.1337423	9.905731464	[M+H]+	178	686
P14990	Enkephalin L	555.2689442	556.2763976	11.90641966	[M+H]+	178	752
P15582		853.3764098	854.3853847	12.04051302	[M+H]+	178	673
P18621	(4Z,6Z)-Octa-4,6-dienoylcarnitine	283.175742	284.183728	12.80260979	[M+H]+	178	708
P22470	Lithospermoside	329.1093629	330.1173829	13.86862097	[M+H]+	178	676
P23442	S-(N-Hydroxy-N-methylcarbamoyl)glutathione	380.0974684	381.1025892	14.13048637	[M+H]+	178	725
P23530	S-Isopropyl 3-methylbut-2-enethioate	158.0766739	159.0842979	14.1500385	[M+H]+	178	687
P32974		499.7155216	500.7233449	16.86354041	[M+H]+	178	664
P33573	Torokonine	449.2233896	450.2276293	17.06002874	[M+H]+	178	730
P37745	Altromycin I	693.2713624	694.2799039	18.76312346	[M+H]+	178	730
P48147	2-Isopropylfuran	110.0727566	111.0801036	25.10224299	[M+H]+	178	691
P13948	O-Desmethyl Gefitinib	432.1359468	433.1430088	11.61396214	[M+H]+	177	725
P18650	U 77803	806.2183438	807.2228479	12.81560217	[M+H]+	177	731
P26580		475.674076	476.678165	15.01144961	[M+H]+	177	694
P28501		433.2604808	434.2678693	15.51755534	[M+H]+	177	698
P28558		400.6988198	401.706836	15.52914921	[M+H]+	177	673
P29734	Stemphyloxin I	382.233257	383.2391747	15.85473844	[M+H]+	177	728
P30823		181.0450059	182.0523309	16.14429001	[M+H]+	177	673
P38200	4-(2-Chlorophenoxy)-N-[3-(methylcarbamoyl)phenyl]piperidine-1-carboxamide	387.1343695	388.1406319	18.91118632	[M+H]+	177	690
P39722	Pellynol H	510.3656563	511.3732278	19.71047589	[M+H]+	177	701
P43007		407.3600048	408.3681479	21.76562576	[M+H]+	177	670
P43793	Acetyl-alpha-methylfentanyl	336.2199727	337.2267775	22.26957036	[M+H]+	177	703
P45177	Fargoside D	778.4080693	779.4154081	23.07698736	[M+H]+	177	712
P05243	5'-Deoxy-5'-fluoroadenosine	269.0921132	270.0999416	8.669097715	[M+H]+	176	755
P12304	Amrubicin	483.1476203	484.1511659	11.05783143	[M+H]+	176	707
P17789	Kaempferol 3-neohesperidoside-7-(6''-malonylglucoside)	872.22633	873.2325335	12.62526059	[M+H]+	176	727
P20561		669.1600632	670.1661723	13.33530156	[M+H]+	176	662
P29540	Kadsuphilol L	606.2044363	607.2073199	15.81666656	[M+H]+	176	630
P29563	Sulfocostunolide A	312.1036447	313.1115941	15.82051351	[M+H]+	176	695
P29935	Acantrifoside A	942.5143404	943.5247684	15.90651389	[M+H]+	176	718
P36283	Isopropyl dodecylfluorophosphonate	294.2113339	295.2184606	18.06776266	[M+H]+	176	649
P38088		365.6483104	366.6560923	18.86494475	[M+H]+	176	743
P00499	1-Pentanesulfonic acid	152.0504436	153.0568725	3.4154939	[M+H]+	175	678
P32791	Tenuecyclamide A	460.099607	461.1056307	16.80241268	[M+H]+	175	687