--- a
+++ b/4-Multi-Omic Integration/datasets/cmpd2metabo.txt
@@ -0,0 +1,1116 @@
+Metabolome	MetaCyc_compounds
+C00009	PHOSPHONATE
+C00009	Pi
+C00015	UDP
+C00016	FAD
+C00016	FADH2
+C00020	AMP
+C00022	PYRUVATE
+C00025	D-GLT
+C00025	GLT
+C00026	2-KETOGLUTARATE
+C00031	ALPHA-D-GALACTOSE
+C00031	ALPHA-GLUCOSE
+C00031	CPD0-1107
+C00031	CPD0-1112
+C00031	CPD-10329
+C00031	CPD-12601
+C00031	CPD-13559
+C00031	GALACTOSE
+C00031	GLC
+C00041	D-ALANINE
+C00041	L-ALPHA-ALANINE
+C00042	SUC
+C00047	LYS
+C00051	GLUTATHIONE
+C00055	CMP
+C00059	SULFATE
+C00062	ARG
+C00063	CTP
+C00064	GLN
+C00068	THIAMINE-PYROPHOSPHATE
+C00072	ASCORBATE
+C00073	MET
+C00077	CPD-217
+C00077	L-ORNITHINE
+C00078	D-TRYPTOPHAN
+C00078	TRP
+C00079	PHE
+C00082	D-TYROSINE
+C00082	TYR
+C00085	CPD-15826
+C00089	SUCROSE
+C00104	IDP
+C00105	UMP
+C00106	URACIL
+C00109	2-KETO-ISOVALERATE
+C00109	2-OXOBUTANOATE
+C00114	CHOLINE
+C00120	BIOTIN
+C00121	CPD0-1108
+C00121	CPD-10330
+C00121	CPD-12045
+C00122	FUM
+C00122	MALEATE
+C00123	ILE
+C00123	L-2-AMINOPENTANOIC-ACID
+C00123	LEU
+C00127	OXIDIZED-GLUTATHIONE
+C00128	CMP-N-ACETYL-NEURAMINATE
+C00129	DELTA3-ISOPENTENYL-PP
+C00135	HIS
+C00140	CPD-12541
+C00140	CPD-13462
+C00140	N-ACETYL-D-GLUCOSAMINE
+C00140	N-ACETYL-D-MANNOSAMINE
+C00143	METHYLENE-THF
+C00146	PHENOL
+C00147	ADENINE
+C00148	D-PROLINE
+C00148	PRO
+C00153	NIACINAMIDE
+C00155	HOMO-CYS
+C00156	4-hydroxybenzoate
+C00158	CIT
+C00158	CPD-618
+C00158	CPD-622
+C00158	THREO-DS-ISO-CITRATE
+C00166	PHENYL-PYRUVATE
+C00170	5-METHYLTHIOADENOSINE
+C00178	THYMINE
+C00179	AGMATHINE
+C00180	BENZOATE
+C00182	CPD-13375
+C00182	CPD-13376
+C00182	CPD-13378
+C00183	VAL
+C00184	DIHYDROXYACETONE
+C00185	CPD-9052
+C00187	CHOLESTEROL
+C00193	BENZALDEHYDE
+C00202	DIISOPROPYL-FLUOROPHOSPHATE
+C00207	ACETONE
+C00209	OXALATE
+C00212	ADENOSINE
+C00214	THYMIDINE
+C00219	ARACHIDONIC_ACID
+C00223	P-COUMAROYL-COA
+C00224	APS
+C00233	2K-4CH3-PENTANOATE
+C00233	2-KETO-3-METHYL-VALERATE
+C00233	CPD-3618
+C00234	10-FORMYL-THF
+C00242	GUANINE
+C00245	TAURINE
+C00246	BUTYRIC_ACID
+C00248	LIPOAMIDE
+C00249	ARACHIDIC_ACID
+C00249	CPD-15179
+C00249	CPD-195
+C00249	CPD-3617
+C00249	CPD-7836
+C00249	DODECANOATE
+C00249	PALMITATE
+C00249	STEARIC_ACID
+C00253	NIACINE
+C00257	CPD0-1083
+C00257	CPD-15127
+C00257	CPD-15530
+C00257	CPD-15633
+C00257	D-ALTRONATE
+C00257	D-GLUCARATE
+C00257	D-MANNONATE
+C00257	GLUCONATE
+C00257	L-GULONATE
+C00257	L-IDONATE
+C00262	HYPOXANTHINE
+C00279	ERYTHROSE-4P
+C00280	ANDROST4ENE
+C00280	CPD-13794
+C00280	CPD-323
+C00280	PROGESTERONE
+C00292	ANILINE
+C00294	INOSINE
+C00295	OROTATE
+C00299	URIDINE
+C00300	CREATINE
+C00300	GUANIDOACETIC_ACID
+C00307	CDP-CHOLINE
+C00314	PYRIDOXINE
+C00317	CPD-13375
+C00317	CPD-13376
+C00317	CPD-13378
+C00318	CARNITINE
+C00318	D-CARNITINE
+C00319	SPHINGOSINE
+C00323	CAFFEOYL-COA
+C00328	CPD-14736
+C00345	CPD-15980
+C00345	CPD-15984
+C00345	CPD-2961
+C00345	CPD-9755
+C00345	D-ALLOSE-6-PHOSPHATE
+C00352	CPD-13469
+C00353	ALL-TRANS-HEPTAPRENYL-DIPHOSPHATE
+C00353	CPD-12461
+C00353	CPD-9444
+C00353	FARNESYL-PP
+C00353	GERANYLGERANYL-PP
+C00353	OCTAPRENYL-DIPHOSPHATE
+C00353	UNDECAPRENYL-DIPHOSPHATE
+C00355	L-DIHYDROXY-PHENYLALANINE
+C00357	CPD-16167
+C00357	CPD-16168
+C00357	N-ACETYL-D-MANNOSAMINE-6P
+C00362	DGMP
+C00365	DUMP
+C00366	URATE
+C00371	CPD-4210
+C00371	CPD-4441
+C00376	RETINAL
+C00378	THIAMINE
+C00385	XANTHINE
+C00386	CARNOSINE
+C00387	GUANOSINE
+C00389	CPD-520
+C00390	CPD-9955
+C00390	CPD-9956
+C00390	CPD-9957
+C00390	CPD-9958
+C00390	QH2
+C00390	UBIQUINOL-30
+C00392	CPD-369
+C00392	MANNITOL
+C00392	SORBITOL
+C00397	CPD-14154
+C00399	CPD0-1118
+C00399	UBIQUINONE-2
+C00400	--MENTHOL
+C00407	ILE
+C00407	L-2-AMINOPENTANOIC-ACID
+C00407	LEU
+C00408	L-PIPECOLATE
+C00413	STREPTOMYCIN
+C00415	DIHYDROFOLATE
+C00417	CIS-ACONITATE
+C00417	CPD-1136
+C00417	CPD-9421
+C00423	CPD-674
+C00427	PROSTAGLANDIN-H2
+C00430	5-AMINO-LEVULINATE
+C00437	N-ALPHA-ACETYLORNITHINE
+C00439	N-FORMIMINO-L-GLUTAMATE
+C00440	5-METHYL-THF
+C00440	THF
+C00441	L-ASPARTATE-SEMIALDEHYDE
+C00448	ALL-TRANS-HEPTAPRENYL-DIPHOSPHATE
+C00448	CPD-12461
+C00448	CPD-9444
+C00448	FARNESYL-PP
+C00448	GERANYLGERANYL-PP
+C00448	OCTAPRENYL-DIPHOSPHATE
+C00448	UNDECAPRENYL-DIPHOSPHATE
+C00463	INDOLE
+C00468	ESTRONE
+C00473	CPD-13524
+C00475	CYTIDINE
+C00482	SINAPATE
+C00486	BILIRUBIN
+C00489	GLUTARATE
+C00491	CYSTINE
+C00500	BILIVERDINE
+C00502	D-XYLONATE
+C00504	CPD-12826
+C00506	L-CYSTEATE
+C00507	ALPHA-D-GALACTOSE
+C00507	ALPHA-GLUCOSE
+C00507	CPD0-1107
+C00507	CPD0-1112
+C00507	CPD-10329
+C00507	CPD-12601
+C00507	CPD-13559
+C00507	GALACTOSE
+C00507	GLC
+C00510	CPD-10269
+C00510	CPD-14269
+C00510	CPD-17313
+C00510	CPD-17370
+C00510	CPD-17624
+C00510	CPD-18346
+C00510	CPD-19144
+C00510	CPD-19147
+C00510	OLEOYL-COA
+C00517	CPD-55
+C00517	PALMITALDEHYDE
+C00523	17-BETA-HYDROXY-5ALPHA-ANDROSTAN-3-O
+C00523	ANDROSTERONE
+C00526	DEOXYURIDINE
+C00535	TESTOSTERONE
+C00542	CPD0-1563
+C00542	L-CYSTATHIONINE
+C00544	HOMOGENTISATE
+C00555	4-AMINO-BUTYRALDEHYDE
+C00556	BENZYL-ALCOHOL
+C00559	DEOXYADENOSINE
+C00579	DIHYDROLIPOAMIDE
+C00580	CPD-7670
+C00590	CONIFERYL-ALCOHOL
+C00593	SULFOACETALDEHYDE
+C00596	OXOPENTENOATE
+C00599	ANDROST4ENE
+C00599	CPD-13794
+C00599	CPD-323
+C00599	PROGESTERONE
+C00601	PHENYLACETALDEHYDE
+C00606	3-SULFINOALANINE
+C00611	BETA-D-GALACTOSYL-ETCETERA-GLUCOSAMINE
+C00611	CPD-16181
+C00637	INDOLE_ACETALDEHYDE
+C00639	5Z13E-15S-9-ALPHA11-ALPHA15-TRIHY
+C00642	4-HYDROXYPHENYLACETATE
+C00666	LL-DIAMINOPIMELATE
+C00666	MESO-DIAMINOPIMELATE
+C00669	L-GAMMA-GLUTAMYLCYSTEINE
+C00695	CHOLATE
+C00695	CPD-15189
+C00700	XTP
+C00712	OLEATE-CPD
+C00729	TROPINE
+C00735	CORTISOL
+C00741	DIACETYL
+C00745	NICOTINE
+C00750	SPERMIDINE
+C00750	SPERMINE
+C00755	VANILLIN
+C00758	BERGAPTOL
+C00761	CPD-1777
+C00762	CORTISONE
+C00762	CPD-286
+C00777	RETINOATE
+C00780	SEROTONIN
+C00783	TROPINONE
+C00785	UROCANATE
+C00788	L-EPINEPHRINE
+C00789	CPD-1111
+C00791	CREATININE
+C00796	DICOUMAROL
+C00803	CPD-17493
+C00803	VALERATE
+C00822	DOPAQUINONE
+C00826	CPD-659
+C00828	CPD-9724
+C00829	NAPHTHALENE
+C00831	CPD-511
+C00832	CPD-14177
+C00835	CPD-374
+C00836	CPD-13612
+C00842	CPD-344
+C00842	DTDP-D-GLUCOSE
+C00842	DTDP-RHAMNOSE
+C00843	CPD-1909
+C00854	CYCLOHEXANOL
+C00854	HEXANOL-CMPD
+C00859	CPD1F-139
+C00870	P-NITROPHENOL
+C00872	AMINOMALONATE
+C00884	CPD-12185
+C00903	CINNAMALDEHYDE
+C00906	DIHYDRO-THYMINE
+C00909	CPD-8892
+C00913	3-Methyl-Adenines
+C00918	CHLORAMPHENICOL
+C00921	7-8-DIHYDROPTEROATE
+C00931	PORPHOBILINOGEN
+C00933	O-SINAPOYLCHOLINE
+C00942	CGMP
+C00951	CPD-352
+C00954	INDOLE_ACETATE_AUXIN
+C00955	CPD-341
+C00956	CPD-468
+C00971	CPD-375
+C00978	N-ACETYL-SEROTONIN
+C00988	CPD-67
+C00993	D-ALA-D-ALA
+C01004	METHYLNICOTINATE
+C01005	3-P-SERINE
+C01007	CPD-316
+C01020	6-HYDROXY-NICOTINATE
+C01028	CPD-265
+C01037	DIAMINONONANOATE
+C01045	CPD-600
+C01051	UROPORPHYRINOGEN-III
+C01054	EPOXYSQUALENE
+C01059	2-5-DIHYDROXYPYRIDINE
+C01068	CPD-372
+C01069	BENZYL-DESULFOGLUCOSINOLATE
+C01079	PROTOPORPHYRINOGEN
+C01081	THIAMINE-P
+C01092	8-AMINO-7-OXONONANOATE
+C01100	L-HISTIDINOL-P
+C01126	2-TRANS6-TRANS-FARNESOL
+C01134	PANTETHEINE-P
+C01136	S-ACETYLDIHYDROLIPOAMIDE
+C01143	CPD-641
+C01152	CPD-1823
+C01169	CPD0-341
+C01175	1-O-SINAPOYL-BETA-D-GLUCOSE
+C01176	17-ALPHA-HYDROXYPROGESTERONE
+C01179	P-HYDROXY-PHENYLPYRUVATE
+C01204	CPD-6741
+C01204	MI-HEXAKISPHOSPHATE
+C01218	CPD-339
+C01226	CPD-729
+C01227	3-BETA-HYDROXYANDROST-5-EN-17-ONE
+C01230	ALL-TRANS-HEPTAPRENYL-DIPHOSPHATE
+C01230	ALL-TRANS-HEXAPRENYL-DIPHOSPHATE
+C01230	CPD-12461
+C01230	CPD-9444
+C01230	FARNESYL-PP
+C01230	GERANYLGERANYL-PP
+C01230	OCTAPRENYL-DIPHOSPHATE
+C01230	UNDECAPRENYL-DIPHOSPHATE
+C01234	CPD-68
+C01239	N-ACETYL-BETA-GLUCOSAMINYLAMINE
+C01249	CPD-274
+C01251	HOMO-CIT
+C01268	CPD-602
+C01301	3-ALPHA7-ALPHA12-ALPHA-TRIHYDROX
+C01304	DIAMINO-OH-PHOSPHORIBOSYLAMINO-PYR
+C01312	5Z13E-15S-69-ALPHA-EPOXY-11-ALPHA
+C01375	CPD-10016
+C01389	PHYTOL
+C01390	PRENOL
+C01407	BENZENE
+C01412	BUTANAL
+C01412	CPD-7031
+C01433	LOGANIN
+C01451	CPD-1142
+C01453	CPD-10887
+C01455	TOLUENE
+C01477	CPD-431
+C01484	CHALCONE-CMPD
+C01495	CPD-3261
+C01516	MORPHINE
+C01530	ARACHIDIC_ACID
+C01530	CPD-15179
+C01530	CPD-195
+C01530	CPD-3617
+C01530	CPD-7836
+C01530	DODECANOATE
+C01530	PALMITATE
+C01530	STEARIC_ACID
+C01531	CPD0-2556
+C01541	CPD-20636
+C01545	CPD-371
+C01545	CPD-55
+C01545	PALMITALDEHYDE
+C01546	2-FUROATE
+C01551	R--ALLANTOIN
+C01551	S-ALLANTOIN
+C01561	CALCIDIOL
+C01571	ARACHIDIC_ACID
+C01571	CPD-15179
+C01571	CPD-195
+C01571	CPD-3617
+C01571	CPD-7836
+C01571	DODECANOATE
+C01571	PALMITATE
+C01571	STEARIC_ACID
+C01575	--EPHEDRINE
+C01585	HEXANOATE
+C01595	CPD-8120
+C01595	LINOLEIC_ACID
+C01598	N-ACETYL-5-METHOXY-TRYPTAMINE
+C01601	ARACHIDIC_ACID
+C01601	CPD-15179
+C01601	CPD-195
+C01601	CPD-3617
+C01601	CPD-7836
+C01601	CPD-8505
+C01601	DODECANOATE
+C01601	PALMITATE
+C01601	STEARIC_ACID
+C01606	PHTHALATE
+C01613	6-KESTOSE
+C01613	BIFURCOSE
+C01613	CPD-1099
+C01613	CPD-170
+C01613	CPD-9550
+C01620	L-THREONATE
+C01630	CPD-13037
+C01661	CPD-13973
+C01682	CPD-308
+C01699	GIBBERELLIN
+C01701	CPD-4405
+C01727	CPD-605
+C01737	CPD-14142
+C01746	PIPERIDINE
+C01747	PSYCHOSINE
+C01752	SCOPOLETIN
+C01753	CPD-4143
+C01762	XANTHOSINE
+C01767	CPD-1089
+C01789	CPD-707
+C01789	CPD-8134
+C01801	2-DEOXYRIBOSE
+C01817	HOMOCYSTINE
+C01822	CPD-4821
+C01838	CPD-55
+C01838	PALMITALDEHYDE
+C01847	FMN
+C01847	FMNH2
+C01850	CPD-6981
+C01851	SCOPOLAMINE
+C01852	SECOLOGANIN-CPD
+C01875	2-UNDECANONE
+C01875	CPD-55
+C01875	PALMITALDEHYDE
+C01877	4-OXOPROLINE
+C01892	ASPARAGUSATE
+C01893	CPD-574
+C01909	DETHIOBIOTIN
+C01921	GLYCOCHOLIC_ACID
+C01924	HOMOARGININE
+C01936	ALPHA-MALTOSE
+C01936	CPD-13556
+C01936	CPD-14017
+C01936	CPD-221
+C01936	MALTOHEXAOSE
+C01936	MALTOPENTAOSE
+C01936	MALTOTETRAOSE
+C01936	MALTOTRIOSE
+C01948	CPD-388
+C01948	CPD-55
+C01948	PALMITALDEHYDE
+C01956	PYRAZINAMIDE
+C01965	CPD0-1581
+C02010	BLASTICIDIN-S
+C02029	CPD-332
+C02035	CPD1F-140
+C02041	CPD-10267
+C02041	CPD-10505
+C02041	CPD-10588
+C02041	CPD-14675
+C02041	CPD-17621
+C02041	CPD-17638
+C02041	CPD-17641
+C02041	CPD-196
+C02041	CPD-21416
+C02041	CPD-558
+C02041	CPD-71
+C02041	CPD-72
+C02041	CPD-9965
+C02041	HEXANOYL-COA
+C02041	LAUROYLCOA-CPD
+C02041	PALMITYL-COA
+C02041	STEAROYL-COA
+C02105	S-RETICULINE
+C02140	CORTICOSTERONE
+C02155	CPD-12312
+C02161	ISOPHENOXAZINE
+C02166	LEUKOTRIENE-C4
+C02220	2-AMINO-MUCONATE
+C02230	CPD-13319
+C02267	CPD-11928
+C02278	CPD-55
+C02278	CPD-7880
+C02278	PALMITALDEHYDE
+C02284	GLYCYRRHIZINATE
+C02294	CPD-593
+C02325	SINAPYL-ALCOHOL
+C02355	CPD-3725
+C02367	3-OXODODECANOATE
+C02367	CPD-19849
+C02367	CPD-19859
+C02367	CPD-19860
+C02367	CPD-19861
+C02445	CPD-9284
+C02445	NONANE-46-DIONE
+C02477	ALPHA-TOCOPHEROL
+C02502	2-HYDROXYPYRIDINE
+C02505	CPD-238
+C02513	CPD-331
+C02528	CHOLATE
+C02528	CPD-15189
+C02567	CPD-568
+C02567	N1-ACETYLSPERMINE
+C02571	O-ACETYLCARNITINE
+C02593	CPD-10267
+C02593	CPD-10505
+C02593	CPD-10588
+C02593	CPD-14675
+C02593	CPD-17621
+C02593	CPD-17638
+C02593	CPD-17641
+C02593	CPD-196
+C02593	CPD-21416
+C02593	CPD-558
+C02593	CPD-71
+C02593	CPD-72
+C02593	HEXANOYL-COA
+C02593	LAUROYLCOA-CPD
+C02593	PALMITYL-COA
+C02593	STEAROYL-COA
+C02593	TETRADECANOYL-COA
+C02631	CPD-9451
+C02633	CPD-276
+C02659	2-HYDROXY-2-METHYLPROPANENITRILE
+C02678	ARACHIDIC_ACID
+C02678	CPD-10670
+C02678	CPD-15179
+C02678	CPD-195
+C02678	CPD-3617
+C02678	CPD-7836
+C02678	DODECANOATE
+C02678	PALMITATE
+C02678	STEARIC_ACID
+C02679	ARACHIDIC_ACID
+C02679	CPD-15179
+C02679	CPD-195
+C02679	CPD-3617
+C02679	CPD-7836
+C02679	DODECANOATE
+C02679	PALMITATE
+C02679	STEARIC_ACID
+C02712	CPD0-2015
+C02717	CPD-440
+C02728	CPD-304
+C02740	PHOTINUS-LUCIFERIN
+C02744	CPD-518
+C02838	L-OCTANOYLCARNITINE
+C02892	CPD-7101
+C02918	CPD-396
+C02924	23-DIMERCAPTOPROPAN-1-OL
+C02947	CPD-412
+C02975	ETHYL-3-OXOHEXANOATE
+C02993	CPD-210
+C03002	CPD-411
+C03087	5-ACETAMIDOVALERATE
+C03149	CPD-12603
+C03248	CPD-1831
+C03309	STRICTOSIDINE-AGLYCONE
+C03340	2-3-DIHYDRODIPICOLINATE
+C03343	2-ETHYLHEXYL-PHTHALATE
+C03401	L-23-DIAMINOPROPANOATE
+C03404	L-TYROSINE-METHYL-ESTER
+C03406	L-ARGININO-SUCCINATE
+C03410	CPD-273
+C03413	CPD-11268
+C03413	CPD-568
+C03413	N1-ACETYLSPERMINE
+C03427	CPD-464
+C03434	TETRACHLOROHYDROQUINONE
+C03451	S-LACTOYL-GLUTATHIONE
+C03492	4-P-PANTOTHENATE
+C03516	MG-PROTOPORPHYRIN
+C03527	OXIDIZED-LATIA-LUCIFERIN
+C03539	CPD-564
+C03577	20-HYDROXY-LEUKOTRIENE-E4
+C03577	7E9E11Z14Z-5S6R-6-CYSTEIN-S-YL
+C03582	CPD-83
+C03594	CPD-266
+C03677	421-DEHYDROGEISSOSCHIZINE
+C03683	6-DEMETHYLSTERIGMATOCYSTIN
+C03722	QUINOLINATE
+C03935	CPD-1077
+C03955	CPD-961
+C03975	2-AMINO-47-DIHYDROXYPTERIDINE
+C03990	CPD-7235
+C04015	CPD-414
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+HMDB0007861	CPD-17373
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+HMDB0031513	CPD-19858
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+HMDB0033369	CPD-13556
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+HMDB0033369	CPD-221
+HMDB0033369	MALTOHEXAOSE
+HMDB0033369	MALTOPENTAOSE
+HMDB0033369	MALTOTETRAOSE
+HMDB0033369	MALTOTRIOSE
+HMDB0033567	CPD-3921
+HMDB0033679	CPD-7843
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