Metabolite_name	RefMet_name	PBS-1	PBS-2	PBS-3	pABA-1	pABA-2	pABA-3
Factors	-	Treatment:-	Treatment:-	Treatment:-	Treatment:pABA (1 mg/ml)	Treatment:pABA (1 mg/ml)	Treatment:pABA (1 mg/ml)
1-Aminocyclopropanecarboxylic acid	1-Aminocyclopropanecarboxylic acid	0.0003	0.0005	0.0004			
2_6-diaminopimelic acid	2,6-Diaminopimelic acid	0.0011	0.0011	0.0011	0.0008	0.0007	0.0008
2-Carboxybenzaldehyde		0.0003	0.0004	0.0003	0.0005	0.0003	0.0002
2-Hydroxyisobutyric acid	2-Hydroxyisobutyric acid	0.0005	0.0004	0.0006	0.0007	0.0016	0.0008
2-Isopropylmalic acid	2-Isopropylmalic acid					0.0006	
2-(Methylamino)benzoic acid	2-(Methylamino)benzoic acid					0.0011	0.0004
2-Phosphoglyceric acid	2-Phosphoglyceric acid	0.0009	0.0007	0.0008	0.0015	0.0016	0.0011
3-Acetylacrylic acid						0.0003	0.0001
3-Hydroxymethylglutaric acid	3-Hydroxymethylglutaric acid				0.0003	0.0068	0.0003
3-Phosphoglyceric acid	3-Phosphoglyceric acid	0.0011	0.0011	0.0011	0.0052	0.0047	0.0035
5-hydroxylysine	5-Hydroxylysine	0.0008	0.0007	0.0006	0.0003	0.0003	0.0005
5^-Methylthioadenosine	5'-Methylthioadenosine	0.0017	0.0011	0.0015	0.0005	0.0005	0.0008
5-Oxo-2-tetrahydrofurancarboxylic acid						0.0005	
5-Oxohexanoic acid	5-Ketocaproic acid	0.0026	0.0030	0.0030	0.0045	0.0162	0.0031
5-Oxoproline	Pyroglutamic acid	0.0020	0.0014	0.0016	0.0012	0.0017	0.0009
Acetyl CoA_divalent	Acetyl-CoA	0.0004	0.0004	0.0003	0.0004	0.0005	0.0002
Adenine	Adenine	0.0021	0.0015	0.0014	0.0009	0.0012	0.0013
Adenosine	Adenosine	0.0034	0.0037	0.0042	0.0006	0.0005	0.0005
Adipic acid	Adipic acid	0.0002	0.0002		0.0002	0.0011	
ADP	ADP	0.0014	0.0013	0.0015	0.0015	0.0015	0.0012
ADP-glucose/GDP-fucose		0.0013	0.0010	0.0011	0.0013	0.0015	0.0012
ADP-ribose	ADP-ribose	0.0016	0.0010	0.0011	0.0004	0.0006	0.0007
Agmatine	Agmatine	0.0024	0.0006	0.0010			
Ala-Ala	Ala-Ala	0.0022	0.0029	0.0035	0.0024	0.0025	0.0026
Alanine	Alanine	0.0368	0.0274	0.0376	0.0096	0.0088	0.0078
AMP	AMP	0.0048	0.0035	0.0037	0.0048	0.0051	0.0051
Arginine	Arginine	0.0155	0.0141	0.0151	0.0087	0.0109	0.0134
Asparagine	Asparagine	0.0045	0.0035	0.0039	0.0018	0.0015	0.0017
Aspartic acid	Aspartic acid	0.0081	0.0031	0.0036	0.0024	0.0025	0.0023
Azelaic acid	Azelaic acid	0.0011	0.0004	0.0003	0.0004	0.0007	0.0005
Benzoic acid	Benzoic acid	0.0090	0.0082	0.0081	0.0116	0.0141	0.0092
beta-hydroxybutyric acid	3-Hydroxybutyric acid	0.0009	0.0007	0.0009	0.0009	0.0023	0.0010
Biotin	Biotin					0.0022	
Butyric acid	Butyric acid	0.0058	0.0028	0.0040	0.0010	0.0020	0.0055
Capric acid	Capric acid	0.0134	0.0106	0.0118	0.0075	0.0103	0.0136
Caproic acid	Caproic acid	0.0094	0.0064	0.0073	0.0027	0.0055	0.0099
Caprylic acid	Caprylic acid	0.0068	0.0052	0.0060	0.0032	0.0051	0.0068
Carboxymethyllysine	N(6)-Carboxymethyl-lysine	0.0027	0.0028	0.0027	0.0015	0.0015	0.0014
Choline	Choline	0.0144	0.0115	0.0115	0.0007	0.0009	0.0009
Citraconic acid	Citraconic acid	0.0012	0.0008	0.0007	0.0012	0.0018	0.0015
Citramalic acid	Citramalic acid	0.0009	0.0006	0.0007	0.0010	0.0089	0.0012
Citrulline	Citrulline	0.0090	0.0083	0.0117	0.0058	0.0043	0.0052
CMP	CMP	0.0004	0.0002	0.0002	0.0004	0.0005	0.0005
CoA_divalent	Coenzyme A				0.0019	0.0005	0.0002
Creatine	Creatine	0.0002					
Creatinine	Creatinine	0.0002					
Cyclohexanecarboxylic acid	Cyclohexanecarboxylic acid	0.0001	0.0002	0.0002	0.0001	0.0002	0.0003
Cyclohexylamine	Cyclohexylamine	0.0002	0.0003	0.0002	0.0006	0.0004	
Cytosine	Cytosine	0.0002	0.0002	0.0002	0.0004	0.0003	0.0003
dAMP	dAMP	0.0004	0.0003	0.0004	0.0032	0.0035	0.0036
dCMP	dCMP	0.0002	0.0002	0.0002	0.0032	0.0036	0.0037
Deoxyadenosine/5^-Deoxyadenosine	Deoxyadenosine				0.0006	0.0005	0.0005
Deoxyguanosine	Deoxyguanosine				0.0014	0.0007	0.0012
Diethanolamine	Diethanolamine	0.0025	0.0034	0.0023	0.0020	0.0018	0.0030
DL-2-hydroxy valeric acid	2-Hydroxyvaleric acid	0.0011	0.0009	0.0009	0.0008	0.0010	0.0012
dTDP	dTDP		0.0002	0.0002	0.0003	0.0003	0.0003
dTMP	dTMP	0.0012	0.0003	0.0004	0.0022	0.0026	0.0028
FAD_divalent	FAD	0.0041	0.0039	0.0038	0.0035	0.0042	0.0028
Fructose 1_6-diphosphate	Fructose 1,6-bisphosphate				0.0008	0.0008	0.0005
Fructose 6-phosphate	Fructose 6-phosphate	0.0028	0.0028	0.0025	0.0098	0.0100	0.0083
Fumaric acid	Fumaric acid	0.0006					
Gamma-Aminobutyric acid	gamma-Aminobutyric acid	0.0009	0.0007	0.0007			
GDP	GDP	0.0013	0.0016	0.0018	0.0032	0.0031	0.0023
GDP-mannose/GDP-galactose		0.0004	0.0004	0.0004	0.0033	0.0036	0.0027
Gluconic acid	Gluconic acid	0.0006	0.0007	0.0007	0.0004	0.0004	0.0003
Glucose 1-phosphate	Glucose 1-phosphate	0.0004	0.0003	0.0003	0.0014	0.0011	0.0011
Glucose 6-phosphate	Glucose 6-phosphate	0.0069	0.0063	0.0064	0.0282	0.0291	0.0260
Glu-Glu	Glu-Glu	0.0004	0.0003	0.0003	0.0002	0.0002	0.0002
Glutamic acid	Glutamic acid	0.0100	0.0070	0.0088	0.0045	0.0031	0.0030
Glutamine	Glutamine	0.0044	0.0042	0.0054	0.0068	0.0052	0.0048
Glutaric acid	Glutaric acid	0.0007	0.0006	0.0006	0.0013	0.0060	0.0013
Gly-Asp	Gly-Asp	0.0006	0.0006	0.0008	0.0003	0.0003	0.0005
Glyceric acid	Glyceric acid	0.0015	0.0010	0.0015	0.0009	0.0009	0.0013
Glycerol 3-phosphate	sn-Glycero-3-phosphate	0.0003	0.0002	0.0002	0.0001	0.0003	0.0003
Glycine	Glycine	0.0129	0.0055	0.0092	0.0035	0.0035	0.0030
Glycolic acid	Glycolic acid	0.0100	0.0071	0.0083	0.0103	0.0071	0.0147
Gly-Gly	Gly-Gly	0.0006	0.0007	0.0007		0.0004	
Gly-Leu	Gly-Leu	0.0119	0.0143	0.0172	0.0097	0.0098	0.0107
GMP	GMP	0.0005	0.0004	0.0004	0.0002	0.0002	0.0002
Guanine	Guanine		0.0002	0.0002	0.0003	0.0005	0.0005
Guanosine	Guanosine	0.0002	0.0002	0.0002	0.0004		0.0004
Heptylic acid	Heptylic acid	0.0043	0.0032	0.0037	0.0017	0.0029	0.0047
His-Glu	His-Glu	0.0001	0.0001	0.0001			0.0002
Histidine	Histidine	0.0082	0.0033	0.0037	0.0038	0.0020	0.0023
Homoserinelactone	Homoserine lactone	0.0015	0.0017	0.0012	0.0007	0.0007	0.0011
Hydrocinnamic acid	Hydrocinnamic acid	0.0027	0.0024	0.0027	0.0029	0.0028	0.0028
Hydroxypropionic acid	Hydroxypropionic acid	0.0004	0.0004	0.0006	0.0005	0.0012	0.0006
Hypoxanthine	Hypoxanthine	0.0020	0.0016	0.0018			
IMP	IMP	0.0003	0.0003	0.0003	0.0002	0.0002	0.0001
Inosine	Inosine	0.0031	0.0030	0.0036	0.0008	0.0011	0.0013
Isobutyryl CoA_divalent	Isobutyryl-CoA	0.0021	0.0015	0.0015	0.0007	0.0009	0.0005
Isoleucine	Isoleucine	0.0113	0.0056	0.0077	0.0043	0.0025	0.0025
Isovaleric acid	Isovaleric acid	0.0069	0.0035	0.0045	0.0012	0.0025	0.0054
Ketoleucine/3-Methyl-2-oxovaleric acid	Ketoleucine	0.0005	0.0006	0.0007	0.0007	0.0006	0.0007
Lactic acid	Lactic acid	0.0943	0.0721	0.0834	0.0615	0.0771	0.0698
Lauric acid	Lauric acid	0.0265	0.0213	0.0256	0.0168	0.0197	0.0286
Leucine	Leucine	0.0196	0.0122	0.0167	0.0090	0.0062	0.0062
Leucinic acid	Leucinic acid	0.0002	0.0002	0.0002	0.0003	0.0008	
Levulinic acid	Levulinic acid	0.0016	0.0014	0.0016	0.0015	0.0033	0.0014
Lysine	Lysine	0.4090	0.3551	0.3888	0.4400	0.4856	0.6210
Maleic acid	Maleic acid					0.0011	0.0006
Malic acid	Malic acid	0.0009	0.0006	0.0007	0.0005	0.0008	0.0006
Malonic acid	Malonic acid	0.0036	0.0027	0.0029	0.0039	0.0165	0.0056
Mannosamine	2-Amino-2-deoxy-D-mannose	0.0004	0.0003	0.0003	0.0003	0.0003	0.0004
Methionine	Methionine	0.0062	0.0051	0.0068	0.0021	0.0015	0.0019
Methionine sulfoxide	Methionine sulfoxide	0.0021	0.0014	0.0017	0.0004	0.0011	0.0007
Methylimidazoleacetic acid	Methylimidazoleacetic acid	0.0012		0.0004			
Methyl sulfate	Methyl sulfate	0.0034	0.0018	0.0015	0.0012	0.0010	0.0008
m-Toluic acid		0.0261	0.0368	0.0348	0.0719	0.0398	0.0357
N6-acetyllysine	N6-Acetyllysine					0.0004	0.0001
N-6-trimethyllysine	N-6-Trimethyllysine				0.0004	0.0005	0.0004
N8-Acetylspermidine	N8-Acetylspermidine	0.0004	0.0001	0.0001		0.0001	
N-Acetyl-Glucosamine 6-Phosphate	N-Acetyl-glucosamine 6-phosphate	0.0002	0.0002	0.0002	0.0004	0.0004	0.0003
N-Acetylornithine	N-Acetylornithine	0.0020	0.0017	0.0028	0.0008	0.0011	0.0013
NAD+	NAD	0.0429	0.0445	0.0446	0.0438	0.0437	0.0411
NADP+	NADP	0.0015	0.0013	0.0014	0.0013	0.0014	0.0009
Niacinamide	Niacinamide	0.0280	0.0120	0.0154	0.0056	0.0084	0.0162
Ornithine	Ornithine	0.0955	0.0599	0.0693	0.0392	0.0409	0.0501
p-Aminobenzoic acid	p-Aminobenzoic acid				0.0045	0.0041	0.0031
Pantothenic acid	Pantothenic acid	0.0009	0.0010	0.0011		0.0001	
Pelargonic acid	Pelargonic acid	0.0124	0.0094	0.0113	0.0066	0.0096	0.0127
PGE2	PGE2	0.0018	0.0008	0.0008	0.0011	0.0011	0.0014
Phenylalanine	Phenylalanine	0.0107	0.0085	0.0114	0.0050	0.0037	0.0043
Phosphoenolpyruvic acid	Phosphoenolpyruvic acid	0.0022	0.0017	0.0020	0.0028	0.0030	0.0024
Phosphoserine	Phosphoserine	0.0065	0.0061	0.0065	0.0103	0.0098	0.0080
Phthalic acid	Phthalic acid	0.0024				0.0002	
Pimelic acid	Pimelic acid					0.0023	
ppGpp_divalent		0.0002	0.0004	0.0004	0.0004	0.0002	0.0001
Proline	Proline	0.0127	0.0082	0.0103	0.0078	0.0055	0.0054
Propionic acid	Propionic acid	0.0036	0.0018	0.0031	0.0010	0.0015	0.0039
Pyridoxal	Pyridoxal	0.0008	0.0007	0.0010	0.0004	0.0002	0.0003
Pyridoxamine	Pyridoxamine	0.0024	0.0022	0.0024	0.0018	0.0016	0.0022
Pyridoxamine 5^-phosphate	Pyridoxamine 5'-phosphate	0.0117	0.0120	0.0116	0.0075	0.0061	0.0064
Pyridoxine	Pyridoxine	0.0005	0.0004	0.0004	0.0002	0.0002	0.0003
Quinic acid	Quinic acid	0.0003	0.0002	0.0002	0.0004	0.0002	0.0003
Riboflavin	Riboflavin	0.0026	0.0030	0.0029	0.0026	0.0034	0.0025
Ribose-5-phosphate	Ribose 5-phosphate	0.0009	0.0008	0.0010	0.0005	0.0005	0.0004
Ribulose-5-phosphate	Ribulose 5-phosphate	0.0010	0.0010	0.0010	0.0008	0.0007	0.0006
S-Adenosylmethionine	S-Adenosylmethionine	0.0108	0.0109	0.0116	0.0040	0.0047	0.0064
Sebacic acid	Sebacic acid	0.0001				0.0003	
Sedoheptulose 7-phosphate	Sedoheptulose 7-phosphate	0.0071	0.0071	0.0070	0.0226	0.0222	0.0201
Ser-Glu	Ser-Glu	0.0009	0.0008	0.0011		0.0003	0.0005
Serine	Serine	0.0577	0.0327	0.0410	0.0137	0.0107	0.0096
sn-glycero-3-phosphocholine	sn-Glycero-3-phosphocholine	0.0006	0.0004	0.0005			
Spermidine	Spermidine	0.0031	0.0014	0.0018	0.0010	0.0012	0.0003
Suberic acid	Suberic acid	0.0003	0.0002	0.0001	0.0001	0.0014	0.0001
Succinic acid	Succinic acid	0.0074	0.0055	0.0061	0.0078	0.0150	0.0079
Thiamine	Thiamine	0.0042	0.0049	0.0053	0.0067	0.0045	0.0048
Thiamine phosphate	TMP	0.0006	0.0006	0.0008	0.0007	0.0005	0.0007
Thr-Asp	Thr-Asp	0.0006	0.0007	0.0008	0.0004	0.0003	0.0004
Threonine	Threonine	0.0137	0.0085	0.0108	0.0158	0.0120	0.0117
Tiglic acid	Tiglic acid	0.0006	0.0004	0.0005		0.0004	0.0007
trans-Ferlic acid	trans-Ferulic acid	0.0004	0.0003	0.0003	0.0004	0.0003	0.0003
Triethanolamine	Triethanolamine	0.0014	0.0013	0.0010	0.0005	0.0009	0.0008
Tryptophan	Tryptophan	0.0142	0.0123	0.0142	0.0042	0.0032	0.0036
Tyramine	Tyramine				0.0002	0.0003	
Tyr-Glu	Tyr-Glu	0.0005	0.0005	0.0006	0.0004	0.0004	0.0004
Tyrosine	Tyrosine	0.0140	0.0124	0.0158	0.0047	0.0040	0.0048
UDP	UDP			0.0001	0.0002	0.0003	
UDP-glucuronic acid	UDP-glucuronic acid	0.0027	0.0028	0.0029	0.0010	0.0010	0.0007
UMP	UMP	0.0013	0.0006	0.0007	0.0004	0.0004	0.0004
Undecylic acid	Undecylic acid	0.0011	0.0010	0.0011	0.0008	0.0011	0.0014
Urea	Urea	0.0376	0.0244	0.0470	0.0241	0.0262	0.0248
Urocanic acid	Urocanic acid	0.0063	0.0009	0.0023	0.0013	0.0011	0.0009
Valine	Valine	0.0135	0.0061	0.0093	0.0044	0.0033	0.0035
Vanillic acid	Vanillic acid					0.0003	
Xanthosine	Xanthosine	0.0003	0.0003	0.0004		0.0001	
XMP	XMP	0.0003	0.0002				
β-Ala-Lys		0.0016	0.0016	0.0016	0.0018	0.0018	0.0021
β-Alanine	beta-Alanine	0.0026	0.0024	0.0031	0.0006	0.0005	0.0006