1	XI7	2-4-dioxo-4-phenylbutanoic acid	1.000
2	040	4-(2-methylphenyl)-2,4-dioxobutanoic acid	0.933
3	043	4-(3-bromophenyl)-2,4-dioxobutanoic acid	0.933
4	3EE	4-(2-aminophenyl)-2,4-dioxobutanoic acid	0.933
5	BQ4	(2z)-2-hydroxy-4-(3-hydroxyphenyl)-4-oxobut-2-enoic acid	0.933
6	BVS	(2z)-2-hydroxy-4-(4-methylphenyl)-4-oxobut-2-enoic acid	0.933
7	EQA	(2z)-4-(2-fluorophenyl)-2-hydroxy-4-oxobut-2-enoic acid	0.933
8	I92	4-(2-bromophenyl)-2,4-dioxobutanoic acid	0.933
9	Y9E	2-oxo-4-phenylbutanoic acid	0.929
10	D1Y	(2z)-4-(2-chloro-4-hydroxyphenyl)-2-hydroxy-4-oxobut-2-enoic acid	0.875
11	E9S	(2z)-4-(2-bromo-3-hydroxyphenyl)-2-hydroxy-4-oxobut-2-enoic acid	0.875
12	EHV	(2s)-4-(2-bromo-6-methylphenyl)-2-hydroxy-4-oxobutanoic acid	0.875
13	ENG	(2z)-4-(2-bromo-4-hydroxyphenyl)-2-hydroxy-4-oxobut-2-enoic acid	0.875
14	GXD	4-(2,6-dichlorophenyl)-2,4-dioxobutanoic acid	0.875
15	GXG	4-(2,6-difluorophenyl)-2,4-dioxobutanoic acid	0.875
16	005	(2s,3s)-3-amino-2-hydroxy-4-phenylbutanoic acid	0.867
17	01B	(2s,3r)-3-amino-2-hydroxy-4-phenylbutanoic acid	0.867
18	KRN	(4r)-4-hydroxy-4-(2-hydroxyphenyl)butanoic acid	0.867
19	KY1	4-(2-aminophenyl)-4-oxobutanoic acid	0.867
20	TOH	(3e)-4-(2-hydroxyphenyl)-2-oxobut-3-enoic acid	0.867
21	VP3	4-(4-fluorophenyl)-4-oxobutanoic acid	0.867
22	CLT	4-phenyl-butanoic acid	0.857
23	5EQ	(2z)-2-hydroxy-4-(1h-indol-5-yl)-4-oxobut-2-enoic acid	0.824
24	GXM	(2z)-2-hydroxy-4-(2-nitrophenyl)-4-oxobut-2-enoic acid	0.824
25	GZV	(2z)-4-(2,6-difluoro-3-methylphenyl)-2-hydroxy-4-oxobut-2-enoic acid	0.824
26	I93	4-(2-chloro-6-fluoro-3-methylphenyl)-2,4-dioxobutanoic acid	0.824
27	KYN	(2s)-2-amino-4-(2-aminophenyl)-4-oxobutanoic acid	0.812
28	TOM	4-(2-methoxyphenyl)-2-oxobut-3-enoic acid	0.812
29	3FB	(3s)-3-amino-4-phenylbutanoic acid	0.800
30	HMF	2-amino-4-phenyl-butyric acid	0.800
31	HPE	Homophenylalanine	0.800
32	P18	3-hydroxy-1-phenylpropan-1-one	0.786
33	5M2	(~{z})-4-(4-methyl-1~{H}-indol-5-yl)-2-oxidanyl-4-oxidanylidene-but-2-enoic acid	0.778
34	BSV	(2z)-4-(5-cyclopropyl-2-methylphenyl)-2-hydroxy-4-oxobut-2-enoic acid	0.778
35	BXS	(2z)-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-hydroxy-4-oxobut-2-enoic acid	0.778
36	C0V	(2z)-2-hydroxy-4-(naphthalen-2-yl)-4-oxobut-2-enoic acid	0.778
37	3DJ	(2s)-2-amino-4-(2-amino-3-hydroxyphenyl)-4-oxobutanoic acid	0.765
38	HMZ	4-(2-hydroxy-4-methoxyphenyl)-4-oxobutanoic acid	0.765
39	OSB	2-succinylbenzoate	0.765
40	6HY	4-oxidanylidene-4-(6-oxidanylidene-1~{H}-pyridin-3-yl)butanoic acid	0.750
41	6VF	(2~{R},3~{S})-3-azanyl-4-(4-hydroxyphenyl)butane-1,2-diol	0.750
42	73O	(2~{S})-2-azanyl-4-(4-hydroxyphenyl)butanoic acid	0.750
43	ACZ	Cis-amiclenomycin	0.750
44	B3Y	(3s)-3-amino-4-(4-hydroxyphenyl)butanoic acid	0.750
45	TZA	Trans-amiclenomycin	0.750
46	W1N	(3s)-3-amino-4-(2-fluorophenyl)butanoic acid	0.750
47	8MK	(~{E})-4-(4-hydroxyphenyl)but-3-en-2-one	0.733
48	A1EDZ	4-oxidanylidene-4-thiophen-2-yl-butanoic acid	0.733
49	BKZ	4-(4-hydroxyphenyl)butan-2-one	0.733
50	164	2-(3-carboxypropionyl)-6-hydroxy-cyclohexa-2,4-diene carboxylic acid	0.722
51	5ER	(2z)-2-hydroxy-4-(1h-indol-3-yl)-4-oxobut-2-enoic acid	0.722
52	HH4	4-(4-tert-butylphenyl)-4-oxobutanoic acid	0.722
53	NFK	N'-formylkynurenine	0.722
54	Q5M	4-(naphthalen-1-yl)-4-oxobutanoic acid	0.722
55	1DJ	(1r)-1-phenylprop-2-yn-1-ol	0.714
56	3PL	3-phenylpropanal	0.714
57	9Y3	(2z)-3-phenylprop-2-enal	0.714
58	9Y6	(2e)-3-phenylprop-2-enal	0.714
59	I1E	1-phenylpropan-1-one	0.714
60	N4B	N-butylbenzene	0.714
61	YGM	(but-3-en-1-yl)benzene	0.714
62	6VA	(3~{R},4~{S})-4-azanyl-2-methyl-5-phenyl-pentane-2,3-diol	0.706
63	BZS	L-benzylsuccinic acid	0.706
64	OQH	~{N}-ethyl-4-oxidanylidene-4-phenyl-butanamide	0.706
65	ENY	(2z)-2-hydroxy-4-(6-methoxynaphthalen-2-yl)-4-oxobut-2-enoic acid	0.700