0  B9R1.6  CC(=O)C1=CC=CC=C1 HMDB0033910 [1,0,0,0,0,0|0,0,0]=1
1  B9R1.6  NC(=O)C1=NC=CN=C1 HMDB0014483 [1,0,0,0,0,0|3,0,0]=4
2  B9R1.6  OC(=O)C1=CC=NC=C1 HMDB0060665 [1,0,0,0,0,0|2,0,0]=3
3  B9R1.6  OC(=O)C1=CN=CC=C1 HMDB0001488 [1,0,0,0,0,0|2,0,0]=3
4  B9R1.6  OC(=O)C1=CN=CC=N1 HMDB0059734 [1,0,0,0,0,0|3,0,0]=4
5  B11R1.159  CC1=C(N)C(=CC=C1)C(O)=O HMDB0060680 [0,1,0,0,0,0|2,0,0]=3
6  B11R1.159  CC1=C(O)C(=CC=C1)C(O)=O HMDB0002390 [0,1,0,0,0,0|2,0,0]=3
7  B11R1.159  NC1=CC=CC(C(O)=O)=C1O HMDB0001972 [0,1,0,0,0,0|2,0,0]=3
8  B11R1.167  NC1=CC(C(O)=O)=C(O)C=C1 HMDB0014389 [0,1,0,0,0,0|2,0,0]=3
9  B8R1.2  OCC1=CC=CC=C1 HMDB0003119 [2,0,0,0,0,0|0,0,2]=4
10  B10R1.13  OC(=O)C1=CC=C(O)C=C1 HMDB0000500 [1,1,0,0,0,0|1,0,0]=3
11  B10R1.15  C=C(C=O)C1=CC=CC=C1 HMDB0060671 [1,1,0,0,0,0|0,0,1]=3
12  B10R1.15  NNC(=O)C1=CC=NC=C1 HMDB0015086 [1,1,0,0,0,0|2,0,0]=4
13  B10R1.61  NC(=O)C1=CC=CC=C1O HMDB0015687 [1,1,0,0,0,0|1,0,0]=3
14  B10R1.61  OC(=O)C1=CC=CC=C1O HMDB0001895 [1,1,0,0,0,0|1,0,0]=3
15  B10R1.61  OC1=CC=CC=C1C([O-])=O HMDB0015469 [1,1,0,0,0,0|1,0,0]=3
16  B10R1.61  OC1=CC=CC=C1C([O-])=O HMDB0015470 [1,1,0,0,0,0|1,0,0]=3
17  B10R1.61  OC1=CC=CC=C1C([O-])=O HMDB0015473 [1,1,0,0,0,0|1,0,0]=3
18  B12R1.19  CC(=O)CC1=CC(O)=C(O)C=C1 HMDB0031132 [0,1,0,0,0,1|0,0,0]=2
19  B12R1.19  CC(N)CC1=CC(O)=C(O)C=C1 HMDB0060807 [0,1,0,0,0,1|1,0,1]=4
20  B12R1.225  C[C@H](N)[C@H](O)C1=CC(O)=CC=C1 HMDB0014748 [0,1,0,0,0,1|1,0,1]=4
21  B12R1.10  CC[N+](C)(C)C1=CC(O)=CC=C1 HMDB0015145 [0,2,0,0,0,0|2,0,0]=4
22  B12R1.17  CNC[C@H](O)C1=CC(O)=CC=C1 HMDB0002182 [0,2,0,0,0,0|0,0,2]=4
23  B12R1.258  OC(=O)C1=CC=CC(=N1)C(O)=O HMDB0033161 [0,2,0,0,0,0|2,0,0]=4
24  B12R2.606  ClC1=CC2=C(OC(=O)N2)C=C1 HMDB0014500 [0,0,0,1,0,1|2,0,0]=4
25  B10R1.18  CC(N)CC1=CC=CC=C1 HMDB0014328 [1,0,0,0,0,1|1,0,1]=4
26  B10R1.18  C[C@@H](N)CC1=CC=CC=C1 HMDB0012128 [1,0,0,0,0,1|1,0,1]=4
27  B10R1.18  C[C@H](N)CC1=CC=CC=C1 HMDB0015516 [1,0,0,0,0,1|1,0,1]=4
28  B10R1.18  OC(=O)CC1=CC=CC=N1 HMDB0060722 [1,0,0,0,0,1|2,0,0]=4