0  B11R1.91  O=C(O)CCC1=CC=CC=C1 HMDB0000764 [1,0,0,0,0,0|0,0,0]=1
1  B11R1.91  O=C(O)\C=C/C1=CC=CC=C1 HMDB0000567 [1,0,0,0,0,0|0,0,2]=3
2  B13R1.417  C\N=C(/NC)NCC1=CC=CC=C1 HMDB0014362 [0,1,0,0,0,0|3,0,0]=4
3  B13R2.10  O=C1CCC(C2=CN=CC=C2)N1 HMDB0001297 [0,0,0,1,0,0|3,0,0]=4
4  B11R1.40  CN[C@@H](C)CC1=CC=CC=C1 HMDB0015517 [0,0,0,0,1,0|2,0,1]=4
5  B10R1.17  CNCCC1=CC=CC=N1 HMDB0015644 [2,0,0,0,0,0|2,0,0]=4
6  B10R1.17  NNCCC1=CC=CC=C1 HMDB0014918 [2,0,0,0,0,0|2,0,0]=4
7  B12R0.248  C\C=C/CC\C=C/CCC(=O)OC HMDB0034708 [0,1,1,0,0,0|0,0,2]=4
8  B12R1.21  O=C(O)CCC1=CC=C(O)C=C1 HMDB0002199 [1,1,0,0,0,0|0,0,0]=2
9  B12R1.21  O=C(O)\C=C/C1=CC=C(O)C=C1 HMDB0030677 [1,1,0,0,0,0|0,0,2]=4
10  B12R1.21  O=C(O)\C=C\C1=CC=C(O)C=C1 HMDB0002035 [1,1,0,0,0,0|0,0,2]=4
11  B12R1.43  N[C@@H](CC1=CC=CC=C1)C(=O)O HMDB0000159 [1,1,0,0,0,0|0,0,0]=2
12  B12R1.43  O=C(O)C(=O)CC1=CC=CC=C1 HMDB0000205 [1,1,0,0,0,0|0,0,1]=3
13  B12R1.43  O=C(O)C(O)CC1=CC=CC=C1 HMDB0000779 [1,1,0,0,0,0|0,0,0]=2
14  B12R1.125  O=C(O)\C=C/C1=CC=CC=C1O HMDB0041592 [1,1,0,0,0,0|0,0,2]=4
15  B12R1.226  O=C(O)CCC1=CC=CC(O)=C1 HMDB0000375 [1,1,0,0,0,0|0,0,0]=2
16  B12R1.226  O=C(O)\C=C\C1=CC=CC(O)=C1 HMDB0001713 [1,1,0,0,0,0|0,0,2]=4
17  B14R2.4514  CN1C(=O)CCC1C2=CN=CC=C2 HMDB0001046 [0,0,0,1,0,1|2,0,0]=4
18  B10R1.18  CC(N)CC1=CC=CC=C1 HMDB0014328 [1,0,0,0,1,0|1,0,1]=4
19  B10R1.18  C[C@H](N)CC1=CC=CC=C1 HMDB0015516 [1,0,0,0,1,0|1,0,1]=4
20  B10R1.18  O=C(O)CC1=CC=CC=C1 HMDB0000209 [1,0,0,0,1,0|0,0,0]=2
21  B10R1.18  O=C(O)CC1=CC=CC=N1 HMDB0060722 [1,0,0,0,1,0|1,0,0]=3
22  B10R1.15  CNC(=O)C1=CN=CC=C1 HMDB0003152 [0,0,0,0,2,0|2,0,0]=4