0  B14R2.112  CCOC1=CC2=C(C=CC=C2)C=C1 HMDB0029688 [0,0,0,0,0,0|0,0,0]=0
1  B13R2.57  COC1=CC2=C(C=CC=C2)C=C1 HMDB0032861 [1,0,0,0,0,0|0,0,0]=1
2  B13R1.42  CCOC(=O)/C=C\C1=CC=CC=C1 HMDB0033834 [0,0,1,0,0,0|1,0,0]=2
3  B13R1.42  CCOC(=O)CCC1=CC=CC=C1 HMDB0040411 [0,0,1,0,0,0|1,0,2]=4
4  B13R1.79  CSC/C(C=O)=C/C1=CC=CC=C1 HMDB0037166 [0,0,1,0,0,0|3,0,0]=4
5  B13R2.1  CNCC1=CNC2=CC=CC=C12 HMDB0038456 [0,0,0,0,1,0|3,0,0]=4
6  B12R1.27  COC(=O)/C=C\C1=CC=CC=C1 HMDB0033833 [1,0,1,0,0,0|1,0,0]=3
7  B12R1.71  COC1=CC=C(/C=C/C=O)C=C1 HMDB0032611 [1,0,1,0,0,0|1,0,0]=3
8  B12R1.71  COC1=CC=C(/C=C/CO)C=C1 HMDB0032586 [1,0,1,0,0,0|1,0,1]=4
9  B12R1.32  CCOC(=O)CC1=CC=CC=C1 HMDB0032618 [1,0,1,0,0,0|1,0,1]=4
10  B12R2.24  CC1=CC2=C(C=C1)N=CC=C2 HMDB0033115 [2,0,0,0,0,0|1,0,0]=3
11  B12R2.24  CC1=NC2=CC=CC=C2C=C1 HMDB0042004 [2,0,0,0,0,0|1,0,0]=3
12  B12R2.24  NC1=NC2=C(C=CC=C2)C=C1 HMDB0034175 [2,0,0,0,0,0|2,0,0]=4
13  B12R2.24  SC1=CC2=C(C=CC=C2)C=C1 HMDB0029689 [2,0,0,0,0,0|0,1,0]=3
14  B14R1.29  CCOC(=O)CC(=O)C1=CC=CC=C1 HMDB0040268 [0,1,1,0,0,0|1,0,1]=4
15  B14R1.156  C=CCOC(=O)/C=C\C1=CC=CC=C1 HMDB0041219 [0,1,1,0,0,0|1,0,1]=4
16  B14R1.156  CCCOC(=O)/C=C\C1=CC=CC=C1 HMDB0037700 [0,1,1,0,0,0|1,0,0]=3
17  B14R1.818  CC(C)OC(=O)/C=C\C1=CC=CC=C1 HMDB0037701 [0,1,1,0,0,0|1,0,0]=3
18  B14R1.467  CCCC/C(C=O)=C/C1=CC=CC=C1 HMDB0037292 [0,1,1,0,0,0|2,0,0]=4
19  B14R2.134  COC1=CC2=C(C=CC(=O)O2)C=C1 HMDB0029758 [1,1,0,0,0,0|1,0,0]=3
20  B14R2.781  CC(=O)C1=CC2=CC=CC=C2C=C1 HMDB0032412 [1,1,0,0,0,0|0,0,1]=3
21  B14R2.510  CC/C=C1/OC(=O)C2=CC=CC=C12 HMDB0031845 [0,1,0,0,1,0|2,0,0]=4
22  B16R2.477  CC(C)COC1=CC2=CC=CC=C2C=C1 HMDB0035076 [0,2,0,0,0,0|0,0,0]=2
23  B16R2.477  OC(=O)COC1=CC2=CC=CC=C2C=C1 HMDB0032706 [0,2,0,0,0,0|0,0,1]=3
24  B16R2.1054  CC/C=C\C1=CC2=CC=CC=C2C(=O)O1 HMDB0030646 [0,2,0,0,0,0|2,0,0]=4
25  B16R2.150515  CCOC1=CC2=C(C=C1)C(C)=CC(=O)O2 HMDB0035095 [0,2,0,0,0,0|1,0,0]=3
26  B14R2.101  C1COC(O1)/C=C/C2=CC=CC=C2 HMDB0037142 [0,0,1,1,0,0|1,0,1]=4
27  B16R3.11020  O=C1OC2=C(C=CC3=C2OCO3)C=C1 HMDB0039045 [0,1,0,1,0,0|2,0,0]=4
28  B12R1.51  CCOC(=O)/C=C\C1=CC=CO1 HMDB0041611 [0,0,1,0,1,0|2,0,0]=4
29  B12R1.308  CCOC(=O)C1=C(O)C=CC=C1 HMDB0029817 [0,0,1,0,1,0|2,0,0]=4
30  B12R1.308  CCOC(=O)C1=CC=CC=C1N HMDB0033589 [0,0,1,0,1,0|2,0,0]=4
31  B12R2.1  NCC1=CNC2=CC=CC=C12 HMDB0029740 [1,0,0,0,1,0|2,0,0]=4
32  B12R2.32  CCC1=NC2=CC=CC=C2S1 HMDB0040034 [1,0,0,0,1,0|2,0,0]=4