0  B10R1.66  CC(=O)OCC1CCCO1 HMDB0031176 [0,0,0,0,0,0|0,0,0]=0
1  B11R1.25  CCC(=O)OCC1CCCO1 HMDB0031177 [0,1,0,0,0,0|0,0,0]=1
2  B9R0.2  CC(=O)NCCCCCN HMDB0002284 [0,0,1,0,0,0|2,0,0]=3
3  B9R0.2  CC/C=C/CCOC(C)=O HMDB0032533 [0,0,1,0,0,0|1,0,1]=3
4  B9R0.2  CCCCCCCC(C)=O HMDB0031266 [0,0,1,0,0,0|2,0,0]=3
5  B9R0.2  CCCCCCCC(O)=O HMDB0000482 [0,0,1,0,0,0|3,0,0]=4
6  B9R0.2  CCCCCCOC(C)=O HMDB0029980 [0,0,1,0,0,0|1,0,0]=2
7  B9R0.43  CCC(CC)COC(C)=O HMDB0031703 [0,0,1,0,0,0|1,0,0]=2
8  B9R1.13  OC(=O)CC1CCCN1 HMDB0029444 [0,0,0,0,1,0|2,0,0]=3
9  B8R0.4  CCCCCCCC=O HMDB0001140 [1,0,1,0,0,0|2,0,0]=4
10  B8R0.4  CCCCCCCCO HMDB0001183 [1,0,1,0,0,0|1,0,1]=4
11  B8R0.7  CC(=O)NCCCCN HMDB0002064 [1,0,1,0,0,0|2,0,0]=4
12  B8R0.7  CC(=O)OCCCC=C HMDB0032460 [1,0,1,0,0,0|0,0,2]=4
13  B8R0.7  CCCCCCC(C)=O HMDB0031294 [1,0,1,0,0,0|1,0,0]=3
14  B8R0.7  CCCCCCC(O)=O HMDB0000666 [1,0,1,0,0,0|2,0,0]=4
15  B8R0.7  CSCCCOC(C)=O HMDB0031717 [1,0,1,0,0,0|1,0,0]=3
16  B8R0.7  OCCCCCC(O)=O HMDB0012843 [1,0,1,0,0,0|1,0,0]=3
17  B8R0.9  CC(=O)OC[C@@H](O)CO HMDB0012485 [1,0,1,0,0,0|1,0,0]=3
18  B10R0.3  CC(CCO)CCCC(C)=C HMDB0037171 [0,1,1,0,0,0|2,0,0]=4
19  B10R0.3  C[C@@H](CCO)CCC=C(C)C HMDB0035093 [0,1,1,0,0,0|2,0,0]=4
20  B10R0.3  C[C@@H](CCO)CCC=C(C)C HMDB0035094 [0,1,1,0,0,0|2,0,0]=4
21  B10R0.4  CCCC/C=C/COC(C)=O HMDB0032307 [0,1,1,0,0,0|1,0,1]=4
22  B10R0.4  CCCCCCCCC(C)=O HMDB0031409 [0,1,1,0,0,0|2,0,0]=4
23  B10R0.4  CCCCCCCOC(C)=O HMDB0031480 [0,1,1,0,0,0|1,0,0]=3
24  B10R0.74  CCCCCCCC(=O)CC HMDB0032212 [0,1,1,0,0,0|2,0,0]=4
25  B10R0.74  CCCCCCCC(=O)OC HMDB0031291 [0,1,1,0,0,0|2,0,0]=4
26  B10R0.97  CC(=O)NCCCCC(O)=O HMDB0012175 [0,1,1,0,0,0|1,0,1]=4
27  B10R0.97  CC(C)CCCCOC(C)=O HMDB0032406 [0,1,1,0,0,0|1,0,0]=3
28  B10R0.97  CC(O)CCCCCC(O)=O HMDB0000486 [0,1,1,0,0,0|2,0,0]=4
29  B10R1.54  OC(=O)CC1CCC(=O)O1 HMDB0029171 [0,1,0,0,1,0|1,0,1]=4
30  B12R1.51  CCCC(=O)OCC1CCCO1 HMDB0036188 [0,2,0,0,0,0|0,0,0]=2
31  B10R1.18  CC(=O)CC1CCCCN1 HMDB0030325 [0,0,1,1,0,0|2,0,0]=4
32  B10R1.18  CC(=O)C[C@H]1CCCCN1 HMDB0030324 [0,0,1,1,0,0|2,0,0]=4
33  B10R1.18  CC(=O)OC1CCCCC1 HMDB0031352 [0,0,1,1,0,0|1,0,0]=3
34  B8R0.16  COC(CC(C)=O)OC HMDB0033851 [0,0,1,0,1,0|1,0,0]=3
35  B8R0.5  CCCC(C)OC(C)=O HMDB0031600 [0,0,1,0,1,0|1,0,0]=3
36  B8R0.5  CCOC(=O)CC(C)=O HMDB0031216 [0,0,1,0,1,0|1,0,1]=4
37  B8R0.5  CCOC(=O)CC(C)=O HMDB0031218 [0,0,1,0,1,0|1,0,1]=4
38  B8R0.5  CCOC(C)OC(C)=O HMDB0032158 [0,0,1,0,1,0|0,0,0]=2
39  B8R0.5  [C@@H](O)(CCC)CC(O)=O HMDB0010718 [0,0,1,0,1,0|1,0,0]=3
40  B8R1.7  CC(=O)C1=NCCC1 HMDB0031308 [0,0,0,0,2,0|1,0,1]=4
41  B8R1.7  OC(=O)[C@@H]1CCCN1 HMDB0000162 [0,0,0,0,2,0|2,0,0]=4
42  B8R1.7  OC(=O)[C@H]1CCCN1 HMDB0003411 [0,0,0,0,2,0|2,0,0]=4
43  B12R1.252  CC(=O)OCCC1CCCCC1 HMDB0031362 [0,0,0,0,0,2|1,0,0]=3