0  B8R0.5  CCOC(=O)CC(C)C YMDB01334 [0,0,0,0,0,0|1,0,0]=1
1  B8R0.5  CCOC(=O)CC(C)O YMDB01425 [0,0,0,0,0,0|0,0,0]=0
2  B7R0.4  CCCCCC(C)O YMDB01343 [1,0,0,0,0,0|1,0,1]=3
3  B7R0.7  CCCC(=O)OCC YMDB01385 [1,0,0,0,0,0|0,0,0]=1
4  B7R0.7  CCCC(S)CCO YMDB01417 [1,0,0,0,0,0|1,1,1]=4
5  B7R0.7  CCOC(C)OCC YMDB01369 [1,0,0,0,0,0|2,0,1]=4
6  B7R0.5  C=C(C)C(=O)OCC YMDB01685 [0,0,0,0,1,0|1,0,1]=3
7  B7R0.5  CCCC(=O)C(C)=O YMDB01708 [0,0,0,0,1,0|1,0,2]=4
8  B7R0.5  CCOC(=O)C(C)O YMDB01429 [0,0,0,0,1,0|0,0,0]=1
9  B9R0.48  CCOC(=O)CCC(=O)O YMDB01402 [0,0,0,0,0,1|1,0,1]=3
10  B6R0.1  CCC(C)CCO YMDB01428 [2,0,0,0,0,0|1,0,1]=4
11  B6R0.1  CCCC(=O)OC YMDB01743 [2,0,0,0,0,0|0,0,0]=2
12  B6R0.1  CCOC(=O)CC YMDB01331 [2,0,0,0,0,0|0,0,0]=2
13  B6R0.2  CC(C)CC(=O)O YMDB01606 [2,0,0,0,0,0|1,0,0]=3
14  B6R0.2  CC(O)CC(=O)O YMDB01561 [2,0,0,0,0,0|0,0,0]=2
15  B6R0.2  O=C(O)CC(=O)O YMDB01566 [2,0,0,0,0,0|1,0,1]=4
16  B6R0.4  CCCCC(C)O YMDB01793 [2,0,0,0,0,0|0,0,1]=3
17  B6R0.6  CCCCCCO YMDB01473 [2,0,0,0,0,0|1,0,1]=4
18  B6R0.6  CCC\C=C\CO YMDB01676 [2,0,0,0,0,0|1,0,1]=4
19  B6R0.6  CCOCCCO YMDB01423 [2,0,0,0,0,0|0,0,1]=3
20  B6R0.6  CC\C=C/CCO YMDB01420 [2,0,0,0,0,0|1,0,0]=3
21  B6R0.6  CC\C=C\CCO YMDB01421 [2,0,0,0,0,0|1,0,0]=3
22  B8R0.1  CCCCC(=O)OCC YMDB01342 [1,1,0,0,0,0|0,0,0]=2
23  B8R0.1  CCCOC(=O)CCC YMDB01397 [1,1,0,0,0,0|0,0,0]=2
24  B8R0.1  CCOC(=O)CCCO YMDB01419 [1,1,0,0,0,0|0,0,0]=2
25  B8R0.3  CCOC(=O)C(C)CC YMDB01353 [1,1,0,0,0,0|0,0,0]=2
26  B10R0.2  CCCC(O)CC(=O)OCC YMDB01356 [0,2,0,0,0,0|0,0,0]=2
27  B10R0.2  CCOC(=O)CC(=O)OCC YMDB01670 [0,2,0,0,0,0|0,0,2]=4
28  B6R0.3  CCC(=O)C(=O)O YMDB00071 [1,0,0,0,1,0|1,0,1]=4
29  B6R0.3  CCC(=O)C(C)=O YMDB01434 [1,0,0,0,1,0|0,0,2]=4
30  B6R0.3  COC(=O)C(C)C YMDB01748 [1,0,0,0,1,0|1,0,0]=3