0  B9R0.55  CC(=O)NCCCC(=O)O YMDB00489 [0,0,0,0,0,0|2,0,0]=2
1  B9R0.55  N=C(N)NCCCC(N)=O YMDB00586 [0,0,0,0,0,0|4,0,0]=4
2  B9R0.55  NC(N)=NCCCC(=O)O YMDB00585 [0,0,0,0,0,0|3,0,0]=3
3  B8R0.7  CC(=O)NCCCC=O YMDB00209 [1,0,0,0,0,0|2,0,0]=3
4  B8R0.7  CCCCCCC(=O)O YMDB01705 [1,0,0,0,0,0|1,0,1]=3
5  B10R0.96  O=C(O)\C=C/C(=O)CC(=O)O YMDB00333 [0,1,0,0,0,0|0,0,3]=4
6  B10R0.98  CC(=O)OCC[C@H](N)C(=O)O YMDB00158 [0,1,0,0,0,0|2,0,0]=3
7  B10R0.98  N[C@@H](CCCC(=O)O)C(=O)O YMDB00999 [0,1,0,0,0,0|0,0,0]=1
8  B10R0.98  O=C(O)CCCC(=O)C(=O)O YMDB00142 [0,1,0,0,0,0|0,0,1]=2
9  B7R0.1  CCCCCCC=O YMDB01704 [2,0,0,0,0,0|1,0,1]=4
10  B7R0.1  OCCCCCCO YMDB01709 [2,0,0,0,0,0|0,0,2]=4
11  B7R0.4  CC(=O)NCCC=O YMDB00315 [2,0,0,0,0,0|2,0,0]=4
12  B7R0.4  CCCCCC(=O)O YMDB01424 [2,0,0,0,0,0|0,0,1]=3
13  B7R0.4  CCCCCC(C)=O YMDB01337 [2,0,0,0,0,0|1,0,1]=4
14  B9R0.2  CCCCCCCC(=O)O YMDB00676 [1,1,0,0,0,0|1,0,1]=4
15  B9R0.47  NC(CCCC=O)C(=O)O YMDB00346 [1,1,0,0,0,0|0,0,0]=2
16  B9R0.47  NCCCC[C@H](N)C(=O)O YMDB00330 [1,1,0,0,0,0|1,0,1]=4
17  B9R0.47  N[C@@H](CCCC=O)C(=O)O YMDB00721 [1,1,0,0,0,0|0,0,0]=2
18  B9R0.7  CC(=O)OC[C@H](N)C(=O)O YMDB00652 [0,1,0,0,1,0|2,0,0]=4
19  B9R0.7  CC(CCC(=O)O)C(=O)O YMDB01573 [0,1,0,0,1,0|0,0,0]=2
20  B9R0.7  C[S@@](=O)CC[C@H](N)C(=O)O YMDB00035 [0,1,0,0,1,0|2,0,0]=4
21  B9R0.7  NC(=O)CC[C@@H](N)C(=O)O YMDB00990 [0,1,0,0,1,0|1,0,0]=3
22  B9R0.7  NC(=O)CC[C@H](N)C(=O)O YMDB00002 [0,1,0,0,1,0|1,0,0]=3
23  B9R0.7  N[C@@H](CCC(=O)O)C(=O)O YMDB00271 [0,1,0,0,1,0|0,0,0]=2
24  B9R0.7  O=C(O)CCC(=O)C(=O)O YMDB00153 [0,1,0,0,1,0|0,0,1]=3
25  B9R0.7  O=C(O)CCC(O)C(=O)O YMDB00059 [0,1,0,0,1,0|0,0,0]=2
26  B11R0.29  N=C(N)NCCC[C@H](N)C(=O)O YMDB00592 [0,1,0,0,0,1|2,0,0]=4
27  B11R0.29  NC(=O)NCCC[C@H](N)C(=O)O YMDB00060 [0,1,0,0,0,1|1,0,0]=3
28  B11R0.318  N[C@@H](CCOP(=O)(O)O)C(=O)O YMDB00258 [0,2,0,0,0,0|2,0,0]=4
29  B9R1.6  O=C(O)C1CCCCN1 YMDB01675 [1,0,0,1,0,0|1,0,1]=4
30  B9R1.35  O=C1CC[C@@H](C(=O)O)N1 YMDB00107 [0,0,0,1,1,0|1,0,0]=3
31  B11R1.178  CC(=O)N1CCC[C@@H]1C(=O)O YMDB00833 [0,0,0,1,0,1|1,0,0]=3
32  B7R0.6  O=C(O)CCC(=O)O YMDB00338 [0,0,0,0,2,0|0,0,0]=2
33  B7R0.6  O=C(O)\C=C\C(=O)O YMDB00101 [0,0,0,0,2,0|0,0,2]=4