0  B13R1.133  N[C@H](CC1CCC(CC1)O)C(=O)O MCULE-1941355829 [0,0,0,0,0,0|1,0,3]=4
1  B13R1.133  O=C(O)C(=O)CC1=CC=C(C=C1)O MCULE-7014208403 [0,0,0,0,0,0|0,0,4]=4
2  B12R1.43  O=C(O)C(=O)CC1CCCCC1 MCULE-2990391321 [1,0,0,0,0,0|0,0,2]=3
3  B12R1.43  O=C(O)C(=O)NC1CCCCC1 MCULE-9213832688 [1,0,0,0,0,0|1,0,2]=4
4  B11R0.29  O=C(O)CCCCC(=O)C(=O)O MCULE-2399783714 [1,0,1,0,0,0|1,0,1]=4
5  B11R0.42  C=CCCCCCC(N)C(=O)O MCULE-1162188913 [1,0,1,0,0,0|1,0,1]=4
6  B11R0.42  C=CCCCCCC(N)C(=O)O MCULE-3131667346 [1,0,1,0,0,0|1,0,1]=4
7  B11R0.42  C=CCCCCCC(N)C(=O)O MCULE-4888632865 [1,0,1,0,0,0|1,0,1]=4
8  B11R0.42  C=CCCCCC[C@@H](N)C(=O)O MCULE-5391769158 [1,0,1,0,0,0|1,0,1]=4
9  B11R0.42  C=CCCCCC[C@@H](N)C(=O)O MCULE-5861402789 [1,0,1,0,0,0|1,0,1]=4
10  B11R0.42  C=CCCCCC[C@@H](N)C(=O)O MCULE-8081984411 [1,0,1,0,0,0|1,0,1]=4
11  B11R0.42  C=CCCCCC[C@@H](N)C(=O)O MCULE-8137198974 [1,0,1,0,0,0|1,0,1]=4
12  B11R0.42  C=CCCCCC[C@H](N)C(=O)O MCULE-1233544353 [1,0,1,0,0,0|1,0,1]=4
13  B11R0.42  C=CCCCCC[C@H](N)C(=O)O MCULE-3790089576 [1,0,1,0,0,0|1,0,1]=4
14  B11R0.42  C=CCCCCC[C@H](N)C(=O)O MCULE-8748986273 [1,0,1,0,0,0|1,0,1]=4
15  B11R0.42  C=CCCCCC[C@H](N)C(=O)O MCULE-9105977293 [1,0,1,0,0,0|1,0,1]=4
16  B11R1.20  O=C(O)CC1CCC(CC1)O MCULE-4327900578 [2,0,0,0,0,0|0,0,2]=4
17  B11R1.20  O=C(O)C[C@H]1CC[C@@H](CC1)O MCULE-4456637498 [2,0,0,0,0,0|0,0,2]=4
18  B11R1.20  O=C(O)C[C@H]1CC[C@H](CC1)O MCULE-7150660975 [2,0,0,0,0,0|0,0,2]=4
19  B11R0.173  CC(/C=C/C(=O)O)C(=O)C(=O)O MCULE-5301069913 [0,0,1,0,1,0|1,0,1]=4
20  B11R0.173  CC(C=CC(=O)O)C(=O)C(=O)O MCULE-1963367626 [0,0,1,0,1,0|1,0,1]=4
21  B11R1.35  O=C(O)C(=O)NC1CCCC1 MCULE-8386452730 [1,0,0,0,1,0|1,0,1]=4
22  B11R1.36  O=C(O)C(=O)C1CCCCC1 MCULE-8959024132 [1,0,0,0,1,0|0,0,2]=4
23  B11R1.36  O=C(O)C(=O)[C@H]1CC=CCC1 MCULE-2654807200 [1,0,0,0,1,0|0,0,2]=4
24  B11R1.39  COC(=O)C[C@@H]1C=C[C@H](C1)O MCULE-2710565886 [1,0,0,0,1,0|2,0,0]=4
25  B11R1.39  COC(=O)C[C@H]1C=C[C@H](C1)O MCULE-8440079209 [1,0,0,0,1,0|2,0,0]=4