0  B7R0.5  NC(CCS)C(O)=O HMDB0000742 [0,1,0,0,0,0|2,0,0]=3
1  B7R0.5  NCCC(N)C(O)=O HMDB0002362 [0,1,0,0,0,0|2,0,0]=3
2  B7R1.4  NN1CCOC1=O HMDB0060739 [0,0,0,1,0,0|3,0,0]=4
3  B7R1.4  N[C@@H]1CONC1=O HMDB0014405 [0,0,0,1,0,0|3,0,0]=4
4  B4R0.1  CC(O)CO HMDB0001881 [2,0,0,0,0,0|1,0,1]=4
5  B4R0.2  C/C=C\C=O HMDB0034233 [2,0,0,0,0,0|0,0,2]=4
6  B6R0.3  CC[C@H](N)C(O)=O HMDB0000452 [1,1,0,0,0,0|1,0,1]=4
7  B6R0.4  CCCOC(C)=O HMDB0034237 [1,1,0,0,0,0|0,0,1]=3
8  B6R0.4  OCCCC([O-])=O HMDB0015507 [1,1,0,0,0,0|1,0,1]=4
9  B8R0.2  CC[C@H](C)[C@H](N)C(O)=O HMDB0000172 [0,2,0,0,0,0|1,0,0]=3
10  B8R0.23  CC(C)C[C@H](N)C(O)=O HMDB0000687 [0,2,0,0,0,0|1,0,0]=3
11  B8R0.8  CSCC[C@H](N)C(O)=O HMDB0000696 [0,2,0,0,0,0|1,0,0]=3
12  B8R1.1  OC1CCN(C1)N=O HMDB0061163 [0,1,0,1,0,0|2,0,0]=4
13  B8R1.2  O=NC1CCNCC1 HMDB0061162 [0,1,0,1,0,0|1,0,0]=3
14  B8R1.7  OC(=O)[C@@H]1CCCN1 HMDB0000162 [0,1,0,1,0,0|1,0,0]=3