0 B8R0.23 CC(=O)N[C@@H](C)C(=O)O HMDB0000766 [0,0,0,0,0,0|2,0,0]=2 1 B8R0.23 CC(CC(=O)O)C(=O)O HMDB0001844 [0,0,0,0,0,0|3,0,0]=3 2 B8R0.23 C\C(=C\C(=O)O)C(=O)O HMDB0000634 [0,0,0,0,0,0|3,0,1]=4 3 B8R0.23 NC(=O)C[C@H](N)C(=O)O HMDB0000168 [0,0,0,0,0,0|4,0,0]=4 4 B8R0.23 N[C@@H](CC(=O)O)C(=O)O HMDB0000191 [0,0,0,0,0,0|4,0,0]=4 5 B8R0.23 N[C@H](CC(=O)O)C(=O)O HMDB0006483 [0,0,0,0,0,0|4,0,0]=4 6 B8R0.23 O=C(O)CC(O)C(=O)O HMDB0000744 [0,0,0,0,0,0|4,0,0]=4 7 B8R0.23 O=C(O)C[C@H](O)C(=O)O HMDB0000156 [0,0,0,0,0,0|4,0,0]=4 8 B7R0.6 CC(=O)CCC(=O)O HMDB0000720 [1,0,0,0,0,0|2,0,0]=3 9 B7R0.6 CC(=O)CCC(C)C HMDB0031549 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.6 CC(=O)NCC(=O)O HMDB0000532 [1,0,0,0,0,0|2,0,0]=3 11 B7R0.6 O=C(O)CCC(=O)O HMDB0000254 [1,0,0,0,0,0|3,0,0]=4 12 B9R0.11 CC(O)(CC(=O)O)C(=O)O HMDB0000426 [0,1,0,0,0,0|3,0,0]=4 13 B9R0.39 CC(=O)N[C@@H](CO)C(=O)O HMDB0002931 [0,1,0,0,0,0|2,0,0]=3 14 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O HMDB0001890 [0,1,0,0,0,0|2,0,0]=3 15 B9R1.35 O=C1CCC(C(=O)O)O1 HMDB0059743 [0,0,0,1,0,0|1,0,0]=2 16 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HMDB0000267 [0,0,0,1,0,0|2,0,0]=3 17 B7R0.16 CC(=O)C(C)C(=O)O HMDB0003771 [0,0,0,0,1,0|1,0,0]=2 18 B7R0.16 CC(C(=O)O)C(=O)O HMDB0000202 [0,0,0,0,1,0|2,0,0]=3 19 B7R0.16 CC(O)C(C)C(=O)O HMDB0000354 [0,0,0,0,1,0|1,0,2]=4 20 B7R0.16 NC(C(=O)O)C(=O)O HMDB0001147 [0,0,0,0,1,0|3,0,0]=4 21 B9R0.7 CC(=O)OC[C@H](N)C(=O)O HMDB0003011 [0,0,0,0,0,1|2,0,0]=3 22 B9R0.7 CC(CCC(=O)O)C(=O)O HMDB0000422 [0,0,0,0,0,1|3,0,0]=4 23 B9R0.7 CC(CNC(N)=O)C(=O)O HMDB0002031 [0,0,0,0,0,1|3,0,0]=4 24 B9R0.53 CC(CC(=O)O)CC(=O)O HMDB0000752 [0,0,0,0,0,1|3,0,0]=4 25 B6R0.2 CC(=O)CC(C)C HMDB0002939 [2,0,0,0,0,0|1,0,0]=3 26 B6R0.2 CC(C)CC(=O)O HMDB0000718 [2,0,0,0,0,0|2,0,0]=4 27 B6R0.4 CCCCC(C)=O HMDB0005842 [2,0,0,0,0,0|1,0,1]=4 28 B6R0.4 O=CCCC(=O)O HMDB0001259 [2,0,0,0,0,0|2,0,0]=4 29 B6R0.3 CCC(C)C(=O)O HMDB0002176 [2,0,0,0,0,0|1,0,1]=4 30 B6R0.3 CC[C@H](C)C(=O)O HMDB0033742 [2,0,0,0,0,0|1,0,1]=4 31 B8R0.9 CCC(=O)NCC(=O)O HMDB0000783 [1,1,0,0,0,0|2,0,0]=4 32 B8R0.9 NCC(=O)CCC(=O)O HMDB0001149 [1,1,0,0,0,0|2,0,0]=4 33 B8R0.9 NCC(=O)NCC(=O)O HMDB0011733 [1,1,0,0,0,0|2,0,0]=4 34 B8R0.18 CCC(C(=O)O)C(=O)O HMDB0000622 [0,1,0,0,1,0|2,0,0]=4 35 B10R0.31 CC(=O)OC(C)C[N+](C)(C)C HMDB0015654 [0,1,0,0,0,1|2,0,0]=4 36 B10R0.23 CCCC(CC(C)=O)C(=O)O HMDB0060683 [0,2,0,0,0,0|2,0,0]=4 37 B8R0.28 CC(=O)CCCC(C)=O HMDB0029165 [1,0,0,0,0,1|1,0,0]=3