0 B8R0.9 CCC(=O)NCC(=O)O HMDB0000783 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.9 NCC(=O)CCC(=O)O HMDB0001149 [0,0,0,0,0,0|3,0,0]=3 2 B8R0.9 NCC(=O)NCC(=O)O HMDB0011733 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.4 CCCCCC(=O)O HMDB0000535 [1,0,0,0,0,0|2,0,1]=4 4 B7R0.4 CCCCCC(C)=O HMDB0003671 [1,0,0,0,0,0|1,0,1]=3 5 B7R0.6 CC(=O)CCC(=O)O HMDB0000720 [1,0,0,0,0,0|0,0,0]=1 6 B7R0.6 CC(=O)CCC(C)C HMDB0031549 [1,0,0,0,0,0|1,0,1]=3 7 B7R0.6 CC(=O)NCC(=O)O HMDB0000532 [1,0,0,0,0,0|1,0,0]=2 8 B7R0.6 CC(C)CCC(=O)O HMDB0000689 [1,0,0,0,0,0|1,0,1]=3 9 B7R0.6 N=C(N)NCC(=O)O HMDB0000128 [1,0,0,0,0,0|3,0,0]=4 10 B7R0.6 O=C(O)CCC(=O)O HMDB0000254 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.6 O=C(O)\C=C\C(=O)O HMDB0000134 [1,0,0,0,0,0|1,0,2]=4 12 B7R0.6 O=C(O)\C=C\C(=O)O HMDB0000176 [1,0,0,0,0,0|1,0,2]=4 13 B9R0.7 CC(C)C(=O)NCC(=O)O HMDB0000730 [0,1,0,0,0,0|3,0,0]=4 14 B9R0.7 O=C(O)CCC(=O)C(=O)O HMDB0000208 [0,1,0,0,0,0|3,0,0]=4 15 B9R0.24 COC(=O)CCC(=O)CN HMDB0015127 [0,1,0,0,0,0|0,0,0]=1 16 B9R0.48 CCCC(=O)NCC(=O)O HMDB0000808 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.35 O=C1CCC(C(=O)O)O1 HMDB0059743 [0,0,0,1,0,0|3,0,0]=4 18 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HMDB0000267 [0,0,0,1,0,0|3,0,0]=4 19 B9R0.1 COC(=O)CCCC(=O)O HMDB0000858 [0,0,0,0,0,1|1,0,0]=2 20 B6R0.1 CCCC(=O)CC HMDB0000753 [2,0,0,0,0,0|1,0,0]=3 21 B6R0.1 CCCC(=O)CO HMDB0059678 [2,0,0,0,0,0|2,0,0]=4 22 B6R0.4 C=CCCC(=O)O HMDB0031602 [2,0,0,0,0,0|0,0,1]=3 23 B6R0.4 CCCCC(=O)O HMDB0000892 [2,0,0,0,0,0|0,0,1]=3 24 B6R0.4 CCCCC(C)=O HMDB0005842 [2,0,0,0,0,0|0,0,1]=3 25 B6R0.4 CSCCC(=O)O HMDB0001527 [2,0,0,0,0,0|1,0,0]=3 26 B6R0.4 NCCCC(=O)O HMDB0000112 [2,0,0,0,0,0|1,0,1]=4 27 B6R0.4 O=C(O)CCCO HMDB0000710 [2,0,0,0,0,0|0,0,2]=4 28 B6R0.4 O=CCCC(=O)O HMDB0001259 [2,0,0,0,0,0|0,0,0]=2 29 B6R0.6 CCCCCC=O HMDB0005994 [2,0,0,0,0,0|1,0,1]=4 30 B8R0.28 CC(=O)CCCC(C)=O HMDB0029165 [1,1,0,0,0,0|1,0,1]=4 31 B8R0.23 CC(=O)N[C@@H](C)C(=O)O HMDB0000766 [1,1,0,0,0,0|1,0,0]=3 32 B8R0.23 CC(C)CC(O)C(=O)O HMDB0000665 [1,1,0,0,0,0|1,0,1]=4 33 B8R0.23 CC(C)C[C@H](N)C(=O)O HMDB0000687 [1,1,0,0,0,0|1,0,1]=4 34 B8R0.23 CC(C)C[C@H](O)C(=O)O HMDB0000746 [1,1,0,0,0,0|1,0,1]=4 35 B8R0.23 CC(CC(=O)O)C(=O)O HMDB0001844 [1,1,0,0,0,0|1,0,0]=3 36 B8R0.23 NC(=O)C[C@H](N)C(=O)O HMDB0000168 [1,1,0,0,0,0|1,0,0]=3 37 B8R0.23 N[C@@H](CC(=O)O)C(=O)O HMDB0000191 [1,1,0,0,0,0|1,0,0]=3 38 B8R0.23 N[C@H](CC(=O)O)C(=O)O HMDB0006483 [1,1,0,0,0,0|1,0,0]=3 39 B8R0.23 O=C(O)CC(=O)C(=O)O HMDB0000223 [1,1,0,0,0,0|1,0,1]=4 40 B8R0.23 O=C(O)CC(O)C(=O)O HMDB0000744 [1,1,0,0,0,0|1,0,0]=3 41 B8R0.23 O=C(O)C[C@H](O)C(=O)O HMDB0000156 [1,1,0,0,0,0|1,0,0]=3 42 B8R0.2 CCC(=O)C(C)C(=O)O HMDB0000408 [0,1,0,0,1,0|2,0,0]=4 43 B8R0.2 COC(=O)[C@H](C)[C@H](C)O HMDB0059770 [0,1,0,0,1,0|0,0,2]=4 44 B10R0.96 CC(=O)CC(=O)CCC(=O)O HMDB0000635 [0,2,0,0,0,0|2,0,0]=4 45 B8R1.18 CN1CC(=O)NC1=O HMDB0003646 [0,0,0,1,1,0|2,0,0]=4 46 B10R1.332 O=C1CCC(O)C(O)CO1 HMDB0002173 [0,1,0,1,0,0|0,0,2]=4 47 B6R0.2 C=C(C)CC(=O)O HMDB0170858 [1,0,0,0,1,0|1,0,0]=3 48 B6R0.2 CC(=O)CC(=O)O HMDB0000060 [1,0,0,0,1,0|0,0,0]=2 49 B6R0.2 CC(=O)CC(C)C HMDB0002939 [1,0,0,0,1,0|1,0,1]=4 50 B6R0.2 CC(C)=CC(=O)O HMDB0000509 [1,0,0,0,1,0|1,0,1]=4 51 B6R0.2 CC(C)CC(=O)O HMDB0000718 [1,0,0,0,1,0|1,0,1]=4 52 B6R0.2 CC(O)CC(=O)O HMDB0000357 [1,0,0,0,1,0|0,0,2]=4 53 B6R0.2 CN(C)CC(=O)O HMDB0000092 [1,0,0,0,1,0|2,0,0]=4 54 B6R0.2 C[C@@H](O)CC(=O)O HMDB0000011 [1,0,0,0,1,0|0,0,2]=4 55 B6R0.2 C[C@H](O)CC(=O)O HMDB0000442 [1,0,0,0,1,0|0,0,2]=4 56 B6R0.2 O=C(O)CC(=O)O HMDB0000691 [1,0,0,0,1,0|1,0,0]=3 57 B6R0.3 CCC(=O)C(=O)O HMDB0000005 [0,0,0,0,2,0|2,0,0]=4