0 B11R0.6 CC(C)=CCCC(C)=CC(O)=O HMDB0036103 [0,0,0,0,0,0|0,0,2]=2 1 B11R0.6 CC(C)CCCC(C)OC(C)=O HMDB0032070 [0,0,0,0,0,0|2,0,2]=4 2 B11R0.6 CC(CCC=C(C)C)CC(O)=O HMDB0035837 [0,0,0,0,0,0|0,0,0]=0 3 B11R0.6 CC(CCC=C(C)C)OC(C)=O HMDB0030031 [0,0,0,0,0,0|2,0,0]=2 4 B11R0.6 CC(O)/C=C(\C)CCC=C(C)C HMDB0032238 [0,0,0,0,0,0|1,0,3]=4 5 B10R0.3 CC(C)=CC/C=C(\C)CC=O HMDB0030893 [1,0,0,0,0,0|0,0,2]=3 6 B10R0.3 CC(C)=CCC/C(C)=C/C=C HMDB0035792 [1,0,0,0,0,0|1,0,2]=4 7 B10R0.3 CC(C)=CCC/C(C)=C/C=O HMDB0035078 [1,0,0,0,0,0|0,0,2]=3 8 B10R0.3 CC(C)=CCC/C(C)=C/C=O HMDB0035092 [1,0,0,0,0,0|0,0,2]=3 9 B10R0.3 CC(C)=CCC/C(C)=C/CO HMDB0035155 [1,0,0,0,0,0|0,0,3]=4 10 B10R0.3 CC(C)CCCC(C)CC=O HMDB0032241 [1,0,0,0,0,0|0,0,2]=3 11 B10R0.3 CC(C)CCCC(C)CCO HMDB0035411 [1,0,0,0,0,0|0,0,3]=4 12 B10R0.3 CC(CCC=C(C)C)CC=O HMDB0035841 [1,0,0,0,0,0|0,0,0]=1 13 B10R0.3 CC(CCO)CCCC(C)=C HMDB0037171 [1,0,0,0,0,0|0,0,3]=4 14 B10R0.3 C[C@@H](CCO)CCC=C(C)C HMDB0035093 [1,0,0,0,0,0|0,0,1]=2 15 B10R0.3 C[C@@H](CCO)CCC=C(C)C HMDB0035094 [1,0,0,0,0,0|0,0,1]=2 16 B10R0.3 C[C@H](CCC=C(C)C)CC=O HMDB0035820 [1,0,0,0,0,0|0,0,0]=1 17 B10R0.3 C[C@H](CCC=C(C)C)CC=O HMDB0035842 [1,0,0,0,0,0|0,0,0]=1 18 B10R0.6 CCCCCC(O)CC(O)=O HMDB0001954 [1,0,0,0,0,0|1,0,2]=4 19 B10R0.6 [C@@H](O)(CCCCC)CC(O)=O HMDB0010722 [1,0,0,0,0,0|1,0,2]=4 20 B10R0.97 CC(=O)NCCCCC(O)=O HMDB0012175 [1,0,0,0,0,0|2,0,0]=3 21 B10R0.97 CC(O)CCCCCC(O)=O HMDB0000486 [1,0,0,0,0,0|1,0,2]=4 22 B10R0.97 OC(=O)CCCCCC(O)=O HMDB0000857 [1,0,0,0,0,0|2,0,1]=4 23 B12R0.140 CC(CCC=C(C)C)CC(C)(C)O HMDB0032543 [0,1,0,0,0,0|1,0,1]=3 24 B12R0.240 COC(=O)CC(C)CCC=C(C)C HMDB0037225 [0,1,0,0,0,0|0,0,0]=1 25 B12R1.1218 CC(C)C1CCC(C)CC(=O)O1 HMDB0040330 [0,0,0,1,0,0|0,0,2]=3 26 B10R0.96 C[C@@H](CCC(O)=O)CC(O)=O HMDB0000555 [0,0,0,0,1,0|2,0,0]=3 27 B10R0.96 OC(CCC(O)=O)CC(O)=O HMDB0000345 [0,0,0,0,1,0|3,0,0]=4 28 B10R0.98 CC(=O)NCC[C@H](N)C(O)=O HMDB0031411 [0,0,0,0,1,0|3,0,0]=4 29 B10R0.98 CC(=O)OCCC(N)C(O)=O HMDB0029423 [0,0,0,0,1,0|3,0,0]=4 30 B10R0.98 CC(C)=CC/C=C(\C)C(O)=O HMDB0035135 [0,0,0,0,1,0|0,0,2]=3 31 B12R0.44 CC(C)CCCC(C)CCC(O)=O HMDB0002373 [0,0,0,0,0,1|0,0,2]=3 32 B9R0.1 CC(CCC=C(C)C)C=O HMDB0031834 [2,0,0,0,0,0|0,0,0]=2 33 B9R0.1 CC(CO)CCCC(C)=C HMDB0037304 [2,0,0,0,0,0|0,0,2]=4 34 B9R0.2 CC/C=C\CCCC(O)=O HMDB0032207 [2,0,0,0,0,0|0,0,2]=4 35 B9R0.2 CCCCCCCC(O)=O HMDB0000482 [2,0,0,0,0,0|0,0,2]=4 36 B11R0.180 CC(CCCC(C)(C)O)CC=O HMDB0031739 [1,1,0,0,0,0|0,0,2]=4 37 B11R0.29 CC(C)=CCSCC(N)C(O)=O HMDB0012286 [1,1,0,0,0,0|1,0,0]=3 38 B11R0.29 CN(C)CCCCC(N)C(O)=O HMDB0013287 [1,1,0,0,0,0|1,0,1]=4 39 B13R0.1592 CC(C)=CCCC(C)(OC(C)=O)C=C HMDB0039522 [0,2,0,0,0,0|2,0,0]=4 40 B11R1.64 CC1CCC(C1C=O)C(C)=C HMDB0038290 [1,0,0,1,0,0|0,0,2]=4 41 B11R1.157 CC1CCOC(C1)C=C(C)C HMDB0036097 [1,0,0,1,0,0|0,0,1]=3 42 B11R1.166 CC(C)=C1CCC(C)=CC1=O HMDB0036999 [1,0,0,1,0,0|0,0,2]=4 43 B11R1.166 CC(C)[C@@H]1CC[C@@H](C)CC1=O HMDB0035162 [1,0,0,1,0,0|0,0,2]=4 44 B11R1.166 CC(C)[C@@H]1CC[C@H](C)CC1=O HMDB0034972 [1,0,0,1,0,0|0,0,2]=4 45 B11R1.166 CC(C)[C@H]1CC[C@H](C)CC1=O HMDB0035783 [1,0,0,1,0,0|0,0,2]=4 46 B11R1.166 CC1CCC(=C(C)C)C(=O)C1 HMDB0035604 [1,0,0,1,0,0|0,0,0]=2 47 B11R1.166 CC1CCC(C(C)=C)C(=O)C1 HMDB0035741 [1,0,0,1,0,0|0,0,2]=4 48 B11R1.20 OC1CCC(CC(O)=O)CC1 HMDB0000451 [0,0,0,1,1,0|1,0,1]=4 49 B11R1.20 O[C@H]1CC[C@H](CC(O)=O)CC1 HMDB0000909 [0,0,0,1,1,0|1,0,1]=4 50 B13R1.5899 CC1COC(C)(CCC=C(C)C)O1 HMDB0032404 [0,0,0,1,0,1|1,0,1]=4 51 B13R2.5151 CC1CCC2C1C(=O)OC=C2C HMDB0035063 [0,0,0,2,0,0|0,0,2]=4 52 B13R2.5151 CC1CCC2C1C(=O)OCC2C HMDB0035829 [0,0,0,2,0,0|0,0,2]=4 53 B9R0.47 C/C=C\SCC(N)C(O)=O HMDB0029440 [1,0,0,0,1,0|2,0,0]=4 54 B9R0.47 CCCCCC(C)C(O)=O HMDB0031587 [1,0,0,0,1,0|0,0,2]=4 55 B9R0.55 CC(=O)NCCCC(O)=O HMDB0003681 [1,0,0,0,1,0|2,0,0]=4 56 B9R0.55 CC(C)CCCCC(O)=O HMDB0031588 [1,0,0,0,1,0|0,0,1]=3 57 B9R0.7 CC(CCC(O)=O)C(O)=O HMDB0000422 [0,0,0,0,2,0|2,0,0]=4 58 B9R0.53 CC(C)CC(O)CC(O)=O HMDB0002207 [0,0,0,0,2,0|1,0,1]=4 59 B9R0.53 CC(CC(O)=O)CC(O)=O HMDB0000752 [0,0,0,0,2,0|2,0,0]=4 60 B11R0.46 CCCCCC(C)CCC(O)=O HMDB0034849 [1,0,0,0,0,1|0,0,2]=4 61 B11R0.30 CC(C)/C=C/CCCCC(O)=O HMDB0012183 [1,0,0,0,0,1|0,0,1]=3 62 B11R0.30 OC(=O)CCCC/C=C/C(O)=O HMDB0000341 [1,0,0,0,0,1|2,0,0]=4 63 B13R0.1398 CC(C)=CCC/C(C)=C\CCC(C)=O HMDB0031846 [0,0,0,0,0,2|1,0,1]=4 64 B13R0.1398 CC(C)=CCC/C(C)=C\COC(C)=O HMDB0035157 [0,0,0,0,0,2|1,0,1]=4 65 B13R0.1398 CC(CCCC(C)=O)CCC=C(C)C HMDB0041490 [0,0,0,0,0,2|1,0,0]=3 66 B13R0.1398 CC(CCOC(C)=O)CCC=C(C)C HMDB0034160 [0,0,0,0,0,2|1,0,0]=3 67 B13R0.1398 C[C@@H](CCOC(C)=O)CCC=C(C)C HMDB0034844 [0,0,0,0,0,2|1,0,0]=3