0 B11R0.148 CCCC/C=C/CCCC(O)=O HMDB0039768 [0,0,0,0,0,0|0,0,4]=4 1 B11R0.148 CCCCC/C=C\CCC(O)=O HMDB0004980 [0,0,0,0,0,0|0,0,4]=4 2 B11R0.148 CCCCCC/C=C\CC(O)=O HMDB0031002 [0,0,0,0,0,0|0,0,2]=2 3 B11R0.148 CCCCCCC/C=C/C(O)=O HMDB0010726 [0,0,0,0,0,0|0,0,0]=0 4 B11R0.148 CCCCCCCCCC(C)O HMDB0030942 [0,0,0,0,0,0|1,0,3]=4 5 B11R0.148 CCCCCCCCCC(O)=O HMDB0000511 [0,0,0,0,0,0|0,0,2]=2 6 B11R0.148 CCCCCCCCOC(C)=O HMDB0038602 [0,0,0,0,0,0|2,0,1]=3 7 B11R0.148 OC(=O)CCCCCCCC=C HMDB0031003 [0,0,0,0,0,0|0,0,4]=4 8 B10R0.4 CCCCCC/C=C\C(O)=O HMDB0031271 [1,0,0,0,0,0|0,0,0]=1 9 B10R0.4 CCCCCCCCC(C)=O HMDB0031409 [1,0,0,0,0,0|1,0,1]=3 10 B10R0.4 CCCCCCCCC(O)=O HMDB0000847 [1,0,0,0,0,0|0,0,1]=2 11 B10R0.4 CCCCCCCOC(C)=O HMDB0031480 [1,0,0,0,0,0|2,0,0]=3 12 B10R0.4 NCCCNCCCC(O)=O HMDB0006009 [1,0,0,0,0,0|2,0,1]=4 13 B10R0.4 [NH3+]CCCCNCCC(O)=O HMDB0006078 [1,0,0,0,0,0|2,0,1]=4 14 B10R0.71 CCCCC/C=C/C=C/CO HMDB0036196 [1,0,0,0,0,0|0,0,3]=4 15 B10R0.71 CCCCC/C=C\C=C\C=C HMDB0030944 [1,0,0,0,0,0|1,0,2]=4 16 B10R0.71 CCCCCCC/C=C/C=O HMDB0030999 [1,0,0,0,0,0|0,0,0]=1 17 B10R0.71 CCCCCCC/C=C/CO HMDB0032532 [1,0,0,0,0,0|0,0,1]=2 18 B10R0.71 CCCCCCCCCC=C HMDB0029551 [1,0,0,0,0,0|1,0,2]=4 19 B10R0.71 CCCCCCCCCC=O HMDB0011623 [1,0,0,0,0,0|0,0,2]=3 20 B10R0.71 CCCCCCCCCCO HMDB0011624 [1,0,0,0,0,0|0,0,3]=4 21 B10R0.71 OCCC=CCCCCCC HMDB0013810 [1,0,0,0,0,0|0,0,3]=4 22 B12R0.4 CCCCCC/C=C(/C)CC(O)=O HMDB0031062 [0,1,0,0,0,0|0,0,2]=3 23 B12R0.4 CCCCCCCC(=O)CC(O)=O HMDB0010724 [0,1,0,0,0,0|0,0,1]=2 24 B12R0.4 CCCCCCCC(=O)CC([O-])=O HMDB0039846 [0,1,0,0,0,0|0,0,2]=3 25 B12R0.4 CCCCCCCC(O)CC(O)=O HMDB0002203 [0,1,0,0,0,0|0,0,2]=3 26 B12R0.4 [C@@H](O)(CCCCCCC)CC(O)=O HMDB0010725 [0,1,0,0,0,0|0,0,2]=3 27 B12R0.184 CCC(C)CCCCCCC(O)=O HMDB0038237 [0,1,0,0,0,0|0,0,2]=3 28 B12R0.234 CCCCCCCCCCC(C)=O HMDB0031019 [0,1,0,0,0,0|1,0,2]=4 29 B12R0.234 CCCCCCCCCCC(O)=O HMDB0000947 [0,1,0,0,0,0|0,0,2]=3 30 B12R0.234 CCCCCCCCCOC(C)=O HMDB0040266 [0,1,0,0,0,0|1,0,2]=4 31 B12R0.234 OC(=O)CCCCCCCCC=C HMDB0033724 [0,1,0,0,0,0|0,0,3]=4 32 B12R0.248 CCCCC/C=C\C=C\C(=O)OC HMDB0034730 [0,1,0,0,0,0|0,0,2]=3 33 B12R0.248 CCCCCCC/C=C/C(=O)OC HMDB0032396 [0,1,0,0,0,0|0,0,0]=1 34 B12R0.248 CCCCCCCCCC(=O)OC HMDB0033848 [0,1,0,0,0,0|0,0,2]=3 35 B12R0.248 CCCCCCCCOC(=O)CC HMDB0034134 [0,1,0,0,0,0|2,0,1]=4 36 B12R0.251 CCCCCCCCC(=O)C(C)=O HMDB0031843 [0,1,0,0,0,0|1,0,1]=3 37 B12R0.255 CCCCCCC(=O)NCC(O)=O HMDB0013010 [0,1,0,0,0,0|1,0,2]=4 38 B12R0.268 CC(C)CCCCCCCC(O)=O HMDB0034456 [0,1,0,0,0,0|0,0,2]=3 39 B12R1.28 CCCCCC1=CC=CC(=O)O1 HMDB0031085 [0,0,0,1,0,0|0,0,2]=3 40 B12R1.252 CC(=O)OCCC1CCCCC1 HMDB0031362 [0,0,0,1,0,0|2,0,1]=4 41 B9R0.2 CC/C=C\CCCC(O)=O HMDB0032207 [2,0,0,0,0,0|0,0,2]=4 42 B9R0.2 CCC/C=C/CCC(O)=O HMDB0039793 [2,0,0,0,0,0|0,0,2]=4 43 B9R0.2 CCCCC/C=C/C(O)=O HMDB0001568 [2,0,0,0,0,0|0,0,0]=2 44 B9R0.2 CCCCC/C=C\C(O)=O HMDB0000392 [2,0,0,0,0,0|0,0,0]=2 45 B9R0.2 CCCCCCCC(C)=O HMDB0031266 [2,0,0,0,0,0|1,0,0]=3 46 B9R0.2 CCCCCCCC(C)O HMDB0033916 [2,0,0,0,0,0|1,0,1]=4 47 B9R0.2 CCCCCCCC(O)=O HMDB0000482 [2,0,0,0,0,0|0,0,0]=2 48 B9R0.2 CCCCCCC[N+](O)=O HMDB0013811 [2,0,0,0,0,0|1,0,0]=3 49 B9R0.2 CCCCCCOC(C)=O HMDB0029980 [2,0,0,0,0,0|2,0,0]=4 50 B9R0.45 CC/C=C\CC/C=C\C=O HMDB0031261 [2,0,0,0,0,0|0,0,2]=4 51 B9R0.45 CCCCCC/C=C/CO HMDB0041498 [2,0,0,0,0,0|0,0,1]=3 52 B9R0.45 CCCCCC/C=C\C=O HMDB0031269 [2,0,0,0,0,0|0,0,0]=2 53 B9R0.45 CCCCCC/C=C\CO HMDB0041499 [2,0,0,0,0,0|0,0,1]=3 54 B9R0.45 CCCCCCCCCO HMDB0031265 [2,0,0,0,0,0|0,0,2]=4 55 B11R0.2 CCCCCCC(O)CC(O)=O HMDB0031513 [1,1,0,0,0,0|0,0,1]=3 56 B11R0.30 OC(=O)CCCC/C=C/C(O)=O HMDB0000341 [1,1,0,0,0,0|1,0,1]=4 57 B11R0.40 CCCCC/C=C\CC(=O)OC HMDB0029859 [1,1,0,0,0,0|0,0,2]=4 58 B11R0.40 CCCCCC/C=C\C(=O)OC HMDB0040194 [1,1,0,0,0,0|0,0,0]=2 59 B11R0.40 CCCCCCC#CC(=O)OC HMDB0031273 [1,1,0,0,0,0|0,0,2]=4 60 B11R0.40 CCCCCCCCC(=O)OC HMDB0031264 [1,1,0,0,0,0|0,0,1]=3 61 B11R0.46 CCCCCC(C)CCC(O)=O HMDB0034849 [1,1,0,0,0,0|0,0,1]=3 62 B11R0.147 CCCCC(S)CCOC(C)=O HMDB0032372 [1,1,0,0,0,0|2,0,0]=4 63 B11R0.176 OC(=O)CCCCC(S)CCS HMDB0012210 [1,1,0,0,0,0|1,0,1]=4 64 B11R0.3 CCCCCC/C=C/C=C/C=O HMDB0031359 [1,1,0,0,0,0|0,0,1]=3 65 B11R0.3 CCCCCCCC/C=C/CO HMDB0034856 [1,1,0,0,0,0|0,0,1]=3 66 B11R0.3 CCCCCCCC/C=C/OC HMDB0032379 [1,1,0,0,0,0|0,0,1]=3 67 B11R0.3 CCCCCCCCCCC=O HMDB0030941 [1,1,0,0,0,0|0,0,2]=4 68 B11R0.4 CCCCCCOC(=O)/C=C\C HMDB0036211 [1,1,0,0,0,0|2,0,0]=4 69 B13R0.54 CCCCCC/C=C\CCCC(O)=O HMDB0000529 [0,2,0,0,0,0|0,0,2]=4 70 B13R0.54 CCCCCCCCC/C=C/C(O)=O HMDB0010729 [0,2,0,0,0,0|0,0,0]=2 71 B13R0.54 CCCCCCCCCCCC(O)=O HMDB0000638 [0,2,0,0,0,0|0,0,2]=4 72 B13R0.54 OC(=O)CCCCCCCCCC=C HMDB0032248 [0,2,0,0,0,0|0,0,2]=4 73 B13R0.147 CCCCCCCCC#CC(=O)OC HMDB0030945 [0,2,0,0,0,0|0,0,2]=4 74 B13R0.154 CCCCCCCC(=O)NCC(O)=O HMDB0000832 [0,2,0,0,0,0|0,0,1]=3 75 B13R0.2 CCCCC/C=C\C=C\C(=O)OCC HMDB0036599 [0,2,0,0,0,0|0,0,2]=4 76 B13R0.2 CCCCCCC/C=C/C(=O)OCC HMDB0037329 [0,2,0,0,0,0|0,0,0]=2 77 B13R0.2 CCCCCCCCCC(=O)OCC HMDB0030998 [0,2,0,0,0,0|0,0,2]=4 78 B11R1.24 CCCCC1CCCC(=O)O1 HMDB0031514 [1,0,0,1,0,0|0,0,1]=3 79 B11R1.27 CCCCCC1CCC(=O)O1 HMDB0031531 [1,0,0,1,0,0|0,0,1]=3 80 B11R1.27 CCCCCC1OC(=O)C=C1 HMDB0032442 [1,0,0,1,0,0|0,0,0]=2 81 B11R1.4 CCCCCCC1=CC=CS1 HMDB0032329 [1,0,0,1,0,0|0,1,1]=4 82 B13R1.1882 CCCCCCC1CC1CC(O)=O HMDB0031087 [0,1,0,1,0,0|0,0,2]=4