0 B10R0.96 CC(=O)CC(=O)CCC(O)=O HMDB0000635 [0,0,0,0,0,0|3,0,1]=4 1 B9R0.4 CCCOC(=O)CC(C)C HMDB0032047 [1,0,0,0,0,0|1,0,1]=3 2 B9R0.48 C/C=C\C(=O)OCC(C)C HMDB0036212 [1,0,0,0,0,0|0,0,1]=2 3 B9R0.48 CCCC(=O)OCC(C)=C HMDB0036236 [1,0,0,0,0,0|0,0,3]=4 4 B9R0.48 CCCC(=O)OCC(C)C HMDB0034161 [1,0,0,0,0,0|0,0,1]=2 5 B9R0.48 CCOC(=O)CCC(C)C HMDB0032272 [1,0,0,0,0,0|2,0,1]=4 6 B9R0.55 CC(C)CCCCC(O)=O HMDB0031588 [1,0,0,0,0,0|2,0,1]=4 7 B11R0.93 CSC(C)CC(=O)OCC(C)C HMDB0032346 [0,1,0,0,0,0|0,1,1]=3 8 B11R0.107 CCC(C)COC(=O)C=C(C)C HMDB0032393 [0,1,0,0,0,0|1,0,1]=3 9 B9R0.53 CC(C)CC(=O)CC(C)C HMDB0013821 [0,0,0,0,1,0|1,0,1]=3 10 B9R0.53 CC(C)CC(=O)CC(C)C HMDB0031417 [0,0,0,0,1,0|1,0,1]=3 11 B9R0.53 CC(C)CC(=O)OC(C)C HMDB0032046 [0,0,0,0,1,0|1,0,1]=3 12 B9R0.53 CC(C)CC(O)CC(O)=O HMDB0002207 [0,0,0,0,1,0|1,0,2]=4 13 B9R0.53 CC(C)SC(=O)C=C(C)C HMDB0032354 [0,0,0,0,1,0|1,1,1]=4 14 B9R0.53 C[C@H](N)CC(=O)CC(O)=O HMDB0012131 [0,0,0,0,1,0|2,0,0]=3 15 B11R0.6 CC(C)CCOC(=O)C=C(C)C HMDB0040530 [0,0,0,0,0,1|1,0,1]=3 16 B11R0.6 CC(C)CCOC(=O)CC(C)C HMDB0030029 [0,0,0,0,0,1|1,0,1]=3 17 B8R0.1 CCCC(=O)OCSC HMDB0038299 [2,0,0,0,0,0|1,0,1]=4 18 B8R0.1 CCCCC(=O)/C=C\C HMDB0031301 [2,0,0,0,0,0|1,0,1]=4 19 B8R0.1 CCCOC(=O)CCC HMDB0039618 [2,0,0,0,0,0|0,0,1]=3 20 B8R0.5 CCCC(=O)CC(O)=O HMDB0010717 [2,0,0,0,0,0|1,0,0]=3 21 B8R0.5 CCOC(=O)CC(C)=O HMDB0031216 [2,0,0,0,0,0|0,0,0]=2 22 B8R0.5 CCOC(=O)CC(C)=O HMDB0031218 [2,0,0,0,0,0|0,0,0]=2 23 B8R0.5 CCOC(=O)CC(C)C HMDB0030028 [2,0,0,0,0,0|1,0,1]=4 24 B8R0.5 CCOC(=O)CC(C)S HMDB0032271 [2,0,0,0,0,0|0,1,1]=4 25 B8R0.5 CCOC(=O)CC(O)=O HMDB0000576 [2,0,0,0,0,0|1,0,0]=3 26 B8R0.7 CCCCCCC(C)=O HMDB0031294 [2,0,0,0,0,0|1,0,1]=4 27 B8R0.9 COC(=O)CCC(C)C HMDB0036238 [2,0,0,0,0,0|2,0,0]=4 28 B10R0.6 CCCCCC(=O)CC(C)=O HMDB0031263 [1,1,0,0,0,0|1,0,0]=3 29 B10R0.6 CCCCCC(=O)CC(O)=O HMDB0010721 [1,1,0,0,0,0|2,0,0]=4 30 B10R0.6 CCCCCC(=O)CC([O-])=O HMDB0039845 [1,1,0,0,0,0|2,0,0]=4 31 B10R0.6 CCCCOC(=O)CC(C)C HMDB0032042 [1,1,0,0,0,0|1,0,1]=4 32 B10R0.57 C/C=C(/C)C(=O)OCC(C)C HMDB0037629 [1,1,0,0,0,0|0,0,1]=3 33 B10R0.31 C[N+](C)(C)CC(=O)CC([O-])=O HMDB0012154 [0,1,0,0,1,0|2,0,0]=4 34 B10R1.329 CC1=CC(=O)CC(C)(C)C1 HMDB0031195 [0,0,0,1,1,0|1,0,1]=4 35 B10R1.329 CC1=CC(C)(C)CC(=O)C1 HMDB0040338 [0,0,0,1,1,0|1,0,0]=3 36 B8R0.8 CCC/C=C(\C)C(C)=O HMDB0031590 [1,0,0,0,1,0|2,0,0]=4 37 B8R0.8 CCCCC(=O)C(C)=O HMDB0031476 [1,0,0,0,1,0|1,0,0]=3 38 B8R0.8 CCCCC(=O)C(O)=O HMDB0001864 [1,0,0,0,1,0|2,0,0]=4 39 B8R0.8 CCCOC(=O)C(C)S HMDB0032495 [1,0,0,0,1,0|0,1,1]=4 40 B8R0.28 CC(C)C/C=C/C(C)=O HMDB0032403 [1,0,0,0,1,0|0,0,1]=3 41 B8R0.28 CC(C)CCCC(O)=O HMDB0031595 [1,0,0,0,1,0|1,0,1]=4 42 B8R0.28 CC(C)CCOC(C)=O HMDB0031528 [1,0,0,0,1,0|1,0,1]=4 43 B8R0.23 CC(C)CC(=O)C(C)=O HMDB0031593 [0,0,0,0,2,0|0,0,0]=2 44 B8R0.23 CC(C)CC(=O)C(O)=O HMDB0000695 [0,0,0,0,2,0|1,0,0]=3 45 B10R0.3 CCCC(=O)OCCC(C)C HMDB0040221 [1,0,0,0,0,1|0,0,1]=3 46 B10R0.97 CC(C)CCCCOC(C)=O HMDB0032406 [1,0,0,0,0,1|1,0,1]=4