0 B13R2.369 OC1=CC2=CC=CC=C2OC1=O HMDB0002149 [0,0,0,0,0,0|0,0,0]=0 1 B12R2.24 OC1=CC2=CC=CC=C2C=C1 HMDB0012322 [1,0,0,0,0,0|1,0,0]=2 2 B12R2.24 SC1=CC2=C(C=CC=C2)C=C1 HMDB0029689 [1,0,0,0,0,0|1,1,0]=3 3 B14R2.8239 OC1=C(O)C=C2C=CC(=O)OC2=C1 HMDB0030819 [0,1,0,0,0,0|2,0,1]=4 4 B12R1.43 CC(=O)C(/C)=C\C1=CC=CC=C1 HMDB0031567 [0,0,1,0,0,0|2,0,0]=3 5 B12R1.43 CC(=O)C(O)CC1=CC=CC=C1 HMDB0032336 [0,0,1,0,0,0|1,0,2]=4 6 B12R1.43 OC(=O)C(/O)=C/C1=CC=CC=C1 HMDB0012225 [0,0,1,0,0,0|0,0,0]=1 7 B12R1.43 OC(=O)C(=O)CC1=CC=CC=C1 HMDB0000205 [0,0,1,0,0,0|0,0,2]=3 8 B12R1.43 OC(CC1=CC=CC=C1)C(O)=O HMDB0000779 [0,0,1,0,0,0|0,0,2]=3 9 B12R1.43 O[C@H](CC1=CC=CC=C1)C(O)=O HMDB0000748 [0,0,1,0,0,0|0,0,2]=3 10 B12R1.43 [C@H](O)(CC1=CC=CC=C1)C(O)=O HMDB0000563 [0,0,1,0,0,0|0,0,2]=3 11 B12R2.100 O=C1C=C2NC=CC2=CC1=O HMDB0006779 [0,0,0,0,1,0|2,0,1]=4 12 B12R2.100 OC1=C(O)C=C2C=CNC2=C1 HMDB0004058 [0,0,0,0,1,0|2,0,1]=4 13 B11R1.40 C/C(C=O)=C/C1=CC=CC=C1 HMDB0031566 [1,0,1,0,0,0|1,0,0]=3 14 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 HMDB0031617 [1,0,1,0,0,0|1,0,0]=3 15 B11R1.91 CC(O)/C=C\C1=CC=CC=C1 HMDB0031616 [1,0,1,0,0,0|1,0,1]=4 16 B11R1.91 OC(=O)/C=C/C1=CC=CC=C1 HMDB0000930 [1,0,1,0,0,0|0,0,0]=2 17 B11R1.91 OC(=O)/C=C\C1=CC=CC=C1 HMDB0000567 [1,0,1,0,0,0|0,0,0]=2 18 B11R1.91 OC(=O)CCC1=CC=CC=C1 HMDB0000764 [1,0,1,0,0,0|0,0,2]=4 19 B11R1.91 OC(=O)COC1=CC=CC=C1 HMDB0031609 [1,0,1,0,0,0|1,0,1]=4 20 B11R1.17 OC1=CC=CC=C1/C=C/C=O HMDB0031725 [1,0,1,0,0,0|0,0,0]=2 21 B11R1.86 CC(=O)OC1=CC=CC=C1C HMDB0032073 [1,0,1,0,0,0|0,0,2]=4 22 B11R1.86 OC(=O)CC1=CC=CC=C1O HMDB0000669 [1,0,1,0,0,0|0,0,1]=3 23 B11R2.20 C1=CC2=CC=CC=C2C=C1 HMDB0029751 [2,0,0,0,0,0|1,0,0]=3 24 B13R1.133 OC(=O)C(/O)=C/C1=CC=C(O)C=C1 HMDB0006915 [0,1,1,0,0,0|0,0,0]=2 25 B13R1.133 OC(=O)C(=O)CC1=CC=C(O)C=C1 HMDB0000707 [0,1,1,0,0,0|0,0,2]=4 26 B13R1.133 OC(CC1=CC=C(O)C=C1)C(O)=O HMDB0000755 [0,1,1,0,0,0|0,0,2]=4 27 B13R1.148 OC(=O)C(=O)CC1=CC(O)=CC=C1 HMDB0011663 [0,1,1,0,0,0|0,0,2]=4 28 B13R2.155 OC1=CC2=C(C=C1)C=CC(=O)O2 HMDB0029865 [1,1,0,0,0,0|0,0,0]=2 29 B13R2.162 OC1=CC2=C(O)C=CN=C2C=C1 HMDB0004077 [1,1,0,0,0,0|2,0,0]=4 30 B13R2.3683 CC1=CC2=C(OC(=O)C=C2)C=C1 HMDB0032394 [1,1,0,0,0,0|0,0,0]=2 31 B13R2.359 CC1(O)C(=O)NC2=CC=CC=C12 HMDB0004186 [0,1,0,0,1,0|1,0,1]=4 32 B15R2.63893 CC1=CC2=C(C=C1)C(C)=C(C)C(=O)O2 HMDB0029495 [0,2,0,0,0,0|1,0,0]=3 33 B13R2.435 OC(=O)C1=CC2=C(N1)C=CC=C2 HMDB0002285 [0,0,1,1,0,0|1,0,0]=3 34 B11R1.36 CC(C(O)=O)C1=CC=CC=C1 HMDB0011743 [0,0,1,0,1,0|1,0,1]=4 35 B11R1.36 NC(C(O)=O)C1=CC=CC=C1 HMDB0002210 [0,0,1,0,1,0|1,0,1]=4 36 B11R1.36 OC(=O)C(=O)C1=CC=CC=C1 HMDB0001587 [0,0,1,0,1,0|0,0,1]=3 37 B11R1.36 O[C@H](C(O)=O)C1=CC=CC=C1 HMDB0000703 [0,0,1,0,1,0|0,0,1]=3 38 B11R2.1 C=C1C=NC2=CC=CC=C12 HMDB0011664 [1,0,0,0,1,0|2,0,0]=4 39 B11R2.1 CC1=CNC2=C1C=CC=C2 HMDB0000466 [1,0,0,0,1,0|2,0,0]=4 40 B11R2.1 O=C1OCC2=CC=CC=C12 HMDB0032469 [1,0,0,0,1,0|1,0,1]=4 41 B11R2.1 OC1=CNC2=CC=CC=C12 HMDB0004094 [1,0,0,0,1,0|1,0,0]=3 42 B11R2.10 CC1=NC2=CC=CC=C2O1 HMDB0032390 [1,0,0,0,1,0|2,0,0]=4 43 B13R2.33 O=C1CCC2=CC=CC=C2OC1 HMDB0029714 [1,0,0,0,0,1|0,0,2]=4