0 B13R2.369 OC1OC2=CC=CC=C2NC1=O HMDB0038318 [0,0,0,0,0,0|2,0,1]=3 1 B12R2.24 CC1=CC2=C(C=C1)N=CC=C2 HMDB0033115 [1,0,0,0,0,0|3,0,0]=4 2 B12R2.24 CC1=NC2=CC=CC=C2C=C1 HMDB0042004 [1,0,0,0,0,0|2,0,0]=3 3 B12R2.24 NC1=NC2=C(C=CC=C2)C=C1 HMDB0034175 [1,0,0,0,0,0|2,0,0]=3 4 B12R2.24 O=C1CCC2=CC=CC=C2O1 HMDB0036626 [1,0,0,0,0,0|0,0,2]=3 5 B12R2.24 O=C1COC2=CC=CC=C2O1 HMDB0040528 [1,0,0,0,0,0|1,0,1]=3 6 B12R2.24 SC1=CC2=C(C=CC=C2)C=C1 HMDB0029689 [1,0,0,0,0,0|1,1,0]=3 7 B14R2.8188 OC1OC2=CC=CC=C2N(O)C1=O HMDB0033733 [0,1,0,0,0,0|2,0,1]=4 8 B14R2.8239 CC1=CC2=C(OC(=O)C=C2)C=C1O HMDB0032990 [0,1,0,0,0,0|3,0,0]=4 9 B14R2.8239 OC1=C(O)C=C2C=CC(=O)OC2=C1 HMDB0030819 [0,1,0,0,0,0|2,0,1]=4 10 B14R2.8239 OC1OC2=C(NC1=O)C=CC(O)=C2 HMDB0038054 [0,1,0,0,0,0|2,0,1]=4 11 B12R1.43 CC(=O)C(/C)=C\C1=CC=CC=C1 HMDB0031567 [0,0,1,0,0,0|2,0,0]=3 12 B12R1.43 CC(=O)C(O)CC1=CC=CC=C1 HMDB0032336 [0,0,1,0,0,0|1,0,2]=4 13 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(O)=O HMDB0000159 [0,0,1,0,0,0|1,0,2]=4 14 B12R2.18 CC1=C(C)C2=CC=CC=C2O1 HMDB0033176 [0,0,0,0,1,0|2,0,0]=3 15 B11R1.40 C/C(C=O)=C/C1=CC=CC=C1 HMDB0031566 [1,0,1,0,0,0|1,0,0]=3 16 B11R1.91 CC(=O)/C=C/C1=CC=CC=C1 HMDB0031617 [1,0,1,0,0,0|1,0,0]=3 17 B11R1.91 CC(O)/C=C\C1=CC=CC=C1 HMDB0031616 [1,0,1,0,0,0|1,0,1]=4 18 B11R1.91 OC(=O)COC1=CC=CC=C1 HMDB0031609 [1,0,1,0,0,0|1,0,1]=4 19 B11R1.17 OC1=CC=CC=C1/C=C/C=O HMDB0031725 [1,0,1,0,0,0|0,0,0]=2 20 B11R1.86 CC(=O)OC1=CC=CC=C1C HMDB0032073 [1,0,1,0,0,0|0,0,2]=4 21 B11R1.1 OC1=CC=C(/C=C/C=O)C=C1 HMDB0040986 [1,0,1,0,0,0|2,0,0]=4 22 B11R2.20 C1=CC2=CC=CC=C2C=C1 HMDB0029751 [2,0,0,0,0,0|1,0,0]=3 23 B11R2.20 C1=CC=C2C=NC=CC2=C1 HMDB0034244 [2,0,0,0,0,0|2,0,0]=4 24 B11R2.20 C1=CC=C2N=CC=CC2=C1 HMDB0033731 [2,0,0,0,0,0|1,0,0]=3 25 B13R1.202 OC(CC1=C(O)C=CC=C1)C(O)=O HMDB0033624 [0,1,1,0,0,0|0,0,2]=4 26 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 HMDB0032861 [1,1,0,0,0,0|1,0,0]=3 27 B13R2.155 OC1=CC2=C(C=C1)C=CC(=O)O2 HMDB0029865 [1,1,0,0,0,0|0,0,0]=2 28 B13R2.3683 CC1=CC2=C(OC(=O)C=C2)C=C1 HMDB0032394 [1,1,0,0,0,0|0,0,0]=2 29 B13R2.135 BrC1=C(C=O)C2=CC=CC=C2N1 HMDB0040147 [0,1,0,0,1,0|2,0,0]=4 30 B13R2.135 SC1=C(C=O)C2=CC=CC=C2N1 HMDB0038591 [0,1,0,0,1,0|1,1,0]=4 31 B13R2.5190 CC1C(=O)OC2=C1C=CC(C)=C2 HMDB0038893 [0,1,0,0,1,0|1,0,1]=4 32 B15R2.1754 OC1=C(C=O)C=C2C=CC(=O)OC2=C1 HMDB0039147 [0,2,0,0,0,0|2,0,0]=4 33 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 34 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 HMDB0035243 [0,0,1,0,1,0|0,0,2]=4 35 B11R2.1 O=C1NSC2=CC=CC=C12 HMDB0034413 [1,0,0,0,1,0|2,0,0]=4 36 B11R2.1 O=C1OCC2=CC=CC=C12 HMDB0032469 [1,0,0,0,1,0|1,0,1]=4 37 B11R2.10 CC1=NC2=CC=CC=C2O1 HMDB0032390 [1,0,0,0,1,0|2,0,0]=4 38 B11R2.10 O=C1NC2=CC=CC=C2O1 HMDB0032931 [1,0,0,0,1,0|1,0,0]=3 39 B13R2.33 O=C1CCC2=CC=CC=C2OC1 HMDB0029714 [1,0,0,0,0,1|0,0,2]=4