0 B11R1.266 COC1=CC=CC(=C1)C(O)=O HMDB0032606 [0,0,0,0,0,0|0,0,0]=0 1 B10R1.113 CC(=O)C1=CC=CC(C)=N1 HMDB0037072 [1,0,0,0,0,0|2,0,0]=3 2 B10R1.113 CC(=O)C1=CC=NC(C)=C1 HMDB0040223 [1,0,0,0,0,0|2,0,0]=3 3 B10R1.113 CC(=O)C1=NC(C)=NC=C1 HMDB0037819 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.113 CC(=O)C1=NC=CC(C)=C1 HMDB0037071 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.113 CC(C)C1=CC=CC(C)=C1 HMDB0037051 [1,0,0,0,0,0|2,0,1]=4 6 B10R1.113 C[N+]1=CC(=CC=C1)C([O-])=O HMDB0000875 [1,0,0,0,0,0|1,0,1]=3 7 B10R1.172 COC1=CC(C=O)=CC=C1 HMDB0031459 [1,0,0,0,0,0|0,0,0]=1 8 B10R1.172 COC1=CC(OC)=CC=C1 HMDB0029672 [1,0,0,0,0,0|2,0,0]=3 9 B12R1.56 COC1=C(O)C=CC(=C1)C(O)=O HMDB0000484 [0,1,0,0,0,0|0,0,0]=1 10 B12R1.258 OC(=O)C1=CC=CC(=N1)C(O)=O HMDB0033161 [0,1,0,0,0,0|3,0,0]=4 11 B10R1.39 CCN1C=CC=C1C(C)=O HMDB0029759 [0,0,0,0,1,0|3,0,0]=4 12 B9R0.55 OC(=O)/C=C/C=C/C(O)=O HMDB0002349 [1,0,1,0,0,0|1,0,0]=3 13 B9R0.55 OC(=O)/C=C\C=C/C(O)=O HMDB0006331 [1,0,1,0,0,0|1,0,0]=3 14 B9R1.2 CC1=CC(C=O)=CC=C1 HMDB0029637 [2,0,0,0,0,0|0,0,0]=2 15 B9R1.6 CC(=O)C1=CC=CC=C1 HMDB0033910 [2,0,0,0,0,0|1,0,0]=3 16 B9R1.6 CC(=O)C1=CC=CC=N1 HMDB0035281 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.6 CC(=O)C1=CN=CC=C1 HMDB0033131 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.6 CC(O)C1=CC=CC=C1 HMDB0032619 [2,0,0,0,0,0|1,0,1]=4 19 B9R1.6 OC(=O)C1=CC=CC=C1 HMDB0001870 [2,0,0,0,0,0|0,0,0]=2 20 B9R1.6 OC(=O)C1=CN=CC=C1 HMDB0001488 [2,0,0,0,0,0|1,0,0]=3 21 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 HMDB0029661 [1,1,0,0,0,0|1,0,0]=3 22 B11R1.21 OC(=O)C1=CC(O)=C(O)C=C1 HMDB0001856 [1,1,0,0,0,0|0,0,0]=2 23 B11R1.74 CC(=O)C1=CC(O)=CC(O)=C1 HMDB0029662 [1,1,0,0,0,0|1,0,0]=3 24 B11R1.159 CC(=O)C1=C(O)C(O)=CC=C1 HMDB0029658 [1,1,0,0,0,0|1,0,0]=3 25 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 HMDB0032592 [1,1,0,0,0,0|1,0,0]=3 26 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 HMDB0032629 [1,1,0,0,0,0|1,0,0]=3 27 B11R1.9 COC1=CC(CO)=CC(O)=C1 HMDB0030570 [1,1,0,0,0,0|0,0,1]=3 28 B11R1.267 COC1=CC=CC(OC)=C1O HMDB0034158 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.280 CCC1=CC(OC)=C(O)C=C1 HMDB0040175 [1,1,0,0,0,0|1,0,1]=4 30 B11R1.280 COC1=C(O)C=CC(CO)=C1 HMDB0032012 [1,1,0,0,0,0|0,0,1]=3 31 B13R2.2121 COC1=CC=C2NC(=O)OC2=C1 HMDB0036582 [0,0,0,1,0,1|1,0,0]=3 32 B13R2.430 OC(=O)C1=CC2=C(OCO2)C=C1 HMDB0032613 [0,1,0,1,0,0|0,0,0]=2 33 B9R1.35 CC(=O)C1=CC=C(C)O1 HMDB0035226 [1,0,0,0,1,0|2,0,0]=4 34 B9R1.35 CC(=O)C1=CC=C(C)S1 HMDB0033130 [1,0,0,0,1,0|2,0,0]=4 35 B9R1.35 OC(=O)C1=CC(O)=CN1 HMDB0034368 [1,0,0,0,1,0|1,0,0]=3 36 B9R1.41 CC(=O)C1=C(C)C=CO1 HMDB0034877 [1,0,0,0,1,0|2,0,0]=4 37 B9R1.41 CC(=O)C1=C(C)C=CS1 HMDB0041502 [1,0,0,0,1,0|2,0,0]=4 38 B9R1.41 CN1C=CC=C1C(C)=O HMDB0040360 [1,0,0,0,1,0|2,0,0]=4 39 B9R1.14 CCN1C=CC=C1C=O HMDB0036058 [1,0,0,0,1,0|2,0,0]=4 40 B11R1.3 COC1=CC=C(C=C1)C(C)=O HMDB0032570 [0,0,0,0,1,1|1,0,0]=3