0 B12R1.286 CCCC1=CC(OC)=C(O)C=C1 HMDB0032135 [0,0,0,0,0,0|0,0,2]=2 1 B12R1.286 COC1=C(O)C=CC(CC=O)=C1 HMDB0005175 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.286 COC1=C(O)C=CC(CCN)=C1 HMDB0000022 [0,0,0,0,0,0|1,0,1]=2 3 B11R1.192 NCCC1=CC(O)=C(O)C=C1 HMDB0000073 [1,0,0,0,0,0|1,0,1]=3 4 B11R1.192 OC1=C(O)C=C(CC=O)C=C1 HMDB0003791 [1,0,0,0,0,0|1,0,0]=2 5 B11R1.280 COC1=C(O)C=CC(CO)=C1 HMDB0032012 [1,0,0,0,0,0|1,0,0]=2 6 B11R1.280 COC1=CC(C=C)=CC=C1O HMDB0013744 [1,0,0,0,0,0|0,0,0]=1 7 B11R1.280 COC1=CC(C=O)=CC=C1O HMDB0012308 [1,0,0,0,0,0|1,0,0]=2 8 B11R1.280 COC1=CC(CN)=CC=C1O HMDB0012309 [1,0,0,0,0,0|1,0,0]=2 9 B13R1.49 COC1=C(O)C=CC(=C1)C(O)C=O HMDB0004061 [0,1,0,0,0,0|1,0,0]=2 10 B13R1.49 COC1=CC(=CC=C1O)C(O)CN HMDB0000819 [0,1,0,0,0,0|1,0,1]=3 11 B13R1.49 COC1=CC(=CC=C1O)C(O)CO HMDB0001490 [0,1,0,0,0,0|1,0,1]=3 12 B13R1.52 COC1=CC(CC(O)=O)=CC=C1O HMDB0000118 [0,1,0,0,0,0|1,0,0]=2 13 B13R1.386 COC1=C(OC)C=C(CC=C)C=C1 HMDB0031864 [0,1,0,0,0,0|0,0,0]=1 14 B13R1.386 COC1=C(OC)C=C(CCN)C=C1 HMDB0041806 [0,1,0,0,0,0|1,0,1]=3 15 B13R1.575 COC1=CC(/C=C/CO)=CC=C1O HMDB0012915 [0,1,0,0,0,0|0,0,2]=3 16 B10R1.10 NCCC1=CC(O)=CC=C1 HMDB0004989 [2,0,0,0,0,0|1,0,1]=4 17 B10R1.172 COC1=CC(C=O)=CC=C1 HMDB0031459 [2,0,0,0,0,0|1,0,0]=3 18 B10R1.172 COC1=CC(OC)=CC=C1 HMDB0029672 [2,0,0,0,0,0|1,0,1]=4 19 B10R1.1 C/C=C\C1=CC=C(O)C=C1 HMDB0030839 [2,0,0,0,0,0|0,0,2]=4 20 B10R1.1 CC1=CC=C(CC=O)C=C1 HMDB0029639 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.1 CCCC1=CC=C(O)C=C1 HMDB0032625 [2,0,0,0,0,0|0,0,2]=4 22 B10R1.1 NCCC1=CC=C(O)C=C1 HMDB0000306 [2,0,0,0,0,0|1,0,1]=4 23 B10R1.1 OC1=CC=C(CC#N)C=C1 HMDB0029757 [2,0,0,0,0,0|1,0,1]=4 24 B10R1.1 OC1=CC=C(CC=O)C=C1 HMDB0003767 [2,0,0,0,0,0|1,0,0]=3 25 B10R1.1 OCCC1=CC=C(O)C=C1 HMDB0004284 [2,0,0,0,0,0|1,0,1]=4 26 B10R1.176 NCC1=CC=C(O)C(O)=C1 HMDB0012153 [2,0,0,0,0,0|1,0,0]=3 27 B10R1.30 COC1=C(O)C=CC(C)=C1 HMDB0032136 [2,0,0,0,0,0|0,0,0]=2 28 B10R1.30 COC1=CC(=O)C=CC1=O HMDB0032576 [2,0,0,0,0,0|1,0,1]=4 29 B12R1.19 CC(=O)CC1=CC(O)=C(O)C=C1 HMDB0031132 [1,1,0,0,0,0|0,0,1]=3 30 B12R1.19 OC(=O)CC1=CC(O)=C(O)C=C1 HMDB0001336 [1,1,0,0,0,0|1,0,0]=3 31 B12R1.44 NCCC1=CC(O)=C(O)C(O)=C1 HMDB0004817 [1,1,0,0,0,0|1,0,1]=4 32 B12R1.288 COC1=C(O)C=C(CCN)C=C1 HMDB0012162 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.367 NC[C@H](O)C1=CC(O)=C(O)C=C1 HMDB0000216 [1,1,0,0,0,0|1,0,1]=4 34 B12R1.367 OC(C=O)C1=CC(O)=C(O)C=C1 HMDB0006242 [1,1,0,0,0,0|1,0,0]=3 35 B12R1.367 OCC(O)C1=CC(O)=C(O)C=C1 HMDB0000318 [1,1,0,0,0,0|1,0,1]=4 36 B12R1.385 CNCCC1=CC(O)=C(O)C=C1 HMDB0032020 [1,1,0,0,0,0|0,0,2]=4 37 B12R1.385 CNCCC1=CC(O)=C(O)C=C1 HMDB0041888 [1,1,0,0,0,0|0,0,2]=4 38 B12R1.1123 NCCC1=C(O)C=C(O)C(O)=C1 HMDB0001537 [1,1,0,0,0,0|1,0,1]=4 39 B12R1.78 COC1=C(OC)C=C(C=O)C=C1 HMDB0032138 [1,1,0,0,0,0|1,0,0]=3 40 B14R1.41 COC1=C(O)C=CC(=C1)[C@H](O)C(O)=O HMDB0000291 [0,2,0,0,0,0|1,0,0]=3 41 B14R1.626 CNCC(O)C1=CC(OC)=C(O)C=C1 HMDB0004063 [0,2,0,0,0,0|0,0,2]=4 42 B14R1.3651 COC1=CC=C(CC(O)=O)C=C1OC HMDB0000434 [0,2,0,0,0,0|1,0,0]=3 43 B14R1.42 COC1=C(O)C=CC(/C=C\C(C)=O)=C1 HMDB0032591 [0,2,0,0,0,0|0,0,1]=3 44 B14R1.42 COC1=C(O)C=CC(CCC(C)=O)=C1 HMDB0032590 [0,2,0,0,0,0|0,0,1]=3 45 B14R1.15069 COC1=CC(O)=C(OC)C=C1CC=C HMDB0031984 [0,2,0,0,0,0|0,0,0]=2 46 B12R2.100 OC1=C(O)C=C2C=CNC2=C1 HMDB0004058 [1,0,0,1,0,0|1,0,0]=3 47 B12R2.100 OC1=C(O)C=C2NCCC2=C1 HMDB0012992 [1,0,0,1,0,0|1,0,1]=4