0 B12R1.4 COC1=CC=C(CC(O)=O)C=C1 HMDB0002072 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 HMDB0032075 [1,0,0,0,0,0|1,0,0]=2 2 B11R1.83 CCCC1=CC=C(OC)C=C1 HMDB0032626 [1,0,0,0,0,0|0,0,1]=2 3 B11R1.83 COC1=CC=C(/C=C\C)C=C1 HMDB0030837 [1,0,0,0,0,0|0,0,1]=2 4 B13R1.35 COC1=CC=C(CC(O)=O)C=C1O HMDB0000333 [0,1,0,0,0,0|1,0,0]=2 5 B13R1.142 CCOC1=CC=C(NC(N)=O)C=C1 HMDB0032565 [0,1,0,0,0,0|2,0,0]=3 6 B11R1.3 CC(=C)C1=CC=C(C=O)C=C1 HMDB0035925 [0,0,0,0,1,0|3,0,0]=4 7 B11R1.3 COC1=CC=C(C=C1)C(C)=O HMDB0032570 [0,0,0,0,1,0|0,0,0]=1 8 B11R1.3 COC1=CC=C(C=C1)C(O)=O HMDB0001101 [0,0,0,0,1,0|1,0,0]=2 9 B13R1.3 COC1=CC=C(/C=C/C(O)=O)C=C1 HMDB0002040 [0,0,0,0,0,1|1,0,1]=3 10 B13R1.3 COC1=CC=C(/C=C/N(=O)=O)C=C1 HMDB0032595 [0,0,0,0,0,1|2,0,1]=4 11 B10R1.1 C/C=C\C1=CC=C(O)C=C1 HMDB0030839 [2,0,0,0,0,0|0,0,1]=3 12 B10R1.1 CC1=CC=C(CC=O)C=C1 HMDB0029639 [2,0,0,0,0,0|0,0,0]=2 13 B10R1.1 CCCC1=CC=C(O)C=C1 HMDB0032625 [2,0,0,0,0,0|0,0,1]=3 14 B10R1.1 CCOC1=CC=C(O)C=C1 HMDB0032036 [2,0,0,0,0,0|1,0,1]=4 15 B10R1.1 NCCC1=CC=C(O)C=C1 HMDB0000306 [2,0,0,0,0,0|1,0,1]=4 16 B10R1.1 OC1=CC=C(CC#N)C=C1 HMDB0029757 [2,0,0,0,0,0|1,0,1]=4 17 B10R1.1 OC1=CC=C(CC=O)C=C1 HMDB0003767 [2,0,0,0,0,0|0,0,0]=2 18 B10R1.1 OCCC1=CC=C(O)C=C1 HMDB0004284 [2,0,0,0,0,0|0,0,2]=4 19 B10R1.18 CC(=O)NC1=CC=CC=C1 HMDB0001250 [2,0,0,0,0,0|1,0,0]=3 20 B10R1.18 NC(=O)CC1=CC=CC=C1 HMDB0010715 [2,0,0,0,0,0|1,0,0]=3 21 B10R1.18 OC(=O)CC1=CC=CC=C1 HMDB0000209 [2,0,0,0,0,0|1,0,0]=3 22 B10R1.18 OC(=O)CC1=CN=CC=C1 HMDB0001538 [2,0,0,0,0,0|2,0,0]=4 23 B10R1.3 CCC1=CC=C(C=O)C=C1 HMDB0032024 [2,0,0,0,0,0|1,0,0]=3 24 B10R1.3 COC1=CC=C(C=O)C=C1 HMDB0029686 [2,0,0,0,0,0|0,0,0]=2 25 B10R1.3 COC1=CC=C(OC)C=C1 HMDB0029671 [2,0,0,0,0,0|1,0,0]=3 26 B12R1.19 CC(=O)CC1=CC(O)=C(O)C=C1 HMDB0031132 [1,1,0,0,0,0|0,0,0]=2 27 B12R1.19 OC(=O)CC1=CC(O)=C(O)C=C1 HMDB0001336 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.20 OC(C(O)=O)C1=CC=C(O)C=C1 HMDB0000822 [1,1,0,0,0,0|1,0,0]=3 29 B12R1.49 CC(CC1=CC=C(C)C=C1)C=O HMDB0031856 [1,1,0,0,0,0|0,0,1]=3 30 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 HMDB0032639 [1,1,0,0,0,0|1,0,1]=4 31 B12R1.71 COC1=CC=C(/C=C/C=O)C=C1 HMDB0032611 [1,1,0,0,0,0|0,0,1]=3 32 B12R1.71 COC1=CC=C(/C=C/CO)C=C1 HMDB0032586 [1,1,0,0,0,0|0,0,1]=3 33 B12R1.71 COC1=CC=C(CN=C=S)C=C1 HMDB0032581 [1,1,0,0,0,0|0,1,1]=4 34 B12R1.113 CC(C)C1=CC=C(CC=O)C=C1 HMDB0041493 [1,1,0,0,0,0|1,0,0]=3 35 B12R1.288 COC1=C(O)C=C(CCN)C=C1 HMDB0012162 [1,1,0,0,0,0|1,0,1]=4 36 B12R1.256 CC(C)C1=CC=C(C=C1)C(C)=O HMDB0032025 [0,1,0,0,1,0|1,0,0]=3 37 B14R1.5 CCC(=O)/C=C/C1=CC=C(OC)C=C1 HMDB0030905 [0,1,0,0,0,1|0,0,1]=3 38 B14R1.5 COC(=O)/C=C/C1=CC=C(OC)C=C1 HMDB0030752 [0,1,0,0,0,1|0,0,1]=3 39 B14R1.2879 CC(CC1=CC=C(C=C1)C(C)C)C=O HMDB0037763 [0,2,0,0,0,0|1,0,1]=4 40 B14R1.3651 COC1=CC=C(CC(O)=O)C=C1OC HMDB0000434 [0,2,0,0,0,0|1,0,0]=3 41 B14R2.134 COC1=CC2=C(C=CC(=O)O2)C=C1 HMDB0029758 [0,0,0,1,0,1|1,0,1]=4 42 B10R1.13 CC(=C)C1=CC=C(C)C=C1 HMDB0029641 [1,0,0,0,1,0|1,0,0]=3 43 B10R1.13 CC(=O)C1=CC=C(C)C=C1 HMDB0032608 [1,0,0,0,1,0|0,0,0]=2 44 B10R1.13 CC(C)C1=CC=C(O)C=C1 HMDB0031446 [1,0,0,0,1,0|1,0,1]=4 45 B10R1.13 CC1=CC=C(C=C1)C(O)=O HMDB0029635 [1,0,0,0,1,0|1,0,0]=3 46 B10R1.13 NC1=CC=C(C=C1)C(O)=O HMDB0001392 [1,0,0,0,1,0|2,0,0]=4 47 B10R1.13 OC(=O)C1=CC=C(O)C=C1 HMDB0000500 [1,0,0,0,1,0|1,0,0]=3 48 B10R1.13 OC(=O)C1=CN=C(O)C=C1 HMDB0002658 [1,0,0,0,1,0|2,0,0]=4 49 B10R1.13 OC1=CC=C(C=C1)[N+]([O-])=O HMDB0001232 [1,0,0,0,1,0|2,0,0]=4 50 B12R1.21 OC(=O)/C=C/C1=CC=C(O)C=C1 HMDB0002035 [1,0,0,0,0,1|1,0,1]=4 51 B12R1.21 OC(=O)/C=C\C1=CC=C(O)C=C1 HMDB0030677 [1,0,0,0,0,1|1,0,1]=4 52 B12R1.21 OC(=O)CCC1=CC=C(O)C=C1 HMDB0002199 [1,0,0,0,0,1|1,0,0]=3