0 B10R1.17 CCOCC1=CC=CC=C1 HMDB0031312 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.17 COCCC1=CC=CC=C1 HMDB0032621 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.17 O=C/C=C\C1=CC=CC=C1 HMDB0032072 [0,0,0,0,0,0|1,1,2]=4 3 B10R1.17 OC/C=C/C1=CC=CC=C1 HMDB0029698 [0,0,0,0,0,0|1,1,2]=4 4 B10R1.17 OCC=CC1=CC=CC=C1 HMDB0029697 [0,0,0,0,0,0|1,1,2]=4 5 B9R1.8 C=CSC1=CC=CC=C1 HMDB0031825 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.8 CCCC1=CC=CC=N1 HMDB0032497 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.8 CSCC1=CC=CC=C1 HMDB0031314 [1,0,0,0,0,0|1,0,1]=3 8 B9R1.8 NCCC1=CC=CC=C1 HMDB0012275 [1,0,0,0,0,0|1,0,1]=3 9 B9R1.8 O=CCC1=CC=CC=C1 HMDB0006236 [1,0,0,0,0,0|0,1,1]=3 10 B9R1.8 SCCC1=CC=CC=C1 HMDB0032637 [1,0,0,0,0,0|0,0,2]=3 11 B11R1.1 CNCCC1=CC=C(O)C=C1 HMDB0003633 [0,1,0,0,0,0|3,0,0]=4 12 B11R1.1 OC1=CC=C(CN=C=S)C=C1 HMDB0032580 [0,1,0,0,0,0|0,0,0]=1 13 B11R1.1 OCCCC1=CC=C(O)C=C1 HMDB0032599 [0,1,0,0,0,0|1,1,1]=4 14 B11R1.16 CNCC(O)C1=CC=CC=C1 HMDB0001387 [0,1,0,0,0,0|3,0,0]=4 15 B11R1.28 O=C/C=C/CC1=CC=CC=C1 HMDB0029602 [0,1,0,0,0,0|1,1,1]=4 16 B11R1.40 COC(=O)CC1=CC=CC=C1 HMDB0032617 [0,1,0,0,0,0|3,0,0]=4 17 B11R1.91 CC(=O)OCC1=CC=CC=C1 HMDB0031310 [0,1,0,0,0,0|1,1,1]=4 18 B11R1.91 CC(O)CCC1=CC=CC=C1 HMDB0031613 [0,1,0,0,0,0|1,1,1]=4 19 B11R1.91 OC(=O)CCC1=CC=CC=C1 HMDB0000764 [0,1,0,0,0,0|1,1,1]=4 20 B11R2.1 O=C1OCC2=CC=CC=C12 HMDB0032469 [0,0,0,1,0,0|1,1,1]=4 21 B11R2.20 C1CC2=C(CN1)C=CC=C2 HMDB0012489 [0,0,0,1,0,0|1,0,2]=4 22 B8R1.2 C=CC1=CC=CC=C1 HMDB0032178 [2,0,0,0,0,0|0,0,2]=4 23 B8R1.2 CCC1=CC=CN=C1 HMDB0029734 [2,0,0,0,0,0|1,0,1]=4 24 B8R1.2 O=CC1=CC=CC=C1 HMDB0006115 [2,0,0,0,0,0|0,1,1]=4 25 B8R1.2 SCC1=CC=CC=C1 HMDB0029633 [2,0,0,0,0,0|0,0,1]=3 26 B10R1.1 CC1=CC=C(CC=O)C=C1 HMDB0029639 [1,1,0,0,0,0|0,1,1]=4 27 B10R1.1 CCCC1=CC=C(O)C=C1 HMDB0032625 [1,1,0,0,0,0|1,0,1]=4 28 B10R1.1 NCCC1=CC=C(O)C=C1 HMDB0000306 [1,1,0,0,0,0|1,0,1]=4 29 B10R1.1 OC1=CC=C(CC#N)C=C1 HMDB0029757 [1,1,0,0,0,0|1,0,1]=4 30 B10R1.1 OC1=CC=C(CC=O)C=C1 HMDB0003767 [1,1,0,0,0,0|0,1,1]=4 31 B10R1.1 OCCC1=CC=C(O)C=C1 HMDB0004284 [1,1,0,0,0,0|0,1,1]=4 32 B10R1.4 CCCC1=CC=CC=C1C HMDB0032627 [1,1,0,0,0,0|1,0,1]=4 33 B10R1.4 CCCC1=CC=CC=C1O HMDB0032624 [1,1,0,0,0,0|1,0,1]=4 34 B10R1.10 NCCC1=CC(O)=CC=C1 HMDB0004989 [1,1,0,0,0,0|1,0,1]=4 35 B10R1.15 CC(C=O)C1=CC=CC=C1 HMDB0031626 [1,1,0,0,0,0|0,1,1]=4 36 B10R1.15 CC(CO)C1=CC=CC=C1 HMDB0031628 [1,1,0,0,0,0|0,1,1]=4 37 B10R1.15 CCC(O)C1=CC=CC=C1 HMDB0031627 [1,1,0,0,0,0|1,0,1]=4 38 B10R1.15 NCC(O)C1=CC=CC=C1 HMDB0001065 [1,1,0,0,0,0|1,0,1]=4 39 B10R1.18 NC(=O)CC1=CC=CC=C1 HMDB0010715 [1,1,0,0,0,0|0,1,1]=4 40 B10R1.18 OC(=O)CC1=CC=CC=C1 HMDB0000209 [1,1,0,0,0,0|0,1,1]=4 41 B12R1.71 COC1=CC=C(CN=C=S)C=C1 HMDB0032581 [0,2,0,0,0,0|0,0,0]=2 42 B10R2.7 C1=CC=C2C(OCC2)=C1 HMDB0013815 [1,0,0,1,0,0|0,1,1]=4