0 B12R1.32 CCCC(O)CC1=CC=CC=C1 HMDB0031625 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.28 O=C/C=C/CC1=CC=CC=C1 HMDB0029602 [1,0,0,0,0,0|1,0,1]=3 2 B11R1.28 O=COCCC1=CC=CC=C1 HMDB0040428 [1,0,0,0,0,0|1,0,0]=2 3 B11R1.28 S=C=NCCC1=CC=CC=C1 HMDB0038445 [1,0,0,0,0,0|0,1,2]=4 4 B11R1.40 C/C(C=O)=C/C1=CC=CC=C1 HMDB0031566 [1,0,0,0,0,0|0,0,2]=3 5 B13R1.1327 CC(C)(CC1=CC=CC=C1)OC=O HMDB0036235 [0,1,0,0,0,0|1,0,0]=2 6 B11R1.16 CC(OC=O)C1=CC=CC=C1 HMDB0037715 [0,0,0,0,1,0|1,0,0]=2 7 B10R1.17 COCCC1=CC=CC=C1 HMDB0032621 [2,0,0,0,0,0|1,0,1]=4 8 B10R1.17 N#CCCC1=CC=CC=C1 HMDB0034236 [2,0,0,0,0,0|1,0,1]=4 9 B10R1.17 O=C/C=C\C1=CC=CC=C1 HMDB0032072 [2,0,0,0,0,0|0,0,2]=4 10 B10R1.17 O=CCCC1=CC=CC=C1 HMDB0033716 [2,0,0,0,0,0|0,0,0]=2 11 B10R1.17 O=COCC1=CC=CC=C1 HMDB0041485 [2,0,0,0,0,0|1,0,0]=3 12 B10R1.17 OCCCC1=CC=CC=C1 HMDB0033962 [2,0,0,0,0,0|0,0,2]=4 13 B10R1.18 CC(=O)OC1=CC=CC=C1 HMDB0040733 [2,0,0,0,0,0|1,0,1]=4 14 B10R1.18 CC(C)CC1=CC=CC=N1 HMDB0037291 [2,0,0,0,0,0|1,0,1]=4 15 B10R1.18 CC(C)CC1=CN=CC=C1 HMDB0037287 [2,0,0,0,0,0|1,0,1]=4 16 B12R1.8 O=COC/C=C\C1=CC=CC=C1 HMDB0040577 [1,1,0,0,0,0|1,0,1]=4 17 B12R1.8 O=COCCCC1=CC=CC=C1 HMDB0034471 [1,1,0,0,0,0|1,0,0]=3 18 B12R1.27 CC(CCC1=CC=CC=C1)C=O HMDB0032415 [1,1,0,0,0,0|1,0,0]=3 19 B12R1.252 CC(=O)OCCC1=CC=CC=C1 HMDB0033945 [1,1,0,0,0,0|1,0,0]=3 20 B12R1.43 CC(=O)C(/C)=C\C1=CC=CC=C1 HMDB0031567 [1,1,0,0,0,0|0,0,2]=4 21 B12R1.43 CC(=O)C(O)CC1=CC=CC=C1 HMDB0032336 [1,1,0,0,0,0|1,0,0]=3 22 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(O)=O HMDB0000159 [1,1,0,0,0,0|1,0,0]=3 23 B12R1.49 CC(CC1=CC=C(C)C=C1)C=O HMDB0031856 [1,1,0,0,0,0|0,0,0]=2 24 B12R1.118 COC(CC1=CC=CC=C1)OC HMDB0032615 [1,1,0,0,0,0|1,0,1]=4 25 B12R1.371 CC(CC1=CC=CC=C1C)C=O HMDB0040245 [1,1,0,0,0,0|0,0,0]=2 26 B12R1.3 C=CC(CC=O)C1=CC=CC=C1 HMDB0038790 [0,1,0,0,1,0|1,0,1]=4 27 B12R1.107 CC(OC(C)=O)C1=CC=CC=C1 HMDB0032620 [0,1,0,0,1,0|1,0,0]=3 28 B14R1.818 CC(CCC1=CC=CC=C1)OC(C)=O HMDB0031614 [0,1,0,0,0,1|1,0,0]=3 29 B14R1.818 OC(CCC1=CC=CC=C1)CC(O)=O HMDB0031517 [0,1,0,0,0,1|2,0,0]=4 30 B14R1.1485 CC(=O)OC(C)(C)CC1=CC=CC=C1 HMDB0031571 [0,2,0,0,0,0|1,0,0]=3 31 B10R1.15 CC(C=O)C1=CC=CC=C1 HMDB0031626 [1,0,0,0,1,0|0,0,0]=2 32 B10R1.15 CC(CO)C1=CC=CC=C1 HMDB0031628 [1,0,0,0,1,0|0,0,2]=4