0 B6R0.6 CCCCCC=O HMDB0005994 [1,0,0,0,0,0|0,0,3]=4 1 B8R0.4 C(=O)C=CCCCCC HMDB0013809 [0,1,0,0,0,0|0,0,2]=3 2 B8R1.2 COC1=CC=CC=C1 HMDB0033895 [0,0,0,1,0,0|2,0,0]=3 3 B8R1.2 NCC1=CC=CC=C1 HMDB0033871 [0,0,0,1,0,0|2,0,0]=3 4 B8R1.5 CC1=CC=CC=C1O HMDB0002055 [0,0,0,1,0,0|0,0,2]=3 5 B8R1.5 OC1=CC=CC=C1O HMDB0000957 [0,0,0,1,0,0|1,0,2]=4 6 B9R0.45 CCCCCC\C=C/C=O HMDB0031269 [0,2,0,0,0,0|0,0,2]=4 7 B9R0.55 O=C(O)\C=C/C=C\C(=O)O HMDB0002349 [0,2,0,0,0,0|1,0,1]=4 8 B7R1.1 O=CC1=CC=CO1 HMDB0032914 [1,0,0,1,0,0|1,0,0]=3 9 B7R1.1 OCC1=CC=CO1 HMDB0013742 [1,0,0,1,0,0|1,0,1]=4 10 B7R1.3 CC1=CC=CC=C1 HMDB0034168 [1,0,0,1,0,0|0,0,1]=3 11 B7R1.3 NC1=CC=CC=C1 HMDB0003012 [1,0,0,1,0,0|1,0,1]=4 12 B7R1.3 OC1=CC=CC=C1 HMDB0000228 [1,0,0,1,0,0|0,0,2]=4 13 B7R1.4 CC1=CSC=C1C HMDB0032980 [1,0,0,1,0,0|2,0,0]=4 14 B9R1.8 NCCC1=CC=CC=C1 HMDB0012275 [0,1,0,1,0,0|1,0,0]=3 15 B9R1.15 COC1=C(O)C=CC=C1 HMDB0001398 [0,1,0,1,0,0|0,0,2]=4 16 B9R1.69 CC1=CC(C)=C(C)C=C1 HMDB0013733 [0,1,0,1,0,0|1,0,1]=4 17 B9R1.1 CCC1=CC=C(O)C=C1 HMDB0029306 [0,1,0,1,0,0|1,0,0]=3 18 B9R1.1 O=CC1=CC=C(O)C=C1 HMDB0011718 [0,1,0,1,0,0|0,0,2]=4 19 B9R1.3 CC1=CC=CC(C)=C1N HMDB0060677 [0,1,0,1,0,0|1,0,1]=4 20 B9R1.6 CC(N)C1=CC=CC=C1 HMDB0002017 [0,1,0,1,0,0|1,0,0]=3 21 B9R1.6 NC(=O)C1=CC=CN=C1 HMDB0001406 [0,1,0,1,0,0|1,0,1]=4 22 B9R1.6 O=C(O)C1=CC=CC=C1 HMDB0001870 [0,1,0,1,0,0|0,0,2]=4 23 B9R1.6 O=C(O)C1=CC=CC=N1 HMDB0002243 [0,1,0,1,0,0|1,0,1]=4 24 B9R1.6 O=C(O)C1=CN=CC=C1 HMDB0001488 [0,1,0,1,0,0|1,0,1]=4