0 B11R1.91 OC(=O)C#CC1=CC=CC=C1 HMDB0002359 [1,0,0,0,0,0|0,0,2]=3 1 B11R1.91 OC(=O)CCC1=CC=CC=C1 HMDB0000764 [1,0,0,0,0,0|0,0,0]=1 2 B13R1.417 CN/C(NCC1=CC=CC=C1)=N\C HMDB0014362 [0,1,0,0,0,0|3,0,0]=4 3 B13R2.10 O=C1CCC(N1)C2=CN=CC=C2 HMDB0001297 [0,0,0,1,0,0|3,0,0]=4 4 B11R1.40 CN[C@@H](C)CC1=CC=CC=C1 HMDB0015517 [0,0,0,0,1,0|2,0,1]=4 5 B10R1.17 CNCCC1=CC=CC=N1 HMDB0015644 [2,0,0,0,0,0|2,0,0]=4 6 B10R1.17 NNCCC1=CC=CC=C1 HMDB0014918 [2,0,0,0,0,0|2,0,0]=4 7 B10R1.17 O=COCC1=CC=CC=C1 HMDB0041485 [2,0,0,0,0,0|1,0,0]=3 8 B12R0.248 COC(=O)CC/C=C\CC/C=C\C HMDB0034708 [0,1,1,0,0,0|0,0,2]=4 9 B12R1.21 CN(C)CCC1=CC=C(O)C=C1 HMDB0004366 [1,1,0,0,0,0|2,0,0]=4 10 B12R1.21 OC(=O)CCC1=CC=C(O)C=C1 HMDB0002199 [1,1,0,0,0,0|0,0,0]=2 11 B12R1.43 CC(CC1=CC=CC=C1)N(C)C HMDB0041880 [1,1,0,0,0,0|2,0,0]=4 12 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(O)=O HMDB0000159 [1,1,0,0,0,0|0,0,0]=2 13 B12R2.24 O=C1OC2=CC=CC=C2C=C1 HMDB0001218 [1,0,0,1,0,0|0,0,2]=4 14 B14R2.4514 CN1C(CCC1=O)C2=CN=CC=C2 HMDB0001046 [0,0,0,1,0,1|2,0,0]=4 15 B10R1.18 CC(N)CC1=CC=CC=C1 HMDB0014328 [1,0,0,0,1,0|1,0,1]=4 16 B10R1.18 C[C@@H](N)CC1=CC=CC=C1 HMDB0012128 [1,0,0,0,1,0|1,0,1]=4 17 B10R1.18 C[C@H](N)CC1=CC=CC=C1 HMDB0015516 [1,0,0,0,1,0|1,0,1]=4 18 B10R1.18 OC(=O)CC1=CC=CC=N1 HMDB0060722 [1,0,0,0,1,0|1,0,0]=3