0 B15R1.499 CC(=O)CCC1=CC=C(OC(C)=O)C=C1 BBL009830 [0,0,0,0,0,0|0,0,0]=0 1 B15R1.499 CC(C)OC1=CC=C(CCC(=O)O)C=C1 BBL012981 [0,0,0,0,0,0|2,0,1]=3 2 B16R1.1282 CC(C)OC1=CC=C(C(N)CC(=O)O)C=C1 BBL005124 [0,1,0,0,0,0|2,0,1]=4 3 B16R2.3892 CC1=NC2=C(C=CC(CCC(=O)O)=C2)N1 BBL019263 [0,0,0,1,0,0|3,0,0]=4 4 B16R2.3892 CC1CC2=C(C=CC(CCC(=O)O)=C2)O1 BBL026408 [0,0,0,1,0,0|2,0,1]=4 5 B14R1.419 C=C(C)COC1=CC=C(C(=O)O)C=C1 BBL023601 [0,0,0,0,1,0|3,0,0]=4 6 B14R1.419 CC(=O)C1=CC=C(OCC(C)C)C=C1 BBL017873 [0,0,0,0,1,0|2,0,1]=4 7 B14R1.419 CC(=O)C1=CC=C(OCC(N)=O)C=C1 BBL016560 [0,0,0,0,1,0|2,0,0]=3 8 B14R1.419 NC(=O)C1=CC=C(NCC(=O)O)C=C1 BBL001186 [0,0,0,0,1,0|3,0,0]=4 9 B14R1.419 O=C(O)CCC1=CC=C([N+](=O)[O-])C=C1 BBL034729 [0,0,0,0,1,0|3,0,0]=4 10 B14R1.419 O=C(O)COC1=CC=C(C(=O)O)C=C1 BBL034638 [0,0,0,0,1,0|3,0,0]=4 11 B14R1.805 CC(=O)CC1=CC=C(OC(C)C)C=C1 BBL028636 [0,0,0,0,1,0|1,0,1]=3 12 B16R1.603 CC(C)COC1=CC=C(CCC(=O)O)C=C1 BBL032468 [0,0,0,0,0,1|2,0,1]=4 13 B16R1.1287 CC(C)OC1=CC=C(CNCC(=O)O)C=C1 BBL032149 [0,0,0,0,0,1|2,0,1]=4 14 B13R1.3 COC1=CC=C(CCC(=O)O)C=C1 BBL002159 [2,0,0,0,0,0|1,0,0]=3 15 B13R1.3 COC1=CC=C(CCC(C)=O)C=C1 BBL027730 [2,0,0,0,0,0|0,0,0]=2 16 B13R1.3 COC1=CC=C(COC(C)=O)C=C1 BBL027940 [2,0,0,0,0,0|1,0,0]=3 17 B13R1.3 COC1=CC=C(OCC(=O)Cl)C=C1 BBL015361 [2,0,0,0,0,0|2,0,0]=4 18 B13R1.3 COC1=CC=C(OCC(=O)O)C=C1 BBL012098 [2,0,0,0,0,0|2,0,0]=4 19 B13R1.3 NC(=O)COC1=CC=C(C=O)C=C1 BBL013430 [2,0,0,0,0,0|2,0,0]=4 20 B13R1.3 O=CC1=CC=C(OCC(=O)O)C=C1 BBL023166 [2,0,0,0,0,0|2,0,0]=4 21 B15R1.104 CCCCC1=CC=C(NC(=O)CCl)C=C1 BBL015715 [1,1,0,0,0,0|1,0,1]=4 22 B15R1.15 CCOC1=CC=C(C(N)CC(=O)O)C=C1 BBL022138 [1,1,0,0,0,0|1,0,1]=4 23 B15R2.926 CC(=O)OC1=CC2=C(C=C1)OC(=O)S2 BBL004040 [0,0,0,1,1,0|2,0,0]=4 24 B17R2.19729 O=C(O)COC1=CC=C2CCC(=O)NC2=C1 BBL011126 [0,0,0,1,0,1|2,0,0]=4 25 B13R1.74 C=CCOC1=CC=C(C(C)=O)C=C1 BBL017132 [1,0,0,0,1,0|1,0,1]=4 26 B13R1.74 CCCCC1=CC=C(C(C)=O)C=C1 BBL037632 [1,0,0,0,1,0|0,0,1]=3 27 B13R1.585 CC(=O)OC1=CC=C(C(C)=O)C=C1 BBL011990 [0,0,0,0,2,0|1,0,0]=3