0 B14R1.42 COC1=C(O)C=CC(CCC(C)=O)=C1 06-1343 [0,0,0,0,0,0|1,0,2]=3 1 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 19-2264 [0,0,0,0,0,0|0,0,0]=0 2 B14R1.42 COC1=C(O)C=CC(\C=C\C(=O)O)=C1 F-001 [0,0,0,0,0,0|0,0,0]=0 3 B14R1.42 COC1=C(O)C=CC(\C=C\C(N)=O)=C1 CS-576 [0,0,0,0,0,0|1,0,0]=1 4 B13R1.511 CC1=C(C)C=C(\C=C\C(=O)O)C=C1 CS-455 [1,0,0,0,0,0|1,0,0]=2 5 B13R1.511 CC1=C(F)C=C(\C=C\C(=O)O)C=C1 07-421 [1,0,0,0,0,0|2,0,0]=3 6 B13R1.511 O=C(O)\C=C\C1=CC(Br)=C(F)C=C1 09-075 [1,0,0,0,0,0|2,0,0]=3 7 B13R1.511 O=C(O)\C=C\C1=CC(Cl)=C(Cl)C=C1 CS-291 [1,0,0,0,0,0|2,0,0]=3 8 B13R1.511 O=C(O)\C=C\C1=CC(Cl)=C(F)C=C1 07-192 [1,0,0,0,0,0|2,0,0]=3 9 B13R1.511 O=C(O)\C=C\C1=CC(F)=C(F)C=C1 09-3357 [1,0,0,0,0,0|2,0,0]=3 10 B13R1.511 O=C(O)\C=C\C1=CC(O)=C(O)C=C1 C-001 [1,0,0,0,0,0|0,0,0]=1 11 B13R1.511 O=C(O)\C=C\C1=CC(O)=C(O)C=C1 C-001N [1,0,0,0,0,0|0,0,0]=1 12 B13R1.511 O=C(O)\C=C\[C@H]1C=CC(O)=C(O)C1 026036 [1,0,0,0,0,0|0,0,2]=3 13 B13R1.575 COC1=C(O)C=CC(\C=C\C=O)=C1 06-1783 [1,0,0,0,0,0|0,0,0]=1 14 B13R1.575 COC1=C(O)C=CC(\C=C\CO)=C1 026028 [1,0,0,0,0,0|0,0,1]=2 15 B13R1.643 COC1=CC=CC(CCC(=O)O)=C1 CS-705 [1,0,0,0,0,0|0,0,2]=3 16 B13R1.643 COC1=CC=CC(OCC(=O)O)=C1 CS-683 [1,0,0,0,0,0|1,0,1]=3 17 B13R1.643 COC1=CC=CC(\C=C\C(=O)O)=C1 01-1014 [1,0,0,0,0,0|0,0,0]=1 18 B15R1.873 O=C(O)\C=C\C1=CC([N+](=O)[O-])=C(Cl)C=C1 CS-216 [0,1,0,0,0,0|3,0,0]=4 19 B15R1.4039 COC(=O)\C=C\C1=CC(OC)=C(O)C=C1 026276 [0,1,0,0,0,0|0,0,0]=1 20 B15R1.4039 COC(=O)\C=C\C1=CC(OC)=C(O)C=C1 CS-575 [0,1,0,0,0,0|0,0,0]=1 21 B15R1.12854 COC1=C(OC)C=C(\C=C\C(=O)O)C=C1 D-023 [0,1,0,0,0,0|0,0,0]=1 22 B15R2.1754 COC1=CC2=C(C=C1O)OC(=O)C=C2 H-109 [0,0,0,1,0,0|0,0,0]=1 23 B15R2.7688 CC(=O)\C=C\C1=CC2=C(C=C1)OCO2 CS-778 [0,0,0,1,0,0|1,0,0]=2 24 B15R2.7688 O=C(O)CCC1=CC2=C(C=C1)OCO2 CS-783 [0,0,0,1,0,0|0,0,2]=3 25 B13R1.52 COC1=C(O)C=CC(CC(=O)O)=C1 026088 [0,0,0,0,1,0|0,0,1]=2 26 B12R1.21 CC(=O)\C=C\C1=CC=C(F)C=C1 26-3837 [2,0,0,0,0,0|2,0,0]=4 27 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 026133 [2,0,0,0,0,0|1,0,0]=3 28 B12R1.21 NC(=O)\C=C\C1=CC=C(Cl)C=C1 CS-186 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 01-952 [2,0,0,0,0,0|0,0,2]=4 30 B12R1.21 O=C(O)COC1=CC=C(O)C=C1 19-2793 [2,0,0,0,0,0|1,0,1]=4 31 B12R1.21 O=C(O)\C=C/C1=CC=C(F)C=C1 09-3499 [2,0,0,0,0,0|1,0,0]=3 32 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 CS-189 [2,0,0,0,0,0|1,0,0]=3 33 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 06-008 [2,0,0,0,0,0|0,0,0]=2 34 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 026030 [2,0,0,0,0,0|0,0,0]=2 35 B12R1.226 O=C(O)\C=C\C1=CC=CC(Cl)=C1 CS-188 [2,0,0,0,0,0|1,0,0]=3 36 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 26-3632 [2,0,0,0,0,0|1,0,0]=3 37 B12R1.286 C=CCC1=CC(OC)=C(O)C=C1 026178S [2,0,0,0,0,0|0,0,1]=3 38 B12R1.286 C\C=C\C1=CC(OC)=C(O)C=C1 025366 [2,0,0,0,0,0|0,0,1]=3 39 B14R1.686 N[C@@H](CC1=CC(O)=C(O)C=C1)C(=O)O 06-803 [1,1,0,0,0,0|0,0,2]=4 40 B14R1.833 COC(=O)\C=C\C1=CC(O)=C(O)C=C1 024965 [1,1,0,0,0,0|0,0,0]=2 41 B14R1.3653 COC1=C(O)C=C(\C=C\C(=O)O)C=C1 026114 [1,1,0,0,0,0|0,0,0]=2 42 B14R1.6036 O=C(O)\C=C\C1=CC(F)=C(F)C=C1F 09-3890 [1,1,0,0,0,0|2,0,0]=4 43 B14R1.6059 O=C(O)\C=C\C1=CC=C(F)C(F)=C1F 09-3887 [1,1,0,0,0,0|2,0,0]=4 44 B14R1.15552 O=C(O)\C=C\C1=CC(F)=C(F)C(F)=C1 09-3892 [1,1,0,0,0,0|2,0,0]=4 45 B14R1.468 CCOC1=CC=CC(CCC(=O)O)=C1 CS-520 [1,1,0,0,0,0|0,0,2]=4 46 B14R1.6355 O=C(O)\C=C\C1=CC=CC([N+](=O)[O-])=C1 CS-838 [1,1,0,0,0,0|2,0,0]=4 47 B14R1.41 COC1=C(O)C=CC([C@@H](O)C(=O)O)=C1 19-2305 [0,1,0,0,1,0|0,0,1]=3 48 B14R1.3651 COC1=C(OC)C=C(CC(=O)O)C=C1 19-411 [0,1,0,0,1,0|0,0,1]=3 49 B14R1.3651 COC1=C(OC)C=C(CC(C)=O)C=C1 CS-442 [0,1,0,0,1,0|1,0,1]=4 50 B14R1.3651 COC1=C(OC)C=C(CC(N)=O)C=C1 CS-438 [0,1,0,0,1,0|1,0,1]=4 51 B16R1.423 COC1=CC(\C=C\C(=O)O)=CC(OC)=C1O 01-1354 [0,2,0,0,0,0|0,0,0]=2 52 B16R1.15083 CCOC(=O)CCC1=CC(OC)=C(O)C=C1 CS-539 [0,2,0,0,0,0|0,0,2]=4 53 B16R1.15083 CCOC(=O)\C=C\C1=CC(OC)=C(O)C=C1 026275 [0,2,0,0,0,0|0,0,0]=2 54 B16R1.20127 COC1=C(OC)C(O)=C(\C=C\C(=O)O)C=C1 CS-561 [0,2,0,0,0,0|0,0,0]=2 55 B16R1.9381 CCOC1=C(OC)C=C(\C=C\C(=O)O)C=C1 CS-512 [0,2,0,0,0,0|0,0,0]=2 56 B14R2.4513 O=C1C=CC2=CC=C(O)C(O)=C2O1 D-109 [1,0,0,1,0,0|0,0,0]=2 57 B14R2.8239 O=C1C=CC2=C(C=C(O)C(O)=C2)O1 D-108 [1,0,0,1,0,0|0,0,0]=2 58 B14R2.8239 O=C1C=CC2=CC(Cl)=C(O)C=C2O1 19-415 [1,0,0,1,0,0|1,0,0]=3 59 B14R2.2332 O=CC1=CC2=C(C=C1)OC(=O)C=C2 28-001 [1,0,0,1,0,0|2,0,0]=4 60 B14R2.11684 COC1=C2OC(=O)C=CC2=CC=C1 19-884 [1,0,0,1,0,0|0,0,0]=2 61 B14R2.1008 CC(=O)OC1=CC2=C(C=C1)OCO2 01-1131 [0,0,0,1,1,0|2,0,0]=4 62 B16R2.36472 COC1=C(O)C(O)=C2OC(=O)C=CC2=C1 020532 [0,1,0,1,0,0|0,0,0]=2 63 B16R2.12045 CC(=O)C1=C2OC(=O)C=CC2=CC=C1O 020583 [0,1,0,1,0,0|1,0,0]=3 64 B16R2.1461 COC1=CC2=C(C=C1OC)OC(=O)C=C2 020551 [0,1,0,1,0,0|0,0,0]=2 65 B16R2.1461 COC1=CC2=C(C=C1OC)OC(=O)C=C2 020586S [0,1,0,1,0,0|0,0,0]=2 66 B16R2.7475 COC1=CC=C2C=CC(=O)OC2=C1OC 06-1804 [0,1,0,1,0,0|0,0,0]=2 67 B16R2.7475 COC1=CC=C2C=CC(=O)OC2=C1OC 19-410 [0,1,0,1,0,0|0,0,0]=2 68 B16R3.10840 O=C1C=CC2=C(C=C3OC=CC3=C2)O1 020504 [0,0,0,2,0,0|1,0,1]=4 69 B16R3.10840 O=C1C=CC2=C(C=C3OC=CC3=C2)O1 020553S [0,0,0,2,0,0|1,0,1]=4 70 B16R3.11020 O=C1C=CC2=C(O1)C3=C(C=C2)OC=C3 06-234 [0,0,0,2,0,0|1,0,1]=4 71 B12R1.19 O=C(O)CC1=CC(Br)=C(O)C=C1 19-866 [1,0,0,0,1,0|1,0,1]=4 72 B12R1.19 O=C(O)CC1=CC(Cl)=C(O)C=C1 CS-194 [1,0,0,0,1,0|1,0,1]=4 73 B12R1.19 O=C(O)CC1=CC(F)=C(O)C=C1 26-3625 [1,0,0,0,1,0|1,0,1]=4 74 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 022073 [1,0,0,0,1,0|0,0,1]=3 75 B12R1.438 COC1=CC=CC(CC(C)=O)=C1 CS-693 [1,0,0,0,1,0|1,0,1]=4 76 B12R1.56 COC1=C(F)C=CC(C(=O)O)=C1 26-3683 [0,0,0,0,2,0|1,0,0]=3 77 B12R1.56 COC1=C(F)C=CC(C(C)=O)=C1 26-3672 [0,0,0,0,2,0|2,0,0]=4 78 B12R1.56 COC1=C(N)C=CC(C(=O)O)=C1 CS-071 [0,0,0,0,2,0|1,0,0]=3 79 B12R1.56 COC1=C(O)C=CC(C(=O)O)=C1 01-909 [0,0,0,0,2,0|0,0,0]=2 80 B12R1.56 COC1=C(O)C=CC(C(C)=O)=C1 026002 [0,0,0,0,2,0|1,0,0]=3 81 B12R1.56 COC1=CC(C(=O)O)=CN=C1Cl 08-4277 [0,0,0,0,2,0|2,0,0]=4