0 B15R1.499 CC(=O)CCC1=CC=C(C=C1)OC(=O)C CNP0297393.0 [0,0,0,0,0,0|0,0,0]=0 1 B15R1.499 CC(=O)OC1=CC=C(C=C1)C=CC(=O)O CNP0197321.0 [0,0,0,0,0,0|1,0,2]=3 2 B15R1.499 CC(=O)OCC1=CC=C(C=C1)OC(=O)C CNP0129543.0 [0,0,0,0,0,0|1,0,0]=1 3 B14R1.68 CCCCC1=CC=C(C=C1)NC(=O)C CNP0197818.0 [1,0,0,0,0,0|1,0,1]=3 4 B16R1.1139 COC(=O)C=CC1=CC=C(C=C1)OC(=O)C CNP0127936.0 [0,1,0,0,0,0|0,0,2]=3 5 B16R1.1282 CC(=O)OC1=CC=C(C=C1)[C@H](C)OC(=O)C CNP0259225.1 [0,1,0,0,0,0|1,0,0]=2 6 B16R1.1282 CC(C)OC1=CC=C(C=C1)[C@@H](N)CC(=O)O CNP0322784.2 [0,1,0,0,0,0|2,0,1]=4 7 B16R1.1282 CC(C)OC1=CC=C(C=C1)[C@H](N)CC(=O)O CNP0322784.1 [0,1,0,0,0,0|2,0,1]=4 8 B16R1.1283 CC(=O)NC1=CC=C(C=C1)C[C@H](N)C(=O)O CNP0148054.1 [0,1,0,0,0,0|2,0,0]=3 9 B16R1.6700 CC(=O)OC1=CC=C(C=C1O)C=CC(=O)O CNP0250642.0 [0,1,0,0,0,0|1,0,2]=4 10 B16R2.11975 CC(=O)OC1=CC=C2C=CC(=O)OC2=C1 CNP0301053.0 [0,0,0,1,0,0|1,0,2]=4 11 B14R1.419 CC(=CCC1=CC=C(C=C1)C(=O)N)C CNP0604669.0 [0,0,0,0,1,0|2,0,1]=4 12 B14R1.419 CC(=CCC1=CC=C(C=C1)C(=O)O)C CNP0170578.0 [0,0,0,0,1,0|2,0,1]=4 13 B14R1.419 CC(=O)C1=CC=C(C=C1)C=CC(=O)O CNP0470131.0 [0,0,0,0,1,0|1,0,2]=4 14 B14R1.419 CC(=O)OCC1=CC=C(C=C1)C(C)C CNP0282955.0 [0,0,0,0,1,0|2,0,1]=4 15 B14R1.419 O=C(O)COC1=CC=C(C=C1)C(=O)O CNP0454411.0 [0,0,0,0,1,0|3,0,0]=4 16 B14R1.805 CC(=O)NC1=CC=C(C=C1)CC(=O)O CNP0071151.0 [0,0,0,0,1,0|2,0,0]=3 17 B14R1.805 CC(=O)NC1=CC=C(C=C1)OC(=O)C CNP0047718.0 [0,0,0,0,1,0|1,0,0]=2 18 B14R1.805 CC(=O)NC1=CC=C(N=C1)NC(=O)C CNP0433589.0 [0,0,0,0,1,0|3,0,0]=4 19 B16R1.603 CC(=O)C=CC1=CC=C(C=C1)C=CC(=O)C CNP0161896.0 [0,0,0,0,0,1|1,0,2]=4 20 B16R1.603 CC(=O)CCC1=CC=C(C=C1)CCC(=O)C CNP0329152.0 [0,0,0,0,0,1|1,0,0]=2 21 B16R1.603 CC(C)COC1=CC=C(C=C1)CCC(=O)O CNP0397899.0 [0,0,0,0,0,1|2,0,1]=4 22 B16R1.1287 CC(=O)NCCC1=CC=C(C=C1)OC(=O)C CNP0163346.0 [0,0,0,0,0,1|0,0,0]=1 23 B13R1.142 C=CCC1=CC=C(C=C1)OC(=O)C CNP0418020.0 [2,0,0,0,0,0|0,0,1]=3 24 B13R1.142 CC(=O)OC1=CC=C(C=C1)CCO CNP0287085.0 [2,0,0,0,0,0|0,0,1]=3 25 B13R1.142 CCOC1=CC=C(C=C1)NC(=O)C CNP0330924.0 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.3 C=CC1=CC=C(C=C1)COC(=O)C CNP0018344.0 [2,0,0,0,0,0|1,0,1]=4 27 B13R1.3 CC(=O)CCC1=CC=C(C=C1)ON CNP0361857.0 [2,0,0,0,0,0|1,0,0]=3 28 B13R1.3 CCC1=CC=C(C=C1)CCC(=O)O CNP0457495.0 [2,0,0,0,0,0|1,0,1]=4 29 B13R1.3 CCC1=CC=C(C=C1)COC(=O)C CNP0564625.0 [2,0,0,0,0,0|1,0,1]=4 30 B13R1.3 COC1=CC=C(C=C1)C=CC(=O)C CNP0085604.0 [2,0,0,0,0,0|0,0,2]=4 31 B13R1.3 COC1=CC=C(C=C1)CCC(=O)C CNP0123166.0 [2,0,0,0,0,0|0,0,0]=2 32 B13R1.3 COC1=CC=C(C=C1)CCC(=O)N CNP0592087.0 [2,0,0,0,0,0|1,0,0]=3 33 B13R1.3 COC1=CC=C(C=C1)CCC(=O)O CNP0156617.0 [2,0,0,0,0,0|1,0,0]=3 34 B13R1.3 COC1=CC=C(C=C1)CCN(C)C CNP0223802.0 [2,0,0,0,0,0|2,0,0]=4 35 B13R1.3 COC1=CC=C(C=C1)CC[C@H](C)O CNP0324316.1 [2,0,0,0,0,0|0,0,2]=4 36 B13R1.3 COC1=CC=C(C=C1)CC[N+](=O)[O-] CNP0491242.0 [2,0,0,0,0,0|2,0,0]=4 37 B13R1.3 COC1=CC=C(C=C1)CNC(=O)C CNP0514444.0 [2,0,0,0,0,0|1,0,0]=3 38 B13R1.3 COC1=CC=C(C=C1)COC(=O)C CNP0232581.0 [2,0,0,0,0,0|1,0,0]=3 39 B13R1.3 COC1=CC=C(C=C1)OCC(=O)O CNP0080091.0 [2,0,0,0,0,0|2,0,0]=4 40 B13R1.3 NC(=O)COC1=CC=C(C=C1)C=O CNP0566426.0 [2,0,0,0,0,0|2,0,0]=4 41 B15R1.104 CCCCC1=CC=C(C=C1)NC(=O)CC CNP0480250.0 [1,1,0,0,0,0|1,0,1]=4 42 B15R1.5504 C[C@@H](CC(=O)O)C1=CC=C(C=C1)C(=O)O CNP0471729.1 [0,1,0,0,1,0|2,0,0]=4 43 B15R1.5504 C[C@H](CC(=O)O)C1=CC=C(C=C1)C(=O)O CNP0471729.2 [0,1,0,0,1,0|2,0,0]=4 44 B15R1.5387 CC(=O)OC1=CC=C(C(=C1)C)OC(=O)C CNP0325745.0 [0,1,0,0,1,0|1,0,0]=3 45 B17R1.1354 COC(=O)CCC1=CC=C(C=C1)O[Si](C)(C)C CNP0086106.0 [0,2,0,0,0,0|1,1,0]=4 46 B17R1.2790 C=C[C@@H](OC(=O)C)C1=CC=C(C=C1)OC(=O)C CNP0165384.2 [0,2,0,0,0,0|1,0,0]=3 47 B17R1.2790 C=C[C@H](OC(=O)C)C1=CC=C(C=C1)OC(=O)C CNP0165384.1 [0,2,0,0,0,0|1,0,0]=3 48 B17R1.2790 CC[C@H](OC(=O)C)C1=CC=C(C=C1)OC(=O)C CNP0320247.1 [0,2,0,0,0,0|1,0,0]=3 49 B17R1.7925 CC(=O)C[C@@H](O)C1=CC(=O)C(=CO1)NC(=O)C CNP0563440.1 [0,2,0,0,0,0|2,0,0]=4 50 B17R1.7925 CC(=O)C[C@H](O)C1=CC(=O)C(=CO1)NC(=O)C CNP0563440.2 [0,2,0,0,0,0|2,0,0]=4 51 B17R1.76148 CC(=O)OCC1=CC(=C(C(=C1)Br)OC(=O)C)Br CNP0324462.0 [0,2,0,0,0,0|1,0,0]=3 52 B15R2.7688 CC(=O)CCC1=CC=C2OCOC2=C1 CNP0147307.0 [1,0,0,1,0,0|0,0,2]=4 53 B15R2.7688 O=C(O)CCC1=CC=C2OCCC2=C1 CNP0116181.0 [1,0,0,1,0,0|1,0,1]=4 54 B15R2.926 CC(=O)NC1=CC=C2CC(=O)NC2=C1 CNP0038642.0 [0,0,0,1,1,0|2,0,0]=4 55 B17R2.19729 CC(=O)CCC1=CC=C2C=CC(=NC2=C1)C CNP0044532.0 [0,0,0,1,0,1|2,0,0]=4 56 B17R2.19759 O=C(O)CCC1=CC=C2NC(=O)CCC2=C1 CNP0454460.0 [0,1,0,1,0,0|2,0,0]=4 57 B13R1.74 CC(C)C1=CC=C(C=C1)CCC=O CNP0002936.0 [1,0,0,0,1,0|1,0,1]=4 58 B13R1.74 CCCCC1=CC=C(C=C1)C(=O)Cl CNP0069306.0 [1,0,0,0,1,0|1,0,1]=4 59 B13R1.74 CCCCC1=CC=C(C=C1)C(=O)O CNP0451250.0 [1,0,0,0,1,0|1,0,1]=4 60 B13R1.585 CC(=O)NC1=CC=C(C=C1)C(=O)O CNP0270069.0 [0,0,0,0,2,0|2,0,0]=4 61 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)C CNP0141125.0 [0,0,0,0,2,0|1,0,0]=3 62 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)O CNP0307817.0 [0,0,0,0,2,0|2,0,0]=4 63 B15R1.1080 CC(=O)C1=CC=C(C=C1)CCCC(=O)O CNP0494538.0 [0,0,0,0,1,1|1,0,0]=3 64 B15R1.1080 CC(=O)C1=CC=C(C=C1)OCC=C(C)C CNP0003443.0 [0,0,0,0,1,1|1,0,1]=4 65 B15R1.8936 CC(=O)OCC1=CC=CC(=C1)OC(=O)C CNP0324819.0 [0,0,0,0,1,1|1,0,0]=3 66 B17R1.1309 CC(=O)OCC=CC1=CC=C(C=C1)OC(=O)C CNP0298263.0 [0,0,0,0,0,2|0,0,1]=3