0 B13R1.510 CC(N)C(=O)C1=CC=C(O)C(O)=C1 RT1554 [0,0,0,0,0,0|0,0,2]=2 1 B13R1.510 C[C@H](N)[C@H](O)C1=CC=C(O)C(O)=C1 RT3655 [0,0,0,0,0,0|0,0,0]=0 2 B13R1.510 O=C(O)C(O)C1=CC=C(O)C(O)=C1 HL0440 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.19 CC(=O)CC1=CC=C(O)C(O)=C1 RT16870 [1,0,0,0,0,0|1,0,1]=3 4 B12R1.20 CC(N)C(O)C1=CC=C(Cl)C=C1 LT5084 [1,0,0,0,0,0|1,0,0]=2 5 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 JZ4498 [1,0,0,0,0,0|2,0,1]=4 6 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 RT11186 [1,0,0,0,0,0|2,0,1]=4 7 B12R1.225 CC(=O)C(O)C1=CC=CC(Cl)=C1 RT11240 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.225 CC(C1=CC=CC(O)=C1)N(C)C RT3091 [1,0,0,0,0,0|3,0,0]=4 9 B12R1.225 C[C@@H](C1=CC(O)=CC=C1)N(C)C YH65470 [1,0,0,0,0,0|3,0,0]=4 10 B12R1.225 O=C(O)C(O)C1=CC=CC(O)=C1 RT6094 [1,0,0,0,0,0|2,0,1]=4 11 B12R1.367 NCC(O)C1=CC(O)=C(O)C=C1 LT7649 [1,0,0,0,0,0|0,0,0]=1 12 B12R1.367 NCC(O)C1=CC(O)=C(O)C=C1 YH04566 [1,0,0,0,0,0|0,0,0]=1 13 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 HL3185 [1,0,0,0,0,0|0,0,0]=1 14 B12R1.367 NCC(O)C1=CC=C(O)C(O)=C1 YH55551 [1,0,0,0,0,0|0,0,0]=1 15 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 LX2603 [1,0,0,0,0,0|0,0,0]=1 16 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 LX2787 [1,0,0,0,0,0|0,0,0]=1 17 B12R1.367 O=C(CCl)C1=CC(O)=C(O)C=C1 XJ0281 [1,0,0,0,0,0|1,0,2]=4 18 B14R1.41 COC1=CC(C(O)C(=O)O)=CC=C1O LQ0006 [0,1,0,0,0,0|2,0,1]=4 19 B14R1.3652 COC1=C(O)C=C(C(O)C(=O)O)C=C1 RT11700 [0,1,0,0,0,0|2,0,1]=4 20 B14R1.685 CN(C)CC(O)C1=CC(O)=C(O)C=C1 RT3082 [0,0,0,0,0,1|2,0,0]=3 21 B14R1.686 O=C(O)[C@H](O)CC1=CC=C(O)C(O)=C1 HL4572 [0,0,0,0,0,1|2,0,1]=4 22 B14R1.686 O=C([O-])C(O)CC1=CC=C(O)C(O)=C1 LL1192 [0,0,0,0,0,1|2,0,1]=4 23 B11R1.20 CC(=O)CC1=CC=C(O)C=C1 YH18094 [2,0,0,0,0,0|1,0,1]=4 24 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 LX2745 [2,0,0,0,0,0|2,0,0]=4 25 B11R1.20 CC(N)CC1=CC=C(F)C=C1 HL1836 [2,0,0,0,0,0|1,0,0]=3 26 B11R1.20 CC(N)CC1=CC=C(F)C=C1 LL1086 [2,0,0,0,0,0|1,0,0]=3 27 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 XJ4357 [2,0,0,0,0,0|1,0,1]=4 28 B11R1.192 C=CCC1=CC(O)=C(O)C=C1 YH25190 [2,0,0,0,0,0|0,0,2]=4 29 B11R1.192 NCCC1=CC(O)=C(O)C=C1 XJ0012 [2,0,0,0,0,0|0,0,0]=2 30 B11R1.192 NCCC1=CC(S)=C(O)C=C1 RT16281 [2,0,0,0,0,0|0,1,0]=3 31 B11R1.192 O=CCC1=CC=C(O)C(O)=C1 RT12179 [2,0,0,0,0,0|1,0,1]=4 32 B11R1.22 CC1=CC=C(C(O)CN)C=C1 RT1609 [2,0,0,0,0,0|1,0,0]=3 33 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 RT11202 [2,0,0,0,0,0|0,0,2]=4 34 B11R1.22 CCC(C)C1=CC=C(Br)C=C1 LT4307 [2,0,0,0,0,0|2,0,0]=4 35 B11R1.22 NCC(=O)C1=CC=C(O)C=C1 YH43755 [2,0,0,0,0,0|0,0,2]=4 36 B11R1.36 CC(C)C(O)C1=CC=CC=C1 XJ1122 [2,0,0,0,0,0|1,0,0]=3 37 B11R1.36 C[C@@H](N)[C@H](O)C1=CC=CC=C1 RT3084 [2,0,0,0,0,0|0,0,0]=2 38 B11R1.23 CCC(=O)C1=CC=CC(O)=C1 LQ3598 [2,0,0,0,0,0|0,0,2]=4 39 B11R1.23 N#CC(O)C1=CC=CC(O)=C1 RT6293 [2,0,0,0,0,0|0,0,2]=4 40 B11R1.23 NCC(O)C1=CC(Cl)=CC=C1 YH05716 [2,0,0,0,0,0|1,0,0]=3 41 B11R1.23 NCC(O)C1=CC(O)=CC=C1 RT2781 [2,0,0,0,0,0|0,0,0]=2 42 B11R1.21 CC(=O)C1=CC(O)=C(O)C=C1 JZ4491 [2,0,0,0,0,0|0,0,2]=4 43 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 LT6644 [2,0,0,0,0,0|1,0,1]=4 44 B13R1.2879 COC(=O)CC1=CC=C(O)C(O)=C1 RT11784 [1,1,0,0,0,0|1,0,1]=4 45 B13R1.21 CNC(C)C(O)C1=CC=C(F)C=C1 RT5943 [1,1,0,0,0,0|1,0,0]=3 46 B13R1.21 CN[C@@H](C)[C@@H](O)C1=CC=C(F)C=C1 RT1394 [1,1,0,0,0,0|1,0,0]=3 47 B13R1.49 COC1=CC(C(O)CN)=CC=C1O RT3146 [1,1,0,0,0,0|0,0,0]=2 48 B13R1.49 COC1=CC(C(O)CO)=CC=C1O RT11623 [1,1,0,0,0,0|1,0,0]=3 49 B13R1.466 CCCC(=O)C1=CC=C(O)C(O)=C1 RT6100 [1,1,0,0,0,0|0,0,2]=4 50 B13R1.466 CNCC(=O)C1=CC=C(O)C(O)=C1 HL1306 [1,1,0,0,0,0|0,0,2]=4 51 B13R1.466 CNCC(O)C1=CC(O)=C(Br)C=C1 RT3620 [1,1,0,0,0,0|1,0,0]=3 52 B13R1.466 CNC[C@H](O)C1=CC(O)=C(Br)C=C1 RT1882 [1,1,0,0,0,0|1,0,0]=3 53 B13R1.466 CNC[C@H](O)C1=CC(O)=C(O)C=C1 HL1020 [1,1,0,0,0,0|0,0,0]=2 54 B13R1.466 CNC[C@H](O)C1=CC(O)=C(O)C=C1 HL1021 [1,1,0,0,0,0|0,0,0]=2 55 B15R1.12853 COC1=CC=C(C(=O)C(C)N)C=C1OC RT1643 [0,2,0,0,0,0|0,0,2]=4 56 B15R1.3956 CCNC(C)C(O)C1=CC=C(O)C(O)=C1 RT3293 [0,2,0,0,0,0|0,0,0]=2 57 B13R2.522 N[C@@H]1CC1C2=CC(F)=C(F)C=C2 RT1805 [1,0,0,1,0,0|2,0,0]=4 58 B13R2.522 N[C@@H]1CC1C2=CC(F)=C(F)C=C2 YH47023 [1,0,0,1,0,0|2,0,0]=4 59 B15R2.62227 N[C@H]1CC2=C(C=C(O)C(O)=C2)OC1=O RT2590 [0,0,0,1,0,1|0,0,2]=4 60 B15R1.889 CC(C)NCC(O)C1=CC(O)=C(O)C=C1 JZ0349 [0,0,0,0,0,2|1,0,0]=3 61 B15R1.889 CC(C)NCC(O)C1=CC(O)=C(O)C=C1 LQ3136 [0,0,0,0,0,2|1,0,0]=3 62 B15R1.889 CC(C)NCC(O)C1=CC=C(O)C(O)=C1 HL1025 [0,0,0,0,0,2|1,0,0]=3