0 B22R0.2907 CCCCCC=CCC=CCCCCCCCCCCC(=O)O MCULE-7936510021 [0,0,0,0,0,0|0,0,4]=4 1 B22R0.2907 CCCCCCCCCCCCCCCCC#CC#CC(=O)O MCULE-5038170956 [0,0,0,0,0,0|0,0,4]=4 2 B22R0.2907 CCCCCCCCCCCCCCCCCCCCC(=O)N MCULE-6110197367 [0,0,0,0,0,0|1,0,0]=1 3 B22R0.2907 CCCCCCCCCCCCCCCCCCCCC(=O)O MCULE-6667030670 [0,0,0,0,0,0|0,0,0]=0 4 B22R0.2907 CCCCCCCCCCCCCCCCCCNCC(C)O MCULE-6894135519 [0,0,0,0,0,0|2,0,1]=3 5 B22R0.2907 CCCCCCCCCCCCCCCCCCNCC(C)O MCULE-8081639869 [0,0,0,0,0,0|2,0,1]=3 6 B22R0.2907 CCCCCCCCCCCCCCCCCC[NH2+]CC(=O)O MCULE-7985017224 [0,0,0,0,0,0|1,0,0]=1 7 B22R0.2907 CCCCCCCCCCCCCCCCCC[NH2+]CC(=O)O MCULE-9347414737 [0,0,0,0,0,0|1,0,0]=1 8 B22R0.2907 N#N=NCCCCCCCCCCCCCCCCCC(=O)O MCULE-2840118475 [0,0,0,0,0,0|3,0,0]=3 9 B22R0.2907 O=C(O)CCCCCCCCCCCCCCCCCCCBr MCULE-3103891127 [0,0,0,0,0,0|1,0,0]=1 10 B22R0.2907 O=C(O)CCCCCCCCCCCCCCCCCCCO MCULE-6200904053 [0,0,0,0,0,0|1,0,0]=1 11 B21R0.81 C=C(C)CCCCCCCCCCCCCCCCCCC MCULE-6200358997 [1,0,0,0,0,0|2,0,0]=3 12 B21R0.81 CCCCCC/C=C\CCCCCCCCCCCC(=O)O MCULE-5077473579 [1,0,0,0,0,0|0,0,2]=3 13 B21R0.81 CCCCCC=CCCCCCCCCCCCCC(=O)O MCULE-3376654817 [1,0,0,0,0,0|0,0,2]=3 14 B21R0.81 CCCCCCC=CCCCCCCCCCCCC(=O)O MCULE-9376142288 [1,0,0,0,0,0|0,0,2]=3 15 B21R0.81 CCCCCCCC/C=C\CCCCCCCCCC(=O)O MCULE-1798812588 [1,0,0,0,0,0|0,0,2]=3 16 B21R0.81 CCCCCCCCC=CCCCCCCCCCC(=O)N MCULE-2886059366 [1,0,0,0,0,0|1,0,2]=4 17 B21R0.81 CCCCCCCCC=CCCCCCCCCCC(=O)O MCULE-5167912454 [1,0,0,0,0,0|0,0,2]=3 18 B21R0.81 CCCCCCCCCC/C=C\CCCCCCCC(=O)O MCULE-8696271470 [1,0,0,0,0,0|0,0,2]=3 19 B21R0.81 CCCCCCCCCCC=CCCCCCCCC(=O)O MCULE-1716285800 [1,0,0,0,0,0|0,0,2]=3 20 B21R0.81 CCCCCCCCCCCC=CCCCCCCC(=O)O MCULE-1737820111 [1,0,0,0,0,0|0,0,2]=3 21 B21R0.81 CCCCCCCCCCCCCCC=CCCCC(=O)O MCULE-6785318094 [1,0,0,0,0,0|0,0,2]=3 22 B21R0.81 CCCCCCCCCCCCCCCCCC=CC(=O)O MCULE-9297237540 [1,0,0,0,0,0|0,0,2]=3 23 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)C MCULE-5537259513 [1,0,0,0,0,0|1,0,0]=2 24 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)N MCULE-7873009658 [1,0,0,0,0,0|1,0,0]=2 25 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)O MCULE-2888473872 [1,0,0,0,0,0|0,0,0]=1 26 B21R0.81 CCCCCCCCCCCCCCCCCCCC(=O)[O-] MCULE-5169106993 [1,0,0,0,0,0|0,0,1]=2 27 B21R0.81 CCCCCCCCCCCCCCCCCCNC(=O)C MCULE-1304155027 [1,0,0,0,0,0|2,0,0]=3 28 B21R0.81 CCCCCCCCCCCCCCCCCCNC(=O)N MCULE-2439500537 [1,0,0,0,0,0|2,0,0]=3 29 B21R0.81 CCCCCCCCCCCCCCCCCCOC(=O)C MCULE-3025838252 [1,0,0,0,0,0|2,0,0]=3 30 B21R0.81 CCCCCCCCCCCCCCCCNCCC(=O)N MCULE-7083473692 [1,0,0,0,0,0|2,0,0]=3 31 B21R0.81 O=C(O)CCCCCCCCCCCCCCCCCCBr MCULE-3663484390 [1,0,0,0,0,0|1,0,0]=2 32 B21R0.81 O=C(O)CCCCCCCCCCCCCCCCCCO MCULE-7315062903 [1,0,0,0,0,0|1,0,0]=2 33 B21R0.81 O=C(O)CCCCCOCCCCCOCCCCCCCl MCULE-3717188596 [1,0,0,0,0,0|3,0,0]=4 34 B21R0.36664 C=CCCCCCCCCCCCCCCCCCCCC MCULE-6678856026 [1,0,0,0,0,0|1,0,0]=2 35 B21R0.36664 CCCCCCCCCCCCCCCCCCCCCC MCULE-1530566068 [1,0,0,0,0,0|1,0,1]=3 36 B21R0.36664 CCCCCCCCCCCCCCCCCCCCCO MCULE-7927521490 [1,0,0,0,0,0|0,0,1]=2 37 B21R0.36664 CCCCCCCCCCCCCCCCCCNCCO MCULE-5601209739 [1,0,0,0,0,0|1,0,1]=3 38 B21R0.36664 CCCCCCCCCCCCCCCCCCOCCO MCULE-4680691489 [1,0,0,0,0,0|1,0,1]=3 39 B21R0.36664 CCCCCCCCCCCCCCCCNCCCNC MCULE-8629116152 [1,0,0,0,0,0|3,0,0]=4 40 B21R0.36664 OCCCCCCCCCCCCCCCCCCCCBr MCULE-3506374911 [1,0,0,0,0,0|1,0,1]=3 41 B21R0.36664 OCCCCCCCCCCCCCCCCCCCCO MCULE-9238594783 [1,0,0,0,0,0|1,0,1]=3 42 B23R0.9269 CCCCCCCCCCCCCCCCCCCCC(=O)OC MCULE-7734389837 [0,1,0,0,0,0|0,0,0]=1 43 B23R0.9269 CCCCCCCCCCCCCCCCCCCCC(C)CC MCULE-2468601346 [0,1,0,0,0,0|2,0,1]=4 44 B23R0.9269 CCCCCCCCCCCCCCCCCCOCC(O)CO MCULE-6612947628 [0,1,0,0,0,0|1,0,2]=4 45 B23R0.9269 COC(=O)CCCCCCCCCCCCCCCCCCCO MCULE-3417556428 [0,1,0,0,0,0|1,0,0]=2 46 B23R0.9276 CCCCCCCCCCCCCCCCCC(=O)NCC(=O)O MCULE-1050379360 [0,1,0,0,0,0|1,0,1]=3 47 B23R0.9276 CCCCCCCCCCCCCCCCNC(=O)CCC(=O)O MCULE-1935040743 [0,1,0,0,0,0|1,0,1]=3 48 B23R0.24479 O=C(O)CCCCCCCCCCCCCCCCCCC(=O)O MCULE-1513008382 [0,1,0,0,0,0|1,0,1]=3 49 B23R0.26031 COC(=O)CCCCCCCCCCCCCCCCCC(=O)O MCULE-6930389258 [0,1,0,0,0,0|1,0,1]=3 50 B23R0.36959 C(=CCCCCCCCCCCCC(=O)N)CCCCCCCC MCULE-2517446049 [0,1,0,0,0,0|1,0,1]=3 51 B23R0.36959 C=CCCCCCCCCCCCCCCCCCCCC(=O)O MCULE-5094008253 [0,1,0,0,0,0|0,0,1]=2 52 B23R0.36959 CCCCCC=CCC=CCCCCCCCCCCCC(=O)O MCULE-4672872339 [0,1,0,0,0,0|0,0,3]=4 53 B23R0.36959 CCCCCCCC/C=C\CCCCCCCCCCCC(=O)N MCULE-5119823846 [0,1,0,0,0,0|1,0,1]=3 54 B23R0.36959 CCCCCCCC/C=C\CCCCCCCCCCCC(=O)O MCULE-8191255112 [0,1,0,0,0,0|0,0,1]=2 55 B23R0.36959 CCCCCCCCC=CCCCCCCCCCCCC(=O)O MCULE-3248745724 [0,1,0,0,0,0|0,0,1]=2 56 B23R0.36959 CCCCCCCCCCC=CCCCCCCCCCC(=O)O MCULE-6889662851 [0,1,0,0,0,0|0,0,1]=2 57 B23R0.36959 CCCCCCCCCCCCCC=CCCCCCCC(=O)O MCULE-3309438037 [0,1,0,0,0,0|0,0,1]=2 58 B23R0.36959 CCCCCCCCCCCCCCCCCCCCCC(=O)N MCULE-1682009540 [0,1,0,0,0,0|1,0,0]=2 59 B23R0.36959 CCCCCCCCCCCCCCCCCCCCCC(=O)O MCULE-1752034684 [0,1,0,0,0,0|0,0,0]=1 60 B23R0.36959 CCCCCCCCCCCCCCCCCCCCCC(=O)[O-] MCULE-9614200331 [0,1,0,0,0,0|0,0,1]=2 61 B23R0.36959 CCCCCCCCCCCCCCCCCCCCOC(=O)C MCULE-9557893208 [0,1,0,0,0,0|1,0,0]=2 62 B23R0.36959 O=C(O)CCCCCCCCCCCCCCCCCCCCBr MCULE-2538565988 [0,1,0,0,0,0|0,0,0]=1 63 B23R0.36959 O=C(O)CCCCCCCCCCCCCCCCCCCCO MCULE-1765648557 [0,1,0,0,0,0|0,0,0]=1 64 B23R0.37246 CCCCCCCCCCCCCCCCCCCC[N+](C)(C)C MCULE-4105590102 [0,1,0,0,0,0|3,0,0]=4 65 B23R0.37246 CCCCCCCCCCCCCCCCCCCC[N+](C)(C)C MCULE-6280873720 [0,1,0,0,0,0|3,0,0]=4 66 B23R0.37246 CCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl MCULE-8678875869 [0,1,0,0,0,0|2,1,0]=4 67 B23R1.1112145 CCCCC[C@H]1O[C@H]1CCCCC=CCCCCCCC(=O)O MCULE-1242138610 [0,0,0,1,0,0|1,0,2]=4 68 B23R1.1112145 CCCCC[C@H]1O[C@H]1CCCCCCCC=CCCCC(=O)O MCULE-8281920512 [0,0,0,1,0,0|1,0,2]=4 69 B20R0.2932 C=CCCCCCCCCCCCCCCCCCCC MCULE-4267987318 [2,0,0,0,0,0|0,0,1]=3 70 B20R0.2932 C=COCCCCCCCCCCCCCCCCCC MCULE-5575330602 [2,0,0,0,0,0|1,0,1]=4 71 B20R0.2932 CCCCCCCCCCCCCCCCCCCC=O MCULE-2583593775 [2,0,0,0,0,0|0,0,0]=2 72 B20R0.2932 CCCCCCCCCCCCCCCCCCCCBr MCULE-7868045769 [2,0,0,0,0,0|1,0,0]=3 73 B20R0.2932 CCCCCCCCCCCCCCCCCCCCC MCULE-3230962872 [2,0,0,0,0,0|0,0,1]=3 74 B20R0.2932 CCCCCCCCCCCCCCCCCCCCCl MCULE-6684617118 [2,0,0,0,0,0|1,0,0]=3 75 B20R0.2932 CCCCCCCCCCCCCCCCCCCCN MCULE-6786366889 [2,0,0,0,0,0|1,0,0]=3 76 B20R0.2932 CCCCCCCCCCCCCCCCCCCCO MCULE-7922551976 [2,0,0,0,0,0|0,0,0]=2 77 B20R0.2932 CCCCCCCCCCCCCCCCCCCCS MCULE-8563857815 [2,0,0,0,0,0|0,1,0]=3 78 B20R0.2932 CCCCCCCCCCCCCCCCCCN=C=O MCULE-4764885390 [2,0,0,0,0,0|1,0,1]=4 79 B20R0.2932 CCCCCCCCCCCCCCCCCCNC=O MCULE-3205565522 [2,0,0,0,0,0|1,0,0]=3 80 B20R0.2932 CCCCCCCCCCCCCCCCNCCCC MCULE-4030338906 [2,0,0,0,0,0|1,0,1]=4 81 B20R0.2932 CCCCCCCCCCCCCCCCNCCCN MCULE-4950352025 [2,0,0,0,0,0|2,0,0]=4 82 B20R0.2932 CCCCCCCCCCCCCCCCNCCCO MCULE-4308349339 [2,0,0,0,0,0|1,0,0]=3 83 B20R0.2932 CCCCCCCCCCCCCCCCOCCCO MCULE-8496439735 [2,0,0,0,0,0|1,0,0]=3 84 B20R0.2932 CCCCCCCCCCNCCCCCCCCCC MCULE-4175489428 [2,0,0,0,0,0|1,0,1]=4 85 B20R0.2932 CCCCCCCCCCNCCCCCCCCCC MCULE-9414456668 [2,0,0,0,0,0|1,0,1]=4 86 B20R0.2932 CCCCCCCCCCOCCCCCCCCCC MCULE-3236292237 [2,0,0,0,0,0|1,0,1]=4 87 B20R0.2932 CCCCCCCCCCSCCCCCCCCCC MCULE-5643913334 [2,0,0,0,0,0|1,0,1]=4 88 B20R0.2932 OCCCCCCCCCCCCCCCCCCCO MCULE-7817124881 [2,0,0,0,0,0|1,0,0]=3 89 B20R0.2932 [NH2+](CCCC)CCCCCCCCCCCCCCCC MCULE-7372521878 [2,0,0,0,0,0|1,0,1]=4 90 B20R0.31940 CCCCCCCC/C=C\CCCCCCCCC(=O)O MCULE-7761893081 [2,0,0,0,0,0|0,0,2]=4 91 B20R0.31940 CCCCCCCCC=CCCCCCCCCC(=O)O MCULE-7486728155 [2,0,0,0,0,0|0,0,2]=4 92 B20R0.31940 CCCCCCCCCCCCCCCCCCB(O)O MCULE-4425312913 [2,0,0,0,0,0|1,0,1]=4 93 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)C MCULE-6612200716 [2,0,0,0,0,0|1,0,0]=3 94 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)Cl MCULE-8687950753 [2,0,0,0,0,0|1,0,0]=3 95 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)N MCULE-5930779500 [2,0,0,0,0,0|1,0,0]=3 96 B20R0.31940 CCCCCCCCCCCCCCCCCCC(=O)O MCULE-3651545554 [2,0,0,0,0,0|0,0,0]=2 97 B20R0.31940 CCCCCCCCCCCCCCCCCCN(=O)=O MCULE-9592584788 [2,0,0,0,0,0|1,0,1]=4 98 B20R0.31940 CCCCCCCCCCCCCCCCCOC(=O)C MCULE-9059316294 [2,0,0,0,0,0|2,0,0]=4 99 B20R0.31940 CCCCCCCCCCCCNCCCCCC(=O)O MCULE-2808072086 [2,0,0,0,0,0|1,0,0]=3 100 B20R0.31940 CCCCCCCNCCCCCCCCCCC(=O)O MCULE-1452338178 [2,0,0,0,0,0|1,0,0]=3 101 B20R0.31940 O=C(O)CCCCCCCCCCCCCCCCCBr MCULE-1900787768 [2,0,0,0,0,0|1,0,0]=3 102 B20R0.31940 O=C(O)CCCCCCCCCCCCCCCCCO MCULE-7843488730 [2,0,0,0,0,0|1,0,0]=3 103 B20R0.31940 O=C(O)CCCCCCCCCCCCCCCCCS MCULE-8278921645 [2,0,0,0,0,0|1,0,0]=3 104 B22R0.2865 CCCCCCCCCCCCCCCC(=O)NCCC(=O)O MCULE-1328237079 [1,1,0,0,0,0|1,0,1]=4 105 B22R0.9148 CC(=O)CCCCCCCCCCCCCCCCCC(=O)C MCULE-7181634778 [1,1,0,0,0,0|1,0,1]=4 106 B22R0.9148 CC(C)CCCCCCCCCCCCCCCCCC(=O)O MCULE-5724324181 [1,1,0,0,0,0|0,0,0]=2 107 B22R0.9148 O=C(O)CCCCCCCCCCCCCCCCCC(=O)O MCULE-6337534436 [1,1,0,0,0,0|1,0,1]=4 108 B22R0.9409 CCCCCC[C@@H](O)CC=CCCCCCCCCCC(=O)O MCULE-9597800948 [1,1,0,0,0,0|0,0,2]=4 109 B22R0.9489 CCCCCCCCCCCCCCCCCCOS(=O)(=O)O MCULE-5496403725 [1,1,0,0,0,0|2,0,0]=4 110 B22R0.25844 CCCCCC(=O)CCCCCCCCCCCCCC(=O)O MCULE-5208343357 [1,1,0,0,0,0|0,0,1]=3 111 B22R0.25844 CCCCCC(O)CCCCCCCCCCCCCC(=O)O MCULE-8386934783 [1,1,0,0,0,0|0,0,0]=2 112 B22R0.31744 CCC(C)CCCCCCCCCCCCCCCCC(=O)O MCULE-2432862438 [1,1,0,0,0,0|0,0,0]=2 113 B22R0.31744 COC(=O)CCCCCCCCCCCCCCCCC(=O)O MCULE-9674637652 [1,1,0,0,0,0|1,0,1]=4 114 B22R0.37842 CCCCCCCC/C=C\CCCCCCCC(O)CC(=O)O MCULE-7179104008 [1,1,0,0,0,0|0,0,2]=4 115 B22R0.37842 CCCCCCCCC=CCCCCCCCC(O)CC(=O)O MCULE-6663139403 [1,1,0,0,0,0|0,0,2]=4 116 B22R0.37842 CCCCCCCCCCCCOCCCNC(C)CC(=O)O MCULE-9421531637 [1,1,0,0,0,0|2,0,0]=4 117 B22R0.37865 CCCCCCCCCCC(=O)CCCCCCCCC(=O)O MCULE-4001240406 [1,1,0,0,0,0|0,0,1]=3 118 B22R0.37964 C=CC(=O)NCCCCCCCCCCCCCCCCCC MCULE-4012460553 [1,1,0,0,0,0|2,0,0]=4 119 B22R0.37964 C=CC(=O)OCCCCCCCCCCCCCCCCCC MCULE-1189701217 [1,1,0,0,0,0|2,0,0]=4 120 B22R0.37964 CCCCCCCC/C=C\CCCCCCCCCC(=O)OC MCULE-8677025904 [1,1,0,0,0,0|0,0,2]=4 121 B22R0.37964 CCCCCCCCC=CCCCCCCCCCC(=O)OC MCULE-1681564890 [1,1,0,0,0,0|0,0,2]=4 122 B22R0.37964 CCCCCCCCCCCC=CCCCCCCC(=O)OC MCULE-5345115078 [1,1,0,0,0,0|0,0,2]=4 123 B22R0.37964 CCCCCCCCCCCCCCC=CCCCC(=O)OC MCULE-5935317639 [1,1,0,0,0,0|0,0,2]=4 124 B22R0.37964 CCCCCCCCCCCCCCCCCCCC(=O)OC MCULE-1741761685 [1,1,0,0,0,0|0,0,0]=2 125 B22R0.37964 CCCCCCCCCCCCCCCCCCOC(=O)CC MCULE-3800893164 [1,1,0,0,0,0|2,0,0]=4 126 B22R0.37964 CCCCCCCCCCCCCCCCCCOC(=O)CS MCULE-9137498075 [1,1,0,0,0,0|1,1,0]=4 127 B22R0.37964 CCCCCCCCCCCCCCCCNCCC(=O)NC MCULE-6546805271 [1,1,0,0,0,0|2,0,0]=4 128 B22R0.37964 CCCCCCCCCCCCCCCCNCCC(=O)NN MCULE-1376039442 [1,1,0,0,0,0|2,0,0]=4 129 B22R0.37964 CCCCCCCCCCCCCCCCNCCC(=O)OC MCULE-7896617043 [1,1,0,0,0,0|1,0,0]=3 130 B22R0.37967 CCCCCCCCCCCCCCCCCCC(C)C(=O)O MCULE-4806310815 [1,1,0,0,0,0|0,0,0]=2 131 B22R0.37967 CCCCCCCCCCCCCCCCCCC(O)C(=O)O MCULE-3500041904 [1,1,0,0,0,0|0,0,0]=2 132 B22R0.37843 CCCCCCCC/C=C\CCCCCCCCCCCCO MCULE-7647040762 [1,1,0,0,0,0|0,0,2]=4 133 B22R0.37843 CCCCCCCCC=CCCCCCCCCCCCCO MCULE-4623064101 [1,1,0,0,0,0|0,0,2]=4 134 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCC#N MCULE-6426624323 [1,1,0,0,0,0|1,0,1]=4 135 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCC=O MCULE-1439012709 [1,1,0,0,0,0|0,0,0]=2 136 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCBr MCULE-3212934075 [1,1,0,0,0,0|1,0,1]=4 137 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCC MCULE-8733316594 [1,1,0,0,0,0|1,0,1]=4 138 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCCl MCULE-9862384556 [1,1,0,0,0,0|1,0,1]=4 139 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCN MCULE-7372937317 [1,1,0,0,0,0|1,0,1]=4 140 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCO MCULE-3239333381 [1,1,0,0,0,0|0,0,1]=3 141 B22R0.37843 CCCCCCCCCCCCCCCCCCCCCCS MCULE-3416640091 [1,1,0,0,0,0|0,1,1]=4 142 B22R0.37843 CCCCCCCCCCCCCCCCCCNCCCO MCULE-2725504602 [1,1,0,0,0,0|0,0,1]=3 143 B22R0.37843 CCCCCCCCCCCCCCCCCCNCCOC MCULE-6886534442 [1,1,0,0,0,0|1,0,1]=4 144 B22R0.37843 CCCCCCCCCCCCCCCCCCOCCC#N MCULE-6722353089 [1,1,0,0,0,0|1,0,1]=4 145 B22R0.37843 CCCCCCCCCCCCCCCCCCOCCCO MCULE-3367784887 [1,1,0,0,0,0|0,0,1]=3 146 B22R0.37843 CCCCCCCCCCCNCCCCCCCCCCC MCULE-8197670124 [1,1,0,0,0,0|1,0,1]=4 147 B22R0.37843 CCCCCCCCCCCOCCCCCCCCCCC MCULE-7463732201 [1,1,0,0,0,0|1,0,1]=4 148 B22R0.37843 CCCCCCCCCCCSCCCCCCCCCCC MCULE-5672331069 [1,1,0,0,0,0|1,0,1]=4 149 B24R0.2854 CCCCCCCCCCCCCCCCCCCC(O)CC(=O)O MCULE-2000398081 [0,2,0,0,0,0|0,0,0]=2 150 B24R0.25589 CCCCCCCCCCCCCCCCCC(=O)N(C)CC(=O)O MCULE-5945872057 [0,2,0,0,0,0|1,0,1]=4 151 B24R0.1515230 CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)[O-] MCULE-4489989413 [0,2,0,0,0,0|1,0,1]=4 152 B24R0.19012 COC(=O)CCCCCCCCCCCCCCCCCCC(=O)O MCULE-7381413053 [0,2,0,0,0,0|0,0,1]=3 153 B24R0.34578 C(=CCCCCCCCCCCCC(=O)OC)CCCCCCCC MCULE-8493572612 [0,2,0,0,0,0|0,0,1]=3 154 B24R0.34578 CCCCCCCCCCCCCCCCCCCCCC(=O)OC MCULE-3875944987 [0,2,0,0,0,0|0,0,0]=2 155 B24R0.34578 COC(=O)CCCCCCCCCCCCCCCCCCCCO MCULE-4618614972 [0,2,0,0,0,0|0,0,0]=2 156 B24R0.34581 CCCCCCCCCCCCCCCCCCCCC(O)C(=O)O MCULE-2337063824 [0,2,0,0,0,0|0,0,0]=2 157 B24R0.1617432 CCCCCCCCS(=O)(=O)NCCCCCCCCCCC(=O)O MCULE-3705714244 [0,2,0,0,0,0|2,0,0]=4 158 B24R0.34069 CCCCCCCCCCCCCCCCCC(=O)OCCC(=O)O MCULE-6758166245 [0,2,0,0,0,0|0,0,1]=3 159 B24R0.17633 CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-] MCULE-6053716400 [0,2,0,0,0,0|1,0,1]=4 160 B24R0.17633 CCCCCCCCCCCCCCCCCCCCOS(=O)(=O)[O-] MCULE-7361007392 [0,2,0,0,0,0|1,0,1]=4 161 B24R0.34120 C=CCCCCCCCCCCCCCCCCCCCCC(=O)O MCULE-3364549999 [0,2,0,0,0,0|0,0,0]=2 162 B24R0.34120 CC=CCCCCCCCCCCCCCCCCCCCC(=O)O MCULE-1000003524 [0,2,0,0,0,0|0,0,0]=2 163 B24R0.34120 CCCCCCCCCCC#CC#CCCCCCCCCC(=O)O MCULE-5860906278 [0,2,0,0,0,0|0,0,2]=4 164 B24R0.34120 CCCCCCCCCCCCCCCCCCCCCCC(=O)N MCULE-3002233012 [0,2,0,0,0,0|1,0,0]=3 165 B24R0.34120 CCCCCCCCCCCCCCCCCCCCCCC(=O)O MCULE-6888441916 [0,2,0,0,0,0|0,0,0]=2 166 B24R0.34120 O=C(O)CCCCCCCCCCCCCCCCCCCCCBr MCULE-6080988401 [0,2,0,0,0,0|0,0,0]=2 167 B24R0.34120 O=C(O)CCCCCCCCCCCCCCCCCCCCCO MCULE-5609061334 [0,2,0,0,0,0|0,0,0]=2 168 B24R0.37373 O=C(O)CCCCCCCCCCCCCCCCCCCC(=O)O MCULE-1020860783 [0,2,0,0,0,0|0,0,1]=3 169 B22R1.3252 CCCCCCCCCCCCCCCCC1CCCCC1 MCULE-8925596462 [1,0,0,1,0,0|1,0,1]=4 170 B24R1.55666 CCCCCCCCCCCCCCCCOCC1COC(=O)O1 MCULE-7511327352 [0,1,0,1,0,0|1,0,0]=3