0 B16R0.61 C#CCC(=O)NCCCCCCCCCCC AIFCHEM-6044162006 [0,0,1,0,0,0|1,0,2]=4 1 B16R0.61 CCCCCCCCCCCCN(C)CCC AIFCHEM-5801696274 [0,0,1,0,0,0|3,0,0]=4 2 B16R0.61 CCCCCCCCCCCNC(=O)CC#N AIFCHEM-94559920572 [0,0,1,0,0,0|2,0,1]=4 3 B16R0.61 CCCCCCCCCCCNC(=O)CCO AIFCHEM-6084003269 [0,0,1,0,0,0|2,0,0]=3 4 B16R0.61 CCCCCCCCCCCNC(=O)COC AIFCHEM-6043825629 [0,0,1,0,0,0|2,0,0]=3 5 B16R0.61 CCCCCCCCCCCNC(=O)CSC AIFCHEM-6079459911 [0,0,1,0,0,0|2,0,0]=3 6 B16R0.61 CCCCCCCCCCCNC(C)CCC AIFCHEM-94560470061 [0,0,1,0,0,0|2,0,1]=4 7 B16R0.61 CCCCCCCCCCCN[C@@H](C)CCC AIFCHEM-5637857562 [0,0,1,0,0,0|2,0,1]=4 8 B16R0.61 CCCCCCCCCCCN[C@H](C)CCC AIFCHEM-6010624500 [0,0,1,0,0,0|2,0,1]=4 9 B16R0.61 CCCCCCCCCCNCC(=O)NCC AIFCHEM-5856033945 [0,0,1,0,0,0|2,0,0]=3 10 B16R0.61 CCCCCCCCCCNCC(=O)OCC AIFCHEM-5593242365 [0,0,1,0,0,0|1,0,0]=2 11 B16R0.61 CCCCCCCCCNCCC(=O)OCC AIFCHEM-6017001590 [0,0,1,0,0,0|1,0,0]=2 12 B16R0.61 CCCCCCCCNCCCC(=O)OCC AIFCHEM-5908307588 [0,0,1,0,0,0|1,0,0]=2 13 B16R0.61 CCCCCCCNCCCCC(=O)OCC AIFCHEM-94589457375 [0,0,1,0,0,0|1,0,0]=2 14 B16R0.61 CCCCCCNCCCCCC(=O)OCC AIFCHEM-6101006220 [0,0,1,0,0,0|1,0,0]=2 15 B16R0.61 CCCCCNCCCCCCC(=O)OCC AIFCHEM-94522653545 [0,0,1,0,0,0|1,0,0]=2 16 B16R0.61 CCOC(=O)CCCCCCNCCCCO AIFCHEM-6502802773 [0,0,1,0,0,0|2,0,0]=3 17 B16R0.61 CCOC(=O)CCCCCCNCCCOC AIFCHEM-5624596167 [0,0,1,0,0,0|2,0,0]=3 18 B16R0.61 CCOC(=O)CCCCCCNCCCSC AIFCHEM-94529054116 [0,0,1,0,0,0|2,0,0]=3 19 B16R0.61 CCOC(=O)CCCCCCNCCSCC AIFCHEM-94566117806 [0,0,1,0,0,0|2,0,0]=3 20 B16R0.61 CCOC(=O)CCCCCNCCCCC#N AIFCHEM-5831820593 [0,0,1,0,0,0|2,0,1]=4 21 B16R0.61 CCOC(=O)CCCCCNCCCCCO AIFCHEM-6504868801 [0,0,1,0,0,0|2,0,0]=3 22 B16R0.61 CCOC(=O)CCCCCNCCOCCO AIFCHEM-5808776497 [0,0,1,0,0,0|3,0,0]=4 23 B16R0.61 CCOC(=O)CCCCCNCCSCCO AIFCHEM-6429393714 [0,0,1,0,0,0|3,0,0]=4 24 B16R0.61 CCOC(=O)CCCCNCCCCCC#N AIFCHEM-5845445150 [0,0,1,0,0,0|2,0,1]=4 25 B16R0.61 CCOC(=O)CCCCNCCCCCCO AIFCHEM-6497028971 [0,0,1,0,0,0|2,0,0]=3 26 B16R0.61 CCOC(=O)CCCCNCCCOCCO AIFCHEM-6409174329 [0,0,1,0,0,0|3,0,0]=4 27 B16R0.61 CCOC(=O)CCCCNCCOCCOC AIFCHEM-5818008979 [0,0,1,0,0,0|3,0,0]=4 28 B16R0.61 CCOCCCNCCCCCC(=O)OCC AIFCHEM-6281225941 [0,0,1,0,0,0|2,0,0]=3 29 B16R0.61 CCOCCNCCCCCCC(=O)OCC AIFCHEM-94548606168 [0,0,1,0,0,0|2,0,0]=3 30 B16R0.68 C#CCCCC(=O)NCCCCCCCCC AIFCHEM-6178589128 [0,0,1,0,0,0|1,0,2]=4 31 B16R0.68 C#CCCCCCCCCC(=O)NCCCC AIFCHEM-5736372527 [0,0,1,0,0,0|1,0,2]=4 32 B16R0.68 C#CCCCCCCCNC(=O)CCCCC AIFCHEM-94585550892 [0,0,1,0,0,0|1,0,2]=4 33 B16R0.68 C#CCCNC(=O)CCCCCCCCCC AIFCHEM-6021995560 [0,0,1,0,0,0|1,0,2]=4 34 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC AIFCHEM-94599902626 [0,0,1,0,0,0|1,0,2]=4 35 B16R0.68 CCCCCCCCCCC(=O)NCCC#N AIFCHEM-5694699901 [0,0,1,0,0,0|2,0,1]=4 36 B16R0.68 CCCCCCCCCCC(=O)NCCCC AIFCHEM-5694099057 [0,0,1,0,0,0|1,0,0]=2 37 B16R0.68 CCCCCCCCCCC(=O)NCCOC AIFCHEM-5990887370 [0,0,1,0,0,0|2,0,0]=3 38 B16R0.68 CCCCCCCCCCC(=O)NCCSC AIFCHEM-94598925662 [0,0,1,0,0,0|2,0,0]=3 39 B16R0.68 CCCCCCCCCCN(C)CCCCC AIFCHEM-94561116473 [0,0,1,0,0,0|3,0,0]=4 40 B16R0.68 CCCCCCCCCNC(=O)CCCC#N AIFCHEM-6092122738 [0,0,1,0,0,0|2,0,1]=4 41 B16R0.68 CCCCCCCCCNC(=O)CCCCC AIFCHEM-94585545923 [0,0,1,0,0,0|1,0,0]=2 42 B16R0.68 CCCCCCCCCNC(C)CCCCC AIFCHEM-94564397363 [0,0,1,0,0,0|2,0,1]=4 43 B16R0.68 CCCCCCCCOCC(=O)NCCCC AIFCHEM-94570983450 [0,0,1,0,0,0|2,0,0]=3 44 B16R0.68 CCCCCCCCOCC(=O)NCCOC AIFCHEM-6016857457 [0,0,1,0,0,0|3,0,0]=4 45 B16R0.68 CCCCCCCCOCC(=O)NCCSC AIFCHEM-5831590132 [0,0,1,0,0,0|3,0,0]=4 46 B16R0.68 CCCCNC(=O)CCCCCCCCCO AIFCHEM-94570978828 [0,0,1,0,0,0|2,0,0]=3 47 B16R0.68 COCCNC(=O)CCCCCCCCCO AIFCHEM-6016881210 [0,0,1,0,0,0|3,0,0]=4 48 B16R0.68 CSCCNC(=O)CCCCCCCCCO AIFCHEM-5865675193 [0,0,1,0,0,0|3,0,0]=4 49 B16R0.136 C#CCCCCCCC(=O)NCCCCCC AIFCHEM-6123683239 [0,0,1,0,0,0|1,0,2]=4 50 B16R0.136 C#CCCCCCNC(=O)CCCCCCC AIFCHEM-94571994839 [0,0,1,0,0,0|1,0,2]=4 51 B16R0.136 C#CCCCCNC(=O)CCCCCCCC AIFCHEM-94537881374 [0,0,1,0,0,0|1,0,2]=4 52 B16R0.136 CCCCCCCC(=O)NCCCCCC#N AIFCHEM-5809729044 [0,0,1,0,0,0|2,0,1]=4 53 B16R0.136 CCCCCCCCC(=O)NCCCCC#N AIFCHEM-94558544002 [0,0,1,0,0,0|2,0,1]=4 54 B16R0.136 CCCCCCCCC(=O)NCCCCCC AIFCHEM-6103560653 [0,0,1,0,0,0|1,0,0]=2 55 B16R0.136 CCCCCCCCC(C)NCCCCCC AIFCHEM-6128680394 [0,0,1,0,0,0|2,0,1]=4 56 B16R0.136 CCCCCCCCN(C)CCCCCCC AIFCHEM-5998480372 [0,0,1,0,0,0|3,0,0]=4 57 B16R0.136 CCCCCCNC(=O)CCCCCCCO AIFCHEM-6123616283 [0,0,1,0,0,0|2,0,0]=3 58 B16R0.136 CCOCCCNC(=O)CCCCCCCO AIFCHEM-6286530353 [0,0,1,0,0,0|3,0,0]=4 59 B16R0.221 C#CC(=O)NCCCCCCCCCCCC AIFCHEM-94584462428 [0,0,1,0,0,0|1,0,2]=4 60 B16R0.221 CCCCCCCCCCCCNC(=O)CC AIFCHEM-94526504398 [0,0,1,0,0,0|1,0,0]=2 61 B16R0.221 CCCCCCCCCCCCNC(=O)CO AIFCHEM-94584462033 [0,0,1,0,0,0|2,0,0]=3 62 B16R0.221 CCCCCCCCCCCNCC(=O)NC AIFCHEM-94562540142 [0,0,1,0,0,0|2,0,0]=3 63 B16R0.221 CCCCCCCCCCCNCC(=O)OC AIFCHEM-6192710841 [0,0,1,0,0,0|1,0,0]=2 64 B16R0.221 CCCCCCCCCCCNCC(C)OC AIFCHEM-5788822919 [0,0,1,0,0,0|2,0,1]=4 65 B16R0.221 CCCCCCCCCCCNC[C@@H](C)OC AIFCHEM-94608835983 [0,0,1,0,0,0|2,0,1]=4 66 B16R0.221 CCCCCCCCCCCNC[C@H](C)OC AIFCHEM-5898333910 [0,0,1,0,0,0|2,0,1]=4 67 B16R0.221 CCCCCCCCCCNCCC(=O)OC AIFCHEM-6108368525 [0,0,1,0,0,0|1,0,0]=2 68 B16R0.221 CCCCCCCCCNCCCC(=O)OC AIFCHEM-94592432757 [0,0,1,0,0,0|1,0,0]=2 69 B16R0.221 CCCCCCCCCNCCNC(=O)CC AIFCHEM-94532522915 [0,0,1,0,0,0|2,0,0]=3 70 B16R0.221 CCCCCCCCNCCCCC(=O)OC AIFCHEM-94578162741 [0,0,1,0,0,0|1,0,0]=2 71 B16R0.221 CCCCCCCNCCCCCC(=O)OC AIFCHEM-94589455014 [0,0,1,0,0,0|1,0,0]=2 72 B16R0.221 CCCCCNCCCCCCCC(=O)OC AIFCHEM-94551436870 [0,0,1,0,0,0|1,0,0]=2 73 B16R0.221 CCCCCNCCOCCOCC(=O)OC AIFCHEM-94551429646 [0,0,1,0,0,0|3,0,0]=4 74 B16R0.221 CCCCNCCOCCOCCC(=O)OC AIFCHEM-94583089546 [0,0,1,0,0,0|3,0,0]=4 75 B16R0.221 CCCCOCCCNCCCCC(=O)OC AIFCHEM-5977610637 [0,0,1,0,0,0|2,0,0]=3 76 B16R0.221 CCCNCCCCCCCCCC(=O)OC AIFCHEM-94569012936 [0,0,1,0,0,0|1,0,0]=2 77 B16R0.221 CCNCCCCCCCCCCC(=O)OC AIFCHEM-94537419890 [0,0,1,0,0,0|1,0,0]=2 78 B16R0.221 COC(=O)CCCCCCCNCCCSC AIFCHEM-94546187851 [0,0,1,0,0,0|2,0,0]=3 79 B16R0.221 COC(=O)CCCCCCNCCCCCO AIFCHEM-5820111032 [0,0,1,0,0,0|2,0,0]=3 80 B16R0.221 COC(=O)CCCCCNCCCCCC#N AIFCHEM-5808851892 [0,0,1,0,0,0|2,0,1]=4 81 B16R0.221 COC(=O)CCCCCNCCCCCCO AIFCHEM-6496853823 [0,0,1,0,0,0|2,0,0]=3 82 B16R0.221 COC(=O)CCCCCNCCCOCCO AIFCHEM-6389389996 [0,0,1,0,0,0|3,0,0]=4 83 B16R0.221 COC(=O)CCCCNCCCCCCCO AIFCHEM-6425319081 [0,0,1,0,0,0|2,0,0]=3 84 B16R0.221 COC(=O)CCCCNCCCOCCCO AIFCHEM-6500898836 [0,0,1,0,0,0|3,0,0]=4 85 B16R0.221 COC(=O)CCCNCCCCCCCCO AIFCHEM-94592437959 [0,0,1,0,0,0|2,0,0]=3 86 B16R0.221 COCCOCCNCCCCCC(=O)OC AIFCHEM-5797100877 [0,0,1,0,0,0|3,0,0]=4 87 B16R0.274 CC(=O)OCCCCNCCCCCCCO AIFCHEM-6409262389 [0,0,1,0,0,0|2,0,0]=3 88 B16R0.274 CC(=O)OCCCCNCCCOCCCO AIFCHEM-6500864121 [0,0,1,0,0,0|3,0,0]=4 89 B16R0.274 CC(=O)SCCCCCCNCCCCCO AIFCHEM-6199497269 [0,0,1,0,0,0|2,1,0]=4 90 B16R0.274 CC(=O)SCCCNCCCCCCCCO AIFCHEM-94560863115 [0,0,1,0,0,0|2,1,0]=4 91 B16R0.274 CCCCCCCCCCCCCNC(=O)C AIFCHEM-94552341343 [0,0,1,0,0,0|1,0,0]=2 92 B16R0.274 CCCCCCCCCCCCNCC(=O)O AIFCHEM-5890320404 [0,0,1,0,0,0|1,0,0]=2 93 B16R0.274 CCCCCCCCCCCCNCC(C)O AIFCHEM-6466598479 [0,0,1,0,0,0|2,0,1]=4 94 B16R0.274 CCCCCCCCCCCCNC[C@@H](C)O AIFCHEM-6491455586 [0,0,1,0,0,0|2,0,1]=4 95 B16R0.274 CCCCCCCCCCCCNC[C@H](C)O AIFCHEM-6509854838 [0,0,1,0,0,0|2,0,1]=4 96 B16R0.274 CCCCCCCCCCCNCCC(=O)N AIFCHEM-5849355456 [0,0,1,0,0,0|2,0,0]=3 97 B16R0.274 CCCCCCCCCCCNCCC(=O)O AIFCHEM-5845845431 [0,0,1,0,0,0|1,0,0]=2 98 B16R0.274 CCCCCCCCCCCNCCC(C)O AIFCHEM-94577732311 [0,0,1,0,0,0|2,0,1]=4 99 B16R0.274 CCCCCCCCCCCNCC[C@H](C)O AIFCHEM-94544710577 [0,0,1,0,0,0|2,0,1]=4 100 B16R0.274 CCCCCCCCCCNCCCC(=O)N AIFCHEM-5946328552 [0,0,1,0,0,0|2,0,0]=3 101 B16R0.274 CCCCCCCCCCNCCCC(=O)O AIFCHEM-5652499985 [0,0,1,0,0,0|1,0,0]=2 102 B16R0.274 CCCCCCCCCCNCCNC(=O)C AIFCHEM-5954414674 [0,0,1,0,0,0|2,0,0]=3 103 B16R0.274 CCCCCCCCCCNCCNC(=O)O AIFCHEM-94535743414 [0,0,1,0,0,0|2,0,0]=3 104 B16R0.274 CCCCCCCCCCNCCOC(=O)C AIFCHEM-5640825983 [0,0,1,0,0,0|1,0,0]=2 105 B16R0.274 CCCCCCCCCCNCCOC(C)C AIFCHEM-6282491119 [0,0,1,0,0,0|2,0,1]=4 106 B16R0.274 CCCCCCCCCNCCCCC(=O)N AIFCHEM-5964670330 [0,0,1,0,0,0|2,0,0]=3 107 B16R0.274 CCCCCCCCCNCCCCC(=O)O AIFCHEM-5629236171 [0,0,1,0,0,0|1,0,0]=2 108 B16R0.274 CCCCCCCCCNCCCNC(=O)C AIFCHEM-94531732282 [0,0,1,0,0,0|2,0,0]=3 109 B16R0.274 CCCCCCCCCNCCCSC(=O)C AIFCHEM-94560857913 [0,0,1,0,0,0|1,1,0]=3 110 B16R0.274 CCCCCCCCCNCCOCC(=O)O AIFCHEM-94563712840 [0,0,1,0,0,0|2,0,0]=3 111 B16R0.274 CCCCCCCCNCCCCCC(=O)O AIFCHEM-5915111423 [0,0,1,0,0,0|1,0,0]=2 112 B16R0.274 CCCCCCCCNCCCCNC(=O)C AIFCHEM-94585133552 [0,0,1,0,0,0|2,0,0]=3 113 B16R0.274 CCCCCCCCNCCCCOC(=O)C AIFCHEM-5823262016 [0,0,1,0,0,0|1,0,0]=2 114 B16R0.274 CCCCCCCNCCCCCCC(=O)O AIFCHEM-94589464691 [0,0,1,0,0,0|1,0,0]=2 115 B16R0.274 CCCCCCCNCCCCCNC(=O)C AIFCHEM-94589448939 [0,0,1,0,0,0|2,0,0]=3 116 B16R0.274 CCCCCCCNCCCSCCC(=O)N AIFCHEM-94590332795 [0,0,1,0,0,0|3,0,0]=4 117 B16R0.274 CCCCCCNCCCCCCCC(=O)O AIFCHEM-6122638093 [0,0,1,0,0,0|1,0,0]=2 118 B16R0.274 CCCCCNCCCCCCCCC(=O)O AIFCHEM-94552820231 [0,0,1,0,0,0|1,0,0]=2 119 B16R0.274 CCCCCNCCOCCOCCC(=O)O AIFCHEM-94551437013 [0,0,1,0,0,0|3,0,0]=4 120 B16R0.274 CCCCNCCCCCCCCCC(=O)O AIFCHEM-94570973923 [0,0,1,0,0,0|1,0,0]=2 121 B16R0.274 CCCCOCCCNCCCCOC(=O)C AIFCHEM-5927333339 [0,0,1,0,0,0|2,0,0]=3 122 B16R0.274 CCCNCCCCCCCCCCC(=O)O AIFCHEM-94569016139 [0,0,1,0,0,0|1,0,0]=2 123 B16R0.274 CCNCCCCCCCCCCCC(=O)O AIFCHEM-94537424481 [0,0,1,0,0,0|1,0,0]=2 124 B16R0.274 CCOCCCNCCCCCCCC(=O)O AIFCHEM-6207960866 [0,0,1,0,0,0|2,0,0]=3 125 B16R0.274 CCOCCNCCCCCCCCC(=O)O AIFCHEM-94548605290 [0,0,1,0,0,0|2,0,0]=3 126 B16R0.274 CCSCCNCCCCCCCCC(=O)O AIFCHEM-94566116928 [0,0,1,0,0,0|2,0,0]=3 127 B16R0.274 COCCCNCCCCCCCCC(=O)O AIFCHEM-5644227437 [0,0,1,0,0,0|2,0,0]=3 128 B16R0.274 COCCNCCCCCCCCCC(=O)O AIFCHEM-6057905060 [0,0,1,0,0,0|2,0,0]=3 129 B16R0.274 CSCCCNCCCCCCCCC(=O)O AIFCHEM-94546173477 [0,0,1,0,0,0|2,0,0]=3 130 B16R0.274 CSCCNCCCCCCCCCC(=O)O AIFCHEM-5848521129 [0,0,1,0,0,0|2,0,0]=3 131 B16R0.274 N#CCCCCNCCCCCCCC(=O)O AIFCHEM-94558543216 [0,0,1,0,0,0|2,0,1]=4 132 B16R0.274 N#CCCNCCCCCCCCCC(=O)O AIFCHEM-5693197384 [0,0,1,0,0,0|2,0,1]=4 133 B16R0.274 O=C(O)CCCCCCCCCNCCCO AIFCHEM-94523164666 [0,0,1,0,0,0|2,0,0]=3 134 B16R0.274 O=C(O)CCCCCCCCNCCCCO AIFCHEM-6488644652 [0,0,1,0,0,0|2,0,0]=3 135 B16R0.274 O=C(O)CCCCCCCNCCCCCO AIFCHEM-6490383789 [0,0,1,0,0,0|2,0,0]=3 136 B16R0.274 O=C(O)CCCCCCCNCCOCCO AIFCHEM-5819275333 [0,0,1,0,0,0|3,0,0]=4 137 B16R0.274 O=C(O)CCCCCCCNCCSCCO AIFCHEM-6454858819 [0,0,1,0,0,0|3,0,0]=4 138 B16R0.274 O=C(O)NCCCCCCNCCCCCO AIFCHEM-94538182507 [0,0,1,0,0,0|3,0,0]=4 139 B16R0.303 CCCCCCCCCCCCCCNCC AIFCHEM-94537417877 [0,0,1,0,0,0|2,0,1]=4 140 B16R0.303 CCCCCCCCCCCCNCCCO AIFCHEM-6421360330 [0,0,1,0,0,0|2,0,1]=4 141 B16R0.303 CCCCCCCCCCCNCCCCO AIFCHEM-6502705701 [0,0,1,0,0,0|2,0,1]=4 142 B16R0.303 CCCCCCCCCCCNCCOCC AIFCHEM-94548602840 [0,0,1,0,0,0|2,0,1]=4 143 B16R0.303 CCCCCCCCCCNCCCCCO AIFCHEM-5662853671 [0,0,1,0,0,0|2,0,1]=4 144 B16R0.303 CCCCCCCCCCNCCCOCC AIFCHEM-6273836298 [0,0,1,0,0,0|2,0,1]=4 145 B16R0.303 CCCCCCCCCNCCCCCCO AIFCHEM-6497790819 [0,0,1,0,0,0|2,0,1]=4 146 B16R0.303 CCCCCCCCNCCCCCCCO AIFCHEM-6469058217 [0,0,1,0,0,0|2,0,1]=4 147 B16R0.303 CCCCCCCNCCCCCCCCO AIFCHEM-94589454934 [0,0,1,0,0,0|2,0,1]=4 148 B16R0.303 CCCCCNCCCCCCCCCCO AIFCHEM-94551430383 [0,0,1,0,0,0|2,0,1]=4 149 B16R0.303 CCCNCCCCCCCCCCCCO AIFCHEM-94569021348 [0,0,1,0,0,0|2,0,1]=4 150 B16R0.303 CSCCCNCCCCCCCCCCO AIFCHEM-94546180084 [0,0,1,0,0,0|3,0,0]=4 151 B16R0.303 OCCCCCCCCCNCCCCCO AIFCHEM-6511354174 [0,0,1,0,0,0|1,0,2]=4 152 B16R0.661 C#CCCC(=O)NCCCCCCCCCC AIFCHEM-5604391236 [0,0,1,0,0,0|1,0,2]=4 153 B16R0.661 C#CCNC(=O)CCCCCCCCCCC AIFCHEM-6195262735 [0,0,1,0,0,0|1,0,2]=4 154 B16R0.661 C/C=C/CC(=O)NCCCCCCCCCC AIFCHEM-5605149810 [0,0,1,0,0,0|1,0,2]=4 155 B16R0.661 CCCCCCCCCCCC(=O)NCCC AIFCHEM-94521374460 [0,0,1,0,0,0|1,0,0]=2 156 B16R0.661 CCCCCCCCCCCC(=O)NCCF AIFCHEM-5801819193 [0,0,1,0,0,0|2,0,0]=3 157 B16R0.661 CCCCCCCCCCCC(C)NCCC AIFCHEM-5875471227 [0,0,1,0,0,0|2,0,1]=4 158 B16R0.661 CCCCCCCCCCNC(=O)CCC#N AIFCHEM-5627409952 [0,0,1,0,0,0|2,0,1]=4 159 B16R0.661 CCCCCCCCCCNC(=O)CCCC AIFCHEM-94534105041 [0,0,1,0,0,0|1,0,0]=2 160 B16R0.661 CCCCCCCCCCNC(=O)CCSC AIFCHEM-5604409073 [0,0,1,0,0,0|2,0,0]=3 161 B16R0.661 CCCCCCCCCCNC(C)CCCC AIFCHEM-94541396848 [0,0,1,0,0,0|2,0,1]=4 162 B16R0.661 CCCCCCCCCCN[C@H](C)CCCC AIFCHEM-94596948578 [0,0,1,0,0,0|2,0,1]=4 163 B16R0.661 CCCCCCCCCNCC(=O)NCCF AIFCHEM-5896582446 [0,0,1,0,0,0|3,0,0]=4 164 B16R0.661 CCCNC(=O)CCCCCCCCCCO AIFCHEM-94521377858 [0,0,1,0,0,0|2,0,0]=3 165 B16R0.661 O=C(CCCCCCCCCCO)NCCF AIFCHEM-5861853123 [0,0,1,0,0,0|3,0,0]=4 166 B16R0.6603 C#CCCCCCCCC(=O)NCCCCC AIFCHEM-94522659166 [0,0,1,0,0,0|1,0,2]=4 167 B16R0.6603 C#CCCCCCCNC(=O)CCCCCC AIFCHEM-94521983437 [0,0,1,0,0,0|1,0,2]=4 168 B16R0.6603 C#CCCCNC(=O)CCCCCCCCC AIFCHEM-5758240447 [0,0,1,0,0,0|1,0,2]=4 169 B16R0.6603 CCCCCCC(=O)NCCCOCCCC AIFCHEM-94521984168 [0,0,1,0,0,0|2,0,0]=3 170 B16R0.6603 CCCCCCCCCC(=O)NCCCCC AIFCHEM-94552829275 [0,0,1,0,0,0|1,0,0]=2 171 B16R0.6603 CCCCCCCCCC(=O)NCCCOC AIFCHEM-94598897441 [0,0,1,0,0,0|2,0,0]=3 172 B16R0.6603 CCCCCCCCCC(=O)NCCCSC AIFCHEM-94529062282 [0,0,1,0,0,0|2,0,0]=3 173 B16R0.6603 CCCCCCCCCC(=O)NCCOCC AIFCHEM-94548614334 [0,0,1,0,0,0|2,0,0]=3 174 B16R0.6603 CCCCCCCCCC(=O)NCCSCC AIFCHEM-6086497430 [0,0,1,0,0,0|2,0,0]=3 175 B16R0.6603 CCCCCCCCCC(C)NCCCCC AIFCHEM-94522650215 [0,0,1,0,0,0|2,0,1]=4 176 B16R0.6603 CCCCCCCCCN(C)CCCCCC AIFCHEM-6013372068 [0,0,1,0,0,0|3,0,0]=4 177 B16R0.6603 CCCCCCCCNC(=O)CCCCCC AIFCHEM-94578165118 [0,0,1,0,0,0|1,0,0]=2 178 B16R0.6603 CCCCCCCCNC(=O)CCCCCO AIFCHEM-94561938060 [0,0,1,0,0,0|2,0,0]=3 179 B16R0.6603 CCCCCCCCNC(=O)CCOCCO AIFCHEM-94578173548 [0,0,1,0,0,0|3,0,0]=4 180 B16R0.6603 CCCCCCCCNC(C)CCCCCC AIFCHEM-94578158315 [0,0,1,0,0,0|2,0,1]=4 181 B16R0.6603 CCCCCCCCN[C@@H](C)CCCCCC AIFCHEM-5796611783 [0,0,1,0,0,0|2,0,1]=4 182 B16R0.6603 CCCCCNC(=O)CCCCCCCCO AIFCHEM-94522662062 [0,0,1,0,0,0|2,0,0]=3 183 B16R0.6603 CCCCCNC(=O)COCCOCCCC AIFCHEM-94538969182 [0,0,1,0,0,0|3,0,0]=4 184 B16R0.6603 CCCCOCCCNC(=O)CCCCCO AIFCHEM-5958830921 [0,0,1,0,0,0|3,0,0]=4 185 B16R0.6603 CCOCCNC(=O)CCCCCCCCO AIFCHEM-94548614685 [0,0,1,0,0,0|3,0,0]=4 186 B16R0.6603 CCSCCNC(=O)CCCCCCCCO AIFCHEM-94566126323 [0,0,1,0,0,0|3,0,0]=4 187 B16R0.6603 COCCCNC(=O)CCCCCCCCO AIFCHEM-5592271523 [0,0,1,0,0,0|3,0,0]=4 188 B16R0.6603 CSCCCNC(=O)CCCCCCCCO AIFCHEM-94529062633 [0,0,1,0,0,0|3,0,0]=4 189 B15R0.70 CCCCCCCCCCCCCNCC AIFCHEM-94552334904 [1,0,1,0,0,0|1,0,1]=4 190 B15R0.70 CCCCCCCCCCCCNCCC AIFCHEM-94569010820 [1,0,1,0,0,0|1,0,1]=4 191 B15R0.70 CCCCCCCCCCCCNCCO AIFCHEM-94577775453 [1,0,1,0,0,0|1,0,1]=4 192 B15R0.70 CCCCCCCCCCCNCCCC AIFCHEM-5725455248 [1,0,1,0,0,0|1,0,1]=4 193 B15R0.70 CCCCCCCCCCCNCCCO AIFCHEM-94523160537 [1,0,1,0,0,0|1,0,1]=4 194 B15R0.70 CCCCCCCCCCCNCCOC AIFCHEM-6038390186 [1,0,1,0,0,0|1,0,1]=4 195 B15R0.70 CCCCCCCCCCNCCCCC AIFCHEM-94552817780 [1,0,1,0,0,0|1,0,1]=4 196 B15R0.70 CCCCCCCCCCNCCCCO AIFCHEM-6488699468 [1,0,1,0,0,0|1,0,1]=4 197 B15R0.70 CCCCCCCCCCNCCCOC AIFCHEM-5624817641 [1,0,1,0,0,0|1,0,1]=4 198 B15R0.70 CCCCCCCCCCNCCOCC AIFCHEM-94548602839 [1,0,1,0,0,0|1,0,1]=4 199 B15R0.70 CCCCCCCCCNCCCCCC AIFCHEM-6123178491 [1,0,1,0,0,0|1,0,1]=4 200 B15R0.70 CCCCCCCCCNCCCCCO AIFCHEM-6508040745 [1,0,1,0,0,0|1,0,1]=4 201 B15R0.70 CCCCCCCCCNCCCOCC AIFCHEM-6286352658 [1,0,1,0,0,0|1,0,1]=4 202 B15R0.70 CCCCCCCCNCCCCCCC AIFCHEM-94589453222 [1,0,1,0,0,0|1,0,1]=4 203 B15R0.70 CCCCCCCCNCCCCCCO AIFCHEM-6497248297 [1,0,1,0,0,0|1,0,1]=4 204 B15R0.70 CCCCCCCNCCCCCCCO AIFCHEM-94589455011 [1,0,1,0,0,0|1,0,1]=4 205 B15R0.70 CCCCCCCNCCCOCCCC AIFCHEM-94589453977 [1,0,1,0,0,0|1,0,1]=4 206 B15R0.70 CCCCCNCCCCCCCCCO AIFCHEM-94551423600 [1,0,1,0,0,0|1,0,1]=4 207 B15R0.70 CCCCNCCCCCCCCCCO AIFCHEM-94523035172 [1,0,1,0,0,0|1,0,1]=4 208 B15R0.70 CCNCCCCCCCCCCCCO AIFCHEM-94537424265 [1,0,1,0,0,0|1,0,1]=4 209 B15R0.70 OCCCCCCCCNCCCCCO AIFCHEM-6395266353 [1,0,1,0,0,0|1,0,1]=4 210 B15R0.81 CCCCCCCCCCCCN(C)CC AIFCHEM-6099523827 [1,0,1,0,0,0|2,0,0]=4 211 B15R0.81 CCCCCCCCCCCNC(=O)CC AIFCHEM-94526510028 [1,0,1,0,0,0|1,0,0]=3 212 B15R0.81 CCCCCCCCCCCNC(=O)CO AIFCHEM-6079389435 [1,0,1,0,0,0|2,0,0]=4 213 B15R0.81 CCCCCCCCCCNCC(=O)NC AIFCHEM-94562540141 [1,0,1,0,0,0|2,0,0]=4 214 B15R0.81 CCCCCCCCCCNCC(=O)OC AIFCHEM-6217493141 [1,0,1,0,0,0|1,0,0]=3 215 B15R0.81 CCCCCCCCCNCCC(=O)OC AIFCHEM-6174028326 [1,0,1,0,0,0|1,0,0]=3 216 B15R0.81 CCCCCCCCNCCCC(=O)OC AIFCHEM-94592432709 [1,0,1,0,0,0|1,0,0]=3 217 B15R0.81 CCCCCCCCNCCNC(=O)CC AIFCHEM-94532522914 [1,0,1,0,0,0|2,0,0]=4 218 B15R0.81 CCCCCCCNCCCCC(=O)OC AIFCHEM-94589457374 [1,0,1,0,0,0|1,0,0]=3 219 B15R0.81 CCCCCCNCCCCCC(=O)OC AIFCHEM-94575436679 [1,0,1,0,0,0|1,0,0]=3 220 B15R0.81 CCCCCNCCCCCCC(=O)OC AIFCHEM-94551428562 [1,0,1,0,0,0|1,0,0]=3 221 B15R0.81 CCCCNCCCCCCCC(=O)OC AIFCHEM-94523041659 [1,0,1,0,0,0|1,0,0]=3 222 B15R0.81 CCCCOCCCNCCCC(=O)OC AIFCHEM-94592437002 [1,0,1,0,0,0|2,0,0]=4 223 B15R0.81 CCNCCCCCCCCCC(=O)OC AIFCHEM-94537415853 [1,0,1,0,0,0|1,0,0]=3 224 B15R0.81 CCOCCCNCCCCCC(=O)OC AIFCHEM-6208021834 [1,0,1,0,0,0|2,0,0]=4 225 B15R0.81 COC(=O)CCCCCCNCCCSC AIFCHEM-94546178263 [1,0,1,0,0,0|2,0,0]=4 226 B15R0.81 COC(=O)CCCCCNCCCCCO AIFCHEM-5664464732 [1,0,1,0,0,0|2,0,0]=4 227 B15R0.81 COC(=O)CCCCNCCCCCCO AIFCHEM-6499634876 [1,0,1,0,0,0|2,0,0]=4 228 B15R0.81 COC(=O)CCCNCCCCCCCO AIFCHEM-94592438036 [1,0,1,0,0,0|2,0,0]=4 229 B15R0.366 CCCCCCCCCCCN(C)CCC AIFCHEM-5808449926 [1,0,1,0,0,0|2,0,0]=4 230 B15R0.366 CCCCCCCCCCNC(=O)CCO AIFCHEM-5663529499 [1,0,1,0,0,0|2,0,0]=4 231 B15R0.366 CCCCCCCCCCNC(=O)COC AIFCHEM-5604292374 [1,0,1,0,0,0|2,0,0]=4 232 B15R0.366 CCCCCCCCCCNC(=O)CSC AIFCHEM-5663544789 [1,0,1,0,0,0|2,0,0]=4 233 B15R0.366 CCCCCCCCCNCC(=O)OCC AIFCHEM-5616753412 [1,0,1,0,0,0|1,0,0]=3 234 B15R0.366 CCCCCCCCNCCC(=O)OCC AIFCHEM-6074414597 [1,0,1,0,0,0|1,0,0]=3 235 B15R0.366 CCCCCCCNCCCC(=O)OCC AIFCHEM-94589461976 [1,0,1,0,0,0|1,0,0]=3 236 B15R0.366 CCCCCCNCCCCC(=O)OCC AIFCHEM-94571763863 [1,0,1,0,0,0|1,0,0]=3 237 B15R0.366 CCCCCNCCCCCC(=O)OCC AIFCHEM-94522652819 [1,0,1,0,0,0|1,0,0]=3 238 B15R0.366 CCCCNCCCCCCC(=O)OCC AIFCHEM-5695158255 [1,0,1,0,0,0|1,0,0]=3 239 B15R0.366 CCOC(=O)CCCCCCNCCCO AIFCHEM-6434194953 [1,0,1,0,0,0|2,0,0]=4 240 B15R0.366 CCOC(=O)CCCCCCNCCSC AIFCHEM-94598922197 [1,0,1,0,0,0|2,0,0]=4 241 B15R0.366 CCOC(=O)CCCCCNCCCCO AIFCHEM-6488846834 [1,0,1,0,0,0|2,0,0]=4 242 B15R0.366 CCOC(=O)CCCCCNCCCOC AIFCHEM-5624927008 [1,0,1,0,0,0|2,0,0]=4 243 B15R0.366 CCOC(=O)CCCCCNCCCSC AIFCHEM-94529053390 [1,0,1,0,0,0|2,0,0]=4 244 B15R0.366 CCOC(=O)CCCCCNCCSCC AIFCHEM-6033078227 [1,0,1,0,0,0|2,0,0]=4 245 B15R0.366 CCOC(=O)CCCCNCCCCCO AIFCHEM-6112814354 [1,0,1,0,0,0|2,0,0]=4 246 B15R0.366 CCOCCCNCCCCC(=O)OCC AIFCHEM-6208280576 [1,0,1,0,0,0|2,0,0]=4 247 B15R0.366 CCOCCNCCCCCC(=O)OCC AIFCHEM-94548605442 [1,0,1,0,0,0|2,0,0]=4 248 B15R0.322 CCCCCC(=O)NCCCOCCCC AIFCHEM-94585549447 [1,0,1,0,0,0|2,0,0]=4 249 B15R0.322 CCCCCCCCCC(=O)NCCCC AIFCHEM-94570981288 [1,0,1,0,0,0|1,0,0]=3 250 B15R0.322 CCCCCCCCCC(=O)NCCOC AIFCHEM-6058552208 [1,0,1,0,0,0|2,0,0]=4 251 B15R0.322 CCCCCCCCCC(=O)NCCSC AIFCHEM-5865732391 [1,0,1,0,0,0|2,0,0]=4 252 B15R0.322 CCCCCCCCCN(C)CCCCC AIFCHEM-6088595192 [1,0,1,0,0,0|2,0,0]=4 253 B15R0.322 CCCCCCCCNC(=O)CCCCC AIFCHEM-94578166631 [1,0,1,0,0,0|1,0,0]=3 254 B15R0.322 CCCCNC(=O)CCCCCCCCO AIFCHEM-94570981639 [1,0,1,0,0,0|2,0,0]=4 255 B15R0.2002 CCCCCCCCCCC(=O)NCCC AIFCHEM-94521372892 [1,0,1,0,0,0|1,0,0]=3 256 B15R0.2002 CCCCCCCCCCN(C)CCCC AIFCHEM-94561116925 [1,0,1,0,0,0|2,0,0]=4 257 B15R0.2002 CCCCCCCCCNC(=O)CCCC AIFCHEM-94534100383 [1,0,1,0,0,0|1,0,0]=3 258 B15R0.2002 CCCCCCCCCNC(=O)CCSC AIFCHEM-6143573886 [1,0,1,0,0,0|2,0,0]=4 259 B15R0.2002 CCCCCCCCOCC(=O)NCCC AIFCHEM-5815261412 [1,0,1,0,0,0|2,0,0]=4 260 B15R0.2002 CCCNC(=O)CCCCCCCCCO AIFCHEM-94521375133 [1,0,1,0,0,0|2,0,0]=4 261 B15R0.133 CCCCCCCC(=O)NCCCCCC AIFCHEM-94571769113 [1,0,1,0,0,0|1,0,0]=3 262 B15R0.133 CCCCCCCN(C)CCCCCCC AIFCHEM-94589458251 [1,0,1,0,0,0|2,0,0]=4 263 B15R0.133 CCCCCCNC(=O)CCCCCCO AIFCHEM-6174291649 [1,0,1,0,0,0|2,0,0]=4 264 B15R0.133 CCCCCCNC(=O)CCCCCOC AIFCHEM-94534419360 [1,0,1,0,0,0|2,0,0]=4 265 B15R0.149 CCCCCCCCC(=O)NCCCCC AIFCHEM-94522657009 [1,0,1,0,0,0|1,0,0]=3 266 B15R0.149 CCCCCCCCC(=O)NCCCOC AIFCHEM-94598892739 [1,0,1,0,0,0|2,0,0]=4 267 B15R0.149 CCCCCCCCC(=O)NCCCSC AIFCHEM-94529057580 [1,0,1,0,0,0|2,0,0]=4 268 B15R0.149 CCCCCCCCC(=O)NCCOCC AIFCHEM-94548609632 [1,0,1,0,0,0|2,0,0]=4 269 B15R0.149 CCCCCCCCC(=O)NCCSCC AIFCHEM-6011957720 [1,0,1,0,0,0|2,0,0]=4 270 B15R0.149 CCCCCCCCN(C)CCCCCC AIFCHEM-6057912456 [1,0,1,0,0,0|2,0,0]=4 271 B15R0.149 CCCCCNC(=O)CCCCCCCO AIFCHEM-94552832134 [1,0,1,0,0,0|2,0,0]=4 272 B15R0.164 CC(=O)OCCCCNCCCCCCO AIFCHEM-6497056541 [1,0,1,0,0,0|2,0,0]=4 273 B15R0.164 CCCCCCCCCCCCNC(=O)C AIFCHEM-94535590097 [1,0,1,0,0,0|1,0,0]=3 274 B15R0.164 CCCCCCCCCCNCCC(=O)N AIFCHEM-5950659651 [1,0,1,0,0,0|2,0,0]=4 275 B15R0.164 CCCCCCCCCCNCCC(=O)O AIFCHEM-5846451006 [1,0,1,0,0,0|1,0,0]=3 276 B15R0.164 CCCCCCCCCNCCCC(=O)N AIFCHEM-5922535443 [1,0,1,0,0,0|2,0,0]=4 277 B15R0.164 CCCCCCCCCNCCCC(=O)O AIFCHEM-5652733093 [1,0,1,0,0,0|1,0,0]=3 278 B15R0.164 CCCCCCCCCNCCNC(=O)C AIFCHEM-5954428782 [1,0,1,0,0,0|2,0,0]=4 279 B15R0.164 CCCCCCCCCNCCNC(=O)O AIFCHEM-94535743837 [1,0,1,0,0,0|2,0,0]=4 280 B15R0.164 CCCCCCCCCNCCOC(=O)C AIFCHEM-5671960250 [1,0,1,0,0,0|1,0,0]=3 281 B15R0.164 CCCCCCCCNCCCCC(=O)N AIFCHEM-5922473638 [1,0,1,0,0,0|2,0,0]=4 282 B15R0.164 CCCCCCCCNCCCCC(=O)O AIFCHEM-5628750668 [1,0,1,0,0,0|1,0,0]=3 283 B15R0.164 CCCCCCCCNCCCNC(=O)C AIFCHEM-94531732281 [1,0,1,0,0,0|2,0,0]=4 284 B15R0.164 CCCCCCCCNCCCSC(=O)C AIFCHEM-94560857865 [1,0,1,0,0,0|1,1,0]=4 285 B15R0.164 CCCCCCCCNCCOCC(=O)O AIFCHEM-6211656324 [1,0,1,0,0,0|2,0,0]=4 286 B15R0.164 CCCCCCCNCCCCCC(=O)O AIFCHEM-94589460859 [1,0,1,0,0,0|1,0,0]=3 287 B15R0.164 CCCCCCCNCCCCNC(=O)C AIFCHEM-94585131238 [1,0,1,0,0,0|2,0,0]=4 288 B15R0.164 CCCCCCCNCCOCCC(=O)O AIFCHEM-94589453077 [1,0,1,0,0,0|2,0,0]=4 289 B15R0.164 CCCCCNCCCCCCCC(=O)O AIFCHEM-94552823787 [1,0,1,0,0,0|1,0,0]=3 290 B15R0.164 CCCCCNCCCCCCNC(=O)O AIFCHEM-94538178983 [1,0,1,0,0,0|2,0,0]=4 291 B15R0.164 CCCCCNCCCCCCSC(=O)C AIFCHEM-94551439258 [1,0,1,0,0,0|1,1,0]=4 292 B15R0.164 CCCCNCCCCCCCCC(=O)O AIFCHEM-94570972244 [1,0,1,0,0,0|1,0,0]=3 293 B15R0.164 CCCNCCCCCCCCCC(=O)O AIFCHEM-5875365059 [1,0,1,0,0,0|1,0,0]=3 294 B15R0.164 CCNCCCCCCCCCCC(=O)O AIFCHEM-94537419056 [1,0,1,0,0,0|1,0,0]=3 295 B15R0.164 CCOCCNCCCCCCCC(=O)O AIFCHEM-94548608846 [1,0,1,0,0,0|2,0,0]=4 296 B15R0.164 CCSCCNCCCCCCCC(=O)O AIFCHEM-6081816444 [1,0,1,0,0,0|2,0,0]=4 297 B15R0.164 COCCCNCCCCCCCC(=O)O AIFCHEM-94598891953 [1,0,1,0,0,0|2,0,0]=4 298 B15R0.164 COCCNCCCCCCCCC(=O)O AIFCHEM-6038678637 [1,0,1,0,0,0|2,0,0]=4 299 B15R0.164 CSCCCNCCCCCCCC(=O)O AIFCHEM-94529056794 [1,0,1,0,0,0|2,0,0]=4 300 B15R0.164 CSCCNCCCCCCCCC(=O)O AIFCHEM-5848594551 [1,0,1,0,0,0|2,0,0]=4 301 B15R0.164 O=C(O)CCCCCCCCCNCCF AIFCHEM-5853585960 [1,0,1,0,0,0|2,0,0]=4 302 B15R0.164 O=C(O)CCCCCCCCCNCCO AIFCHEM-94577779581 [1,0,1,0,0,0|2,0,0]=4 303 B15R0.164 O=C(O)CCCCCCCCNCCCO AIFCHEM-94523162987 [1,0,1,0,0,0|2,0,0]=4 304 B15R0.164 O=C(O)CCCCCCCNCCCCO AIFCHEM-6511715173 [1,0,1,0,0,0|2,0,0]=4 305 B15R0.164 O=C(O)CCCCCCNCCCCCO AIFCHEM-94596324530 [1,0,1,0,0,0|2,0,0]=4 306 B17R0.88 CCCCCCCC(C)NCCCC(=O)OCC AIFCHEM-5905959252 [0,1,1,0,0,0|1,0,0]=3 307 B17R0.88 CCCCCCCN(C)CCCCC(=O)OCC AIFCHEM-6068980225 [0,1,1,0,0,0|1,0,0]=3 308 B17R0.88 CCCCCCNC(=O)CCCCC(=O)OCC AIFCHEM-94575445481 [0,1,1,0,0,0|1,0,1]=4 309 B17R0.88 CCOC(=O)CCCCN(C)CCCCCCO AIFCHEM-94534164633 [0,1,1,0,0,0|2,0,0]=4 310 B17R0.90 CCCCC(=O)NCCCCCCC(=O)OCC AIFCHEM-94534106682 [0,1,1,0,0,0|1,0,1]=4 311 B17R0.90 CCCCC(C)NCCCCCCC(=O)OCC AIFCHEM-94541398862 [0,1,1,0,0,0|1,0,0]=3 312 B17R0.90 CCCC[C@@H](C)NCCCCCCC(=O)OCC AIFCHEM-94596951907 [0,1,1,0,0,0|1,0,0]=3 313 B17R0.90 CCCNC(=O)CCCCCCCC(=O)OCC AIFCHEM-5793828727 [0,1,1,0,0,0|1,0,1]=4 314 B17R0.90 CCOC(=O)CCCCCCNC(C)CCCO AIFCHEM-94575408378 [0,1,1,0,0,0|2,0,0]=4 315 B17R0.90 CCOC(=O)CCCCCCNC(C)CCSC AIFCHEM-5745427860 [0,1,1,0,0,0|2,0,0]=4 316 B17R0.90 CCOC(=O)CCCCCCN[C@@H](C)CCCO AIFCHEM-6431739626 [0,1,1,0,0,0|2,0,0]=4 317 B17R0.90 CCOC(=O)CCCCCCN[C@H](C)CCCO AIFCHEM-6409874723 [0,1,1,0,0,0|2,0,0]=4 318 B17R0.90 CCOC(=O)CCCCCNC[C@H](C)CCCO AIFCHEM-6439074859 [0,1,1,0,0,0|2,0,0]=4 319 B17R0.116 CC(C)NC(=O)CCCCCCCCCCCO AIFCHEM-94520549336 [0,1,1,0,0,0|2,0,0]=4 320 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C AIFCHEM-94520550386 [0,1,1,0,0,0|1,0,0]=3 321 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C AIFCHEM-5998449369 [0,1,1,0,0,0|1,0,0]=3 322 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)O AIFCHEM-5997971917 [0,1,1,0,0,0|1,0,0]=3 323 B17R0.116 CCCCCCCCCCCNC(=O)CC(F)F AIFCHEM-6079300073 [0,1,1,0,0,0|2,0,0]=4 324 B17R0.116 CCCCCCCCCCCNC(=O)CN(C)C AIFCHEM-6018100389 [0,1,1,0,0,0|2,0,0]=4 325 B17R0.116 CCCCCCCCCCCNC(=O)C[C@@H](C)O AIFCHEM-5998010578 [0,1,1,0,0,0|1,0,0]=3 326 B17R0.116 CCCCCCCCCCNCC(=O)NC(C)C AIFCHEM-94530807774 [0,1,1,0,0,0|2,0,0]=4 327 B17R0.196 C#CCCC(=O)NCCCCCCCCCCC AIFCHEM-6083850720 [0,1,1,0,0,0|1,0,1]=4 328 B17R0.196 C#CCNC(=O)CCCCCCCCCCCC AIFCHEM-94588320364 [0,1,1,0,0,0|1,0,1]=4 329 B17R0.196 C/C=C/CC(=O)NCCCCCCCCCCC AIFCHEM-5998245014 [0,1,1,0,0,0|1,0,1]=4 330 B17R0.196 CCCCCCCCCCCCC(=O)NCCC AIFCHEM-5853810387 [0,1,1,0,0,0|1,0,0]=3 331 B17R0.196 CCCCCCCCCCCCC(=O)NCCF AIFCHEM-5828063600 [0,1,1,0,0,0|1,0,0]=3 332 B17R0.196 CCCCCCCCCCCNC(=O)CCC#N AIFCHEM-6083903649 [0,1,1,0,0,0|1,0,1]=4 333 B17R0.196 CCCCCCCCCCCNC(=O)CCCC AIFCHEM-94534110670 [0,1,1,0,0,0|1,0,0]=3 334 B17R0.196 CCCCCCCCCCCNC(=O)CCSC AIFCHEM-6079336020 [0,1,1,0,0,0|1,0,0]=3 335 B17R0.196 CCCCCCCCCCCNC(=O)COCC AIFCHEM-6079527690 [0,1,1,0,0,0|1,0,0]=3 336 B17R0.196 CCCCCCCCCCCNC(=O)CSCC AIFCHEM-94580220338 [0,1,1,0,0,0|1,0,0]=3 337 B17R0.196 CCCCCCCCCCNCC(=O)NCCF AIFCHEM-5941690693 [0,1,1,0,0,0|2,0,0]=4 338 B17R0.196 CCCNC(=O)CCCCCCCCCCCO AIFCHEM-5875542227 [0,1,1,0,0,0|2,0,0]=4 339 B17R0.231 CCCCCCCCCNC(C)CC(=O)OCC AIFCHEM-94544055376 [0,1,1,0,0,0|1,0,0]=3 340 B17R0.231 CCCCCCCCCN[C@@H](C)CC(=O)OCC AIFCHEM-6052613863 [0,1,1,0,0,0|1,0,0]=3 341 B17R0.231 CCOC(=O)CC(C)NCCCCCCCCO AIFCHEM-94544060578 [0,1,1,0,0,0|2,0,0]=4 342 B17R0.247 CCCCCCC(=O)NCCCCC(=O)OCC AIFCHEM-94521986942 [0,1,1,0,0,0|1,0,1]=4 343 B17R0.247 CCCCCCC(C)NCCCCC(=O)OCC AIFCHEM-94531833021 [0,1,1,0,0,0|1,0,0]=3 344 B17R0.247 CCCCCCN(C)CCCCCC(=O)OCC AIFCHEM-6040052632 [0,1,1,0,0,0|1,0,0]=3 345 B17R0.247 CCCCCNC(=O)CCCCCC(=O)OCC AIFCHEM-94552829219 [0,1,1,0,0,0|1,0,1]=4 346 B17R0.247 CCOC(=O)CCCCCN(C)CCCCCO AIFCHEM-6389329759 [0,1,1,0,0,0|2,0,0]=4 347 B17R0.250 CC#CC(=O)NCCCCCCCCCCCC AIFCHEM-94584709170 [0,1,1,0,0,0|1,0,1]=4 348 B17R0.250 CCCCCCCCCCCCNC(=O)CCO AIFCHEM-5627474197 [0,1,1,0,0,0|2,0,0]=4 349 B17R0.250 CCCCCCCCCCCCNC(=O)COC AIFCHEM-5677824237 [0,1,1,0,0,0|2,0,0]=4 350 B17R0.250 CCCCCCCCCCCCNC(=O)CSC AIFCHEM-94584706483 [0,1,1,0,0,0|2,0,0]=4 351 B17R0.250 CCCCCCCCCCCNCC(=O)NCC AIFCHEM-5845040035 [0,1,1,0,0,0|1,0,0]=3 352 B17R0.250 CCCCCCCCCCCNCC(=O)OCC AIFCHEM-5654992947 [0,1,1,0,0,0|0,0,0]=2 353 B17R0.250 CCCCCCCCCNCCCC(=O)OCC AIFCHEM-5906252278 [0,1,1,0,0,0|0,0,0]=2 354 B17R0.250 CCCCCCCCNCCCCC(=O)OCC AIFCHEM-6112869281 [0,1,1,0,0,0|0,0,0]=2 355 B17R0.250 CCCCCCCNCCCCCC(=O)OCC AIFCHEM-94589458249 [0,1,1,0,0,0|0,0,0]=2 356 B17R0.250 CCCCCCNCCCCCCC(=O)OCC AIFCHEM-94571764976 [0,1,1,0,0,0|0,0,0]=2 357 B17R0.250 CCCCOCCCNCCCCC(=O)OCC AIFCHEM-5977576929 [0,1,1,0,0,0|1,0,0]=3 358 B17R0.250 CCOC(=O)CCCCCCNCCCCC#N AIFCHEM-94558540538 [0,1,1,0,0,0|1,0,1]=4 359 B17R0.250 CCOC(=O)CCCCCCNCCCCCO AIFCHEM-5695446622 [0,1,1,0,0,0|1,0,0]=3 360 B17R0.250 CCOC(=O)CCCCCCNCCOCCO AIFCHEM-5725660478 [0,1,1,0,0,0|2,0,0]=4 361 B17R0.250 CCOC(=O)CCCCCCNCCSCCO AIFCHEM-6446337050 [0,1,1,0,0,0|2,0,0]=4 362 B17R0.250 CCOC(=O)CCCCCNCCCCCC#N AIFCHEM-5845518274 [0,1,1,0,0,0|1,0,1]=4 363 B17R0.250 CCOC(=O)CCCCCNCCCCCCO AIFCHEM-6497930097 [0,1,1,0,0,0|1,0,0]=3 364 B17R0.250 CCOC(=O)CCCCCNCCCOCCO AIFCHEM-6449184245 [0,1,1,0,0,0|2,0,0]=4 365 B17R0.250 CCOC(=O)CCCCCNCCOCCOC AIFCHEM-5818274424 [0,1,1,0,0,0|2,0,0]=4 366 B17R0.250 CCOC(=O)CCCCNCCCCCCCO AIFCHEM-6461140080 [0,1,1,0,0,0|1,0,0]=3 367 B17R0.250 CCOC(=O)CCCCNCCCOCCCO AIFCHEM-6511464583 [0,1,1,0,0,0|2,0,0]=4 368 B17R0.250 CCOCCCNCCCCCCC(=O)OCC AIFCHEM-6219024633 [0,1,1,0,0,0|1,0,0]=3 369 B17R0.256 CCOC(=O)CCCCCCNCCCC(C)C AIFCHEM-5738001779 [0,1,1,0,0,0|1,0,0]=3 370 B17R0.256 CCOC(=O)CCCCCCNCCCN(C)C AIFCHEM-94584123451 [0,1,1,0,0,0|2,0,0]=4 371 B17R0.256 CCOC(=O)CCCCCCNCCOC(C)C AIFCHEM-6258770894 [0,1,1,0,0,0|2,0,0]=4 372 B17R0.256 CCOC(=O)CCCCCNCCCCN(C)C AIFCHEM-5697859523 [0,1,1,0,0,0|2,0,0]=4 373 B17R0.256 CCOC(=O)CCCCNCCCCCN(C)C AIFCHEM-5659242641 [0,1,1,0,0,0|2,0,0]=4 374 B17R0.285 CCOC(=O)CCCCCCNCC(O)COC AIFCHEM-6457004416 [0,1,1,0,0,0|2,0,0]=4 375 B17R0.383 CCCCCC(=O)NCCCCCC(=O)OCC AIFCHEM-94585552922 [0,1,1,0,0,0|1,0,1]=4 376 B17R0.383 CCCCCC(C)NCCCCCC(=O)OCC AIFCHEM-94564408460 [0,1,1,0,0,0|1,0,0]=3 377 B17R0.383 CCCCCN(C)CCCCCCC(=O)OCC AIFCHEM-6112743323 [0,1,1,0,0,0|1,0,0]=3 378 B17R0.383 CCCCNC(=O)CCCCCCC(=O)OCC AIFCHEM-5696133932 [0,1,1,0,0,0|1,0,1]=4 379 B17R0.383 CCOC(=O)CCCCCCN(C)CCCCO AIFCHEM-6438888354 [0,1,1,0,0,0|2,0,0]=4 380 B17R0.1022 CCCCCCCCC(=O)NCCC(=O)OCC AIFCHEM-6057395144 [0,1,1,0,0,0|1,0,1]=4 381 B17R0.1022 CCCCCCCCC(C)CNCC(=O)OCC AIFCHEM-5643776926 [0,1,1,0,0,0|1,0,0]=3 382 B17R0.1022 CCCCCCCCC(C)NCCC(=O)OCC AIFCHEM-6074522925 [0,1,1,0,0,0|1,0,0]=3 383 B17R0.1022 CCCCCCCCN(C)CCCC(=O)OCC AIFCHEM-5943673061 [0,1,1,0,0,0|1,0,0]=3 384 B17R0.1022 CCOC(=O)CCCC(C)NCCCCCCO AIFCHEM-94560927198 [0,1,1,0,0,0|2,0,0]=4 385 B17R0.3112 CCCCCCCCCCCCC(=O)N(C)CC AIFCHEM-94563268858 [0,1,1,0,0,0|1,0,0]=3 386 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)CC AIFCHEM-6018339173 [0,1,1,0,0,0|1,0,0]=3 387 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)OC AIFCHEM-5997759122 [0,1,1,0,0,0|2,0,0]=4 388 B17R0.3112 CCCCCCCCCCCNC(=O)C(O)CC AIFCHEM-6044133238 [0,1,1,0,0,0|1,0,0]=3 389 B17R0.3112 CCCCCCCCCCCNC(=O)C(O)CO AIFCHEM-6044077693 [0,1,1,0,0,0|2,0,0]=4 390 B17R0.3112 CCCCCCCCCCCNC(=O)[C@@H](C)CC AIFCHEM-5998101412 [0,1,1,0,0,0|1,0,0]=3 391 B17R0.3112 CCCCCCCCCCCNC(=O)[C@@H](C)OC AIFCHEM-6079346027 [0,1,1,0,0,0|2,0,0]=4 392 B17R0.3112 CCCCCCCCCCCNC(=O)[C@H](C)CC AIFCHEM-6079455250 [0,1,1,0,0,0|1,0,0]=3 393 B17R0.3112 CCCCCCCCCCCNC(=O)[C@H](C)OC AIFCHEM-6043769665 [0,1,1,0,0,0|2,0,0]=4 394 B17R0.3112 CCN(C)C(=O)CCCCCCCCCCCO AIFCHEM-6099793791 [0,1,1,0,0,0|2,0,0]=4 395 B17R0.3167 CCOC(=O)CCCCCCNCCC(C)CO AIFCHEM-6469610984 [0,1,1,0,0,0|2,0,0]=4 396 B17R0.3167 CCOC(=O)CCCCCCNCCC(C)SC AIFCHEM-5736751735 [0,1,1,0,0,0|2,0,0]=4 397 B17R0.13602 CCCCCCCCCCNC(C)C(=O)OCC AIFCHEM-5832442434 [0,1,1,0,0,0|1,0,0]=3 398 B17R0.13602 CCCCCCCCCCN[C@@H](C)C(=O)NCC AIFCHEM-94595321698 [0,1,1,0,0,0|2,0,0]=4 399 B17R0.13602 CCCCCCCCCCN[C@@H](C)C(=O)OCC AIFCHEM-5851102038 [0,1,1,0,0,0|1,0,0]=3 400 B17R0.13602 CCCCCCCCCCN[C@@H](C)C(=O)SCC AIFCHEM-5752966920 [0,1,1,0,0,0|1,1,0]=4 401 B17R0.13602 CCCCCCCCCCN[C@H](C)C(=O)OCC AIFCHEM-6133670004 [0,1,1,0,0,0|1,0,0]=3 402 B17R0.13602 CCCCCCCCCNCC(C)C(=O)OCC AIFCHEM-6091971800 [0,1,1,0,0,0|1,0,0]=3 403 B17R0.13602 CCOC(=O)C(C)CNCCCCCCCCO AIFCHEM-6483563040 [0,1,1,0,0,0|2,0,0]=4 404 B17R0.14267 CCCCCCCCCC(=O)NCC(=O)OCC AIFCHEM-5663770123 [0,1,1,0,0,0|1,0,1]=4 405 B17R0.14267 CCCCCCCCCC(C)NCC(=O)NCC AIFCHEM-5793723824 [0,1,1,0,0,0|2,0,0]=4 406 B17R0.14267 CCCCCCCCCC(C)NCC(=O)OCC AIFCHEM-5643848479 [0,1,1,0,0,0|1,0,0]=3 407 B17R0.14267 CCCCCCCCCN(C)CCC(=O)OCC AIFCHEM-5914426514 [0,1,1,0,0,0|1,0,0]=3 408 B17R0.14267 CCCCCCCCNC(C)CCC(=O)OCC AIFCHEM-5795607421 [0,1,1,0,0,0|1,0,0]=3 409 B17R0.14267 CCCCOCCCNC(C)CCC(=O)OCC AIFCHEM-5977632143 [0,1,1,0,0,0|2,0,0]=4 410 B17R0.14267 CCOC(=O)CCC(C)NCCCCCCCO AIFCHEM-6409433116 [0,1,1,0,0,0|2,0,0]=4 411 B17R0.38 CC(C)CCNC(=O)CCCCCCCCCO AIFCHEM-6184138155 [0,1,1,0,0,0|2,0,0]=4 412 B17R0.38 CCCCCCCCCCC(=O)NCCC(=O)C AIFCHEM-6219815792 [0,1,1,0,0,0|1,0,1]=4 413 B17R0.38 CCCCCCCCCCC(=O)NCCC(C)C AIFCHEM-6122119567 [0,1,1,0,0,0|1,0,0]=3 414 B17R0.38 CCCCCCCCCCC(=O)NCCC(F)F AIFCHEM-6213541154 [0,1,1,0,0,0|2,0,0]=4 415 B17R0.38 CCCCCCCCCCC(=O)NCCN(C)C AIFCHEM-94537679114 [0,1,1,0,0,0|2,0,0]=4 416 B17R0.38 CCCCCCCCCNC(=O)CCCC(C)C AIFCHEM-6178423723 [0,1,1,0,0,0|1,0,0]=3 417 B17R0.38 CCCCCCCCCNC(=O)COCC(C)C AIFCHEM-6143574391 [0,1,1,0,0,0|2,0,0]=4 418 B17R0.38 CCCCCCCCOCC(=O)NCCC(C)C AIFCHEM-6184200568 [0,1,1,0,0,0|2,0,0]=4 419 B17R0.454 CCCCCCCCN[C@@H](C)C(=O)OCCCC AIFCHEM-5807179685 [0,1,1,0,0,0|1,0,0]=3 420 B17R0.3110 CCCCCCCCCCCC(=O)NCCCC AIFCHEM-94570977736 [0,1,1,0,0,0|1,0,0]=3 421 B17R0.3110 CCCCCCCCCCCC(=O)NCCOC AIFCHEM-6048736124 [0,1,1,0,0,0|2,0,0]=4 422 B17R0.3110 CCCCCCCCCCCC(=O)NCCSC AIFCHEM-5865651288 [0,1,1,0,0,0|2,0,0]=4 423 B17R0.3110 CCCCCCCCCCNC(=O)CCCCC AIFCHEM-94585550581 [0,1,1,0,0,0|1,0,0]=3 424 B17R0.3110 CCCCNC(=O)CCCCCCCCCCO AIFCHEM-94570981553 [0,1,1,0,0,0|1,0,0]=3 425 B17R0.3110 COCCNC(=O)CCCCCCCCCCO AIFCHEM-6039116021 [0,1,1,0,0,0|2,0,0]=4 426 B17R0.3110 CSCCNC(=O)CCCCCCCCCCO AIFCHEM-94598930628 [0,1,1,0,0,0|2,0,0]=4 427 B17R0.6195 CCCCCCNC(C)CCC(=O)OCCCC AIFCHEM-94571763612 [0,1,1,0,0,0|1,0,0]=3 428 B17R0.6195 CCCCOC(=O)CCC(C)NCCCCCO AIFCHEM-94591491508 [0,1,1,0,0,0|2,0,0]=4 429 B17R0.6195 CCCCOC(=O)CCC(C)NCCCOCC AIFCHEM-94591496079 [0,1,1,0,0,0|2,0,0]=4 430 B17R0.12412 C#CCCCNC(=O)CCCCCCCCCC AIFCHEM-5688216512 [0,1,1,0,0,0|1,0,1]=4 431 B17R0.12412 CCCCCCCCCCC(=O)NCCCCC AIFCHEM-94522657010 [0,1,1,0,0,0|1,0,0]=3 432 B17R0.12412 CCCCCCCCCCC(=O)NCCCOC AIFCHEM-5602022760 [0,1,1,0,0,0|1,0,0]=3 433 B17R0.12412 CCCCCCCCCCC(=O)NCCCSC AIFCHEM-94529057581 [0,1,1,0,0,0|1,0,0]=3 434 B17R0.12412 CCCCCCCCCCC(=O)NCCOCC AIFCHEM-94548609633 [0,1,1,0,0,0|1,0,0]=3 435 B17R0.12412 CCCCCCCCCCC(=O)NCCSCC AIFCHEM-94566121271 [0,1,1,0,0,0|1,0,0]=3 436 B17R0.12412 CCCCCCCCCNC(=O)CCCCCC AIFCHEM-94521980644 [0,1,1,0,0,0|1,0,0]=3 437 B17R0.12412 CCCCCCCCCNC(=O)CCOCCO AIFCHEM-6144639810 [0,1,1,0,0,0|2,0,0]=4 438 B17R0.12412 CCCCCCCCOCC(=O)NCCCCC AIFCHEM-94522663873 [0,1,1,0,0,0|2,0,0]=4 439 B17R0.12412 CCCCCCCCOCC(=O)NCCCOC AIFCHEM-5601814905 [0,1,1,0,0,0|2,0,0]=4 440 B17R0.12412 CCCCCCCCOCC(=O)NCCCSC AIFCHEM-94529064444 [0,1,1,0,0,0|2,0,0]=4 441 B17R0.12412 CCCCCCCCOCC(=O)NCCOCC AIFCHEM-94548616496 [0,1,1,0,0,0|2,0,0]=4 442 B17R0.12412 CCCCCCCCOCC(=O)NCCSCC AIFCHEM-94566128134 [0,1,1,0,0,0|2,0,0]=4 443 B17R0.12412 CCCCCNC(=O)CCCCCCCCCO AIFCHEM-94522659251 [0,1,1,0,0,0|2,0,0]=4 444 B17R0.12412 CCOCCNC(=O)CCCCCCCCCO AIFCHEM-94548611874 [0,1,1,0,0,0|2,0,0]=4 445 B17R0.12412 CCSCCNC(=O)CCCCCCCCCO AIFCHEM-6055232283 [0,1,1,0,0,0|2,0,0]=4 446 B17R0.12412 COCCCNC(=O)CCCCCCCCCO AIFCHEM-5644887532 [0,1,1,0,0,0|2,0,0]=4 447 B17R0.12412 CSCCCNC(=O)CCCCCCCCCO AIFCHEM-94529059822 [0,1,1,0,0,0|2,0,0]=4 448 B17R0.12415 CCC(C)CNC(=O)CCCCCCCCCO AIFCHEM-94534479101 [0,1,1,0,0,0|2,0,0]=4 449 B17R0.12415 CCC(F)CNC(=O)CCCCCCCCCO AIFCHEM-5801799872 [0,1,1,0,0,0|2,0,0]=4 450 B17R0.12415 CCCCCCCCCCC(=O)NCC(=O)CC AIFCHEM-6148897428 [0,1,1,0,0,0|1,0,1]=4 451 B17R0.12415 CCCCCCCCCCC(=O)NCC(C)CC AIFCHEM-94534476860 [0,1,1,0,0,0|1,0,0]=3 452 B17R0.12415 CCCCCCCCCCC(=O)NCC(F)CC AIFCHEM-5839779061 [0,1,1,0,0,0|1,0,0]=3 453 B17R0.12415 CCCCCCCCCCC(=O)NC[C@@H](C)OC AIFCHEM-94608842776 [0,1,1,0,0,0|2,0,0]=4 454 B17R0.12415 CCCCCCCCCCC(=O)NC[C@H](C)OC AIFCHEM-5952881608 [0,1,1,0,0,0|2,0,0]=4 455 B17R0.12415 CCCCCCCCCNC(=O)CCC(C)CC AIFCHEM-6164096228 [0,1,1,0,0,0|1,0,0]=3 456 B17R0.12415 CCCCCCCCOCC(=O)NCC(C)CC AIFCHEM-94534483723 [0,1,1,0,0,0|2,0,0]=4 457 B17R0.12415 CCCCCCCCOCC(=O)NCC(F)CC AIFCHEM-5859830870 [0,1,1,0,0,0|2,0,0]=4 458 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCOC AIFCHEM-5998839376 [0,1,1,0,0,0|2,0,0]=4 459 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCSC AIFCHEM-94607185493 [0,1,1,0,0,0|2,0,0]=4 460 B17R0.12416 CCCCCCCCCNC(=O)C(C)CCCC AIFCHEM-6092538475 [0,1,1,0,0,0|1,0,0]=3 461 B17R0.12416 CCCCCCCCCNC(=O)C(O)CCCC AIFCHEM-6154960146 [0,1,1,0,0,0|1,0,0]=3 462 B17R0.12416 CCCCCCCCCNC(=O)C(O)CCSC AIFCHEM-6144074033 [0,1,1,0,0,0|2,0,0]=4 463 B17R0.78 CCCCCCCC(=O)NCCCCCN(C)C AIFCHEM-5686801149 [0,1,1,0,0,0|2,0,0]=4 464 B17R0.78 CCCCCCNC(=O)CCCCCCC(C)C AIFCHEM-6122910165 [0,1,1,0,0,0|1,0,0]=3 465 B17R0.78 CCOCCCNC(=O)CCCCCCC(C)C AIFCHEM-6286380971 [0,1,1,0,0,0|2,0,0]=4 466 B17R0.101 CCCCCCCCC(=O)NCCCCN(C)C AIFCHEM-5749589840 [0,1,1,0,0,0|2,0,0]=4 467 B17R0.104 C#CCCCCCNC(=O)CCCCCCCC AIFCHEM-94571994166 [0,1,1,0,0,0|1,0,1]=4 468 B17R0.104 CCCCCCCCC(=O)NCCCCCC#N AIFCHEM-5881887799 [0,1,1,0,0,0|1,0,1]=4 469 B17R0.5500 CCCCCCCCC(=O)N(C)CCCCCC AIFCHEM-6058826965 [0,1,1,0,0,0|1,0,0]=3 470 B17R0.5500 CCCCCCN(C)C(=O)CCCCCCCO AIFCHEM-6058823664 [0,1,1,0,0,0|2,0,0]=4 471 B17R0.7631 CCCCCCC(C)NC(=O)CCCCCCO AIFCHEM-94531842590 [0,1,1,0,0,0|2,0,0]=4 472 B17R0.7631 CCCCCCC(C)NC(=O)CCCCCOC AIFCHEM-94534419024 [0,1,1,0,0,0|2,0,0]=4 473 B17R0.7631 CCCCCCCC(=O)NC(C)CCCCCC AIFCHEM-94531838271 [0,1,1,0,0,0|1,0,0]=3 474 B17R0.7631 CCCCCC[C@@H](C)NC(=O)CCCCCCO AIFCHEM-6115411703 [0,1,1,0,0,0|2,0,0]=4 475 B17R0.7631 CCCCCC[C@@H](C)NC(=O)CCCCCOC AIFCHEM-94534415827 [0,1,1,0,0,0|2,0,0]=4 476 B17R0.7631 CCCCCC[C@H](C)NC(=O)CCCCCCO AIFCHEM-5877915439 [0,1,1,0,0,0|2,0,0]=4 477 B17R0.7631 CCCCCC[C@H](C)NC(=O)CCCCCOC AIFCHEM-94534415826 [0,1,1,0,0,0|2,0,0]=4 478 B17R0.8809 C#CCCCCCCCC(=O)NCCCCCC AIFCHEM-94571770597 [0,1,1,0,0,0|1,0,1]=4 479 B17R0.8809 C#CCCCCCCNC(=O)CCCCCCC AIFCHEM-5639291026 [0,1,1,0,0,0|1,0,1]=4 480 B17R0.8809 CCCCCCCCCC(=O)NCCCCCC AIFCHEM-94575443410 [0,1,1,0,0,0|1,0,0]=3 481 B17R0.8809 CCCCCCCCCC(=O)NCCCOCC AIFCHEM-6281402716 [0,1,1,0,0,0|2,0,0]=4 482 B17R0.8809 CCCCCCCCNC(=O)CCCCCCO AIFCHEM-94561942702 [0,1,1,0,0,0|2,0,0]=4 483 B17R0.8809 CCCCCCCCNC(=O)CCCCCOC AIFCHEM-94578170484 [0,1,1,0,0,0|2,0,0]=4 484 B17R0.8809 CCCCCCNC(=O)CCCCCCCCO AIFCHEM-94575443761 [0,1,1,0,0,0|1,0,0]=3 485 B17R0.8809 CCCCCCNC(=O)COCCOCCCC AIFCHEM-94538971857 [0,1,1,0,0,0|2,0,0]=4 486 B17R0.8809 CCCCOCCCNC(=O)CCCCCCO AIFCHEM-5977807220 [0,1,1,0,0,0|2,0,0]=4 487 B17R0.8809 CCCCOCCCNC(=O)CCCCCOC AIFCHEM-94534412571 [0,1,1,0,0,0|2,0,0]=4 488 B17R0.8809 CCOCCCNC(=O)CCCCCCCCO AIFCHEM-6273895842 [0,1,1,0,0,0|2,0,0]=4 489 B17R0.13545 CCCCCCCC(=O)N(C)CCCCCCC AIFCHEM-6069432184 [0,1,1,0,0,0|1,0,0]=3 490 B17R0.13545 CCCCCCCC(C)C(=O)NCCCCCC AIFCHEM-94574196158 [0,1,1,0,0,0|1,0,0]=3 491 B17R0.13545 CCCCCCCC(C)C(=O)NCCCOCC AIFCHEM-94574205596 [0,1,1,0,0,0|2,0,0]=4 492 B17R0.13545 CCCCCCCN(C)C(=O)CCCCCCO AIFCHEM-6071889766 [0,1,1,0,0,0|2,0,0]=4 493 B17R0.13545 CCCCCCCN(C)C(=O)CCCCCOC AIFCHEM-94534416048 [0,1,1,0,0,0|2,0,0]=4 494 B17R0.133 CCCCCCC(=O)NCCCCCC(=O)OC AIFCHEM-94521985033 [0,1,1,0,0,0|1,0,1]=4 495 B17R0.133 CCCCCCC(C)NCCCCCC(=O)OC AIFCHEM-5664619195 [0,1,1,0,0,0|1,0,0]=3 496 B17R0.133 CCCCCC[C@H](C)NCCCCCC(=O)OC AIFCHEM-5857178554 [0,1,1,0,0,0|1,0,0]=3 497 B17R0.133 CCCCCNC(=O)CCCCCCC(=O)OC AIFCHEM-94552829742 [0,1,1,0,0,0|1,0,1]=4 498 B17R0.195 C#CC(=O)NCCCCCCCCCCCCC AIFCHEM-94525197462 [0,1,1,0,0,0|1,0,1]=4 499 B17R0.195 CCCCCCCCCCCCCNC(=O)CC AIFCHEM-94552344235 [0,1,1,0,0,0|1,0,0]=3 500 B17R0.195 CCCCCCCCCCCCCNC(=O)CO AIFCHEM-94532681114 [0,1,1,0,0,0|2,0,0]=4 501 B17R0.195 CCCCCCCCCCCCNCC(=O)NC AIFCHEM-94562540143 [0,1,1,0,0,0|1,0,0]=3 502 B17R0.195 CCCCCCCCCCCCNCC(=O)OC AIFCHEM-6193980990 [0,1,1,0,0,0|0,0,0]=2 503 B17R0.195 CCCCCCCCCCCCNCC(C)OC AIFCHEM-5787463933 [0,1,1,0,0,0|1,0,1]=4 504 B17R0.195 CCCCCCCCCCCCNC[C@@H](C)OC AIFCHEM-94608835984 [0,1,1,0,0,0|1,0,1]=4 505 B17R0.195 CCCCCCCCCCCCNC[C@H](C)OC AIFCHEM-94588779890 [0,1,1,0,0,0|1,0,1]=4 506 B17R0.195 CCCCCCCCCCNCCCC(=O)OC AIFCHEM-94592438387 [0,1,1,0,0,0|0,0,0]=2 507 B17R0.195 CCCCCCCCCCNCCNC(=O)CC AIFCHEM-94532522492 [0,1,1,0,0,0|1,0,0]=3 508 B17R0.195 CCCCCCCCCNCCCCC(=O)OC AIFCHEM-6163694405 [0,1,1,0,0,0|0,0,0]=2 509 B17R0.195 CCCCCCCCNCCCCCC(=O)OC AIFCHEM-94561935681 [0,1,1,0,0,0|0,0,0]=2 510 B17R0.195 CCCCCCCNCCCCCCC(=O)OC AIFCHEM-94589454521 [0,1,1,0,0,0|0,0,0]=2 511 B17R0.195 CCCCCNCCOCCOCCC(=O)OC AIFCHEM-94583089094 [0,1,1,0,0,0|2,0,0]=4 512 B17R0.195 CCCCNCCCCCCCCCC(=O)OC AIFCHEM-94523032166 [0,1,1,0,0,0|0,0,0]=2 513 B17R0.195 CCCCOCCCNCCCCCC(=O)OC AIFCHEM-5926985115 [0,1,1,0,0,0|1,0,0]=3 514 B17R0.195 CCCNCCCCCCCCCCC(=O)OC AIFCHEM-94569016973 [0,1,1,0,0,0|0,0,0]=2 515 B17R0.195 CCNCCCCCCCCCCCC(=O)OC AIFCHEM-94537421570 [0,1,1,0,0,0|0,0,0]=2 516 B17R0.195 COC(=O)CCCCCCCNCCOCCO AIFCHEM-5856778290 [0,1,1,0,0,0|2,0,0]=4 517 B17R0.195 COC(=O)CCCCCNCCCCCCCO AIFCHEM-6425177539 [0,1,1,0,0,0|1,0,0]=3 518 B17R0.195 COC(=O)CCCCCNCCCOCCCO AIFCHEM-6501795121 [0,1,1,0,0,0|2,0,0]=4 519 B17R0.195 COC(=O)CCCCNCCCCCCCCO AIFCHEM-6436128351 [0,1,1,0,0,0|1,0,0]=3 520 B17R0.195 COC(=O)CCCNCCCCCCCCCO AIFCHEM-94592432584 [0,1,1,0,0,0|1,0,0]=3 521 B17R0.5801 CCCCC(=O)NCCCCCCCC(=O)OC AIFCHEM-94534111046 [0,1,1,0,0,0|1,0,1]=4 522 B17R0.5801 CCCCC(C)NCCCCCCCC(=O)OC AIFCHEM-94541404315 [0,1,1,0,0,0|1,0,0]=3 523 B17R0.5801 CCCNC(=O)CCCCCCCCC(=O)OC AIFCHEM-94521380693 [0,1,1,0,0,0|1,0,1]=4 524 B17R0.5801 COC(=O)CCCCCCCNC(C)CCSC AIFCHEM-5805618476 [0,1,1,0,0,0|2,0,0]=4 525 B17R0.8798 CCCCCCCCCC(=O)NCCC(=O)OC AIFCHEM-6132197952 [0,1,1,0,0,0|1,0,1]=4 526 B17R0.8798 CCCCCCCCCC(C)CNCC(=O)NC AIFCHEM-94562540086 [0,1,1,0,0,0|2,0,0]=4 527 B17R0.8798 CCCCCCCCCC(C)NCCC(=O)OC AIFCHEM-6150628930 [0,1,1,0,0,0|1,0,0]=3 528 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)OC AIFCHEM-5640887096 [0,1,1,0,0,0|1,0,0]=3 529 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC AIFCHEM-94578166934 [0,1,1,0,0,0|1,0,1]=4 530 B17R0.8798 CCCCCCCCNC(C)CCCC(=O)OC AIFCHEM-94578159263 [0,1,1,0,0,0|1,0,0]=3 531 B17R0.8798 CCCCOCCCNC(C)CCCC(=O)OC AIFCHEM-5977661603 [0,1,1,0,0,0|2,0,0]=4 532 B17R0.8798 COC(=O)CCCC(C)NCCCCCCCO AIFCHEM-6409455188 [0,1,1,0,0,0|2,0,0]=4 533 B17R0.11645 CCC(=O)NCCCCCCCCCC(=O)OC AIFCHEM-94526502746 [0,1,1,0,0,0|1,0,1]=4 534 B17R0.11645 COC(=O)CCCCCCCCCNC(C)CO AIFCHEM-6017134151 [0,1,1,0,0,0|2,0,0]=4 535 B17R0.11645 COC(=O)CCCCCCCNCCC(C)SC AIFCHEM-5831078944 [0,1,1,0,0,0|2,0,0]=4 536 B17R0.13601 CCCCCCCCCCCN(C)CC(=O)NC AIFCHEM-94608441323 [0,1,1,0,0,0|2,0,0]=4 537 B17R0.13601 CCCCCCCCCCNC(=O)CC(=O)OC AIFCHEM-94549709185 [0,1,1,0,0,0|1,0,1]=4 538 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)NC AIFCHEM-94602597790 [0,1,1,0,0,0|2,0,0]=4 539 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)OC AIFCHEM-6061145121 [0,1,1,0,0,0|1,0,0]=3 540 B17R0.13601 CCCCCCCCCCN[C@@H](C)CC(=O)OC AIFCHEM-5718581653 [0,1,1,0,0,0|1,0,0]=3 541 B17R0.13601 CCCCCCCCCCN[C@H](C)CC(=O)OC AIFCHEM-94564415952 [0,1,1,0,0,0|1,0,0]=3 542 B17R0.13601 CCCCCCCCCNC[C@H](C)NC(=O)OC AIFCHEM-6128260612 [0,1,1,0,0,0|2,0,0]=4 543 B17R0.13601 COC(=O)CC(C)NCCCCCCCCCO AIFCHEM-6487033610 [0,1,1,0,0,0|2,0,0]=4 544 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C AIFCHEM-94584710338 [0,1,1,0,0,0|1,0,0]=3 545 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)O AIFCHEM-94536262897 [0,1,1,0,0,0|1,0,0]=3 546 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@@H](C)O AIFCHEM-94584702315 [0,1,1,0,0,0|1,0,0]=3 547 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@H](C)O AIFCHEM-94584464507 [0,1,1,0,0,0|1,0,0]=3 548 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C AIFCHEM-5642122016 [0,1,1,0,0,0|2,0,0]=4 549 B17R0.14245 CCCCCCCCCCNCCC(=O)N(C)C AIFCHEM-5851332540 [0,1,1,0,0,0|2,0,0]=4 550 B17R0.14363 COC(=O)CCCCCCCCCCNC(=O)C AIFCHEM-94605351813 [0,1,1,0,0,0|1,0,1]=4 551 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)C AIFCHEM-94572975190 [0,1,1,0,0,0|1,0,0]=3 552 B17R0.14363 COC(=O)CCCCCNCCCCCN(C)C AIFCHEM-5681572905 [0,1,1,0,0,0|2,0,0]=4 553 B17R0.43 CC(=O)OCCCCNCCCCCCCCO AIFCHEM-6472397330 [0,1,1,0,0,0|1,0,0]=3 554 B17R0.43 CC(=O)SCCCNCCCCCCCCCO AIFCHEM-94560857740 [0,1,1,0,0,0|1,1,0]=4 555 B17R0.43 CCCCCCCCCCCCCCNC(=O)C AIFCHEM-94535593475 [0,1,1,0,0,0|1,0,0]=3 556 B17R0.43 CCCCCCCCCCCCNCCC(=O)N AIFCHEM-5933115353 [0,1,1,0,0,0|1,0,0]=3 557 B17R0.43 CCCCCCCCCCCCNCCC(=O)O AIFCHEM-5846249562 [0,1,1,0,0,0|0,0,0]=2 558 B17R0.43 CCCCCCCCCCCCNCCC(C)O AIFCHEM-94577732312 [0,1,1,0,0,0|1,0,1]=4 559 B17R0.43 CCCCCCCCCCCCNCC[C@H](C)O AIFCHEM-94544710578 [0,1,1,0,0,0|1,0,1]=4 560 B17R0.43 CCCCCCCCCCCNCCCC(=O)N AIFCHEM-5945928798 [0,1,1,0,0,0|1,0,0]=3 561 B17R0.43 CCCCCCCCCCCNCCCC(=O)O AIFCHEM-5596423881 [0,1,1,0,0,0|0,0,0]=2 562 B17R0.43 CCCCCCCCCCCNCCNC(=O)C AIFCHEM-5919990042 [0,1,1,0,0,0|1,0,0]=3 563 B17R0.43 CCCCCCCCCCCNCCNC(=O)O AIFCHEM-94535743415 [0,1,1,0,0,0|1,0,0]=3 564 B17R0.43 CCCCCCCCCCCNCCOC(=O)C AIFCHEM-5671752792 [0,1,1,0,0,0|0,0,0]=2 565 B17R0.43 CCCCCCCCCCCNCCOC(C)C AIFCHEM-6227664135 [0,1,1,0,0,0|1,0,1]=4 566 B17R0.43 CCCCCCCCCCNCCCCC(=O)N AIFCHEM-5904529842 [0,1,1,0,0,0|1,0,0]=3 567 B17R0.43 CCCCCCCCCCNCCCCC(=O)O AIFCHEM-5614274361 [0,1,1,0,0,0|0,0,0]=2 568 B17R0.43 CCCCCCCCCCNCCCNC(=O)C AIFCHEM-94531731859 [0,1,1,0,0,0|1,0,0]=3 569 B17R0.43 CCCCCCCCCCNCCCSC(=O)C AIFCHEM-94560863543 [0,1,1,0,0,0|0,1,0]=3 570 B17R0.43 CCCCCCCCCCNCCOCC(=O)O AIFCHEM-94563712417 [0,1,1,0,0,0|1,0,0]=3 571 B17R0.43 CCCCCCCCCNCCCCCC(=O)O AIFCHEM-94574974467 [0,1,1,0,0,0|0,0,0]=2 572 B17R0.43 CCCCCCCCCNCCCCNC(=O)C AIFCHEM-94585133553 [0,1,1,0,0,0|1,0,0]=3 573 B17R0.43 CCCCCCCCCNCCOCCC(=O)O AIFCHEM-5949465346 [0,1,1,0,0,0|1,0,0]=3 574 B17R0.43 CCCCCCCCNCCCCCCC(=O)O AIFCHEM-5758837537 [0,1,1,0,0,0|0,0,0]=2 575 B17R0.43 CCCCCCCCNCCCCCNC(=O)C AIFCHEM-94565851891 [0,1,1,0,0,0|1,0,0]=3 576 B17R0.43 CCCCCCCNCCCCCCCC(=O)O AIFCHEM-94589457131 [0,1,1,0,0,0|0,0,0]=2 577 B17R0.43 CCCCCCCNCCCCCCNC(=O)O AIFCHEM-94589452918 [0,1,1,0,0,0|1,0,0]=3 578 B17R0.43 CCCCCCCNCCCCCCSC(=O)C AIFCHEM-94589465217 [0,1,1,0,0,0|0,1,0]=3 579 B17R0.43 CCCCCCCNCCOCCOCC(=O)O AIFCHEM-94520998625 [0,1,1,0,0,0|2,0,0]=4 580 B17R0.43 CCCCCCNCCCCCCCCC(=O)O AIFCHEM-94571764098 [0,1,1,0,0,0|0,0,0]=2 581 B17R0.43 CCCCCNCCCCCCCCCC(=O)O AIFCHEM-94522654346 [0,1,1,0,0,0|0,0,0]=2 582 B17R0.43 CCCCNCCCCCCCCCCC(=O)O AIFCHEM-94523035369 [0,1,1,0,0,0|0,0,0]=2 583 B17R0.43 CCCNCCCCCCCCCCCC(=O)O AIFCHEM-94576122052 [0,1,1,0,0,0|0,0,0]=2 584 B17R0.43 CCOCCCNCCCCCCCCC(=O)O AIFCHEM-6208522103 [0,1,1,0,0,0|1,0,0]=3 585 B17R0.43 CCOCCNCCCCCCCCCC(=O)O AIFCHEM-94548606969 [0,1,1,0,0,0|1,0,0]=3 586 B17R0.43 CCSCCNCCCCCCCCCC(=O)O AIFCHEM-94566118607 [0,1,1,0,0,0|1,0,0]=3 587 B17R0.43 COCCCNCCCCCCCCCC(=O)O AIFCHEM-94598890076 [0,1,1,0,0,0|1,0,0]=3 588 B17R0.43 COCCOCCNCCCCCCCC(=O)O AIFCHEM-5793864519 [0,1,1,0,0,0|2,0,0]=4 589 B17R0.43 CSCCCNCCCCCCCCCC(=O)O AIFCHEM-94546175598 [0,1,1,0,0,0|1,0,0]=3 590 B17R0.43 N#CCCCCCNCCCCCCCC(=O)O AIFCHEM-5881579330 [0,1,1,0,0,0|1,0,1]=4 591 B17R0.43 N#CCCCCNCCCCCCCCC(=O)O AIFCHEM-94558539660 [0,1,1,0,0,0|1,0,1]=4 592 B17R0.43 O=C(O)CCCCCCCCCNCCCCO AIFCHEM-6505295391 [0,1,1,0,0,0|1,0,0]=3 593 B17R0.43 O=C(O)CCCCCCCCNCCCCCO AIFCHEM-6490916164 [0,1,1,0,0,0|1,0,0]=3 594 B17R0.43 O=C(O)CCCCCCCCNCCOCCO AIFCHEM-5769780197 [0,1,1,0,0,0|2,0,0]=4 595 B17R0.43 O=C(O)CCCCCCCCNCCSCCO AIFCHEM-6446580315 [0,1,1,0,0,0|2,0,0]=4 596 B17R0.43 O=C(O)CCCCCCCNCCCCCCO AIFCHEM-6510656707 [0,1,1,0,0,0|1,0,0]=3 597 B17R0.43 O=C(O)CCCCCCCNCCCOCCO AIFCHEM-6409015115 [0,1,1,0,0,0|2,0,0]=4 598 B17R0.139 CCCCCCC(C)NCCCCCCC(=O)O AIFCHEM-94596321026 [0,1,1,0,0,0|1,0,0]=3 599 B17R0.139 CCCCCCC(C)NCCCCCNC(=O)C AIFCHEM-6083749507 [0,1,1,0,0,0|2,0,0]=4 600 B17R0.139 CN(CCCCCO)CCCCCCCC(=O)O AIFCHEM-6448175028 [0,1,1,0,0,0|2,0,0]=4 601 B17R0.170 CC(CCCO)NCCCCCCCCC(=O)O AIFCHEM-94575407500 [0,1,1,0,0,0|2,0,0]=4 602 B17R0.170 CCCCC(C)NCCCCCCCCC(=O)O AIFCHEM-94541391221 [0,1,1,0,0,0|1,0,0]=3 603 B17R0.170 CCCC[C@@H](C)NCCCCCCCCC(=O)O AIFCHEM-94596951029 [0,1,1,0,0,0|1,0,0]=3 604 B17R0.170 CN(CCCO)CCCCCCCCCC(=O)O AIFCHEM-6456680156 [0,1,1,0,0,0|2,0,0]=4 605 B17R0.170 COCCN(C)CCCCCCCCCC(=O)O AIFCHEM-6044079647 [0,1,1,0,0,0|2,0,0]=4 606 B17R0.170 CSCCC(C)NCCCCCCCCC(=O)O AIFCHEM-5707870414 [0,1,1,0,0,0|2,0,0]=4 607 B17R0.170 CSCCN(C)CCCCCCCCCC(=O)O AIFCHEM-94607182829 [0,1,1,0,0,0|2,0,0]=4 608 B17R0.170 C[C@@H](CCCO)NCCCCCCCCC(=O)O AIFCHEM-6389244554 [0,1,1,0,0,0|2,0,0]=4 609 B17R0.170 C[C@H](CCCO)CNCCCCCCCC(=O)O AIFCHEM-6439079262 [0,1,1,0,0,0|2,0,0]=4 610 B17R0.170 C[C@H](CCCO)NCCCCCCCCC(=O)O AIFCHEM-6475755860 [0,1,1,0,0,0|2,0,0]=4 611 B17R0.192 CC(=O)OCC(C)NCCCCCCCCCO AIFCHEM-94599171369 [0,1,1,0,0,0|2,0,0]=4 612 B17R0.192 CC(CCC(=O)O)NCCCCCCCCCO AIFCHEM-6501189792 [0,1,1,0,0,0|2,0,0]=4 613 B17R0.192 CCCCCCCCCCCN(C)CCC(=O)O AIFCHEM-6020136255 [0,1,1,0,0,0|1,0,0]=3 614 B17R0.192 CCCCCCCCCCNC(=O)COC(=O)C AIFCHEM-5604863500 [0,1,1,0,0,0|1,0,1]=4 615 B17R0.192 CCCCCCCCCCNC(C)CCC(=O)O AIFCHEM-5626916714 [0,1,1,0,0,0|1,0,0]=3 616 B17R0.192 CCCCCCCCCCNC(C)CNC(=O)C AIFCHEM-5626335596 [0,1,1,0,0,0|2,0,0]=4 617 B17R0.192 CCCCCCCCCCNC(C)COC(=O)C AIFCHEM-94599177172 [0,1,1,0,0,0|1,0,0]=3 618 B17R0.197 CCCCCCCCCCCNCCS(=O)(=O)O AIFCHEM-5743950541 [0,1,1,0,0,0|2,0,0]=4 619 B17R0.197 CCCCCCCCCCNCCCS(=O)(=O)O AIFCHEM-5676585461 [0,1,1,0,0,0|2,0,0]=4 620 B17R0.1713 CC(C)CCCNCCCCCCCCC(=O)O AIFCHEM-5700257296 [0,1,1,0,0,0|1,0,0]=3 621 B17R0.1713 CC(C)CCNCCCCCCCCCC(=O)O AIFCHEM-6120888716 [0,1,1,0,0,0|1,0,0]=3 622 B17R0.1713 CC(C)CNCCCCCCCCCCC(=O)O AIFCHEM-94572978393 [0,1,1,0,0,0|1,0,0]=3 623 B17R0.1713 CC(C)OCCNCCCCCCCCC(=O)O AIFCHEM-6282481813 [0,1,1,0,0,0|2,0,0]=4 624 B17R0.1713 CC(O)CCNCCCCCCCCCC(=O)O AIFCHEM-94577736440 [0,1,1,0,0,0|1,0,0]=3 625 B17R0.1713 CN(C)CCCCNCCCCCCCC(=O)O AIFCHEM-94602186535 [0,1,1,0,0,0|2,0,0]=4 626 B17R0.1713 CN(C)CCCNCCCCCCCCC(=O)O AIFCHEM-94584122573 [0,1,1,0,0,0|2,0,0]=4 627 B17R0.1713 C[C@H](O)CCNCCCCCCCCCC(=O)O AIFCHEM-94544714706 [0,1,1,0,0,0|1,0,0]=3 628 B17R0.1713 O=C(O)CCCCCCCCCNCCC(F)F AIFCHEM-6231248339 [0,1,1,0,0,0|2,0,0]=4 629 B17R0.8801 CC(=O)OCCCC(C)NCCCCCCCO AIFCHEM-6409154652 [0,1,1,0,0,0|2,0,0]=4 630 B17R0.8801 CC(CCCCC(=O)O)NCCCCCCCO AIFCHEM-6408594810 [0,1,1,0,0,0|2,0,0]=4 631 B17R0.8801 CCCCCCCCCC(=O)NCCOC(=O)C AIFCHEM-5615969408 [0,1,1,0,0,0|1,0,1]=4 632 B17R0.8801 CCCCCCCCCC(C)NCCCC(=O)N AIFCHEM-5892658781 [0,1,1,0,0,0|2,0,0]=4 633 B17R0.8801 CCCCCCCCCC(C)NCCCC(=O)O AIFCHEM-5676643825 [0,1,1,0,0,0|1,0,0]=3 634 B17R0.8801 CCCCCCCCCC(C)NCCNC(=O)C AIFCHEM-5902363332 [0,1,1,0,0,0|2,0,0]=4 635 B17R0.8801 CCCCCCCCCC(C)NCCNC(=O)O AIFCHEM-94535743413 [0,1,1,0,0,0|2,0,0]=4 636 B17R0.8801 CCCCCCCCCC(C)NCCOC(=O)C AIFCHEM-5621308786 [0,1,1,0,0,0|1,0,0]=3 637 B17R0.8801 CCCCCCCCNC(C)CCCCC(=O)O AIFCHEM-94561933720 [0,1,1,0,0,0|1,0,0]=3 638 B17R0.8801 CCCCCCCCNC(C)CCCOC(=O)C AIFCHEM-5822723228 [0,1,1,0,0,0|1,0,0]=3 639 B17R0.8801 CCCCOCCCNC(C)CCCCC(=O)O AIFCHEM-5977599674 [0,1,1,0,0,0|2,0,0]=4 640 B17R0.117 CCCCCCCCCCCCCCNCCO AIFCHEM-6431716414 [0,1,1,0,0,0|1,0,1]=4 641 B17R0.117 CCCCCCCCCCCCNCCCCO AIFCHEM-6503053254 [0,1,1,0,0,0|1,0,1]=4 642 B17R0.117 CCCCCCCCCCCCNCCOCC AIFCHEM-94548602841 [0,1,1,0,0,0|1,0,1]=4 643 B17R0.117 CCCCCCCCCCCNCCCCCO AIFCHEM-5997563053 [0,1,1,0,0,0|1,0,1]=4 644 B17R0.117 CCCCCCCCCCCNCCCOCC AIFCHEM-6286296303 [0,1,1,0,0,0|1,0,1]=4 645 B17R0.117 CCCCCCCCCCNCCCCCCO AIFCHEM-6504112689 [0,1,1,0,0,0|1,0,1]=4 646 B17R0.117 CCCCCCCCCNCCCCCCCO AIFCHEM-6469248699 [0,1,1,0,0,0|1,0,1]=4 647 B17R0.117 CCCCCCCCNCCCCCCCCO AIFCHEM-6472333138 [0,1,1,0,0,0|1,0,1]=4 648 B17R0.117 CCCCCCCNCCCCCCCCCO AIFCHEM-94589449559 [0,1,1,0,0,0|1,0,1]=4 649 B17R0.117 CCCCNCCCCCCCCCCCCO AIFCHEM-94523040578 [0,1,1,0,0,0|1,0,1]=4 650 B17R0.117 OCCCCCCCCCCNCCCCCO AIFCHEM-6512594983 [0,1,1,0,0,0|0,0,2]=4 651 B17R0.14268 CCCCCCCCCC(O)CC(=O)NCCC AIFCHEM-5791285426 [0,1,1,0,0,0|1,0,0]=3 652 B17R1.716 CCCCCCCCCCN1CCOC(=O)C1 AIFCHEM-5829494809 [0,0,1,1,0,0|1,0,0]=3 653 B17R1.915 CCOC(=O)CCCCCNCC1CCCC1 AIFCHEM-94573916069 [0,0,1,1,0,0|1,0,0]=3 654 B17R1.915 CCOC(=O)CCCCNCCN1CCCC1 AIFCHEM-5761368559 [0,0,1,1,0,0|2,0,0]=4 655 B17R1.957 CCOC(=O)CCCCCN1CCCC[C@@H]1C AIFCHEM-94588084627 [0,0,1,1,0,0|1,0,0]=3 656 B17R1.957 CCOC(=O)CCCCCN1CCCC[C@H]1C AIFCHEM-5694003022 [0,0,1,1,0,0|1,0,0]=3 657 B17R1.957 CCOC(=O)CCCCCN1CCOCC1C AIFCHEM-94530729016 [0,0,1,1,0,0|2,0,0]=4 658 B17R1.957 CCOC(=O)CCCCCN1CCOC[C@@H]1C AIFCHEM-94571064163 [0,0,1,1,0,0|2,0,0]=4 659 B17R1.957 CCOC(=O)CCCCCN1CCOC[C@H]1C AIFCHEM-5672677645 [0,0,1,1,0,0|2,0,0]=4 660 B17R1.957 CCOC(=O)CCCCNC1CCOCC1C AIFCHEM-6153781706 [0,0,1,1,0,0|2,0,0]=4 661 B17R1.995 CCOC(=O)CCCCCNC1CCSCC1 AIFCHEM-5808775968 [0,0,1,1,0,0|2,0,0]=4 662 B17R1.995 CCOC(=O)CCCCNCC1CCCCO1 AIFCHEM-94560317092 [0,0,1,1,0,0|2,0,0]=4 663 B17R1.995 CCOC(=O)CCCNCCC1CCOCC1 AIFCHEM-5907598284 [0,0,1,1,0,0|2,0,0]=4 664 B17R1.4620 CCCCNC1CCCCCC1C(=O)OCC AIFCHEM-94570975014 [0,0,1,1,0,0|1,0,0]=3 665 B17R1.6374 CCCCCN1CCCCC1CC(=O)OCC AIFCHEM-94551431080 [0,0,1,1,0,0|1,0,0]=3 666 B17R1.11019 CCCCCCCCCCCNC(=O)C1CC1 AIFCHEM-6018949816 [0,0,1,1,0,0|1,0,0]=3 667 B17R1.19162 CCOC(=O)CCCCCCNCC1CCC1 AIFCHEM-5736399834 [0,0,1,1,0,0|1,0,0]=3 668 B17R1.21117 CCOC(=O)CCCCCCNCCC1CC1 AIFCHEM-5784105193 [0,0,1,1,0,0|1,0,0]=3 669 B17R1.21119 CCNC(=O)CNC1CCCCCCCCC1 AIFCHEM-94590930962 [0,0,1,1,0,0|2,0,0]=4 670 B17R1.21186 CCOC(=O)CCNCC1CCCCCCC1 AIFCHEM-94592421505 [0,0,1,1,0,0|1,0,0]=3 671 B17R1.21317 CCOC(=O)CCCCCCN1CCSC1C AIFCHEM-94597268647 [0,0,1,1,0,0|2,0,0]=4 672 B17R1.25106 CCCCCNC1COCCC1C(=O)OCC AIFCHEM-94522653477 [0,0,1,1,0,0|2,0,0]=4 673 B17R1.1308 CCCCCCCCCCC(=O)N1CCSC1 AIFCHEM-5684333421 [0,0,1,1,0,0|2,0,0]=4 674 B17R1.1308 CCCCCCCCNCC(=O)N1CCCC1 AIFCHEM-6022903586 [0,0,1,1,0,0|2,0,0]=4 675 B17R1.1854 CCCCCC(=O)NCCOC1CCCCC1 AIFCHEM-94585546606 [0,0,1,1,0,0|2,0,0]=4 676 B17R1.26145 CCCCCCCCCCC(=O)NC1CCC1 AIFCHEM-5739393391 [0,0,1,1,0,0|1,0,0]=3 677 B17R1.26145 O=C(CCCCCCCCCO)NC1CCC1 AIFCHEM-5738778819 [0,0,1,1,0,0|2,0,0]=4 678 B17R1.26146 CCCCCCCCCCC(=O)NCC1CC1 AIFCHEM-94592475742 [0,0,1,1,0,0|1,0,0]=3 679 B17R1.26146 CCCCCCCCCNC(=O)CCC1CC1 AIFCHEM-6144458156 [0,0,1,1,0,0|1,0,0]=3 680 B17R1.26146 CCCCCCCCOCC(=O)NCC1CC1 AIFCHEM-94592482605 [0,0,1,1,0,0|2,0,0]=4 681 B17R1.26146 O=C(CCCCCCCCCO)NCC1CC1 AIFCHEM-94592477983 [0,0,1,1,0,0|2,0,0]=4 682 B17R1.26147 CCCCCCCCOCC(=O)N1CC[C@@H]1C AIFCHEM-5745087685 [0,0,1,1,0,0|2,0,0]=4 683 B17R1.26147 CCCCCCCCOCC(=O)N1CC[C@H]1C AIFCHEM-6275592834 [0,0,1,1,0,0|2,0,0]=4 684 B17R1.1287 CCCCCCNC(=O)CCC1CCCCC1 AIFCHEM-94575445929 [0,0,1,1,0,0|1,0,0]=3 685 B17R1.9267 CCCCCCCC(=O)N1CCCCC1CC AIFCHEM-5791468214 [0,0,1,1,0,0|1,0,0]=3 686 B17R1.9271 CCCCCCCC(=O)N1CCC[C@@H]1COC AIFCHEM-5938812844 [0,0,1,1,0,0|2,0,0]=4 687 B17R1.9271 CCCCCCCC(=O)N1CCC[C@H]1COC AIFCHEM-6119079483 [0,0,1,1,0,0|2,0,0]=4 688 B17R1.9274 CC1CCCCC1NC(=O)CCCCCCO AIFCHEM-5637135826 [0,0,1,1,0,0|2,0,0]=4 689 B17R1.9274 C[C@@H]1CCCC[C@@H]1NC(=O)CCCCCCO AIFCHEM-5814328195 [0,0,1,1,0,0|2,0,0]=4 690 B17R1.9274 C[C@H]1CCCC[C@H]1NC(=O)CCCCCCO AIFCHEM-94605793473 [0,0,1,1,0,0|2,0,0]=4 691 B17R1.66922 O=C(CCCCCCO)NC1CCCCCC1 AIFCHEM-5614895983 [0,0,1,1,0,0|2,0,0]=4 692 B17R1.347 COC(=O)CCCCN1CCCCC1CCO AIFCHEM-6418576155 [0,0,1,1,0,0|2,0,0]=4 693 B17R1.347 COC(=O)CCCCN1CCCC[C@@H]1CCO AIFCHEM-6512755376 [0,0,1,1,0,0|2,0,0]=4 694 B17R1.347 COC(=O)CCCCN1CCCC[C@H]1CCO AIFCHEM-94599263528 [0,0,1,1,0,0|2,0,0]=4 695 B17R1.1158 COC(=O)CCCCNCCN1CCCCC1 AIFCHEM-94531651302 [0,0,1,1,0,0|2,0,0]=4 696 B17R1.1338 COC(=O)CCCCCNC1CCCCC1O AIFCHEM-94571782698 [0,0,1,1,0,0|2,0,0]=4 697 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCCC[C@@H]1O AIFCHEM-6435769531 [0,0,1,1,0,0|2,0,0]=4 698 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCCC[C@H]1F AIFCHEM-5828480201 [0,0,1,1,0,0|2,0,0]=4 699 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCCC[C@H]1O AIFCHEM-6437588581 [0,0,1,1,0,0|2,0,0]=4 700 B17R1.1338 COC(=O)CCCCCN[C@H]1CCCC[C@@H]1O AIFCHEM-6444271672 [0,0,1,1,0,0|2,0,0]=4 701 B17R1.1338 COC(=O)CCCCCN[C@H]1CCCC[C@H]1O AIFCHEM-6490008957 [0,0,1,1,0,0|2,0,0]=4 702 B17R1.1420 CCC1CCCCN1CCCCCC(=O)OC AIFCHEM-5812151091 [0,0,1,1,0,0|1,0,0]=3 703 B17R1.4167 CCCCCCCN1CCC[C@H]1CC(=O)OC AIFCHEM-94589456826 [0,0,1,1,0,0|1,0,0]=3 704 B17R1.24374 COC(=O)CCCCCNCC1CCCN1C AIFCHEM-5717444915 [0,0,1,1,0,0|2,0,0]=4 705 B17R1.24374 COC(=O)CCCCCNC[C@@H]1CCCN1C AIFCHEM-5965451254 [0,0,1,1,0,0|2,0,0]=4 706 B17R1.24374 COC(=O)CCCCCNC[C@H]1CCCN1C AIFCHEM-5637932088 [0,0,1,1,0,0|2,0,0]=4 707 B17R1.24374 COC(=O)CCCCNCCC1CCCN1C AIFCHEM-6168296834 [0,0,1,1,0,0|2,0,0]=4 708 B17R1.27076 CCN1CCCC1CNCCCCC(=O)OC AIFCHEM-6240834518 [0,0,1,1,0,0|2,0,0]=4 709 B17R1.27076 CCN1CCC[C@H]1CNCCCCC(=O)OC AIFCHEM-6143921240 [0,0,1,1,0,0|2,0,0]=4 710 B17R1.1311 CC(=O)SCCCNCCCC1CCCCC1 AIFCHEM-94560867315 [0,0,1,1,0,0|1,1,0]=4 711 B17R1.1311 O=C(O)CCCCCCCNC1CCCOC1 AIFCHEM-94589549852 [0,0,1,1,0,0|2,0,0]=4 712 B17R1.1311 O=C(O)CCCCCCCN[C@@H]1CCCOC1 AIFCHEM-94588270536 [0,0,1,1,0,0|2,0,0]=4 713 B17R1.1311 O=C(O)CCCCCCCN[C@H]1CCCOC1 AIFCHEM-6135989416 [0,0,1,1,0,0|2,0,0]=4 714 B17R1.1311 O=C(O)NCCCCCCNC1CCCCC1 AIFCHEM-94538178921 [0,0,1,1,0,0|2,0,0]=4 715 B17R1.1411 CCC1CCCC1NCCCCCCC(=O)O AIFCHEM-5738088599 [0,0,1,1,0,0|1,0,0]=3 716 B17R1.1411 O=C(O)CCCCCCCN1CCCC1CO AIFCHEM-6492636157 [0,0,1,1,0,0|2,0,0]=4 717 B17R1.1411 O=C(O)CCCCCCCN1CCC[C@@H]1CO AIFCHEM-6466275171 [0,0,1,1,0,0|2,0,0]=4 718 B17R1.1411 O=C(O)CCCCCCCN1CCC[C@H]1CO AIFCHEM-6411430079 [0,0,1,1,0,0|2,0,0]=4 719 B17R1.1419 CCC1CCCCC1NCCCCCC(=O)O AIFCHEM-5896035644 [0,0,1,1,0,0|1,0,0]=3 720 B17R1.1419 CCC1CCCCC1NCCCCNC(=O)C AIFCHEM-94585140536 [0,0,1,1,0,0|2,0,0]=4 721 B17R1.1503 CCCCCC1CCCC1NCCOC(=O)C AIFCHEM-94555810581 [0,0,1,1,0,0|1,0,0]=3 722 B17R1.4165 CCCCCCCN1CCCC1CCC(=O)O AIFCHEM-94600406047 [0,0,1,1,0,0|1,0,0]=3 723 B17R1.5251 CCCCCCCCCN1CCCC1C(=O)O AIFCHEM-6145005453 [0,0,1,1,0,0|1,0,0]=3 724 B17R1.5251 CCCCCCCCCN1CCC[C@@H]1C(=O)O AIFCHEM-6007823584 [0,0,1,1,0,0|1,0,0]=3 725 B17R1.5251 CCCCCCCCCN1CCC[C@H]1C(=O)O AIFCHEM-94570457763 [0,0,1,1,0,0|1,0,0]=3 726 B17R1.5251 CCCCCCCCCN1COCC1C(=O)O AIFCHEM-94604006060 [0,0,1,1,0,0|2,0,0]=4 727 B17R1.5251 CCCCCCCCN[C@@H]1CCC[C@H]1C(=O)O AIFCHEM-6221911439 [0,0,1,1,0,0|1,0,0]=3 728 B17R1.6307 O=C(O)CCCCCCCCN1CC[C@@H]1CO AIFCHEM-94554356790 [0,0,1,1,0,0|2,0,0]=4 729 B17R1.6307 O=C(O)CCCCCCCCN1CC[C@H]1CO AIFCHEM-94538001654 [0,0,1,1,0,0|2,0,0]=4 730 B17R1.7901 CCCCCCCCN1CCCCC1C(=O)N AIFCHEM-94559973119 [0,0,1,1,0,0|2,0,0]=4 731 B17R1.9279 O=C(O)CCCCCCCNCC1CCCC1 AIFCHEM-6138570322 [0,0,1,1,0,0|1,0,0]=3 732 B17R1.9279 O=C(O)CCCCCCCNCC1CCOC1 AIFCHEM-94557844681 [0,0,1,1,0,0|2,0,0]=4 733 B17R1.9279 O=C(O)CCCCCCCNC[C@@H]1CCOC1 AIFCHEM-94530322223 [0,0,1,1,0,0|2,0,0]=4 734 B17R1.9279 O=C(O)CCCCCCCNC[C@H]1CCOC1 AIFCHEM-6066046704 [0,0,1,1,0,0|2,0,0]=4 735 B17R1.11118 C[C@@H]1C[C@H]1CNCCCCCCCCC(=O)O AIFCHEM-94599416257 [0,0,1,1,0,0|1,0,0]=3 736 B17R1.11118 C[C@@H]1C[C@H]1NCCCCCCCCCC(=O)O AIFCHEM-94559009862 [0,0,1,1,0,0|1,0,0]=3 737 B17R1.11118 O=C(O)CCCCCCCCCNC1CC1F AIFCHEM-5830733166 [0,0,1,1,0,0|2,0,0]=4 738 B17R1.11118 O=C(O)CCCCCCCCCN[C@@H]1C[C@@H]1F AIFCHEM-6032314730 [0,0,1,1,0,0|2,0,0]=4 739 B17R1.11118 O=C(O)CCCCCCCCCN[C@@H]1C[C@H]1F AIFCHEM-5830873828 [0,0,1,1,0,0|2,0,0]=4 740 B17R1.11118 O=C(O)CCCCCCCCCN[C@H]1C[C@@H]1F AIFCHEM-6045572005 [0,0,1,1,0,0|2,0,0]=4 741 B17R1.14460 C[C@@H]1CCN1CCCCCCCCCC(=O)O AIFCHEM-6261220934 [0,0,1,1,0,0|1,0,0]=3 742 B17R1.14460 C[C@H]1CCN1CCCCCCCCCC(=O)O AIFCHEM-5740263141 [0,0,1,1,0,0|1,0,0]=3 743 B17R1.16345 O=C(O)CSCCNC1CCCCCCCC1 AIFCHEM-94535040672 [0,0,1,1,0,0|2,0,0]=4 744 B17R1.16396 O=C(O)CCCCCCCCCNC1CCC1 AIFCHEM-94576046630 [0,0,1,1,0,0|1,0,0]=3 745 B17R1.16396 O=C(O)CCCCCCCCCNC1COC1 AIFCHEM-5762625952 [0,0,1,1,0,0|2,0,0]=4 746 B17R1.16396 O=C(O)CCCCCCCCCNC1CSC1 AIFCHEM-5980522185 [0,0,1,1,0,0|2,0,0]=4 747 B17R1.16396 O=C(O)CCCCCCCCNCC1CCC1 AIFCHEM-5698502641 [0,0,1,1,0,0|1,0,0]=3 748 B17R1.16396 O=C(O)CCCCCCCCNCC1CCO1 AIFCHEM-94567676349 [0,0,1,1,0,0|2,0,0]=4 749 B17R1.16396 O=C(O)CCCCCCCCNCC1COC1 AIFCHEM-5895939297 [0,0,1,1,0,0|2,0,0]=4 750 B17R1.16396 O=C(O)CCCCCCCCNC[C@@H]1CCO1 AIFCHEM-5863792736 [0,0,1,1,0,0|2,0,0]=4 751 B17R1.16396 O=C(O)CCCCCCCCNC[C@H]1CCO1 AIFCHEM-5695310149 [0,0,1,1,0,0|2,0,0]=4 752 B17R1.16477 O=C(O)CCCCCCCCCNCC1CC1 AIFCHEM-6187148399 [0,0,1,1,0,0|1,0,0]=3 753 B17R1.16477 O=C(O)CCCCCCCCNCCC1CC1 AIFCHEM-5764018542 [0,0,1,1,0,0|1,0,0]=3 754 B17R1.103159 CC(=O)NCCCCCNC1CCCCCC1 AIFCHEM-94529602800 [0,0,1,1,0,0|2,0,0]=4 755 B17R1.29773 CCCCCCCCCCCC(=O)N1CCC1 AIFCHEM-94536655398 [0,0,1,1,0,0|1,0,0]=3 756 B17R1.29775 CCCCCCCCCCCC(=O)NC1CC1 AIFCHEM-94536652616 [0,0,1,1,0,0|1,0,0]=3 757 B17R1.29775 CCCCCCCCCNCC(=O)NC1CC1 AIFCHEM-6153667366 [0,0,1,1,0,0|2,0,0]=4 758 B17R1.29775 O=C(CCCCCCCCCCO)NC1CC1 AIFCHEM-94573324486 [0,0,1,1,0,0|2,0,0]=4 759 B17R1.30208 CCCOC(=O)CNCC1CCCCCCC1 AIFCHEM-94592414278 [0,0,1,1,0,0|1,0,0]=3 760 B17R1.754 CCCCCCCNCC(=O)N1CCCCC1 AIFCHEM-94589460177 [0,0,1,1,0,0|2,0,0]=4 761 B17R1.1484 CCCCCCCCCC(=O)NC1CCCC1 AIFCHEM-94542384717 [0,0,1,1,0,0|1,0,0]=3 762 B17R1.1484 O=C(CCCCCCCCO)NC1CCCC1 AIFCHEM-94542385068 [0,0,1,1,0,0|2,0,0]=4 763 B17R1.5106 CCCCCCC(=O)N1CCCCC1COC AIFCHEM-94586944246 [0,0,1,1,0,0|2,0,0]=4 764 B17R1.6494 CCCCCCC(=O)NCCC1CCCN1C AIFCHEM-94521988868 [0,0,1,1,0,0|2,0,0]=4 765 B17R1.6511 CCCCCCC(=O)NC1CCCCC1OC AIFCHEM-94521988347 [0,0,1,1,0,0|2,0,0]=4 766 B17R1.18502 CC1CCCN1C(=O)CCCCCCCCO AIFCHEM-5729232469 [0,0,1,1,0,0|2,0,0]=4 767 B17R1.18502 CCCCCCCCNC(=O)C1CCCC1C AIFCHEM-5823754564 [0,0,1,1,0,0|1,0,0]=3 768 B17R1.18502 C[C@@H]1CCCN1C(=O)CCCCCCCCO AIFCHEM-6052111635 [0,0,1,1,0,0|2,0,0]=4 769 B17R1.18502 C[C@H]1CCCN1C(=O)CCCCCCCCO AIFCHEM-94569873188 [0,0,1,1,0,0|2,0,0]=4 770 B17R1.29613 CCCCCCCCNC(=O)CCC1CCC1 AIFCHEM-94578170605 [0,0,1,1,0,0|1,0,0]=3 771 B17R1.29614 CCCCCCCCCC(=O)NCCC1CC1 AIFCHEM-5697936640 [0,0,1,1,0,0|1,0,0]=3 772 B17R1.29614 CCCCCCCCOC(=O)CNCC1CC1 AIFCHEM-5590482716 [0,0,1,1,0,0|1,0,0]=3 773 B17R1.29614 O=C(CCCCCCCCO)NCCC1CC1 AIFCHEM-5764158021 [0,0,1,1,0,0|2,0,0]=4 774 B17R1.40210 CCCCCCC(=O)N1CCCCCCCC1 AIFCHEM-94559695346 [0,0,1,1,0,0|1,0,0]=3