0 B13R0.1398 C=C(C)CCC[C@@H](C)CCOC(=O)C CNP0240009.1 [0,0,0,0,0,0|0,0,4]=4 1 B13R0.1398 C=C(C)OCC=C(C)CCC=C(C)C CNP0265101.0 [0,0,0,0,0,0|1,0,0]=1 2 B13R0.1398 CC(=CCC/C(=C/CC[C@@H](C)O)/C)C CNP0168723.1 [0,0,0,0,0,0|1,0,2]=3 3 B13R0.1398 CC(=CCC/C(=C/CC[C@H](C)O)/C)C CNP0168723.2 [0,0,0,0,0,0|1,0,2]=3 4 B13R0.1398 CC(=CCCC(=CCCC(=O)O)C)C CNP0587564.0 [0,0,0,0,0,0|2,0,0]=2 5 B13R0.1398 CC(=CCCC(=CCN=C(N)N)C)C CNP0166436.0 [0,0,0,0,0,0|3,0,0]=3 6 B13R0.1398 CC(=CCCC(=CCNC(=N)N)C)C CNP0537532.0 [0,0,0,0,0,0|3,0,0]=3 7 B13R0.1398 CC(=CCCC(C)CCCC(=O)O)C CNP0536242.0 [0,0,0,0,0,0|2,0,2]=4 8 B13R0.1398 CC(=O)C=CC=C(C)CCC=C(C)C CNP0137850.0 [0,0,0,0,0,0|1,0,1]=2 9 B13R0.1398 CC(=O)C=CC=C(C)CCCC(C)C CNP0076086.0 [0,0,0,0,0,0|1,0,3]=4 10 B13R0.1398 CC(=O)CCC=C(C)CCC=C(C)C CNP0288544.0 [0,0,0,0,0,0|1,0,0]=1 11 B13R0.1398 CC(=O)CCCC(C)CCC=C(C)C CNP0351132.0 [0,0,0,0,0,0|1,0,2]=3 12 B13R0.1398 CC(=O)OCC=C(C)CCC=C(C)C CNP0301697.0 [0,0,0,0,0,0|0,0,0]=0 13 B13R0.1398 CC(=O)OCC[C@@H](C)CCC=C(C)C CNP0277078.2 [0,0,0,0,0,0|0,0,2]=2 14 B13R0.1398 CC(=O)OCC[C@@H](C)CCCC(C)C CNP0292341.1 [0,0,0,0,0,0|0,0,4]=4 15 B13R0.1398 CC(=O)OCC[C@H](C)CCC=C(C)C CNP0277078.1 [0,0,0,0,0,0|0,0,2]=2 16 B13R0.1398 CC(=O)OCC[C@H](C)CCCC(C)C CNP0292341.2 [0,0,0,0,0,0|0,0,4]=4 17 B12R0.233 C=COCC=C(C)CCC=C(C)C CNP0076773.0 [1,0,0,0,0,0|0,0,1]=2 18 B12R0.233 CC(=CCCC(=CCOC=O)C)C CNP0394032.0 [1,0,0,0,0,0|0,0,0]=1 19 B12R0.233 CC(=CCC[C@@H](C)CCOC=O)C CNP0301531.2 [1,0,0,0,0,0|0,0,2]=3 20 B12R0.233 CC(=CCC[C@H](C)CCOC=O)C CNP0301531.1 [1,0,0,0,0,0|0,0,2]=3 21 B14R0.222 C=C(C)C(=O)CCC(=CCOC(=O)C)C CNP0300729.0 [0,1,0,0,0,0|0,0,1]=2 22 B14R0.222 C=C(C)[C@@H](O)CC/C(=C/COC(=O)C)/C CNP0280561.1 [0,1,0,0,0,0|0,0,2]=3 23 B14R0.222 C=C(C)[C@H](O)CC/C(=C/COC(=O)C)/C CNP0280561.2 [0,1,0,0,0,0|0,0,2]=3 24 B14R0.222 C=C(CCC(=CCCC(=O)C)C)C(C)C CNP0209165.0 [0,1,0,0,0,0|1,0,1]=3 25 B14R0.304 C=C(CC)CCC=C(C)CCC=C(C)C CNP0605448.0 [0,1,0,0,0,0|2,0,0]=3 26 B14R0.304 C=CC(=C)CCC=C(C)CCC=C(C)C CNP0242426.0 [0,1,0,0,0,0|2,0,1]=4 27 B14R0.304 C=CC(=CCC=C(C)CCC=C(C)C)C CNP0220187.0 [0,1,0,0,0,0|2,0,0]=3 28 B14R0.304 C=C[C@@H](C)CC/C=C(\C)/CCC=C(C)C CNP0363934.1 [0,1,0,0,0,0|2,0,1]=4 29 B14R0.304 CC(=CCC/C(=C/CC[C@H](C)C=O)/C)C CNP0211191.1 [0,1,0,0,0,0|1,0,1]=3 30 B14R0.304 CC(=CCCC(=CCCC(C)CO)C)C CNP0520856.0 [0,1,0,0,0,0|1,0,2]=4 31 B14R0.304 CC(=CCC[C@H](C)/C=C/C=C(\C)/C=O)C CNP0250475.1 [0,1,0,0,0,0|1,0,2]=4 32 B14R0.304 CC(=O)OCC=C(C)CCC=C(C)CO CNP0518371.0 [0,1,0,0,0,0|0,0,0]=1 33 B14R0.304 CC=C(C)C=CC=C(C)CCC=C(C)C CNP0293472.0 [0,1,0,0,0,0|2,0,1]=4 34 B14R0.304 CC=C(C)CCC=C(C)CCC=C(C)C CNP0154379.0 [0,1,0,0,0,0|2,0,0]=3 35 B14R0.304 CCC(=O)OCC=C(C)CCC=C(C)C CNP0223801.0 [0,1,0,0,0,0|0,0,0]=1 36 B14R0.304 CCC(=O)OCC[C@H](C)CCC=C(C)C CNP0196713.1 [0,1,0,0,0,0|0,0,2]=3 37 B14R0.426 CC(=O)CCC=C(C)CC(=O)C=C(C)C CNP0179349.0 [0,1,0,0,0,0|1,0,1]=3 38 B14R0.426 CC(=O)OC(C)C=C(C)CCC=C(C)C CNP0003285.0 [0,1,0,0,0,0|0,0,0]=1 39 B14R0.426 CC(=O)OC(O)CC(C)CCC=C(C)C CNP0546886.0 [0,1,0,0,0,0|0,0,2]=3 40 B14R0.1421 CC(=CCC(=O)C(=CCCC(=O)O)C)C CNP0510155.0 [0,1,0,0,0,0|2,0,1]=4 41 B14R0.1421 CC(=O)CCC=C(C)C(O)CC=C(C)C CNP0143486.0 [0,1,0,0,0,0|1,0,0]=2 42 B14R0.1421 CC(=O)OCC=C(C)C(=O)CC=C(C)C CNP0317671.0 [0,1,0,0,0,0|0,0,1]=2 43 B14R0.2691 CC(=CCCC(=CCOP(=O)(O)O)C)C CNP0419716.0 [0,1,0,0,0,0|2,0,0]=3 44 B14R0.2691 CC(=O)CCC=C(C)CC=CC(C)(C)O CNP0165322.0 [0,1,0,0,0,0|1,0,2]=4 45 B14R0.2691 CC(=O)OCC=C(C)CC=CC(C)(C)O CNP0312171.0 [0,1,0,0,0,0|0,0,2]=3 46 B14R1.164 CC(=O)O[C@H]1C=C(CC[C@@H]1C(C)C)C CNP0076193.2 [0,0,0,1,0,0|0,0,2]=3 47 B14R1.164 CC(=O)O[C@H]1C=C(CC[C@H]1C(C)C)C CNP0076193.1 [0,0,0,1,0,0|0,0,2]=3 48 B14R1.4447 C=C(C)[C@@H]1CCC(=C1CCC(=O)C)C CNP0215490.2 [0,0,0,1,0,0|1,0,2]=4 49 B14R1.4447 C=C(C)[C@H]1CCC(=C1CCC(=O)C)C CNP0215490.1 [0,0,0,1,0,0|1,0,2]=4 50 B14R1.5977 CC(=O)CCC1=C(CCCC1(C)C)C CNP0289751.0 [0,0,0,1,0,0|1,0,2]=4 51 B14R1.5977 CC(=O)OCC1=C(CCCC1(C)C)C CNP0088009.0 [0,0,0,1,0,0|0,0,2]=3 52 B14R1.14223 CC1=CCOC(=O)CC=C(CCC1)C CNP0259995.0 [0,0,0,1,0,0|0,0,2]=3 53 B14R1.14223 CC1=CCOC(=O)CCC(=CCC1)C CNP0322424.0 [0,0,0,1,0,0|0,0,0]=1 54 B12R0.44 CC(=CCCC(=CC=C(Br)Br)C)C CNP0081219.0 [0,0,0,0,1,0|2,0,1]=4 55 B12R0.44 CC(=CCCC(=NNC(=O)N)C)C CNP0123715.0 [0,0,0,0,1,0|3,0,0]=4 56 B12R0.44 CC(=CCCC(C)CCC(=O)O)C CNP0572331.0 [0,0,0,0,1,0|1,0,2]=4 57 B12R0.44 CC(=O)CC=C(C)CCC=C(C)C CNP0460160.0 [0,0,0,0,1,0|0,0,0]=1 58 B12R0.44 CC(=O)OC=C(C)CCC=C(C)C CNP0086373.0 [0,0,0,0,1,0|0,0,0]=1 59 B12R0.44 CC(=O)OCC=C(C)COC(=O)C CNP0165891.0 [0,0,0,0,1,0|2,0,0]=3 60 B14R0.67 CC(=CCCC(=CCNCC(C)C)C)C CNP0364609.0 [0,0,0,0,0,1|2,0,1]=4 61 B14R0.67 CC(=CCCC(=CCOCC(C)C)C)C CNP0426391.0 [0,0,0,0,0,1|1,0,1]=3 62 B14R0.67 CC(=CCCC=C(C)CCC=C(C)C)C CNP0126829.0 [0,0,0,0,0,1|2,0,0]=3 63 B11R0.147 CC(=CCCC(=CCCO)C)C CNP0346393.0 [2,0,0,0,0,0|0,0,2]=4 64 B11R0.147 COCC=C(C)CCC=C(C)C CNP0517198.0 [2,0,0,0,0,0|0,0,0]=2 65 B11R0.148 C=CCCCC=CCOC(=O)C CNP0076931.0 [2,0,0,0,0,0|0,0,2]=4 66 B11R0.148 CC=CCCC=CCCC(=O)O CNP0199986.0 [2,0,0,0,0,0|2,0,0]=4 67 B11R0.148 CCCCCC=CCOC(=O)C CNP0255180.0 [2,0,0,0,0,0|0,0,2]=4 68 B13R0.1 CC(=CCCC(C)CCOCC=O)C CNP0218068.0 [1,1,0,0,0,0|0,0,2]=4 69 B13R0.331 CCOC(=O)C=C(C)CCC=C(C)C CNP0190103.0 [1,1,0,0,0,0|0,0,2]=4 70 B13R0.208 C=CC(=CCC=C(C)COC(=O)C)C CNP0002622.0 [0,1,0,0,1,0|0,0,2]=4 71 B13R0.444 C=C(C)[C@H](O)C/C(=C/COC(=O)C)/C CNP0401232.1 [0,1,0,0,1,0|0,0,1]=3 72 B13R0.1403 CC(=O)O[C@@H](C)[C@H](C)CCC=C(C)C CNP0321482.1 [0,1,0,0,1,0|0,0,1]=3 73 B15R0.246 CC(=CCCC(=CCCC=C(C)CO)C)C CNP0534184.0 [0,1,0,0,0,1|1,0,1]=4 74 B15R0.2722 CC(=CCCC(=CCOC(=O)C(C)C)C)C CNP0120961.0 [0,1,0,0,0,1|1,0,1]=4 75 B15R0.1697 C=CC(=C(C)CC=C(C)CCC=C(C)C)C CNP0200332.0 [0,2,0,0,0,0|2,0,0]=4 76 B15R0.2547 C=C(C)[C@H](CC/C(=C/COC(=O)C)/C)OO CNP0331300.1 [0,2,0,0,0,0|0,0,2]=4 77 B15R0.2547 C=C(C)[C@H](CO)C/C=C(/C)\CCC=C(C)C CNP0076913.2 [0,2,0,0,0,0|2,0,0]=4 78 B15R0.2547 C=C(C)[C@H](CO)C/C=C(\C)/CCC=C(C)C CNP0076913.1 [0,2,0,0,0,0|2,0,0]=4 79 B15R0.2547 CC(=CCCC(=CCC(=C(C)C)C=O)C)C CNP0214658.0 [0,2,0,0,0,0|2,0,0]=4 80 B15R0.110 C=C(CCO)CCC=C(C)CCC=C(C)C CNP0496474.0 [0,2,0,0,0,0|2,0,0]=4 81 B15R0.110 C=CC=C(C)CCC=C(C)CCC=C(C)C CNP0247164.0 [0,2,0,0,0,0|2,0,0]=4 82 B15R0.110 CC(=CCCC(=CC=CC(=CC=O)C)C)C CNP0076912.0 [0,2,0,0,0,0|1,0,1]=4 83 B15R0.110 CC(=CCCC(=CCCC(=CC=O)C)C)C CNP0146703.0 [0,2,0,0,0,0|1,0,0]=3 84 B15R0.110 CC(=CCCC(=CCCC(=CCN)C)C)C CNP0200461.0 [0,2,0,0,0,0|2,0,0]=4 85 B15R0.110 CC(=CCCC(=CCCC(=CCO)C)C)C CNP0232612.0 [0,2,0,0,0,0|1,0,1]=4 86 B15R0.110 CCCC(=O)OCC=C(C)CCC=C(C)C CNP0260151.0 [0,2,0,0,0,0|0,0,0]=2 87 B15R0.110 CCCC(=O)OCC[C@H](C)CCC=C(C)C CNP0359188.1 [0,2,0,0,0,0|0,0,2]=4 88 B15R0.331 CC(=O)OCC=C(C)CC=CC(C)(C)OO CNP0138010.0 [0,2,0,0,0,0|0,0,2]=4 89 B15R0.2075 C=CC(=CCC=C(CC)CCC=C(C)C)C CNP0284336.0 [0,2,0,0,0,0|2,0,0]=4 90 B15R0.3302 CCC(=O)OCC(=C(C)CCC=C(C)C)C CNP0546330.0 [0,2,0,0,0,0|0,0,0]=2 91 B15R1.5468 CC(=CCCC(=CC1OCC(O1)C)C)C CNP0002830.0 [0,0,0,1,0,1|0,0,2]=4 92 B15R1.6620 CC(=O)[C@@H]1CCC=C([C@H]1CC=C(C)C)C CNP0233027.1 [0,0,0,1,0,1|1,0,0]=3 93 B15R1.9000 CC(=O)[C@@H]1CCC=C(C1)CCC=C(C)C CNP0300778.1 [0,0,0,1,0,1|1,0,0]=3 94 B15R1.29090 CC1=CCCC=C(CC(=C(C)C)CC1)C CNP0025367.0 [0,0,0,1,0,1|2,0,0]=4 95 B15R1.31249 CC(=O)OC/C=C(\C)/CC[C@H]1OC1(C)C CNP0333202.1 [0,0,0,1,0,1|0,0,2]=4 96 B15R1.41808 CC(=O)OCC1OC1(C)CCC=C(C)C CNP0609956.0 [0,0,0,1,0,1|0,0,2]=4 97 B15R1.876 CC(=O)[C@H]1CC=C([C@@H](C1)CC=C(C)C)C CNP0227023.1 [0,1,0,1,0,0|1,0,0]=3 98 B15R1.1080 CC(=O)[C@H]1CC=C(CC1)CCC=C(C)C CNP0217929.1 [0,1,0,1,0,0|1,0,0]=3 99 B15R1.8434 CC(=O)OCC1=C(CC[C@H](C1(C)C)C)C CNP0314930.1 [0,1,0,1,0,0|0,0,2]=4 100 B15R1.25488 C=C(C)[C@@H]1C/C=C(/CC/C=C(/CC1)\C)\C CNP0169677.6 [0,1,0,1,0,0|2,0,0]=4 101 B15R1.25488 C=C(C)[C@@H]1C/C=C(/CC/C=C(\CC1)/C)\C CNP0169677.2 [0,1,0,1,0,0|2,0,0]=4 102 B15R1.25488 C=C(C)[C@@H]1C/C=C(\CC/C=C(/CC1)\C)/C CNP0169677.4 [0,1,0,1,0,0|2,0,0]=4 103 B15R1.25488 C=C(C)[C@@H]1C/C=C(\CC/C=C(\CC1)/C)/C CNP0169677.1 [0,1,0,1,0,0|2,0,0]=4 104 B15R1.25488 C=C(C)[C@H]1C/C=C(/CC/C=C(\CC1)/C)\C CNP0169677.5 [0,1,0,1,0,0|2,0,0]=4 105 B15R1.25488 C=C(C)[C@H]1C/C=C(\CC/C=C(/CC1)\C)/C CNP0169677.3 [0,1,0,1,0,0|2,0,0]=4 106 B15R1.25488 C=C(C)[C@H]1C/C=C(\CC/C=C(\CC1)/C)/C CNP0169677.7 [0,1,0,1,0,0|2,0,0]=4 107 B15R1.25488 CC1=CCC(=C(C)C)CCC(=CCC1)C CNP0176906.0 [0,1,0,1,0,0|2,0,0]=4 108 B15R1.25586 CC1=CCC(C(=O)CCC(=CCC1)C)C CNP0537370.0 [0,1,0,1,0,0|1,0,0]=3 109 B15R1.882 CC(=CC/C=C(/C)\[C@@H]1CC=C(CC1)C)C CNP0266750.3 [0,1,0,1,0,0|2,0,0]=4 110 B15R1.882 CC(=CC/C=C(/C)\[C@H]1CC=C(CC1)C)C CNP0266750.4 [0,1,0,1,0,0|2,0,0]=4 111 B15R1.882 CC(=CC/C=C(\C)/[C@@H]1CC=C(CC1)C)C CNP0266750.1 [0,1,0,1,0,0|2,0,0]=4 112 B15R1.882 CC(=CC/C=C(\C)/[C@H]1CC=C(CC1)C)C CNP0266750.5 [0,1,0,1,0,0|2,0,0]=4 113 B15R1.882 CC(=CCC=C(C)[C@H]1CC=C(CC1)C)C CNP0266750.2 [0,1,0,1,0,0|2,0,0]=4 114 B15R1.882 CC(=CCCC(=C1CC=C(CC1)C)C)C CNP0126761.0 [0,1,0,1,0,0|2,0,0]=4 115 B15R1.25606 C=C1CC/C=C(\CCC=C(C[C@H]1O)C)/C CNP0104366.1 [0,1,0,1,0,0|2,0,0]=4 116 B15R1.8400 C=C(C)[C@@H]1C[C@H](C(=C[C@@H]1OC(=O)C)C)O CNP0309927.1 [0,1,0,1,0,0|0,0,2]=4 117 B15R2.9809 CC(=O)O[C@@H]1C=C([C@@H]2C[C@H]1C2(C)C)C CNP0076761.2 [0,0,0,2,0,0|0,0,2]=4 118 B15R2.9809 CC(=O)O[C@H]1C=C(C2CC1C2(C)C)C CNP0076761.1 [0,0,0,2,0,0|0,0,2]=4 119 B15R2.9809 CC(=O)O[C@H]1C=C([C@@H]2C[C@H]1C2(C)C)C CNP0076761.3 [0,0,0,2,0,0|0,0,2]=4 120 B15R2.9809 CC(=O)O[C@H]1C=C([C@H]2C[C@@H]1C2(C)C)C CNP0076761.4 [0,0,0,2,0,0|0,0,2]=4 121 B11R0.6 CC(=CCC=C(C)CC(=O)O)C CNP0143090.0 [0,0,0,0,2,0|1,0,1]=4 122 B11R0.6 CC(=CCCC(=CC(=O)O)C)C CNP0281881.0 [0,0,0,0,2,0|1,0,0]=3 123 B11R0.6 CC(=CCCC(=CC(C)O)C)C CNP0116095.0 [0,0,0,0,2,0|0,0,2]=4 124 B11R0.6 CC(=CCC[C@@H](C)CC(=O)O)C CNP0402865.1 [0,0,0,0,2,0|1,0,1]=4 125 B11R0.6 CC(=CCC[C@H](C)CC(=O)O)C CNP0402865.2 [0,0,0,0,2,0|1,0,1]=4 126 B11R0.6 CC(=O)C=C(C)CCC=C(C)C CNP0003286.0 [0,0,0,0,2,0|0,0,0]=2 127 B11R0.6 CC(=O)CC(=CCC=C(C)C)C CNP0372207.0 [0,0,0,0,2,0|0,0,1]=3 128 B11R0.6 CC(=O)OC(=CCC=C(C)C)C CNP0434676.0 [0,0,0,0,2,0|0,0,1]=3 129 B11R0.6 CC(=O)O[C@@H](C)CCC=C(C)C CNP0306070.1 [0,0,0,0,2,0|0,0,1]=3 130 B11R0.6 CC(=O)O[C@H](C)CCC=C(C)C CNP0306070.2 [0,0,0,0,2,0|0,0,1]=3 131 B15R0.221 CC(=O)OCCCC=C(C)CCC=C(C)C CNP0259458.0 [0,0,0,0,0,2|0,0,0]=2