0 B9R0.35 C/C=C/[C@H](C)C(=O)OCC CNP0248214.1 [0,0,0,0,0,0|0,0,2]=2 1 B9R0.35 C=C=CC(C)C(=O)OCC CNP0002840.0 [0,0,0,0,0,0|0,0,2]=2 2 B9R0.35 C=CCC(C)C(=O)OCC CNP0139800.0 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.35 CCC=C(C)C(=O)OCC CNP0154719.0 [0,0,0,0,0,0|0,0,4]=4 4 B9R0.35 CCCC(=O)C(O)CCC CNP0003366.0 [0,0,0,0,0,0|2,0,2]=4 5 B9R0.35 CCC[C@H](C)C(=O)OCC CNP0333238.1 [0,0,0,0,0,0|0,0,2]=2 6 B9R0.35 CCOC(=O)C(C)SSC CNP0103429.0 [0,0,0,0,0,0|2,0,1]=3 7 B8R0.1 C=CCC(O)CCCC CNP0566566.0 [1,0,0,0,0,0|2,0,1]=4 8 B8R0.1 C=CCCC(=O)OCC CNP0003358.0 [1,0,0,0,0,0|0,0,0]=1 9 B8R0.1 C=CCC[C@@H](O)CCC CNP0196626.2 [1,0,0,0,0,0|1,0,2]=4 10 B8R0.1 C=CCC[C@H](O)CCC CNP0196626.1 [1,0,0,0,0,0|1,0,2]=4 11 B8R0.1 C=CCOC(=O)C=CC CNP0018156.0 [1,0,0,0,0,0|2,0,1]=4 12 B8R0.1 C=CCOC(=O)CCC CNP0002468.0 [1,0,0,0,0,0|2,0,0]=3 13 B8R0.1 CCCCC(=O)CCC CNP0094009.0 [1,0,0,0,0,0|1,0,2]=4 14 B8R0.1 CCCCC(=O)OCC CNP0305309.0 [1,0,0,0,0,0|0,0,2]=3 15 B8R0.1 CCOC(=O)CCC=O CNP0576338.0 [1,0,0,0,0,0|1,0,0]=2 16 B8R0.1 CCOC(=O)CCCO CNP0364509.0 [1,0,0,0,0,0|1,0,1]=3 17 B8R0.1 CCOC(=O)CCSC CNP0199051.0 [1,0,0,0,0,0|1,0,1]=3 18 B8R0.3 C/C=C/C(=O)[C@@H](C)CC CNP0293827.1 [1,0,0,0,0,0|1,0,2]=4 19 B8R0.3 C/C=C/C(=O)[C@H](C)CC CNP0293827.2 [1,0,0,0,0,0|1,0,2]=4 20 B8R0.3 C=CCC(C)C(=O)CC CNP0611593.0 [1,0,0,0,0,0|0,0,0]=1 21 B8R0.3 CC=C(C)C(=O)OCC CNP0316393.0 [1,0,0,0,0,0|0,0,2]=3 22 B8R0.3 CCCC(=O)C(C)CC CNP0595391.0 [1,0,0,0,0,0|1,0,1]=3 23 B8R0.3 CCC[C@@H](C)C(=O)CC CNP0243373.2 [1,0,0,0,0,0|0,0,2]=3 24 B8R0.3 CCC[C@H](C)C(=O)CC CNP0243373.1 [1,0,0,0,0,0|0,0,2]=3 25 B8R0.3 CCC[C@H](C)C(=O)OC CNP0002914.1 [1,0,0,0,0,0|0,0,2]=3 26 B8R0.3 CCOC(=O)C(=CBr)Br CNP0179684.0 [1,0,0,0,0,0|2,0,1]=4 27 B8R0.3 CCOC(=O)C(=CI)I CNP0386420.0 [1,0,0,0,0,0|2,0,1]=4 28 B8R0.3 CCOC(=O)C(=NO)C CNP0380826.0 [1,0,0,0,0,0|2,0,1]=4 29 B8R0.3 CCOC(=O)C(=O)CC CNP0506120.0 [1,0,0,0,0,0|1,0,2]=4 30 B8R0.3 CCOC(=O)[C@@H](C)C=O CNP0028245.1 [1,0,0,0,0,0|1,0,0]=2 31 B8R0.3 CCOC(=O)[C@@H](C)CC CNP0105613.2 [1,0,0,0,0,0|0,0,1]=2 32 B8R0.3 CCOC(=O)[C@@H](N)CO CNP0522179.2 [1,0,0,0,0,0|2,0,0]=3 33 B8R0.3 CCOC(=O)[C@@H](N)CS CNP0398806.2 [1,0,0,0,0,0|2,0,0]=3 34 B8R0.3 CCOC(=O)[C@H](C)CC CNP0105613.1 [1,0,0,0,0,0|0,0,1]=2 35 B8R0.3 CCOC(=O)[C@H](N)CO CNP0522179.1 [1,0,0,0,0,0|2,0,0]=3 36 B8R0.3 CCOC(=O)[C@H](O)C#N CNP0342133.1 [1,0,0,0,0,0|2,0,1]=4 37 B8R0.3 CNC[C@@H](C)C(=O)OC CNP0198050.1 [1,0,0,0,0,0|1,0,1]=3 38 B8R0.3 COC[C@@H](N)C(=O)OC CNP0591691.1 [1,0,0,0,0,0|2,0,1]=4 39 B8R0.3 COC[C@H](N)C(=O)OC CNP0591691.2 [1,0,0,0,0,0|2,0,1]=4 40 B10R0.19 CCCCC(=O)[C@@H](C)CCC CNP0177247.2 [0,1,0,0,0,0|1,0,2]=4 41 B10R0.19 CCCCC(=O)[C@H](C)CCC CNP0177247.1 [0,1,0,0,0,0|1,0,2]=4 42 B10R0.19 CCCCC(O)C(=O)OCC CNP0612227.0 [0,1,0,0,0,0|1,0,2]=4 43 B10R0.19 CCCC[C@H](Br)C(=O)OCC CNP0154903.1 [0,1,0,0,0,0|1,0,2]=4 44 B10R0.19 CCOC(=O)[C@@H](N)CCSC CNP0177391.1 [0,1,0,0,0,0|1,0,2]=4 45 B10R0.32 CCOC(=O)[C@@H](N)CC(C)C CNP0332739.1 [0,1,0,0,0,0|1,0,2]=4 46 B10R0.32 CCOC(=O)[C@@H](O)CC(C)C CNP0389022.1 [0,1,0,0,0,0|1,0,2]=4 47 B10R0.32 CCOC(=O)[C@H](C)C[C@H](C)O CNP0280330.1 [0,1,0,0,0,0|0,0,2]=3 48 B10R0.32 CCOC(=O)[C@H](C)OC(=O)C CNP0114784.1 [0,1,0,0,0,0|1,0,1]=3 49 B10R0.35 CCOC(=O)C(O)C(C)CC CNP0296108.0 [0,1,0,0,0,0|1,0,2]=4 50 B10R1.4 CCCC1CCCOC1=O CNP0416617.0 [0,0,0,1,0,0|0,0,2]=3 51 B10R1.4 CCOC1=CC=CC=C1C CNP0253397.0 [0,0,0,1,0,0|1,0,2]=4 52 B10R1.4 CCOC1=NC=CN=C1C CNP0003338.0 [0,0,0,1,0,0|2,0,1]=4 53 B10R1.11 CCOC(=O)C1=CC=CN1 CNP0153288.0 [0,0,0,1,0,0|1,0,2]=4 54 B10R1.11 CCOC(=O)C1=CC=CO1 CNP0247126.0 [0,0,0,1,0,0|1,0,2]=4 55 B10R1.11 CCOC(=O)[C@@H]1CCNC1 CNP0206039.2 [0,0,0,1,0,0|1,0,1]=3 56 B10R1.11 CCOC(=O)[C@H]1CCNC1 CNP0206039.1 [0,0,0,1,0,0|1,0,1]=3 57 B10R1.118 C[C@@H]1C[C@H]([C@@H](OC1=O)C)C CNP0283141.1 [0,0,0,1,0,0|0,0,2]=3 58 B10R1.118 C[C@@H]1NC(=O)[C@@H](NC1=O)C CNP0321267.2 [0,0,0,1,0,0|3,0,0]=4 59 B10R1.118 C[C@@H]1NC(=O)[C@H](NC1=O)C CNP0321267.1 [0,0,0,1,0,0|3,0,0]=4 60 B10R1.118 C[C@H]1NC(=O)[C@H](NC1=O)C CNP0321267.3 [0,0,0,1,0,0|3,0,0]=4 61 B10R1.135 CCOC(=O)C1CC1CO CNP0490095.0 [0,0,0,1,0,0|1,0,1]=3 62 B10R1.256 C[C@@H]1C(=O)O[C@@H]([C@H]1CO)C CNP0104665.1 [0,0,0,1,0,0|1,0,1]=3 63 B10R1.256 C[C@@H]1OC(=O)[C@@H]([C@H]1CO)C CNP0104665.2 [0,0,0,1,0,0|1,0,1]=3 64 B10R0.2 CCCC(=O)OC(C)CCC CNP0118403.0 [0,0,0,0,0,1|1,0,2]=4 65 B10R0.2 CCCC(O)CC(=O)OCC CNP0256152.0 [0,0,0,0,0,1|1,0,2]=4 66 B7R0.1 C=CCCCCCC CNP0246919.0 [2,0,0,0,0,0|1,0,1]=4 67 B7R0.1 CCC=CCCC=O CNP0265888.0 [2,0,0,0,0,0|2,0,0]=4 68 B7R0.3 C=CC(=CCCC)C CNP0605951.0 [2,0,0,0,0,0|1,0,1]=4 69 B7R0.3 C=CC(C)CCCC CNP0354372.0 [2,0,0,0,0,0|1,0,1]=4 70 B7R0.3 C=CCCC(=O)OC CNP0383041.0 [2,0,0,0,0,0|0,0,0]=2 71 B7R0.3 C=CCSC(=O)CC CNP0172366.0 [2,0,0,0,0,0|1,0,0]=3 72 B7R0.3 C=CCSS(=O)OC CNP0499912.0 [2,0,0,0,0,0|2,0,0]=4 73 B7R0.3 CCC(=O)CCSC CNP0003468.0 [2,0,0,0,0,0|1,0,1]=4 74 B7R0.3 CCCCC(=O)CC CNP0286726.0 [2,0,0,0,0,0|0,0,2]=4 75 B7R0.3 CCCCC(=O)OC CNP0184855.0 [2,0,0,0,0,0|0,0,2]=4 76 B7R0.3 COC(=O)CCC#N CNP0076214.0 [2,0,0,0,0,0|1,0,1]=4 77 B7R0.3 COC(=O)CCC=O CNP0246367.0 [2,0,0,0,0,0|1,0,0]=3 78 B7R0.3 COC(=O)CCSC CNP0302353.0 [2,0,0,0,0,0|1,0,1]=4 79 B7R0.7 C=CCC(=CCC)C CNP0076324.0 [2,0,0,0,0,0|0,0,1]=3 80 B7R0.7 C=CCC(=O)OCC CNP0305215.0 [2,0,0,0,0,0|0,0,0]=2 81 B7R0.7 C=CCS(=O)OCC CNP0003495.0 [2,0,0,0,0,0|1,0,0]=3 82 B7R0.7 CC=CC(=O)OCC CNP0251499.0 [2,0,0,0,0,0|0,0,2]=4 83 B7R0.7 CCCC(=O)CCC CNP0310318.0 [2,0,0,0,0,0|1,0,1]=4 84 B7R0.7 CCCC(=O)OCC CNP0232050.0 [2,0,0,0,0,0|0,0,1]=3 85 B7R0.7 CCCC(=S)OCC CNP0612025.0 [2,0,0,0,0,0|0,1,1]=4 86 B7R0.7 CCCC(C)CC=O CNP0405888.0 [2,0,0,0,0,0|1,0,1]=4 87 B7R0.7 CCC[C@H](C)OCC CNP0076637.1 [2,0,0,0,0,0|0,0,2]=4 88 B7R0.7 CCOC(=O)C=CBr CNP0103315.0 [2,0,0,0,0,0|1,0,1]=4 89 B7R0.7 CCOC(=O)C=CCl CNP0155772.0 [2,0,0,0,0,0|1,0,1]=4 90 B7R0.7 CCOC(=O)C=CI CNP0229422.0 [2,0,0,0,0,0|1,0,1]=4 91 B7R0.7 CCOC(=O)CCS CNP0347470.0 [2,0,0,0,0,0|1,0,0]=3 92 B7R0.7 CCOC(=O)CNC CNP0575591.0 [2,0,0,0,0,0|1,0,1]=4 93 B7R0.7 CCOC(=O)CSC CNP0330528.0 [2,0,0,0,0,0|1,0,1]=4 94 B7R0.7 CCOC(=O)OCC CNP0167765.0 [2,0,0,0,0,0|1,0,1]=4 95 B7R0.5 C=C(C)C(=O)OCC CNP0262350.0 [2,0,0,0,0,0|0,0,1]=3 96 B7R0.5 C=C(Cl)C(=O)OCC CNP0017723.0 [2,0,0,0,0,0|1,0,1]=4 97 B7R0.5 C=C(O)C(=O)OCC CNP0311886.0 [2,0,0,0,0,0|1,0,1]=4 98 B7R0.5 C=CCC(C)C(=O)O CNP0293941.0 [2,0,0,0,0,0|0,0,0]=2 99 B7R0.5 C=CCC(C)C(C)C CNP0601967.0 [2,0,0,0,0,0|1,0,1]=4 100 B7R0.5 C=CC[C@@H](N)C(=O)O CNP0299155.1 [2,0,0,0,0,0|1,0,0]=3 101 B7R0.5 C=CC[C@H](N)C(=O)O CNP0299155.2 [2,0,0,0,0,0|1,0,0]=3 102 B7R0.5 CC=CC(C)C(=O)O CNP0085321.0 [2,0,0,0,0,0|0,0,2]=4 103 B7R0.5 CCCC(=O)C(C)C CNP0310980.0 [2,0,0,0,0,0|1,0,0]=3 104 B7R0.5 CCCC(=O)[C@@H](C)O CNP0229678.1 [2,0,0,0,0,0|2,0,0]=4 105 B7R0.5 CCCC(=O)[C@H](C)O CNP0229678.2 [2,0,0,0,0,0|2,0,0]=4 106 B7R0.5 CCCC(C)C(=O)C CNP0145602.0 [2,0,0,0,0,0|0,0,2]=4 107 B7R0.5 CCC[C@@H](C)C(=O)O CNP0218134.2 [2,0,0,0,0,0|0,0,2]=4 108 B7R0.5 CCC[C@H](C)C(=O)O CNP0218134.1 [2,0,0,0,0,0|0,0,2]=4 109 B7R0.5 CCOC(=O)C(=O)C CNP0125982.0 [2,0,0,0,0,0|1,0,1]=4 110 B7R0.5 CCOC(=O)C(Br)Br CNP0156394.0 [2,0,0,0,0,0|2,0,0]=4 111 B7R0.5 CCOC(=O)C(C)C CNP0230163.0 [2,0,0,0,0,0|0,0,0]=2 112 B7R0.5 CCOC(=O)C(C)S CNP0003364.0 [2,0,0,0,0,0|1,0,0]=3 113 B7R0.5 CCOC(=O)C(I)I CNP0017599.0 [2,0,0,0,0,0|2,0,0]=4 114 B7R0.5 CCOC(=O)[C@@H](C)O CNP0196373.1 [2,0,0,0,0,0|1,0,0]=3 115 B7R0.5 CCOC(=O)[C@@H](N)O CNP0223333.1 [2,0,0,0,0,0|2,0,0]=4 116 B7R0.5 CCOC(=O)[C@H](Br)I CNP0114584.1 [2,0,0,0,0,0|2,0,0]=4 117 B7R0.5 CCOC(=O)[C@H](C)O CNP0196373.2 [2,0,0,0,0,0|1,0,0]=3 118 B7R0.5 C[C@@H](CCN)C(=O)O CNP0117278.1 [2,0,0,0,0,0|1,0,1]=4 119 B7R0.5 C[C@H](CCN)C(=O)O CNP0117278.2 [2,0,0,0,0,0|1,0,1]=4 120 B7R0.5 N[C@@H](CC=O)C(=O)O CNP0119915.1 [2,0,0,0,0,0|2,0,0]=4 121 B7R0.5 N[C@H](CC=O)C(=O)O CNP0119915.2 [2,0,0,0,0,0|2,0,0]=4 122 B7R0.10 CC=C(C)C(=O)CC CNP0305910.0 [2,0,0,0,0,0|0,0,2]=4 123 B7R0.10 CC=C(C)C(=O)OC CNP0136936.0 [2,0,0,0,0,0|0,0,2]=4 124 B7R0.10 CCC(=O)C(=CN)C CNP0051930.0 [2,0,0,0,0,0|1,0,1]=4 125 B7R0.10 CCC(=O)[C@@H](C)CC CNP0326368.2 [2,0,0,0,0,0|0,0,1]=3 126 B7R0.10 CCC(=O)[C@H](C)CC CNP0326368.1 [2,0,0,0,0,0|0,0,1]=3 127 B7R0.10 CCC(O)C(=O)OC CNP0611994.0 [2,0,0,0,0,0|1,0,1]=4 128 B7R0.10 CC[C@@H](C)C(=O)OC CNP0253021.1 [2,0,0,0,0,0|0,0,1]=3 129 B7R0.10 CC[C@H](C)C(=O)OC CNP0253021.2 [2,0,0,0,0,0|0,0,1]=3 130 B7R0.10 CN[C@@H](C)C(=O)OC CNP0066351.2 [2,0,0,0,0,0|1,0,1]=4 131 B7R0.10 CN[C@H](C)C(=O)OC CNP0066351.1 [2,0,0,0,0,0|1,0,1]=4 132 B7R0.10 COC(=O)C(C)CO CNP0487988.0 [2,0,0,0,0,0|1,0,0]=3 133 B7R0.10 COC(=O)[C@@H](N)CO CNP0398727.2 [2,0,0,0,0,0|2,0,0]=4 134 B7R0.10 COC(=O)[C@@H](N)CS CNP0178612.1 [2,0,0,0,0,0|2,0,0]=4 135 B7R0.10 COC(=O)[C@@H](O)CO CNP0269483.1 [2,0,0,0,0,0|2,0,0]=4 136 B7R0.10 COC(=O)[C@H](C)C=O CNP0094897.1 [2,0,0,0,0,0|1,0,0]=3 137 B7R0.10 COC(=O)[C@H](N)CS CNP0178612.2 [2,0,0,0,0,0|2,0,0]=4 138 B7R0.10 COC(=O)[C@H](O)CO CNP0269483.2 [2,0,0,0,0,0|2,0,0]=4 139 B9R0.4 C=CCOC(=O)CC(C)C CNP0131911.0 [1,1,0,0,0,0|2,0,0]=4 140 B9R0.4 CCCCC(=O)OC(C)C CNP0348909.0 [1,1,0,0,0,0|0,0,2]=4 141 B9R0.5 C=CCCCC(=O)OCC CNP0023026.0 [1,1,0,0,0,0|0,0,0]=2 142 B9R0.5 CC=CC=CC(=O)OCC CNP0002481.0 [1,1,0,0,0,0|0,0,2]=4 143 B9R0.5 CC=CCCC(=O)CCC CNP0280412.0 [1,1,0,0,0,0|1,0,0]=3 144 B9R0.5 CCC=CCC(=O)OCC CNP0055106.0 [1,1,0,0,0,0|0,0,2]=4 145 B9R0.5 CCCC(=O)CCCC=O CNP0599929.0 [1,1,0,0,0,0|1,0,1]=4 146 B9R0.5 CCCCCC(=O)OCC CNP0149883.0 [1,1,0,0,0,0|0,0,2]=4 147 B9R0.5 CCOC(=O)CCCC#N CNP0244990.0 [1,1,0,0,0,0|0,0,2]=4 148 B9R0.5 CCOC(=O)CCCSC CNP0002800.0 [1,1,0,0,0,0|0,0,2]=4 149 B9R0.18 C=CCOC(=O)CCCC CNP0003307.0 [1,1,0,0,0,0|2,0,0]=4 150 B9R0.18 C=CCOC(=O)OCCO CNP0325066.0 [1,1,0,0,0,0|1,0,0]=3 151 B9R0.18 CCCCC(=O)OCCC CNP0084151.0 [1,1,0,0,0,0|0,0,2]=4 152 B9R0.34 C=C[C@H](O)CC(=O)/C=C/C CNP0207948.1 [1,1,0,0,0,0|1,0,1]=4 153 B9R0.34 CCOC(=O)CC(C)SC CNP0019037.0 [1,1,0,0,0,0|1,0,1]=4 154 B9R0.34 CCOC(=O)C[C@@H](O)CC CNP0017829.1 [1,1,0,0,0,0|0,0,2]=4 155 B9R0.34 CCOC(=O)C[C@H](C)CC CNP0112934.1 [1,1,0,0,0,0|0,0,2]=4 156 B9R0.48 C=C(C)COC(=O)CCC CNP0002915.0 [1,1,0,0,0,0|2,0,0]=4 157 B9R0.48 CCCC(=O)CCC(=O)C CNP0566396.0 [1,1,0,0,0,0|1,0,1]=4 158 B9R0.48 CCOC(=O)CCC(=O)C CNP0002491.0 [1,1,0,0,0,0|0,0,1]=3 159 B9R0.48 CCOC(=O)CCC(=O)N CNP0277152.0 [1,1,0,0,0,0|1,0,0]=3 160 B9R0.48 CCOC(=O)CCC(=O)O CNP0186824.0 [1,1,0,0,0,0|1,0,0]=3 161 B9R0.48 CCOC(=O)CCC(C)C CNP0084329.0 [1,1,0,0,0,0|0,0,2]=4 162 B9R0.48 CCOC(=O)CC[N+](=O)[O-] CNP0530407.0 [1,1,0,0,0,0|2,0,0]=4 163 B9R0.48 CCOC(=O)CC[S@+](C)[O-] CNP0541212.1 [1,1,0,0,0,0|1,0,1]=4 164 B9R0.6 CCOC(=O)C(C)C(=O)C CNP0103680.0 [1,1,0,0,0,0|0,0,1]=3 165 B9R0.6 CCOC(=O)C(C)C(C)S CNP0164740.0 [1,1,0,0,0,0|0,0,1]=3 166 B9R0.6 CCOC(=O)[C@@H](N)C(C)C CNP0535653.1 [1,1,0,0,0,0|1,0,1]=4 167 B9R0.6 CCOC(=O)[C@H](O)C(C)C CNP0170066.1 [1,1,0,0,0,0|1,0,1]=4 168 B9R0.12 C=CCC(CC)C(=O)CC CNP0001522.0 [1,1,0,0,0,0|0,0,0]=2 169 B9R0.12 CN[C@@H](COC)C(=O)OC CNP0562303.1 [1,1,0,0,0,0|1,0,1]=4 170 B9R0.12 CN[C@H](COC)C(=O)OC CNP0562303.2 [1,1,0,0,0,0|1,0,1]=4 171 B9R0.19 CCOC(=O)C(C)(O)CC CNP0222840.0 [1,1,0,0,0,0|0,0,1]=3 172 B9R0.23 CC=C(C)C(=O)OC(C)C CNP0322856.0 [1,1,0,0,0,0|0,0,2]=4 173 B9R0.23 CCC(=O)[C@H](C)NC(=O)C CNP0481788.1 [1,1,0,0,0,0|1,0,1]=4 174 B9R0.23 CC[C@@H](C)C(=O)OC(C)C CNP0190185.1 [1,1,0,0,0,0|0,0,1]=3 175 B9R0.23 COC(=O)C(C)CC(=O)O CNP0352524.0 [1,1,0,0,0,0|1,0,0]=3 176 B9R0.23 COC(=O)[C@@H](N)CC(=O)N CNP0041402.1 [1,1,0,0,0,0|2,0,0]=4 177 B9R0.23 COC(=O)[C@@H](O)CC(=O)C CNP0113476.2 [1,1,0,0,0,0|1,0,1]=4 178 B9R0.23 COC(=O)[C@H](N)CC(=O)N CNP0041402.2 [1,1,0,0,0,0|2,0,0]=4 179 B9R0.23 COC(=O)[C@H](O)CC(=O)C CNP0113476.1 [1,1,0,0,0,0|1,0,1]=4 180 B9R0.23 COC(=O)[C@H](O)CC(=O)O CNP0269332.1 [1,1,0,0,0,0|2,0,0]=4 181 B9R0.27 CCC(=O)C(=O)C(C)CC CNP0330922.0 [1,1,0,0,0,0|1,0,1]=4 182 B9R0.27 CCC(=O)[C@@H](C)[C@@H](O)CC CNP0412913.2 [1,1,0,0,0,0|0,0,2]=4 183 B9R0.27 CCC(=O)[C@H](C)[C@H](O)CC CNP0412913.1 [1,1,0,0,0,0|0,0,2]=4 184 B9R0.27 CCC(C)C(=O)C(C)CC CNP0499224.0 [1,1,0,0,0,0|1,0,1]=4 185 B9R0.27 CC[C@@H](O)[C@@H](C)C(=O)OC CNP0229138.1 [1,1,0,0,0,0|0,0,2]=4 186 B9R0.37 CCOC(=O)C(CC)CC CNP0165107.0 [1,1,0,0,0,0|0,0,1]=3 187 B9R0.37 CCOC(=O)[C@@H](CC)NC CNP0599736.1 [1,1,0,0,0,0|0,0,1]=3 188 B9R0.37 CCOC(=O)[C@H](CC)NC CNP0599736.2 [1,1,0,0,0,0|0,0,1]=3 189 B9R0.60 COC[C@@](C)(N)C(=O)OC CNP0570502.2 [1,1,0,0,0,0|1,0,1]=4 190 B9R0.60 COC[C@](C)(N)C(=O)OC CNP0570502.1 [1,1,0,0,0,0|1,0,1]=4 191 B11R0.1 CCOC(=O)C[C@@H](C)NC(=O)C CNP0207369.1 [0,1,0,0,0,1|1,0,1]=4 192 B11R0.59 CCOC(=O)[C@@H](N)CSC(=O)C CNP0029965.1 [0,2,0,0,0,0|1,0,1]=4 193 B11R0.191 CCCCC(CC)C(=O)OCC CNP0003276.0 [0,2,0,0,0,0|0,0,2]=4 194 B9R1.8 C=CCC1CCCCC1 CNP0156672.0 [1,0,0,1,0,0|1,0,1]=4 195 B9R1.27 CCC1=C(CCC1=O)C CNP0197955.0 [1,0,0,1,0,0|1,0,1]=4 196 B9R1.27 CCN1C(=O)CCC1=O CNP0304586.0 [1,0,0,1,0,0|2,0,0]=4 197 B9R1.48 C[C@H]1CCCCC(=O)O1 CNP0109717.1 [1,0,0,1,0,0|0,0,2]=4 198 B9R1.69 CC1=C(OC(=O)CC1)C CNP0612037.0 [1,0,0,1,0,0|0,0,2]=4 199 B9R1.69 C[C@@H]1CCC(=O)O[C@H]1C CNP0250448.1 [1,0,0,1,0,0|0,0,2]=4 200 B9R1.69 C[C@@H]1OC(=O)CC[C@@H]1C CNP0250448.2 [1,0,0,1,0,0|0,0,2]=4 201 B9R1.3 CC1C(=O)CCCC1=O CNP0609104.0 [1,0,0,1,0,0|2,0,0]=4 202 B9R1.3 CC1CCCC(C1=O)C CNP0612142.0 [1,0,0,1,0,0|0,0,2]=4 203 B9R1.5 CC1CCCCCC1=O CNP0489162.0 [1,0,0,1,0,0|0,0,2]=4 204 B9R1.5 C[C@H]1CCCCOC1=O CNP0187217.1 [1,0,0,1,0,0|0,0,1]=3 205 B9R1.11 COC(=O)[C@@H]1C=CCC1 CNP0166268.1 [1,0,0,1,0,0|0,0,2]=4 206 B9R1.37 CC1=C(C(=O)[C@@H](C1)C)C CNP0135578.1 [1,0,0,1,0,0|0,0,2]=4 207 B9R1.37 CC1=C([C@H](OC1=O)C)C CNP0229013.1 [1,0,0,1,0,0|0,0,2]=4 208 B9R1.37 C[C@@H]1OC(=O)C(C1O)O CNP0227310.1 [1,0,0,1,0,0|2,0,0]=4 209 B9R1.37 C[C@@H]1OC(=O)[C@@H]([C@H]1O)O CNP0227310.2 [1,0,0,1,0,0|2,0,0]=4 210 B9R1.37 C[C@H]1[C@@H](C(=O)O[C@@H]1C)N CNP0418917.1 [1,0,0,1,0,0|1,0,1]=4 211 B9R1.74 CCOC(=O)C1(CC1)N CNP0409533.0 [1,0,0,1,0,0|1,0,1]=4 212 B9R1.202 CCC1(CCOC1=O)C CNP0050181.0 [1,0,0,1,0,0|0,0,1]=3 213 B9R1.202 CCC1(CCSC1=O)C CNP0109603.0 [1,0,0,1,0,0|0,1,1]=4 214 B9R1.202 O=C1OCC[C@@]1(O)CO CNP0229397.1 [1,0,0,1,0,0|2,0,0]=4 215 B11R1.15 CCOC(=O)C1CCC(=O)O1 CNP0001512.0 [0,1,0,1,0,0|1,0,1]=4 216 B11R1.15 CCOC(=O)[C@@H]1CCC(=N1)O CNP0524043.1 [0,1,0,1,0,0|1,0,1]=4 217 B11R1.15 CCOC(=O)[C@@H]1CCC(=O)N1 CNP0367585.2 [0,1,0,1,0,0|1,0,1]=4 218 B11R1.15 CCOC(=O)[C@H]1CCC(=N1)O CNP0524043.2 [0,1,0,1,0,0|1,0,1]=4 219 B11R1.15 CCOC(=O)[C@H]1CCC(=O)N1 CNP0367585.1 [0,1,0,1,0,0|1,0,1]=4 220 B11R1.16 CCOC(=O)C1CCCCC1 CNP0408576.0 [0,1,0,1,0,0|0,0,2]=4 221 B11R1.17 CC=CCC1CCCCC1=O CNP0520836.0 [0,1,0,1,0,0|1,0,0]=3 222 B11R1.277 CC[C@@H]1OC(=O)[C@@H](C[C@H]1C)C CNP0145697.1 [0,1,0,1,0,0|0,0,2]=4 223 B11R1.277 CC[C@H]1OC(=O)[C@@H](C[C@H]1C)C CNP0145697.2 [0,1,0,1,0,0|0,0,2]=4 224 B11R1.673 C[C@@H]1C(=O)O[C@@H]([C@H]1C(=O)O)C CNP0351194.2 [0,1,0,1,0,0|1,0,0]=3 225 B11R1.673 C[C@@H]1OC(=O)[C@@H]([C@H]1C(=O)O)C CNP0351194.1 [0,1,0,1,0,0|1,0,0]=3 226 B11R1.838 C=CCC1(CC1)C(=O)OCC CNP0507082.0 [0,1,0,1,0,0|0,0,0]=2 227 B11R1.32 C[C@@H]1[C@@H]([C@H](C(=O)O[C@@H]1C)C)O CNP0311543.2 [0,1,0,1,0,0|0,0,2]=4 228 B11R1.32 C[C@@H]1[C@@H]([C@H](C(=O)O[C@H]1C)C)O CNP0311543.1 [0,1,0,1,0,0|0,0,2]=4 229 B11R1.800 CCOC(=O)[C@@](C)(N)C1CC1 CNP0555371.1 [0,1,0,1,0,0|0,0,2]=4 230 B11R1.800 CCOC(=O)[C@](C)(N)C1CC1 CNP0555371.2 [0,1,0,1,0,0|0,0,2]=4