0 B8R0.5 C/C=C/[C@@H](O)CC(C)C CNP0115092.2 [0,0,0,0,0,0|1,0,3]=4 1 B8R0.5 C/C=C\[C@H](O)CC(C)C CNP0115092.1 [0,0,0,0,0,0|1,0,3]=4 2 B8R0.5 CC(=CC=O)CC(C)C CNP0364248.0 [0,0,0,0,0,0|3,0,1]=4 3 B8R0.5 CCCC(=O)C=C(C)C CNP0207293.0 [0,0,0,0,0,0|1,0,2]=3 4 B8R0.5 CCCC(=O)CC(=O)C CNP0351307.0 [0,0,0,0,0,0|2,0,1]=3 5 B8R0.5 CCCC(=O)CC(=O)O CNP0037462.0 [0,0,0,0,0,0|3,0,1]=4 6 B8R0.5 CCCC(=O)CC(C)C CNP0504556.0 [0,0,0,0,0,0|1,0,0]=1 7 B8R0.5 CCCC(=O)OC(C)C CNP0194975.0 [0,0,0,0,0,0|2,0,0]=2 8 B8R0.5 CCCC(C)CC(C)C CNP0086425.0 [0,0,0,0,0,0|2,0,1]=3 9 B8R0.5 CCCC(C)CC(C)O CNP0100557.0 [0,0,0,0,0,0|3,0,1]=4 10 B8R0.5 CCOC(=O)C=C(Br)Br CNP0238604.0 [0,0,0,0,0,0|2,0,2]=4 11 B8R0.5 CCOC(=O)C=C(C)C CNP0502082.0 [0,0,0,0,0,0|0,0,2]=2 12 B8R0.5 CCOC(=O)C=C(Cl)Cl CNP0166336.0 [0,0,0,0,0,0|2,0,2]=4 13 B8R0.5 CCOC(=O)CC(=O)C CNP0003525.0 [0,0,0,0,0,0|1,0,1]=2 14 B8R0.5 CCOC(=O)CC(=O)N CNP0369111.0 [0,0,0,0,0,0|2,0,1]=3 15 B8R0.5 CCOC(=O)CC(=O)O CNP0380624.0 [0,0,0,0,0,0|2,0,1]=3 16 B8R0.5 CCOC(=O)CC(C)C CNP0224486.0 [0,0,0,0,0,0|0,0,0]=0 17 B8R0.5 CCOC(=O)CC(C)S CNP0121387.0 [0,0,0,0,0,0|1,0,0]=1 18 B8R0.5 CCOC(=O)C[C@@H](C)N CNP0183857.1 [0,0,0,0,0,0|1,0,0]=1 19 B8R0.5 CCOC(=O)C[C@@H](C)O CNP0265277.2 [0,0,0,0,0,0|1,0,0]=1 20 B8R0.5 CCOC(=O)C[C@H](C)O CNP0265277.1 [0,0,0,0,0,0|1,0,0]=1 21 B8R0.5 CCOC(=O)C[S+](C)C CNP0041723.0 [0,0,0,0,0,0|1,0,0]=1 22 B8R0.5 CCOC(=O)C[S](C)C CNP0481099.0 [0,0,0,0,0,0|1,0,0]=1 23 B8R0.5 CCOC(=O)NC(=O)N CNP0241486.0 [0,0,0,0,0,0|3,0,1]=4 24 B8R0.5 CCSC(=S)OC(C)C CNP0320559.0 [0,0,0,0,0,0|1,2,0]=3 25 B7R0.2 C=CC(=O)NC(C)C CNP0414888.0 [1,0,0,0,0,0|1,0,2]=4 26 B7R0.2 CC(C)CC(=O)C#N CNP0113699.0 [1,0,0,0,0,0|1,0,1]=3 27 B7R0.2 CC(C)C[C@@H](N)CO CNP0295420.1 [1,0,0,0,0,0|2,0,1]=4 28 B7R0.2 CC(C)C[C@H](N)CO CNP0295420.2 [1,0,0,0,0,0|2,0,1]=4 29 B7R0.2 CCC(=O)C=C(C)C CNP0540144.0 [1,0,0,0,0,0|0,0,2]=3 30 B7R0.2 CCC(=O)CC(=O)O CNP0066606.0 [1,0,0,0,0,0|2,0,1]=4 31 B7R0.2 CCC(=O)CC(C)C CNP0284484.0 [1,0,0,0,0,0|0,0,0]=1 32 B7R0.2 CCC(=O)NC(=O)C CNP0168988.0 [1,0,0,0,0,0|2,0,1]=4 33 B7R0.2 CCC(=O)OC(C)C CNP0250066.0 [1,0,0,0,0,0|1,0,0]=2 34 B7R0.2 CC[C@H](C)CC(C)C CNP0229015.1 [1,0,0,0,0,0|1,0,1]=3 35 B7R0.2 CN(C)CC(=O)NN CNP0250241.0 [1,0,0,0,0,0|3,0,0]=4 36 B7R0.2 COC(=O)C=C(C)C CNP0329537.0 [1,0,0,0,0,0|0,0,2]=3 37 B7R0.2 COC(=O)CC(=O)C CNP0086286.0 [1,0,0,0,0,0|1,0,1]=3 38 B7R0.2 COC(=O)CC(=O)O CNP0461449.0 [1,0,0,0,0,0|2,0,1]=4 39 B7R0.2 COC(=O)CC(C)C CNP0289344.0 [1,0,0,0,0,0|0,0,0]=1 40 B7R0.2 COC(=O)CC(C)S CNP0050854.0 [1,0,0,0,0,0|1,0,0]=2 41 B7R0.2 COC(=O)CN(C)C CNP0318263.0 [1,0,0,0,0,0|1,0,0]=2 42 B7R0.2 COC(=O)C[C@@H](C)N CNP0127877.1 [1,0,0,0,0,0|1,0,0]=2 43 B7R0.2 COC(=O)C[C@H](C)O CNP0117417.1 [1,0,0,0,0,0|1,0,0]=2 44 B7R0.2 COC(=O)C[S+](C)C CNP0025669.0 [1,0,0,0,0,0|1,0,0]=2 45 B7R0.2 COC(=O)C[S](C)C CNP0539244.0 [1,0,0,0,0,0|1,0,0]=2 46 B7R0.2 CSC(=O)CC(C)C CNP0084338.0 [1,0,0,0,0,0|0,1,0]=2 47 B7R0.4 CC(C)CCCCO CNP0497904.0 [1,0,0,0,0,0|2,0,1]=4 48 B7R0.4 CC(C)CCOC=O CNP0324042.0 [1,0,0,0,0,0|1,0,2]=4 49 B7R0.4 CC(C)CCON=O CNP0341686.0 [1,0,0,0,0,0|2,0,1]=4 50 B7R0.4 CC/C=C/C[C@H](C)O CNP0273661.3 [1,0,0,0,0,0|2,0,0]=3 51 B7R0.4 CC/C=C\C[C@@H](C)O CNP0273661.2 [1,0,0,0,0,0|2,0,0]=3 52 B7R0.4 CC/C=C\C[C@H](C)O CNP0273661.1 [1,0,0,0,0,0|2,0,0]=3 53 B7R0.4 CCC=CCC(=O)C CNP0207647.0 [1,0,0,0,0,0|2,0,1]=4 54 B7R0.4 CCCCCC(C)C CNP0146536.0 [1,0,0,0,0,0|1,0,1]=3 55 B7R0.4 CCCCC[C@@H](C)N CNP0336832.2 [1,0,0,0,0,0|2,0,1]=4 56 B7R0.4 CCCCC[C@@H](C)O CNP0256316.1 [1,0,0,0,0,0|2,0,1]=4 57 B7R0.4 CCCCC[C@@H](C)S CNP0076785.2 [1,0,0,0,0,0|2,0,1]=4 58 B7R0.4 CCCCC[C@H](C)N CNP0336832.1 [1,0,0,0,0,0|2,0,1]=4 59 B7R0.4 CCCCC[C@H](C)O CNP0256316.2 [1,0,0,0,0,0|2,0,1]=4 60 B7R0.4 CCCCC[C@H](C)S CNP0076785.1 [1,0,0,0,0,0|2,0,1]=4 61 B7R0.4 CCCNCC(C)C CNP0333564.0 [1,0,0,0,0,0|2,0,0]=3 62 B7R0.4 CCCSCC(C)C CNP0116113.0 [1,0,0,0,0,0|2,0,0]=3 63 B7R0.4 CCCSSC(C)C CNP0309421.0 [1,0,0,0,0,0|3,0,0]=4 64 B7R0.4 CCNCCC(C)C CNP0184897.0 [1,0,0,0,0,0|1,0,1]=3 65 B7R0.4 CCOCC=C(C)C CNP0002719.0 [1,0,0,0,0,0|0,0,3]=4 66 B7R0.4 CCOCCC(=O)C CNP0086134.0 [1,0,0,0,0,0|1,0,2]=4 67 B7R0.4 CCOCCC(C)C CNP0032749.0 [1,0,0,0,0,0|0,0,1]=2 68 B7R0.4 CSSC=CC(C)C CNP0002674.0 [1,0,0,0,0,0|1,1,1]=4 69 B7R0.4 [CH2]CCCCC(C)C CNP0488090.0 [1,0,0,0,0,0|1,0,2]=4 70 B7R0.7 C=C(CCC)CCC CNP0515689.0 [1,0,0,0,0,0|2,0,0]=3 71 B7R0.7 C=C(OCC)OCC CNP0510072.0 [1,0,0,0,0,0|2,0,0]=3 72 B7R0.7 C=CCC(=O)OCC CNP0305215.0 [1,0,0,0,0,0|0,0,2]=3 73 B7R0.7 C=CCS(=O)OCC CNP0003495.0 [1,0,0,0,0,0|1,0,2]=4 74 B7R0.7 CC=CC(=O)CCC CNP0003369.0 [1,0,0,0,0,0|1,0,1]=3 75 B7R0.7 CC=CC(=O)OCC CNP0251499.0 [1,0,0,0,0,0|0,0,2]=3 76 B7R0.7 CCC=C(C)CCC CNP0345457.0 [1,0,0,0,0,0|2,0,0]=3 77 B7R0.7 CCCC(=O)CCC CNP0310318.0 [1,0,0,0,0,0|1,0,0]=2 78 B7R0.7 CCCC(=O)OCC CNP0232050.0 [1,0,0,0,0,0|0,0,0]=1 79 B7R0.7 CCCC(=S)OCC CNP0612025.0 [1,0,0,0,0,0|0,1,0]=2 80 B7R0.7 CCCC(C)CCC CNP0137963.0 [1,0,0,0,0,0|2,0,1]=4 81 B7R0.7 CCCC(O)CCC CNP0407378.0 [1,0,0,0,0,0|1,0,2]=4 82 B7R0.7 CCC[C@@H](C)SCC CNP0322285.1 [1,0,0,0,0,0|1,1,1]=4 83 B7R0.7 CCC[C@H](C)OCC CNP0076637.1 [1,0,0,0,0,0|1,0,1]=3 84 B7R0.7 CCOC(=O)C=CBr CNP0103315.0 [1,0,0,0,0,0|1,0,2]=4 85 B7R0.7 CCOC(=O)C=CCl CNP0155772.0 [1,0,0,0,0,0|1,0,2]=4 86 B7R0.7 CCOC(=O)C=CI CNP0229422.0 [1,0,0,0,0,0|1,0,2]=4 87 B7R0.7 CCOC(=O)CCS CNP0347470.0 [1,0,0,0,0,0|1,0,0]=2 88 B7R0.7 CCOC(=O)CNC CNP0575591.0 [1,0,0,0,0,0|1,0,0]=2 89 B7R0.7 CCOC(=O)CSC CNP0330528.0 [1,0,0,0,0,0|1,0,0]=2 90 B7R0.7 CCOC(=O)OCC CNP0167765.0 [1,0,0,0,0,0|1,0,0]=2 91 B7R0.7 CCOC(C)OCC CNP0177172.0 [1,0,0,0,0,0|2,0,1]=4 92 B7R0.7 CCOP(=O)OCC CNP0575132.0 [1,0,0,0,0,0|2,0,0]=3 93 B9R0.4 C=CCOC(=O)CC(C)C CNP0131911.0 [0,1,0,0,0,0|0,0,1]=2 94 B9R0.4 CCCCC(=O)C=C(C)C CNP0611962.0 [0,1,0,0,0,0|1,0,2]=4 95 B9R0.4 CCCCC(=O)CC(=O)C CNP0579463.0 [0,1,0,0,0,0|2,0,1]=4 96 B9R0.4 CCCCC(=O)OC(C)C CNP0348909.0 [0,1,0,0,0,0|2,0,0]=3 97 B9R0.4 CCCC[C@@H](O)CC(C)C CNP0080555.1 [0,1,0,0,0,0|1,0,2]=4 98 B9R0.4 CCCC[C@H](O)CC(C)C CNP0080555.2 [0,1,0,0,0,0|1,0,2]=4 99 B9R0.4 CCCOC(=O)CC(=O)O CNP0488661.0 [0,1,0,0,0,0|2,0,1]=4 100 B9R0.4 CCCOC(=O)CC(C)C CNP0105828.0 [0,1,0,0,0,0|0,0,0]=1 101 B9R0.6 C=C(C(=O)OCC)[C@@H](C)O CNP0184419.1 [0,1,0,0,0,0|1,0,1]=3 102 B9R0.6 CCOC(=O)C(=O)C(C)C CNP0303947.0 [0,1,0,0,0,0|0,0,1]=2 103 B9R0.6 CCOC(=O)C(=O)N(C)C CNP0355375.0 [0,1,0,0,0,0|1,0,1]=3 104 B9R0.6 CCOC(=O)C(C)C(=O)C CNP0103680.0 [0,1,0,0,0,0|1,0,1]=3 105 B9R0.6 CCOC(=O)C(C)C(C)S CNP0164740.0 [0,1,0,0,0,0|1,0,0]=2 106 B9R0.6 CCOC(=O)[C@@H](N)C(C)C CNP0535653.1 [0,1,0,0,0,0|0,0,0]=1 107 B9R0.6 CCOC(=O)[C@H](O)C(C)C CNP0170066.1 [0,1,0,0,0,0|0,0,0]=1 108 B9R0.14 CCCC(CO)CC(C)C CNP0076276.0 [0,1,0,0,0,0|1,0,2]=4 109 B9R0.23 CC(=NO)C(=O)CC(C)C CNP0240772.0 [0,1,0,0,0,0|3,0,0]=4 110 B9R0.23 CC=C(C)C(=O)OC(C)C CNP0322856.0 [0,1,0,0,0,0|2,0,1]=4 111 B9R0.23 CCC(=O)C(=O)CC(C)C CNP0169073.0 [0,1,0,0,0,0|1,0,0]=2 112 B9R0.23 CC[C@@H](C)C(=O)OC(C)C CNP0190185.1 [0,1,0,0,0,0|2,0,0]=3 113 B9R0.23 COC(=O)C(=O)CC(C)C CNP0112927.0 [0,1,0,0,0,0|2,0,0]=3 114 B9R0.34 CCCC(=O)OC(C)CC CNP0531548.0 [0,1,0,0,0,0|2,0,0]=3 115 B9R0.34 CCCC(C)CC(C)CC CNP0083059.0 [0,1,0,0,0,0|2,0,1]=4 116 B9R0.34 CCOC(=O)CC(C)SC CNP0019037.0 [0,1,0,0,0,0|0,0,0]=1 117 B9R0.34 CCOC(=O)C[C@@H](O)CC CNP0017829.1 [0,1,0,0,0,0|1,0,0]=2 118 B9R0.34 CCOC(=O)C[C@H](C)CC CNP0112934.1 [0,1,0,0,0,0|0,0,0]=1 119 B9R0.44 CC=CC(=O)OC(C)(C)C CNP0118436.0 [0,1,0,0,0,0|2,0,1]=4 120 B9R0.44 CCCC(C)CC(C)(C)C CNP0003380.0 [0,1,0,0,0,0|2,0,1]=4 121 B9R0.44 CCOC(=O)CC(C)(C)O CNP0234032.0 [0,1,0,0,0,0|0,0,0]=1 122 B9R0.44 CCOC(=O)CS(=O)(=O)Cl CNP0190677.0 [0,1,0,0,0,0|3,0,0]=4 123 B9R0.53 CC(=CC(=O)OC(C)C)C CNP0228790.0 [0,1,0,0,0,0|0,0,2]=3 124 B9R0.53 CC(=CC(=O)SC(C)C)C CNP0219971.0 [0,1,0,0,0,0|0,1,2]=4 125 B9R0.53 CC(=O)O[C@H](C)CC(C)C CNP0489311.1 [0,1,0,0,0,0|1,0,2]=4 126 B9R0.53 CC(C)CC(=O)CC(C)C CNP0084478.0 [0,1,0,0,0,0|1,0,0]=2 127 B9R0.53 CC(C)CC(=O)OC(C)C CNP0311912.0 [0,1,0,0,0,0|0,0,0]=1 128 B9R0.53 CC(C)CC(=O)SC(C)C CNP0159406.0 [0,1,0,0,0,0|0,1,0]=2 129 B9R0.53 CC(C)CC(C)CC(C)C CNP0076048.0 [0,1,0,0,0,0|2,0,1]=4 130 B9R0.53 CC(C)CC(O)CC(C)C CNP0003532.0 [0,1,0,0,0,0|1,0,2]=4 131 B9R0.53 CC(C)NC(=N)NC(C)C CNP0566006.0 [0,1,0,0,0,0|3,0,0]=4 132 B9R0.53 CC(C)NC(=O)NC(C)C CNP0313716.0 [0,1,0,0,0,0|2,0,0]=3 133 B9R0.53 CC(C)OC(C)OC(C)C CNP0324928.0 [0,1,0,0,0,0|2,0,1]=4 134 B9R0.53 CC(C)OP(=O)OC(C)C CNP0511332.0 [0,1,0,0,0,0|2,0,0]=3 135 B9R1.7 CCC[C@H]1CC[C@H](C1)C CNP0173723.1 [0,0,0,1,0,0|2,0,1]=4 136 B9R1.13 CC(C)CC1=CCCC1 CNP0610558.0 [0,0,0,1,0,0|2,0,0]=3 137 B9R1.13 CC(C)CC1NCCS1 CNP0121305.0 [0,0,0,1,0,0|1,1,1]=4 138 B9R1.22 CC[C@@H]1C[C@@H](C[C@H]1C)C CNP0257399.1 [0,0,0,1,0,0|2,0,1]=4 139 B9R1.34 CC1=CC(=O)CC(C1)C CNP0386862.0 [0,0,0,1,0,0|1,0,1]=3 140 B9R1.34 CC1CC(CC(C1)O)C CNP0084709.0 [0,0,0,1,0,0|1,0,2]=4 141 B9R1.34 CC1CC(OC(=N1)S)C CNP0608703.0 [0,0,0,1,0,0|1,1,0]=3 142 B9R1.34 CC1CC(OC(=S)N1)C CNP0132039.0 [0,0,0,1,0,0|1,1,0]=3 143 B9R1.34 CC1OC(=O)CC(=O)O1 CNP0094345.0 [0,0,0,1,0,0|2,0,1]=4 144 B9R1.34 C[C@@H]1CC(=CC(=O)O1)O CNP0195692.1 [0,0,0,1,0,0|1,0,2]=4 145 B9R1.34 C[C@@H]1C[C@H](CC(=O)O1)O CNP0232226.2 [0,0,0,1,0,0|1,0,0]=2 146 B9R1.34 C[C@H]1CC(=CC(=O)O1)O CNP0195692.2 [0,0,0,1,0,0|1,0,2]=4 147 B9R1.34 C[C@H]1C[C@@H](CC(=O)O1)O CNP0232226.1 [0,0,0,1,0,0|1,0,0]=2 148 B9R1.34 C[C@H]1C[C@@H](C[C@H](C1)C)C CNP0111309.1 [0,0,0,1,0,0|2,0,1]=4 149 B9R1.34 C[C@H]1C[C@H](C[C@H](C1)C)C CNP0566092.0 [0,0,0,1,0,0|2,0,1]=4 150 B9R1.38 CC1(OC(=O)C[C@H]1O)C CNP0199015.1 [0,0,0,1,0,0|3,0,0]=4 151 B9R1.38 CC1=CC(=O)CC1(C)C CNP0611990.0 [0,0,0,1,0,0|1,0,1]=3 152 B9R1.41 CC(=O)C1CCOC1=O CNP0411848.0 [0,0,0,1,0,0|1,0,1]=3 153 B9R1.41 CC(C)[C@@H]1CCCC1=O CNP0314072.2 [0,0,0,1,0,0|1,0,0]=2 154 B9R1.41 CC(C)[C@H]1CCCC1=O CNP0314072.1 [0,0,0,1,0,0|1,0,0]=2 155 B9R1.48 CC1=CC(=O)NCCC1 CNP0425910.0 [0,0,0,1,0,0|1,0,2]=4 156 B9R1.48 CC1CCCCC(=O)C1 CNP0513414.0 [0,0,0,1,0,0|1,0,0]=2 157 B9R1.48 C[C@H]1CCCCC(=O)O1 CNP0109717.1 [0,0,0,1,0,0|2,0,0]=3 158 B9R1.48 O=C1CCCCC(=O)C1 CNP0554115.0 [0,0,0,1,0,0|2,0,1]=4 159 B9R1.66 CC1(C=C(CCC1)O)C CNP0082060.0 [0,0,0,1,0,0|1,0,2]=4 160 B9R1.66 C[C@@]1(CCOC(=O)C1)O CNP0242599.2 [0,0,0,1,0,0|1,0,0]=2 161 B9R1.66 C[C@H]1CCCC(C1)(C)C CNP0230826.1 [0,0,0,1,0,0|2,0,1]=4 162 B9R1.66 C[C@]1(CCOC(=O)C1)O CNP0242599.1 [0,0,0,1,0,0|1,0,0]=2 163 B9R1.66 C[N+]1(CCOC(C1)O)C CNP0499821.0 [0,0,0,1,0,0|1,0,2]=4 164 B9R1.183 CCOC(=O)C1OC1C CNP0611901.0 [0,0,0,1,0,0|1,0,0]=2 165 B7R0.5 C=C(C)C(=O)OCC CNP0262350.0 [0,0,0,0,1,0|0,0,2]=3 166 B7R0.5 C=C(CCO)C(C)C CNP0174657.0 [0,0,0,0,1,0|3,0,0]=4 167 B7R0.5 C=C(Cl)C(=O)OCC CNP0017723.0 [0,0,0,0,1,0|1,0,2]=4 168 B7R0.5 C=C(O)C(=O)OCC CNP0311886.0 [0,0,0,0,1,0|1,0,2]=4 169 B7R0.5 CC(=CCO)C(C)C CNP0253008.0 [0,0,0,0,1,0|3,0,0]=4 170 B7R0.5 CCCC(=O)C(=O)C CNP0318298.0 [0,0,0,0,1,0|2,0,1]=4 171 B7R0.5 CCCC(=O)C(C)C CNP0310980.0 [0,0,0,0,1,0|1,0,0]=2 172 B7R0.5 CCCC(=O)[C@@H](C)O CNP0229678.1 [0,0,0,0,1,0|2,0,0]=3 173 B7R0.5 CCCC(=O)[C@H](C)O CNP0229678.2 [0,0,0,0,1,0|2,0,0]=3 174 B7R0.5 CCC[C@H](C)C(C)C CNP0153562.1 [0,0,0,0,1,0|2,0,1]=4 175 B7R0.5 CCOC(=O)C(=O)C CNP0125982.0 [0,0,0,0,1,0|1,0,1]=3 176 B7R0.5 CCOC(=O)C(Br)Br CNP0156394.0 [0,0,0,0,1,0|2,0,0]=3 177 B7R0.5 CCOC(=O)C(C)C CNP0230163.0 [0,0,0,0,1,0|0,0,0]=1 178 B7R0.5 CCOC(=O)C(C)S CNP0003364.0 [0,0,0,0,1,0|1,0,0]=2 179 B7R0.5 CCOC(=O)C(I)I CNP0017599.0 [0,0,0,0,1,0|2,0,0]=3 180 B7R0.5 CCOC(=O)[C@@H](C)O CNP0196373.1 [0,0,0,0,1,0|1,0,0]=2 181 B7R0.5 CCOC(=O)[C@@H](N)O CNP0223333.1 [0,0,0,0,1,0|2,0,0]=3 182 B7R0.5 CCOC(=O)[C@H](Br)I CNP0114584.1 [0,0,0,0,1,0|2,0,0]=3 183 B7R0.5 CCOC(=O)[C@H](C)O CNP0196373.2 [0,0,0,0,1,0|1,0,0]=2 184 B7R0.5 CCSC(C)C(C)C CNP0213489.0 [0,0,0,0,1,0|1,1,1]=4 185 B9R0.48 C=C(C)COC(=O)CCC CNP0002915.0 [0,0,0,0,0,1|1,0,2]=4 186 B9R0.48 CC=CC(=O)OCC(C)C CNP0002921.0 [0,0,0,0,0,1|1,0,1]=3 187 B9R0.48 CCCC(=O)CCC(=O)C CNP0566396.0 [0,0,0,0,0,1|2,0,1]=4 188 B9R0.48 CCCC(=O)COC(=O)C CNP0598796.0 [0,0,0,0,0,1|2,0,1]=4 189 B9R0.48 CCCC(=O)NCC(C)C CNP0405550.0 [0,0,0,0,0,1|1,0,0]=2 190 B9R0.48 CCCC(=O)OCC(C)C CNP0134371.0 [0,0,0,0,0,1|1,0,0]=2 191 B9R0.48 CCCC(O)CCC(C)C CNP0579701.0 [0,0,0,0,0,1|1,0,2]=4 192 B9R0.48 CCOC(=O)C=CC(C)C CNP0167612.0 [0,0,0,0,0,1|0,0,1]=2 193 B9R0.48 CCOC(=O)C=CN(C)C CNP0336666.0 [0,0,0,0,0,1|1,0,1]=3 194 B9R0.48 CCOC(=O)CCC(=O)C CNP0002491.0 [0,0,0,0,0,1|1,0,1]=3 195 B9R0.48 CCOC(=O)CCC(=O)N CNP0277152.0 [0,0,0,0,0,1|2,0,1]=4 196 B9R0.48 CCOC(=O)CCC(=O)O CNP0186824.0 [0,0,0,0,0,1|2,0,1]=4 197 B9R0.48 CCOC(=O)CCC(C)C CNP0084329.0 [0,0,0,0,0,1|0,0,0]=1 198 B9R0.48 CCOC(=O)CC[N+](=O)[O-] CNP0530407.0 [0,0,0,0,0,1|3,0,0]=4 199 B9R0.48 CCOC(=O)CC[S@+](C)[O-] CNP0541212.1 [0,0,0,0,0,1|2,0,0]=3 200 B9R0.48 CCSC(=O)CNC(=O)C CNP0507251.0 [0,0,0,0,0,1|1,1,1]=4 201 B6R0.1 C=C([CH]CC)CC CNP0529223.0 [2,0,0,0,0,0|1,0,1]=4 202 B6R0.1 C=CC(=O)CCC CNP0162905.0 [2,0,0,0,0,0|0,0,2]=4 203 B6R0.1 C=CC(=O)OCC CNP0197495.0 [2,0,0,0,0,0|0,0,2]=4 204 B6R0.1 C=CCC(=O)CC CNP0580605.0 [2,0,0,0,0,0|0,0,2]=4 205 B6R0.1 CC=CC(=O)CC CNP0127812.0 [2,0,0,0,0,0|0,0,2]=4 206 B6R0.1 CC=CC(=O)OC CNP0003452.0 [2,0,0,0,0,0|0,0,2]=4 207 B6R0.1 CCC(=O)CSC CNP0170567.0 [2,0,0,0,0,0|1,0,0]=3 208 B6R0.1 CCCC(=O)C#N CNP0204240.0 [2,0,0,0,0,0|1,0,1]=4 209 B6R0.1 CCCC(=O)C=O CNP0111121.0 [2,0,0,0,0,0|1,0,1]=4 210 B6R0.1 CCCC(=O)CC CNP0248158.0 [2,0,0,0,0,0|0,0,0]=2 211 B6R0.1 CCCC(=O)CO CNP0084314.0 [2,0,0,0,0,0|1,0,0]=3 212 B6R0.1 CCCC(=O)OC CNP0159910.0 [2,0,0,0,0,0|0,0,0]=2 213 B6R0.1 CCCC(=O)SC CNP0084452.0 [2,0,0,0,0,0|0,1,0]=3 214 B6R0.1 CCC[C@@H](C)CC CNP0407855.1 [2,0,0,0,0,0|1,0,1]=4 215 B6R0.1 CCC[C@@H](O)CC CNP0346810.2 [2,0,0,0,0,0|0,0,2]=4 216 B6R0.1 CCC[C@H](C)CC CNP0407855.2 [2,0,0,0,0,0|1,0,1]=4 217 B6R0.1 CCC[C@H](O)CC CNP0346810.1 [2,0,0,0,0,0|0,0,2]=4 218 B6R0.1 CCNC(=O)CC CNP0586892.0 [2,0,0,0,0,0|1,0,0]=3 219 B6R0.1 CCNC(=O)OC CNP0585352.0 [2,0,0,0,0,0|1,0,0]=3 220 B6R0.1 CCOC(=O)C=O CNP0218484.0 [2,0,0,0,0,0|1,0,1]=4 221 B6R0.1 CCOC(=O)CC CNP0169171.0 [2,0,0,0,0,0|0,0,0]=2 222 B6R0.1 CCOC(=O)CI CNP0158474.0 [2,0,0,0,0,0|1,0,0]=3 223 B6R0.1 CCOC(=O)NC CNP0565390.0 [2,0,0,0,0,0|1,0,0]=3 224 B6R0.1 CCOC(C)CC CNP0086282.0 [2,0,0,0,0,0|1,0,1]=4 225 B6R0.1 CCSC(=O)CC CNP0265303.0 [2,0,0,0,0,0|0,1,0]=3 226 B6R0.1 CNCC(=O)OC CNP0311286.0 [2,0,0,0,0,0|1,0,0]=3 227 B6R0.1 COC(=O)CC=O CNP0187576.0 [2,0,0,0,0,0|1,0,1]=4 228 B6R0.1 COC(=O)CSC CNP0189712.0 [2,0,0,0,0,0|1,0,0]=3 229 B6R0.1 COCC(=O)OC CNP0202591.0 [2,0,0,0,0,0|1,0,0]=3 230 B6R0.2 C=C(C)CC(=O)C CNP0331918.0 [2,0,0,0,0,0|0,0,2]=4 231 B6R0.2 CC(=CC(=O)O)C CNP0191929.0 [2,0,0,0,0,0|0,0,2]=4 232 B6R0.2 CC(=CC(C)C)C CNP0084966.0 [2,0,0,0,0,0|1,0,1]=4 233 B6R0.2 CC(=C[13C](=O)C)C CNP0541964.0 [2,0,0,0,0,0|0,0,2]=4 234 B6R0.2 CC(=N)CC(=O)C CNP0178786.0 [2,0,0,0,0,0|1,0,1]=4 235 B6R0.2 CC(=O)C=C(C)C CNP0258331.0 [2,0,0,0,0,0|0,0,2]=4 236 B6R0.2 CC(=O)CC(=O)C CNP0267628.0 [2,0,0,0,0,0|1,0,1]=4 237 B6R0.2 CC(=O)CC(=O)O CNP0286292.0 [2,0,0,0,0,0|1,0,1]=4 238 B6R0.2 CC(=O)CC(C)C CNP0178924.0 [2,0,0,0,0,0|0,0,0]=2 239 B6R0.2 CC(=O)C[C@@H](C)O CNP0209002.1 [2,0,0,0,0,0|1,0,0]=3 240 B6R0.2 CC(=O)C[C@H](C)O CNP0209002.2 [2,0,0,0,0,0|1,0,0]=3 241 B6R0.2 CC(=O)OC(C)C CNP0234567.0 [2,0,0,0,0,0|1,0,0]=3 242 B6R0.2 CC(=S)OC(C)C CNP0539735.0 [2,0,0,0,0,0|1,1,0]=4 243 B6R0.2 CC(C)CC(=O)N CNP0512695.0 [2,0,0,0,0,0|1,0,0]=3 244 B6R0.2 CC(C)CC(C)C CNP0241759.0 [2,0,0,0,0,0|1,0,1]=4 245 B6R0.2 CC(C)CC(C)O CNP0493734.0 [2,0,0,0,0,0|0,0,2]=4 246 B6R0.2 CC(C)C[C@@H](C)N CNP0556567.1 [2,0,0,0,0,0|1,0,1]=4 247 B6R0.2 CC(C)C[S@@+](C)[O-] CNP0553779.1 [2,0,0,0,0,0|1,0,1]=4 248 B6R0.2 CC(C)C[S@@H+](C)[O-] CNP0593384.1 [2,0,0,0,0,0|1,0,1]=4 249 B6R0.2 CC(C)NC(=O)N CNP0331187.0 [2,0,0,0,0,0|2,0,0]=4 250 B6R0.2 CC(O)CC(=O)N CNP0217857.0 [2,0,0,0,0,0|2,0,0]=4 251 B6R0.2 CN(C)CC(=O)Cl CNP0017846.0 [2,0,0,0,0,0|2,0,0]=4 252 B6R0.2 CN(C)CC(=O)N CNP0045146.0 [2,0,0,0,0,0|2,0,0]=4 253 B6R0.2 CN(C)CC(=O)O CNP0175140.0 [2,0,0,0,0,0|1,0,0]=3 254 B6R0.2 C[C@@H](N)CC(=O)O CNP0287180.2 [2,0,0,0,0,0|1,0,0]=3 255 B6R0.2 C[C@@H](O)CC(=O)O CNP0161860.1 [2,0,0,0,0,0|1,0,0]=3 256 B6R0.2 C[C@H](N)CC(=O)O CNP0287180.1 [2,0,0,0,0,0|1,0,0]=3 257 B6R0.2 C[C@H](O)CC(=O)O CNP0161860.2 [2,0,0,0,0,0|1,0,0]=3 258 B6R0.2 C[C@H]([13CH3])CC(=O)O CNP0175489.1 [2,0,0,0,0,0|0,0,0]=2 259 B6R0.2 C[C](C)CC(=O)O CNP0606523.0 [2,0,0,0,0,0|0,0,1]=3 260 B6R0.2 C[S+](C)CC(=O)O CNP0149325.0 [2,0,0,0,0,0|1,0,0]=3 261 B6R0.2 C[S+](C)CC(=O)[O-] CNP0153505.0 [2,0,0,0,0,0|1,0,1]=4 262 B6R0.4 CC(C)CC=NO CNP0235743.0 [2,0,0,0,0,0|2,0,0]=4 263 B6R0.4 CC(C)CCCO CNP0344466.0 [2,0,0,0,0,0|1,0,1]=4 264 B6R0.4 CC(C)COC=O CNP0232692.0 [2,0,0,0,0,0|1,0,1]=4 265 B6R0.4 CC(C)CON=O CNP0224607.0 [2,0,0,0,0,0|2,0,0]=4 266 B6R0.4 CC=CCC(C)C CNP0081831.0 [2,0,0,0,0,0|0,0,1]=3 267 B6R0.4 CC=CCC(C)O CNP0217280.0 [2,0,0,0,0,0|1,0,1]=4 268 B6R0.4 CCCCC(C)C CNP0312749.0 [2,0,0,0,0,0|0,0,1]=3 269 B6R0.4 CCCC[C@@H](C)O CNP0276755.1 [2,0,0,0,0,0|1,0,1]=4 270 B6R0.4 CCCC[C@H](C)O CNP0276755.2 [2,0,0,0,0,0|1,0,1]=4 271 B6R0.4 CCCSC(C)C CNP0228244.0 [2,0,0,0,0,0|1,0,1]=4 272 B6R0.4 CCNCC(C)C CNP0165310.0 [2,0,0,0,0,0|1,0,0]=3 273 B6R0.4 CCOC[C@@H](C)O CNP0076159.1 [2,0,0,0,0,0|1,0,0]=3 274 B6R0.4 CCSCC(C)C CNP0208462.0 [2,0,0,0,0,0|0,1,0]=3 275 B6R0.4 CCSSC(C)C CNP0003135.0 [2,0,0,0,0,0|1,1,0]=4 276 B6R0.4 CNCCC(C)C CNP0254439.0 [2,0,0,0,0,0|1,0,1]=4 277 B6R0.4 COCCC(C)C CNP0316382.0 [2,0,0,0,0,0|0,0,1]=3 278 B6R0.4 COCCN(C)C CNP0429553.0 [2,0,0,0,0,0|1,0,1]=4 279 B6R0.6 CCC=CCCC CNP0391454.0 [2,0,0,0,0,0|1,0,0]=3 280 B6R0.6 CCC=CCCO CNP0255718.0 [2,0,0,0,0,0|2,0,0]=4 281 B6R0.6 CCCC=CCO CNP0254124.0 [2,0,0,0,0,0|2,0,0]=4 282 B6R0.6 CCCCCCC CNP0290800.0 [2,0,0,0,0,0|1,0,1]=4 283 B6R0.6 CCCNCCC CNP0129820.0 [2,0,0,0,0,0|2,0,0]=4 284 B6R0.6 CCCSCCC CNP0173387.0 [2,0,0,0,0,0|2,0,0]=4 285 B6R0.6 CCCSSCC CNP0322971.0 [2,0,0,0,0,0|1,1,0]=4 286 B6R0.6 CCOCCCO CNP0304052.0 [2,0,0,0,0,0|1,0,1]=4 287 B6R0.6 CCOCCCS CNP0267296.0 [2,0,0,0,0,0|1,0,1]=4 288 B8R0.2 C=C(C(=O)OC)[C@H](C)O CNP0274042.1 [1,1,0,0,0,0|1,0,1]=4 289 B8R0.2 CC(C)[C@@H](N)C(=O)NO CNP0510615.1 [1,1,0,0,0,0|2,0,0]=4 290 B8R0.2 CCC(=O)[C@@H](C)C(=O)C CNP0050073.1 [1,1,0,0,0,0|1,0,1]=4 291 B8R0.2 CC[C@H](C)[C@H](C)C(C)C CNP0324956.1 [1,1,0,0,0,0|1,0,1]=4 292 B8R0.2 COC(=O)C(=O)C(C)C CNP0337448.0 [1,1,0,0,0,0|0,0,1]=3 293 B8R0.2 COC(=O)C(C)C(C)C CNP0354391.0 [1,1,0,0,0,0|0,0,0]=2 294 B8R0.2 COC(=O)C(O)C(C)C CNP0612001.0 [1,1,0,0,0,0|0,0,0]=2 295 B8R0.2 COC(=O)[C@@H](C)[C@H](C)O CNP0193149.3 [1,1,0,0,0,0|1,0,0]=3 296 B8R0.2 COC(=O)[C@@H](N)C(C)C CNP0369647.2 [1,1,0,0,0,0|0,0,0]=2 297 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O CNP0109671.2 [1,1,0,0,0,0|1,0,0]=3 298 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O CNP0109671.1 [1,1,0,0,0,0|1,0,0]=3 299 B8R0.2 COC(=O)[C@H](C)[C@@H](C)O CNP0193149.2 [1,1,0,0,0,0|1,0,0]=3 300 B8R0.2 COC(=O)[C@H](C)[C@H](C)O CNP0193149.1 [1,1,0,0,0,0|1,0,0]=3 301 B8R0.16 CCC(CC)CC(C)C CNP0577588.0 [1,1,0,0,0,0|1,0,1]=4 302 B8R0.16 CCC(CO)CC(C)C CNP0084487.0 [1,1,0,0,0,0|0,0,2]=4 303 B8R0.16 CO/C(=N/O)/C[C@H](C)O CNP0423292.1 [1,1,0,0,0,0|1,0,1]=4 304 B8R0.16 COC(CC(C)C)OC CNP0256947.0 [1,1,0,0,0,0|0,0,2]=4 305 B8R0.19 CC=C(C)CC(=O)OC CNP0103912.0 [1,1,0,0,0,0|0,0,1]=3 306 B8R0.19 CCC(=CC(=O)OC)C CNP0599334.0 [1,1,0,0,0,0|0,0,2]=4 307 B8R0.19 CCC(=O)C=C(C)CC CNP0594723.0 [1,1,0,0,0,0|0,0,2]=4 308 B8R0.19 CCC(=O)C[C@@H](C)CC CNP0076878.1 [1,1,0,0,0,0|0,0,0]=2 309 B8R0.19 CCC(=O)C[C@H](C)CC CNP0076878.2 [1,1,0,0,0,0|0,0,0]=2 310 B8R0.19 CCC(=O)O[C@@H](C)CC CNP0151376.1 [1,1,0,0,0,0|1,0,0]=3 311 B8R0.19 CCC(C)CC(C)CO CNP0072771.0 [1,1,0,0,0,0|1,0,1]=4 312 B8R0.19 CC[C@@H](C)C[C@@H](C)CC CNP0385244.1 [1,1,0,0,0,0|1,0,1]=4 313 B8R0.19 CC[C@H](C)CC(=O)OC CNP0302802.1 [1,1,0,0,0,0|0,0,0]=2 314 B8R0.19 CC[C@H](C)C[C@H](O)CC CNP0324526.1 [1,1,0,0,0,0|0,0,2]=4 315 B8R0.19 CC[C@H](O)CC(=O)OC CNP0318883.1 [1,1,0,0,0,0|1,0,0]=3 316 B8R0.19 CNC(=CC(=O)OC)C CNP0390582.0 [1,1,0,0,0,0|0,0,2]=4 317 B8R0.19 COC(=O)CC(=O)OC CNP0320608.0 [1,1,0,0,0,0|1,0,1]=4 318 B8R0.19 COC(=O)CC(C)SC CNP0007855.0 [1,1,0,0,0,0|0,0,0]=2 319 B8R0.19 O=C(CO)C[C@@H](O)CO CNP0343552.1 [1,1,0,0,0,0|2,0,0]=4 320 B8R0.23 CC(=O)C(=O)CC(C)C CNP0131749.0 [1,1,0,0,0,0|0,0,1]=3 321 B8R0.23 CC(=O)CC(=O)C(C)C CNP0109827.0 [1,1,0,0,0,0|1,0,1]=4 322 B8R0.23 CC(C)CC(=O)C(=O)O CNP0271985.0 [1,1,0,0,0,0|1,0,1]=4 323 B8R0.23 CC(C)CC(=O)C(C)O CNP0003258.0 [1,1,0,0,0,0|0,0,0]=2 324 B8R0.23 CC(C)C[C@H](C)C(C)C CNP0297055.1 [1,1,0,0,0,0|1,0,1]=4 325 B8R0.23 CC(C)OC(=O)C(C)C CNP0251914.0 [1,1,0,0,0,0|1,0,0]=3 326 B8R0.23 CN(C)CC(=O)N(C)C CNP0095024.0 [1,1,0,0,0,0|2,0,0]=4 327 B8R0.24 C=C(C[N+](C)(C)C)OC CNP0599697.0 [1,1,0,0,0,0|2,0,0]=4 328 B8R0.24 CC(C)(C)NC(=O)CCl CNP0053512.0 [1,1,0,0,0,0|2,0,0]=4 329 B8R0.24 CC=C(C)CC(C)(C)C CNP0003427.0 [1,1,0,0,0,0|1,0,1]=4 330 B8R0.24 CCC(=O)OC(C)(C)C CNP0611667.0 [1,1,0,0,0,0|1,0,0]=3 331 B8R0.24 CC[C@H](C)CC(C)(C)O CNP0378790.1 [1,1,0,0,0,0|1,0,1]=4 332 B8R0.24 COC(=O)CC(C)(C)O CNP0003368.0 [1,1,0,0,0,0|0,0,0]=2 333 B8R0.6 CCCCC[C@H](C)CC CNP0121781.1 [1,1,0,0,0,0|1,0,1]=4 334 B8R0.7 CC(C)CCCCCO CNP0090200.0 [1,1,0,0,0,0|1,0,1]=4 335 B8R0.7 CCC=C=CCC(C)C CNP0589849.0 [1,1,0,0,0,0|1,0,0]=3 336 B8R0.7 CCCCCCC(C)C CNP0161146.0 [1,1,0,0,0,0|1,0,1]=4 337 B8R0.7 CCOCC=CC(C)C CNP0076367.0 [1,1,0,0,0,0|0,0,1]=3 338 B8R0.8 CCCCC(O)C(C)C CNP0610502.0 [1,1,0,0,0,0|1,0,1]=4 339 B8R0.8 CCCC[C@H](C)C(C)C CNP0331704.1 [1,1,0,0,0,0|1,0,1]=4 340 B8R0.9 CCC(=O)CCC(C)C CNP0542568.0 [1,1,0,0,0,0|1,0,1]=4 341 B8R0.9 CCC(=O)OCC(C)C CNP0246924.0 [1,1,0,0,0,0|2,0,0]=4 342 B8R0.9 CCC(C)CCC(C)C CNP0495437.0 [1,1,0,0,0,0|1,0,1]=4 343 B8R0.9 CCC(O)CCC(C)C CNP0554641.0 [1,1,0,0,0,0|1,0,1]=4 344 B8R0.21 CCCCCC(C)(C)S CNP0505610.0 [1,1,0,0,0,0|1,0,1]=4 345 B8R0.28 CC(=O)C=CCC(C)C CNP0400137.0 [1,1,0,0,0,0|1,0,1]=4 346 B8R0.28 CC(=O)OCCC(C)C CNP0303079.0 [1,1,0,0,0,0|0,0,2]=4 347 B8R0.28 CC(=S)OCCC(C)C CNP0547891.0 [1,1,0,0,0,0|0,0,2]=4 348 B8R0.28 CC(C)CCCC(C)C CNP0166483.0 [1,1,0,0,0,0|1,0,1]=4 349 B8R0.28 CC(C)CCC[C@@H](C)N CNP0402006.1 [1,1,0,0,0,0|1,0,1]=4 350 B8R0.28 CC(C)CCC[C@H](C)N CNP0402006.2 [1,1,0,0,0,0|1,0,1]=4 351 B8R0.28 CC(C)CCC[C@H](C)O CNP0182781.1 [1,1,0,0,0,0|1,0,1]=4 352 B8R0.28 CC(C)CNCC(C)C CNP0347227.0 [1,1,0,0,0,0|2,0,0]=4 353 B8R0.28 CC(C)COCC(C)C CNP0126629.0 [1,1,0,0,0,0|2,0,0]=4 354 B8R0.1 C=CCCC(=O)OCC CNP0003358.0 [1,1,0,0,0,0|0,0,1]=3 355 B8R0.1 C=CCOC(=O)CCC CNP0002468.0 [1,1,0,0,0,0|0,0,1]=3 356 B8R0.1 CC=CC(=O)CCCC CNP0170062.0 [1,1,0,0,0,0|1,0,1]=4 357 B8R0.1 CCCC(=O)OCSC CNP0002701.0 [1,1,0,0,0,0|0,0,0]=2 358 B8R0.1 CCCCC(=O)CCC CNP0094009.0 [1,1,0,0,0,0|1,0,0]=3 359 B8R0.1 CCCCC(=O)OCC CNP0305309.0 [1,1,0,0,0,0|0,0,0]=2 360 B8R0.1 CCCOC(=O)CCC CNP0083884.0 [1,1,0,0,0,0|0,0,0]=2 361 B8R0.1 CCCOC(C)OCC CNP0154058.0 [1,1,0,0,0,0|1,0,1]=4 362 B8R0.1 CCOC(=O)CCC=O CNP0576338.0 [1,1,0,0,0,0|0,0,1]=3 363 B8R0.1 CCOC(=O)CCCO CNP0364509.0 [1,1,0,0,0,0|0,0,0]=2 364 B8R0.1 CCOC(=O)CCSC CNP0199051.0 [1,1,0,0,0,0|0,0,0]=2 365 B8R0.1 CCO[S@H](=O)SCSC CNP0547114.1 [1,1,0,0,0,0|2,0,0]=4 366 B8R0.1 CCO[S@](=O)SCSC CNP0331532.1 [1,1,0,0,0,0|2,0,0]=4 367 B8R0.3 C/C=C/C(=O)[C@@H](C)CC CNP0293827.1 [1,1,0,0,0,0|1,0,1]=4 368 B8R0.3 C/C=C/C(=O)[C@H](C)CC CNP0293827.2 [1,1,0,0,0,0|1,0,1]=4 369 B8R0.3 C=C(CC)C(=O)COC CNP0612231.0 [1,1,0,0,0,0|2,0,0]=4 370 B8R0.3 CC=C(C)C(=O)OCC CNP0316393.0 [1,1,0,0,0,0|0,0,2]=4 371 B8R0.3 CCCC(=O)C(=O)CC CNP0163333.0 [1,1,0,0,0,0|1,0,0]=3 372 B8R0.3 CCCC(=O)C(C)CC CNP0595391.0 [1,1,0,0,0,0|1,0,0]=3 373 B8R0.3 CCOC(=O)C(=O)CC CNP0506120.0 [1,1,0,0,0,0|0,0,1]=3 374 B8R0.3 CCOC(=O)[C@@H](C)C=O CNP0028245.1 [1,1,0,0,0,0|1,0,1]=4 375 B8R0.3 CCOC(=O)[C@@H](C)CC CNP0105613.2 [1,1,0,0,0,0|0,0,0]=2 376 B8R0.3 CCOC(=O)[C@@H](N)CO CNP0522179.2 [1,1,0,0,0,0|1,0,0]=3 377 B8R0.3 CCOC(=O)[C@@H](N)CS CNP0398806.2 [1,1,0,0,0,0|1,0,0]=3 378 B8R0.3 CCOC(=O)[C@H](C)CC CNP0105613.1 [1,1,0,0,0,0|0,0,0]=2 379 B8R0.3 CCOC(=O)[C@H](N)CO CNP0522179.1 [1,1,0,0,0,0|1,0,0]=3 380 B8R0.3 CCOC(=O)[C@H](O)C#N CNP0342133.1 [1,1,0,0,0,0|1,0,1]=4 381 B8R0.22 CCC=C(C=O)CCC CNP0527539.0 [1,1,0,0,0,0|1,0,0]=3 382 B8R0.22 CCCC(=NO)CCC CNP0366648.0 [1,1,0,0,0,0|1,0,1]=4 383 B8R0.22 CCCN(C=O)CCC CNP0082253.0 [1,1,0,0,0,0|2,0,0]=4 384 B8R0.30 CCCS(=O)(=O)CCC CNP0537279.0 [1,1,0,0,0,0|2,0,0]=4 385 B8R0.30 CCOP(=O)(Cl)OCC CNP0609096.0 [1,1,0,0,0,0|2,0,0]=4 386 B8R0.30 CCOP(=O)(O)OCC CNP0088182.0 [1,1,0,0,0,0|2,0,0]=4 387 B8R0.30 CCOS(=O)(=O)OCC CNP0264783.0 [1,1,0,0,0,0|2,0,0]=4 388 B8R0.14 CCCC(=O)C(C)(C)C CNP0077010.0 [0,1,0,0,1,0|1,0,0]=3 389 B8R0.14 CCOC(=O)C(Br)(Br)Br CNP0194648.0 [0,1,0,0,1,0|2,0,0]=4 390 B8R0.14 CCOC(=O)C(C)(C)Br CNP0075932.0 [0,1,0,0,1,0|0,0,0]=2 391 B8R0.15 CCNC(C=O)C(C)C CNP0584260.0 [0,1,0,0,1,0|1,0,1]=4 392 B10R0.26 CCOC(=O)C=C(C)C(C)C CNP0344485.0 [0,1,0,0,0,1|0,0,1]=3 393 B10R0.32 CCOC(=O)[C@@H](N)CC(C)C CNP0332739.1 [0,1,0,0,0,1|0,0,0]=2 394 B10R0.32 CCOC(=O)[C@@H](O)CC(C)C CNP0389022.1 [0,1,0,0,0,1|0,0,0]=2 395 B10R0.32 CCOC(=O)[C@H](C)C[C@H](C)O CNP0280330.1 [0,1,0,0,0,1|1,0,0]=3 396 B10R0.32 CCOC(=O)[C@H](C)OC(=O)C CNP0114784.1 [0,1,0,0,0,1|1,0,1]=4 397 B10R0.57 CC=C(C)C(=O)NCC(C)C CNP0353529.0 [0,1,0,0,0,1|1,0,1]=4 398 B10R0.57 CC=C(C)C(=O)OCC(C)C CNP0164553.0 [0,1,0,0,0,1|1,0,1]=4 399 B10R0.57 CCC(C)C(=O)OCC(C)C CNP0380651.0 [0,1,0,0,0,1|1,0,0]=3 400 B10R0.78 CCCCC(=O)OCC(C)C CNP0437103.0 [0,1,0,0,0,1|1,0,0]=3 401 B10R0.78 CCCOC(=O)CCC(=O)C CNP0002391.0 [0,1,0,0,0,1|1,0,1]=4 402 B10R0.96 CC(=O)CC(=O)OCC(C)C CNP0066978.0 [0,1,0,0,0,1|1,0,1]=4 403 B10R0.96 CC(C)C=CC(=O)CC(C)C CNP0168890.0 [0,1,0,0,0,1|1,0,1]=4 404 B10R0.96 CC(C)CNC(=O)CC(C)C CNP0439722.0 [0,1,0,0,0,1|1,0,0]=3 405 B10R0.96 CC(C)COC(=O)CC(C)C CNP0361085.0 [0,1,0,0,0,1|1,0,0]=3 406 B10R0.105 CCO[P@](=O)(O)CCN(C)C CNP0139534.1 [0,1,0,0,0,1|2,0,0]=4 407 B10R0.108 CCCC(=O)OCC(C)CC CNP0003450.0 [0,1,0,0,0,1|1,0,0]=3 408 B10R0.108 CCCC(=O)OC[C@@H](O)CO CNP0583085.2 [0,1,0,0,0,1|2,0,0]=4 409 B10R0.108 CCCC(=O)OC[C@H](O)CO CNP0583085.1 [0,1,0,0,0,1|2,0,0]=4 410 B10R0.108 CCOC(=O)CNC(=O)CN CNP0593562.0 [0,1,0,0,0,1|1,0,1]=4 411 B10R0.109 CCOC(=O)CCS(=O)(=O)C CNP0414710.0 [0,1,0,0,0,1|2,0,0]=4 412 B10R0.6 CC(C)CC(=O)NCCC=O CNP0412095.0 [0,2,0,0,0,0|1,0,0]=3 413 B10R0.6 CCCCCC(=O)OC(C)C CNP0202716.0 [0,2,0,0,0,0|2,0,0]=4 414 B10R0.6 CCCCOC(=O)CC(=O)C CNP0002486.0 [0,2,0,0,0,0|1,0,1]=4 415 B10R0.6 CCCCOC(=O)CC(C)C CNP0084165.0 [0,2,0,0,0,0|0,0,0]=2 416 B10R0.6 CCCCOC(=O)C[C@@H](C)O CNP0226564.2 [0,2,0,0,0,0|1,0,0]=3 417 B10R0.6 CCCCOC(=O)C[C@H](C)O CNP0226564.1 [0,2,0,0,0,0|1,0,0]=3 418 B10R0.6 COCCOC(=O)C[C@@H](C)O CNP0205160.1 [0,2,0,0,0,0|1,0,0]=3 419 B10R0.28 CC(C)(C)OC(=O)NCCN CNP0061154.0 [0,2,0,0,0,0|2,0,0]=4 420 B10R0.44 C=CC(=CC(=O)CC(C)C)C CNP0231823.0 [0,2,0,0,0,0|1,0,1]=4 421 B10R0.44 C=C[C@@H](C)CC(=O)CC(C)C CNP0350392.1 [0,2,0,0,0,0|1,0,0]=3 422 B10R0.44 C=C[C@H](C)CC(=O)CC(C)C CNP0350392.2 [0,2,0,0,0,0|1,0,0]=3 423 B10R0.44 CCC(C)CC(=O)C=C(C)C CNP0609623.0 [0,2,0,0,0,0|1,0,1]=4 424 B10R0.44 CC[C@@H](C)SC(=O)CC(C)C CNP0382441.1 [0,2,0,0,0,0|0,1,0]=3 425 B10R0.13 CC(=O)OC(=O)[C@H](O)C(C)C CNP0276510.1 [0,2,0,0,0,0|0,0,1]=3 426 B10R0.13 CC(=O)[C@H](C)C(=O)CC(C)C CNP0277115.1 [0,2,0,0,0,0|1,0,1]=4 427 B10R0.35 CCOC(=O)C(O)C(C)CC CNP0296108.0 [0,2,0,0,0,0|0,0,0]=2 428 B10R0.36 CCOC(=O)C(C)(C)C(C)O CNP0562929.0 [0,2,0,0,0,0|1,0,0]=3 429 B10R0.79 CCOC(CC(C)C)OCC CNP0003252.0 [0,2,0,0,0,0|0,0,2]=4 430 B10R0.46 CC[C@@H](C)SC(=O)[C@H](C)CC CNP0265928.1 [0,2,0,0,0,0|2,0,0]=4 431 B10R0.2 CCCC(=O)CC(=O)OCC CNP0003512.0 [0,2,0,0,0,0|1,0,1]=4 432 B10R0.2 CCCC(=O)OC(C)CCC CNP0118403.0 [0,2,0,0,0,0|2,0,0]=4 433 B10R0.2 CCCC(O)CC(=O)OCC CNP0256152.0 [0,2,0,0,0,0|1,0,0]=3 434 B10R0.2 CCOC(=O)CC(=O)OCC CNP0079918.0 [0,2,0,0,0,0|1,0,1]=4 435 B10R0.7 CCOC(=O)C[C@](C)(O)CC CNP0284617.1 [0,2,0,0,0,0|0,0,0]=2 436 B10R0.165 CC(C)OP(=O)(C)OC(C)C CNP0077258.0 [0,2,0,0,0,0|2,0,0]=4 437 B8R1.1 CC[C@@H]1CC[C@@H](C1)C CNP0136815.1 [1,0,0,1,0,0|1,0,1]=4 438 B8R1.1 CC[C@@H]1CC[C@H](C1)C CNP0136815.2 [1,0,0,1,0,0|1,0,1]=4 439 B8R1.4 CC1=CC(=O)CCC1 CNP0209762.0 [1,0,0,1,0,0|0,0,2]=4 440 B8R1.4 CC1=CC(=O)OCC1 CNP0413900.0 [1,0,0,1,0,0|0,0,2]=4 441 B8R1.4 CC1=CC(CCC1)C CNP0085833.0 [1,0,0,1,0,0|1,0,1]=4 442 B8R1.4 CC1=CCCC(=O)C1 CNP0076330.0 [1,0,0,1,0,0|0,0,2]=4 443 B8R1.4 CC1CC=CC(=O)C1 CNP0522143.0 [1,0,0,1,0,0|0,0,2]=4 444 B8R1.4 CC1CCOC(=O)C1 CNP0282964.0 [1,0,0,1,0,0|0,0,0]=2 445 B8R1.4 C[C@@H]1CCCC(=O)C1 CNP0243495.2 [1,0,0,1,0,0|0,0,0]=2 446 B8R1.4 C[C@@H]1CCCC(=O)O1 CNP0340427.1 [1,0,0,1,0,0|1,0,0]=3 447 B8R1.4 C[C@@H]1CCC[C@@H](C1)C CNP0169936.1 [1,0,0,1,0,0|1,0,1]=4 448 B8R1.4 C[C@@H]1CCC[C@@H](C1)O CNP0155717.1 [1,0,0,1,0,0|0,0,2]=4 449 B8R1.4 C[C@@H]1CCC[C@H](C1)C CNP0169936.2 [1,0,0,1,0,0|1,0,1]=4 450 B8R1.4 C[C@@H]1CCC[C@H](C1)O CNP0155717.2 [1,0,0,1,0,0|0,0,2]=4 451 B8R1.4 C[C@H]1CCCC(=O)C1 CNP0243495.1 [1,0,0,1,0,0|0,0,0]=2 452 B8R1.4 C[C@H]1CCCC(=O)O1 CNP0340427.2 [1,0,0,1,0,0|1,0,0]=3 453 B8R1.4 C[C@H]1CCC[C@@H](C1)O CNP0155717.3 [1,0,0,1,0,0|0,0,2]=4 454 B8R1.4 C[C@H]1CCC[C@H](C1)O CNP0155717.4 [1,0,0,1,0,0|0,0,2]=4 455 B8R1.18 CC1CC(C(=O)O1)N CNP0391379.0 [1,0,0,1,0,0|2,0,0]=4 456 B8R1.18 CC1CN(NC1=O)C CNP0529089.0 [1,0,0,1,0,0|2,0,0]=4 457 B8R1.18 CC1C[C@H]([C@@H](C1)C)C CNP0321029.2 [1,0,0,1,0,0|1,0,1]=4 458 B8R1.18 C[C@@H]1C[C@@H](C(=O)O1)C CNP0247990.1 [1,0,0,1,0,0|1,0,0]=3 459 B8R1.18 C[C@@H]1C[C@@H](C(=O)O1)O CNP0321716.1 [1,0,0,1,0,0|2,0,0]=4 460 B8R1.18 C[C@@H]1C[C@H]([C@H](C1)C)C CNP0321029.1 [1,0,0,1,0,0|1,0,1]=4 461 B8R1.31 C[C@@H](O)[C@@H]1CNC1=O CNP0044057.1 [1,0,0,1,0,0|2,0,0]=4 462 B8R1.51 CC1(C=CC(=O)C1)C CNP0075974.0 [1,0,0,1,0,0|0,0,2]=4 463 B8R1.51 CC1(COC(=O)C1)C CNP0084721.0 [1,0,0,1,0,0|0,0,0]=2 464 B8R1.51 CC1=NC(CO1)(C)C CNP0063673.0 [1,0,0,1,0,0|2,0,0]=4 465 B8R1.51 C[C@H]1CCC(C1)(C)C CNP0133145.1 [1,0,0,1,0,0|1,0,1]=4 466 B8R1.7 CC(C)C1CCCC1 CNP0315126.0 [1,0,0,1,0,0|1,0,1]=4 467 B8R1.19 C[C@H]1CCCC1(C)C CNP0142130.1 [1,0,0,1,0,0|1,0,1]=4 468 B8R1.22 CC1CCCCCC1 CNP0214318.0 [1,0,0,1,0,0|1,0,1]=4 469 B8R1.36 CCCCCC1CC1 CNP0610547.0 [1,0,0,1,0,0|1,0,1]=4 470 B8R1.72 CC1(CCCCC1)C CNP0281819.0 [1,0,0,1,0,0|1,0,1]=4 471 B8R1.8 CCC=C1CCCC1 CNP0325076.0 [1,0,0,1,0,0|2,0,0]=4 472 B8R1.8 CCCN1OCCO1 CNP0257167.0 [1,0,0,1,0,0|1,0,1]=4 473 B8R1.11 CCC1=C(CCC1)C CNP0488475.0 [1,0,0,1,0,0|2,0,0]=4 474 B8R1.11 CCC1=CCCC1=O CNP0033334.0 [1,0,0,1,0,0|1,0,1]=4 475 B8R1.11 CCC1CCCC1=O CNP0494839.0 [1,0,0,1,0,0|1,0,0]=3 476 B8R1.11 CCC1SCCC1=O CNP0185206.0 [1,0,0,1,0,0|2,0,0]=4 477 B8R1.11 CC[C@@H]1CC=CC1=O CNP0060906.1 [1,0,0,1,0,0|1,0,1]=4 478 B8R1.11 CC[C@H]1CC=CC1=O CNP0060906.2 [1,0,0,1,0,0|1,0,1]=4 479 B8R1.11 CC[C@H]1CCNC1=O CNP0289303.1 [1,0,0,1,0,0|1,0,0]=3 480 B8R1.5 C=C1CCCCC1C CNP0595985.0 [0,0,0,1,1,0|2,0,0]=4 481 B8R1.5 CC1CCCC=C1Cl CNP0566805.0 [0,0,0,1,1,0|2,0,0]=4 482 B8R1.5 CC1CCCCC1=O CNP0003363.0 [0,0,0,1,1,0|1,0,0]=3 483 B8R1.5 CC1CCCOC1=O CNP0340524.0 [0,0,0,1,1,0|0,0,0]=2 484 B8R1.5 N[C@@H]1CCCNC1=O CNP0274946.1 [0,0,0,1,1,0|2,0,0]=4 485 B8R1.5 O=C1CCCCC1O CNP0610127.0 [0,0,0,1,1,0|2,0,0]=4 486 B10R1.59 CC(C)C1=CC(=O)O[C@H]1C CNP0132158.1 [0,0,0,1,0,1|0,0,1]=3 487 B10R1.64 CC(=O)N[C@H]1CCOC1=O CNP0535066.1 [0,0,0,1,0,1|1,0,1]=4 488 B10R1.66 CC(C)CCC1=CCCC1 CNP0084867.0 [0,0,0,1,0,1|2,0,0]=4 489 B10R1.107 CC(=O)N[C@@H]1C(=O)O[C@@H]1C CNP0213056.1 [0,0,0,1,0,1|1,0,1]=4 490 B10R1.107 CC(=O)N[C@H]1C(=O)O[C@H]1C CNP0213056.2 [0,0,0,1,0,1|1,0,1]=4 491 B10R1.113 CC(C)C1=CC(=O)OCC1 CNP0611279.0 [0,0,0,1,0,1|0,0,1]=3 492 B10R1.302 CC1(C=CC(=O)CCC1)C CNP0102920.0 [0,0,0,1,0,1|1,0,1]=4 493 B10R1.8 CCC1=CC(=O)C[C@@H](O1)C CNP0217841.2 [0,1,0,1,0,0|2,0,0]=4 494 B10R1.8 CCC1=CC(=O)C[C@H](O1)C CNP0217841.1 [0,1,0,1,0,0|2,0,0]=4 495 B10R1.61 CC(C)C1CCCCC1=O CNP0486183.0 [0,1,0,1,0,0|1,0,0]=3 496 B10R1.61 CC(C)C1OCCNC1=O CNP0105827.0 [0,1,0,1,0,0|1,0,0]=3 497 B10R1.61 CC1=C(CCCO1)C(C)C CNP0344846.0 [0,1,0,1,0,0|1,0,1]=4 498 B10R1.61 CC1=C(CCOC1)C(C)C CNP0355159.0 [0,1,0,1,0,0|1,0,1]=4 499 B10R1.61 CC1=C(NCCO1)C(C)C CNP0315971.0 [0,1,0,1,0,0|1,0,1]=4 500 B10R1.120 CC1(OC(=O)CC[C@@H]1O)C CNP0280120.1 [0,1,0,1,0,0|2,0,0]=4 501 B10R1.192 C[C@@H]1COC(=O)[C@H]1[C@@H](C)O CNP0272849.1 [0,1,0,1,0,0|1,0,0]=3 502 B10R1.192 C[C@H](O)C1C(=O)OC[C@@H]1C CNP0272849.2 [0,1,0,1,0,0|1,0,0]=3 503 B10R1.192 C[C@H](O)[C@@H]1C(=O)OC[C@H]1C CNP0272849.3 [0,1,0,1,0,0|1,0,0]=3 504 B10R1.444 CCC1=CC(=O)OC1(C)C CNP0124592.0 [0,1,0,1,0,0|2,0,0]=4 505 B10R1.34 CCC1CC(C(=O)C1=O)C CNP0002849.0 [0,1,0,1,0,0|1,0,1]=4 506 B10R1.291 CC(=O)[C@@]1(CCOC1=O)C CNP0364399.2 [0,1,0,1,0,0|1,0,1]=4 507 B10R1.291 CC(=O)[C@]1(CCOC1=O)C CNP0364399.1 [0,1,0,1,0,0|1,0,1]=4 508 B10R1.339 C=C1C[C@H](C([C@H]1C)(C)C)C CNP0483236.1 [0,1,0,1,0,0|2,0,0]=4 509 B10R1.162 CN[C@@H]1CCCCC(=O)C1 CNP0162632.1 [0,1,0,1,0,0|1,0,0]=3 510 B10R1.162 CN[C@H]1CCCCC(=O)C1 CNP0162632.2 [0,1,0,1,0,0|1,0,0]=3 511 B10R1.194 CC(C)C1CCC(=O)C1=O CNP0002623.0 [0,1,0,1,0,0|1,0,0]=3 512 B10R1.271 CC1=C(C(=O)CC1(C)C)O CNP0380715.0 [0,1,0,1,0,0|1,0,1]=4 513 B10R1.135 CCOC(=O)C1CC1CO CNP0490095.0 [0,1,0,1,0,0|0,0,0]=2 514 B10R1.149 CCC(C)C1CCCC1=O CNP0505342.0 [0,1,0,1,0,0|1,0,0]=3 515 B10R1.485 C=C[C@@]1(CCOC(=O)C1)O CNP0311946.1 [0,1,0,1,0,0|1,0,1]=4 516 B10R1.485 C=C[C@]1(CCOC(=O)C1)O CNP0311946.2 [0,1,0,1,0,0|1,0,1]=4 517 B10R1.329 CC1(CC(=O)C=C(C1)O)C CNP0462432.0 [0,1,0,1,0,0|1,0,1]=4 518 B10R1.329 CC1(CC(=O)CC(=O)C1)C CNP0566053.0 [0,1,0,1,0,0|1,0,1]=4 519 B10R1.329 CC1=CC(=O)CC(C1)(C)C CNP0196251.0 [0,1,0,1,0,0|1,0,1]=4 520 B10R1.329 CC1=CC(=O)OC(C1)(C)C CNP0077000.0 [0,1,0,1,0,0|0,0,2]=4 521 B10R1.329 CC1=CC(CC(=O)C1)(C)C CNP0135841.0 [0,1,0,1,0,0|1,0,1]=4 522 B10R1.329 CC1=C[C@@H](CC(C1)(C)C)O CNP0077291.2 [0,1,0,1,0,0|2,0,0]=4 523 B10R1.329 CC1=C[C@H](CC(C1)(C)C)O CNP0077291.1 [0,1,0,1,0,0|2,0,0]=4 524 B10R1.329 C[C@@H]1CC(=O)CC(C1)(C)C CNP0419285.1 [0,1,0,1,0,0|1,0,0]=3 525 B10R1.329 C[C@@]1(CC(=O)O[C@H](C1)O)O CNP0293170.1 [0,1,0,1,0,0|1,0,0]=3 526 B10R2.244 O=C1NCCCC2C1O2 CNP0610958.0 [0,0,0,2,0,0|2,0,0]=4 527 B10R2.244 O=C1NCCC[C@@H]2[C@H]1O2 CNP0610958.1 [0,0,0,2,0,0|2,0,0]=4 528 B10R2.179 CC12CCCC(=O)C1O2 CNP0566501.0 [0,0,0,2,0,0|2,0,0]=4 529 B6R0.3 C=C(C)C(=O)OC CNP0278102.0 [1,0,0,0,1,0|0,0,2]=4 530 B6R0.3 C=CC(=O)C(C)C CNP0350661.0 [1,0,0,0,1,0|0,0,2]=4 531 B6R0.3 CC(Br)C(=O)CBr CNP0435945.0 [1,0,0,0,1,0|2,0,0]=4 532 B6R0.3 CC(C)C(=O)C#N CNP0344819.0 [1,0,0,0,1,0|1,0,1]=4 533 B6R0.3 CC(O)C(=O)CO CNP0185354.0 [1,0,0,0,1,0|2,0,0]=4 534 B6R0.3 CCC(=C(C)C)C CNP0076862.0 [1,0,0,0,1,0|1,0,1]=4 535 B6R0.3 CCC(=O)C(=O)C CNP0311036.0 [1,0,0,0,1,0|1,0,1]=4 536 B6R0.3 CCC(=O)C(C)C CNP0169958.0 [1,0,0,0,1,0|0,0,0]=2 537 B6R0.3 CCC(=O)C(C)S CNP0003027.0 [1,0,0,0,1,0|1,0,0]=3 538 B6R0.3 CCC(=O)N(C)C CNP0205998.0 [1,0,0,0,1,0|1,0,0]=3 539 B6R0.3 CCC(=O)[C@H](C)N CNP0316941.1 [1,0,0,0,1,0|1,0,0]=3 540 B6R0.3 CCC(=O)[C@H](C)O CNP0287252.1 [1,0,0,0,1,0|1,0,0]=3 541 B6R0.3 CCC(O)C(C)C CNP0265736.0 [1,0,0,0,1,0|0,0,2]=4 542 B6R0.3 CCC(S)C(C)C CNP0611989.0 [1,0,0,0,1,0|0,1,1]=4 543 B6R0.3 CC[C@H](C)C(C)C CNP0304167.1 [1,0,0,0,1,0|1,0,1]=4 544 B6R0.3 CNC(=O)N(C)C CNP0499080.0 [1,0,0,0,1,0|2,0,0]=4 545 B6R0.3 COC(=O)C(=O)C CNP0301085.0 [1,0,0,0,1,0|1,0,1]=4 546 B6R0.3 COC(=O)C(Br)Br CNP0192713.0 [1,0,0,0,1,0|2,0,0]=4 547 B6R0.3 COC(=O)C(C)C CNP0354997.0 [1,0,0,0,1,0|0,0,0]=2 548 B6R0.3 COC(=O)[C@@H](C)N CNP0396122.3 [1,0,0,0,1,0|1,0,0]=3 549 B6R0.3 COC(=O)[C@@H](C)O CNP0238296.2 [1,0,0,0,1,0|1,0,0]=3 550 B6R0.3 COC(=O)[C@@H](N)O CNP0142697.1 [1,0,0,0,1,0|2,0,0]=4 551 B6R0.3 COC(=O)[C@H](C)N CNP0396122.2 [1,0,0,0,1,0|1,0,0]=3 552 B6R0.3 COC(=O)[C@H](C)O CNP0238296.1 [1,0,0,0,1,0|1,0,0]=3 553 B6R0.3 COC(=S)C(C)C CNP0507266.0 [1,0,0,0,1,0|0,1,0]=3 554 B10R0.3 CCCC(=O)OCCC(C)C CNP0144794.0 [0,0,0,0,0,2|1,0,0]=3 555 B10R0.3 CCOC(=O)/C=C/C[C@H](C)O CNP0226246.1 [0,0,0,0,0,2|1,0,0]=3 556 B10R0.3 CCOC(=O)CCCC(=O)C CNP0564200.0 [0,0,0,0,0,2|1,0,1]=4 557 B10R0.3 CCOC(=O)CCCC(C)C CNP0181211.0 [0,0,0,0,0,2|0,0,0]=2 558 B10R0.3 CCOC(=O)CCCC(C)O CNP0612036.0 [0,0,0,0,0,2|1,0,0]=3 559 B10R0.3 COCC(=O)NCCC(C)C CNP0213339.0 [0,0,0,0,0,2|2,0,0]=4