0 B8R0.28 C=C(C)CCCC(=O)O 2321-1-18 [0,0,0,0,0,0|0,0,2]=2 1 B8R0.28 CC(=O)CCCC(=O)O 2129-1-0X [0,0,0,0,0,0|1,0,1]=2 2 B8R0.28 CC(=O)CCCC(C)C 2117-1-0E [0,0,0,0,0,0|1,0,0]=1 3 B8R0.28 CC(=O)CCCN(C)C 4156-1-51 [0,0,0,0,0,0|2,0,0]=2 4 B8R0.28 CC(=O)CCOC(C)C 2117-1-0F [0,0,0,0,0,0|2,0,0]=2 5 B8R0.28 CC(=O)COCC(C)F 2117-3-1F [0,0,0,0,0,0|3,0,0]=3 6 B8R0.28 CC(=O)COCC(F)F 2117-3-1L [0,0,0,0,0,0|4,0,0]=4 7 B8R0.28 CC(=O)OCC=C(C)C 2323-1-0B [0,0,0,0,0,0|2,0,2]=4 8 B8R0.28 CC(=O)OCCN(C)C 4132-1-05 [0,0,0,0,0,0|3,0,0]=3 9 B8R0.28 CC(C)CCCC(=O)O 2121-1-15 [0,0,0,0,0,0|0,0,0]=0 10 B8R0.28 CC(C)CCOC(=O)Cl 2116-5-27 [0,0,0,0,0,0|2,0,0]=2 11 B8R0.28 CC(C)CCO[N+](=O)[O-] 4254-1-03 [0,0,0,0,0,0|2,0,1]=3 12 B8R0.28 CC(C)CNCC(C)C 3133-5-09 [0,0,0,0,0,0|3,0,1]=4 13 B8R0.28 CC(C)COCC(C)C 2107-1-0D [0,0,0,0,0,0|3,0,1]=4 14 B8R0.28 CC(C)C[AlH4]CC(C)C 9113-1-01 [0,0,0,0,0,0|3,0,1]=4 15 B8R0.28 CN(C)C\C=C\C(=O)O 4358-5-32 [0,0,0,0,0,0|1,0,2]=3 16 B8R0.28 NC(=O)CCC[N+](=O)[O-] 4148-1-46 [0,0,0,0,0,0|4,0,0]=4 17 B8R0.28 NC(=O)COCC(=O)O 4148-1-23 [0,0,0,0,0,0|3,0,1]=4 18 B8R0.28 O=C(Cl)CCCC(=O)Cl 2126-5-X0 [0,0,0,0,0,0|3,0,1]=4 19 B8R0.28 O=C(O)CCCC(=O)O 2121-1-25 [0,0,0,0,0,0|2,0,1]=3 20 B8R0.28 O=C(O)CNCC(=O)O 4157-1-48 [0,0,0,0,0,0|3,0,1]=4 21 B8R0.28 O=C(O)COCC(=O)O 2121-1-0B [0,0,0,0,0,0|3,0,1]=4 22 B7R0.4 C=C(Br)CCCCC 1300-9-09 [1,0,0,0,0,0|2,0,0]=3 23 B7R0.4 C=C(C)CCCCC 1300-1-36 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.4 C=C(Cl)CCCCC 1300-5-27 [1,0,0,0,0,0|2,0,0]=3 25 B7R0.4 C=CCCCC(=O)O 2321-1-0P [1,0,0,0,0,0|0,0,2]=3 26 B7R0.4 C=CCOCC(C)F 2307-3-00 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.4 CC(=O)CCCC#N 4137-1-0V [1,0,0,0,0,0|2,0,1]=4 28 B7R0.4 CC(=O)CCCCCl 2117-5-05 [1,0,0,0,0,0|2,0,0]=3 29 B7R0.4 CC(=O)COCCBr 2117-9-07 [1,0,0,0,0,0|3,0,0]=4 30 B7R0.4 CC(=O)COCCCl 2117-5-0B [1,0,0,0,0,0|3,0,0]=4 31 B7R0.4 CC(=O)NCCCN 4148-5-0D [1,0,0,0,0,0|3,0,0]=4 32 B7R0.4 CC(=O)NCCCO 4156-1-Y9 [1,0,0,0,0,0|3,0,0]=4 33 B7R0.4 CC(=O)OCCCCl 2123-5-0U [1,0,0,0,0,0|3,0,0]=4 34 B7R0.4 CC(=O)OCCCF 2123-3-1D [1,0,0,0,0,0|3,0,0]=4 35 B7R0.4 CC(C)=CCOC=O 2323-1-28 [1,0,0,0,0,0|1,0,2]=4 36 B7R0.4 CC(C)NCCCO 4156-1-3T [1,0,0,0,0,0|1,0,1]=3 37 B7R0.4 CC(C)OCCCCl 2107-5-0Y [1,0,0,0,0,0|2,0,1]=4 38 B7R0.4 CC(C)OCCCF 2107-3-6X [1,0,0,0,0,0|2,0,1]=4 39 B7R0.4 CC(F)COCCO 2107-3-0B [1,0,0,0,0,0|2,0,1]=4 40 B7R0.4 CCCCC=C(F)F 1300-3-97 [1,0,0,0,0,0|2,0,1]=4 41 B7R0.4 CCCCCC(C)=O 2117-1-14 [1,0,0,0,0,0|1,0,0]=2 42 B7R0.4 CCCCCC(C)N 3130-1-X7 [1,0,0,0,0,0|2,0,1]=4 43 B7R0.4 CCCCCC(C)O 2102-1-05 [1,0,0,0,0,0|1,0,1]=3 44 B7R0.4 CCCCCC(N)=O 4148-1-1F [1,0,0,0,0,0|1,0,0]=2 45 B7R0.4 CCCCOC(=O)Cl 2116-5-31 [1,0,0,0,0,0|2,0,0]=3 46 B7R0.4 CCCCOC(N)=O 4156-1-2H [1,0,0,0,0,0|2,0,0]=3 47 B7R0.4 CCCCO[N+](=O)[O-] 4154-1-0C [1,0,0,0,0,0|2,0,1]=4 48 B7R0.4 CCCCSC(C)=O 6166-1-0F [1,0,0,0,0,0|2,0,0]=3 49 B7R0.4 CCCOCC(=O)O 2121-1-0F [1,0,0,0,0,0|1,0,0]=2 50 B7R0.4 CCC\C=C\C(C)=O 2317-1-0B [1,0,0,0,0,0|1,0,2]=4 51 B7R0.4 CCOCCC(=O)O 2121-1-0E [1,0,0,0,0,0|1,0,0]=2 52 B7R0.4 CN(C)CCCC#N 3137-1-0C [1,0,0,0,0,0|2,0,1]=4 53 B7R0.4 CN(C)CCCCN 3132-1-00 [1,0,0,0,0,0|2,0,1]=4 54 B7R0.4 CN(C)CCCCO 4132-1-04 [1,0,0,0,0,0|1,0,1]=3 55 B7R0.4 CNCCNC(C)C 3131-1-20 [1,0,0,0,0,0|3,0,0]=4 56 B7R0.4 COCCCC(=O)O 2121-1-51 [1,0,0,0,0,0|1,0,0]=2 57 B7R0.4 COCCCN(C)C 4156-1-53 [1,0,0,0,0,0|3,0,0]=4 58 B7R0.4 COCCNC(C)C 4156-1-3P [1,0,0,0,0,0|3,0,0]=4 59 B7R0.4 C\C=C\CCC(=O)O 2321-1-X1 [1,0,0,0,0,0|0,0,2]=3 60 B7R0.4 N#CCCCC(=O)O 4137-1-0M [1,0,0,0,0,0|1,0,1]=3 61 B7R0.4 NCCCCC(=O)O 4157-1-22 [1,0,0,0,0,0|1,0,0]=2 62 B7R0.4 NOCCCC(=O)O 4147-9-01 [1,0,0,0,0,0|2,0,0]=3 63 B7R0.4 O=C(Cl)CCCCBr 2116-D-X0 [1,0,0,0,0,0|2,0,0]=3 64 B7R0.4 O=C(Cl)OCCCCl 2123-5-0S [1,0,0,0,0,0|3,0,0]=4 65 B7R0.4 O=C(O)CCCCCl 2121-5-05 [1,0,0,0,0,0|1,0,0]=2 66 B7R0.4 O=C(O)COCCCl 2121-5-01 [1,0,0,0,0,0|2,0,0]=3 67 B7R0.4 O=C([O-])CCCCO 2129-1-1E [1,0,0,0,0,0|1,0,1]=3 68 B7R0.4 [C-]#[N+]CCCN(C)C 3137-1-0F [1,0,0,0,0,0|3,0,0]=4 69 B9R0.1 C=CC(=O)OCCC(C)C 2123-1-1B [0,1,0,0,0,0|2,0,0]=3 70 B9R0.1 CCC(C)CCOC(C)=O 2123-1-1C [0,1,0,0,0,0|2,0,0]=3 71 B9R0.1 COC(=O)CCCC(=O)Cl 2123-5-0Y [0,1,0,0,0,0|2,0,1]=4 72 B9R0.1 COC(=O)CCCC(=O)O 2123-1-0N [0,1,0,0,0,0|1,0,1]=3 73 B9R0.1 COC(=O)CCC[N+](=O)[O-] 4154-1-0D [0,1,0,0,0,0|3,0,0]=4 74 B9R0.1 COC(=O)COCC(C)F 2123-3-6K [0,1,0,0,0,0|2,0,0]=3 75 B9R0.1 COC(=O)COCC(F)F 2123-3-6Q [0,1,0,0,0,0|3,0,0]=4 76 B9R0.1 COC(C)CCOC(C)=O 2123-1-1E [0,1,0,0,0,0|2,0,0]=3 77 B9R0.1 O=C(O)CCNC(=O)CCl 4158-5-32 [0,1,0,0,0,0|2,0,1]=4 78 B9R0.7 CC(=O)OCC(N)C(=O)O 4157-1-X8 [0,1,0,0,0,0|2,0,1]=4 79 B9R0.7 CC(=O)SCC(C)C(=O)O 6166-1-X3 [0,1,0,0,0,0|2,0,1]=4 80 B9R0.7 CC(CCC(=O)O)C(=O)O 2121-1-40 [0,1,0,0,0,0|2,0,1]=4 81 B9R0.7 CC(N)C(=O)NCC(=O)O 4157-1-21 [0,1,0,0,0,0|2,0,1]=4 82 B9R0.7 C[C@@H](CCC(=O)O)C(=O)O 2121-1-0V [0,1,0,0,0,0|2,0,1]=4 83 B9R0.7 C[C@H](CCC(=O)O)C(=O)O 2121-1-R2 [0,1,0,0,0,0|2,0,1]=4 84 B9R0.7 C[S+](C)CCC(N)C(=O)O 8166-9-00 [0,1,0,0,0,0|1,0,0]=2 85 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O 8166-9-R0 [0,1,0,0,0,0|1,0,0]=2 86 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O 4157-1-R7 [0,1,0,0,0,0|2,0,1]=4 87 B9R0.7 NC(CCC(=O)O)C(=O)O 4157-1-17 [0,1,0,0,0,0|2,0,1]=4 88 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O 4157-5-S4 [0,1,0,0,0,0|2,0,1]=4 89 B9R0.7 N[C@H](CCC(=O)O)C(=O)O 4157-1-R4 [0,1,0,0,0,0|2,0,1]=4 90 B9R0.7 [C@@H](C)(CSC(C)=O)C(=O)O 6166-1-S1 [0,1,0,0,0,0|2,0,1]=4 91 B9R0.7 [C@H](N)(CCC(=O)O)C(=O)O 4157-1-S4 [0,1,0,0,0,0|2,0,1]=4 92 B9R0.53 CC(=O)CC(=O)CC(C)C 2118-1-06 [0,1,0,0,0,0|1,0,1]=3 93 B9R0.53 CC(C)CC(O)CC(C)C 2102-1-0A [0,1,0,0,0,0|2,0,1]=4 94 B9R0.53 CC(CC(=O)O)CC(=O)O 2121-1-28 [0,1,0,0,0,0|2,0,1]=4 95 B9R0.53 CN(C)CC(O)CC(=O)O 4129-1-X1 [0,1,0,0,0,0|1,0,0]=2 96 B9R0.56 CC(=O)COCC(C)(F)F 2117-3-1P [0,1,0,0,0,0|3,0,0]=4 97 B9R0.56 CC(=O)SCC[N+](C)(C)C 8166-9-01 [0,1,0,0,0,0|3,0,0]=4 98 B9R0.56 CC(=O)SCC[N+](C)(C)C 8166-H-01 [0,1,0,0,0,0|3,0,0]=4 99 B9R0.56 CC(C)(C)OCCC(=O)O 2121-1-10 [0,1,0,0,0,0|1,0,0]=2 100 B9R0.56 CC(C)CCCC(C)(C)Cl 1100-5-43 [0,1,0,0,0,0|2,0,1]=4 101 B9R0.56 CN(C)CCCC(C)(C)Cl 3132-5-06 [0,1,0,0,0,0|3,0,0]=4 102 B9R0.56 CS(=O)(=O)SCCC(=O)O 6166-1-X0 [0,1,0,0,0,0|3,0,0]=4 103 B9R0.56 NS(=O)(=O)CCCC(=O)O 8169-1-06 [0,1,0,0,0,0|3,0,0]=4 104 B9R0.56 O=C(O)CCCP(=O)(O)O 6177-1-26 [0,1,0,0,0,0|3,0,0]=4 105 B9R0.56 O=C(O)CCSC(F)(F)F 6166-3-05 [0,1,0,0,0,0|3,0,0]=4 106 B9R0.56 O=C(O)COCC(F)(F)F 2121-3-0J [0,1,0,0,0,0|3,0,0]=4 107 B9R1.35 CC(=O)C1CCC(=O)O1 2H25-1-36 [0,0,0,1,0,0|1,0,1]=3 108 B9R1.35 CC(=O)N1CC[C@@H](O)C1 4H56-1-PC [0,0,0,1,0,0|3,0,0]=4 109 B9R1.35 CC(C)N1CCC(O)C1 4H01-1-DM [0,0,0,1,0,0|2,0,1]=4 110 B9R1.35 CC(C)[C@@H]1COC(=S)N1 8H67-1-R1 [0,0,0,1,0,0|2,1,0]=4 111 B9R1.35 CC(C)[C@@H]1CSC(=S)N1 7H67-1-R3 [0,0,0,1,0,0|2,1,0]=4 112 B9R1.35 CC(C)[C@H]1COC(=S)N1 8H67-1-S1 [0,0,0,1,0,0|2,1,0]=4 113 B9R1.35 CC(C)[C@H]1CSC(=S)N1 7H67-1-S1 [0,0,0,1,0,0|2,1,0]=4 114 B9R1.35 CC1=NC(C(C)C)CO1 4H44-1-29 [0,0,0,1,0,0|3,0,0]=4 115 B9R1.35 CC1NC(C(=O)O)CS1 8H21-1-72 [0,0,0,1,0,0|2,0,0]=3 116 B9R1.35 CN1CCC(C(=O)O)C1 4H21-5-0C [0,0,0,1,0,0|1,0,0]=2 117 B9R1.35 CN1CC[C@@H](C(=O)O)C1 4H58-5-3S [0,0,0,1,0,0|1,0,0]=2 118 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 4H21-1-S3 [0,0,0,1,0,0|1,0,0]=2 119 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 4H21-5-0M [0,0,0,1,0,0|1,0,0]=2 120 B9R1.35 NC(=O)C1CC(O)CN1 4H48-1-NP [0,0,0,1,0,0|3,0,0]=4 121 B9R1.35 NC1CCC(C(=O)O)C1 4257-5-04 [0,0,0,1,0,0|1,0,0]=2 122 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 4H57-5-X2 [0,0,0,1,0,0|2,0,0]=3 123 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 4H58-1-JN [0,0,0,1,0,0|2,0,0]=3 124 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 4257-1-09 [0,0,0,1,0,0|1,0,0]=2 125 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 4H21-3-24 [0,0,0,1,0,0|2,0,0]=3 126 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 4H56-7-63 [0,0,0,1,0,0|2,0,0]=3 127 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 4H58-3-X7 [0,0,0,1,0,0|2,0,0]=3 128 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 4H58-5-4C [0,0,0,1,0,0|2,0,0]=3 129 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 4H58-3-X5 [0,0,0,1,0,0|2,0,0]=3 130 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 4H29-1-26 [0,0,0,1,0,0|2,0,0]=3 131 B9R1.35 O=C1CCC(C(=O)O)C1 2229-1-06 [0,0,0,1,0,0|1,0,1]=3 132 B9R1.35 O=C1CCC(C(=O)O)N1 4H58-1-009 [0,0,0,1,0,0|2,0,1]=4 133 B9R1.35 O=C1CN[C@H](C(=O)O)C1 4H33-9-0A [0,0,0,1,0,0|2,0,1]=4 134 B9R1.35 O=C1OCC(C(F)F)O1 2H28-3-21 [0,0,0,1,0,0|3,0,0]=4 135 B9R1.49 CN1CCCC(=O)CC1 4H56-5-AU [0,0,0,1,0,0|2,0,0]=3 136 B9R1.49 CN1CCCC(O)CC1 4H01-5-2K [0,0,0,1,0,0|2,0,1]=4 137 B9R1.49 CN1CCNC(=O)CC1 4H48-1-1Z [0,0,0,1,0,0|3,0,0]=4 138 B9R1.49 O=C1CCC(O)CCN1 4H48-1-1G [0,0,0,1,0,0|3,0,0]=4 139 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 4257-1-08 [0,0,0,1,0,0|1,0,0]=2 140 B9R1.66 CC1(C)CC(=O)CCO1 2H17-1-0A [0,0,0,1,0,0|2,0,0]=3 141 B9R1.66 CC1(C)CC(O)CCO1 2H02-1-05 [0,0,0,1,0,0|2,0,1]=4 142 B9R1.66 CC1(C)CCCC(=O)C1 2217-1-32 [0,0,0,1,0,0|1,0,0]=2 143 B9R1.66 CC1(C)CS(=O)CCN1 8H65-1-02 [0,0,0,1,0,0|3,0,0]=4 144 B9R1.66 CC1(C)CS(=O)CCN1 8H65-5-01 [0,0,0,1,0,0|3,0,0]=4 145 B9R1.161 CC(C)C1CC1C(=O)O 2221-1-14 [0,0,0,1,0,0|0,0,0]=1 146 B7R0.6 C=C(C)CCC(=O)O 2321-1-0E [0,0,0,0,1,0|0,0,2]=3 147 B7R0.6 CC(=O)CCC(C)C 2117-1-12 [0,0,0,0,1,0|1,0,0]=2 148 B7R0.6 CC(=O)OCC(C)F 2123-3-0L [0,0,0,0,1,0|3,0,0]=4 149 B7R0.6 CC(C)CCB(O)O 6160-1-0B [0,0,0,0,1,0|1,0,1]=3 150 B7R0.6 CC(C)CCC(=N)N 3141-1-00 [0,0,0,0,1,0|2,0,0]=3 151 B7R0.6 CC(C)CCC(=O)O 2121-1-29 [0,0,0,0,1,0|0,0,0]=1 152 B7R0.6 CC(C)CCC(C)O 2102-1-0C [0,0,0,0,1,0|1,0,1]=3 153 B7R0.6 CC(Cl)CCC(=O)Cl 2116-5-0B [0,0,0,0,1,0|2,0,0]=3 154 B7R0.6 CC(F)COC(=O)Cl 2123-7-0B [0,0,0,0,1,0|3,0,0]=4 155 B7R0.6 CC(N)CCC(=O)O 4157-5-14 [0,0,0,0,1,0|1,0,0]=2 156 B7R0.6 C[C@@H](O)CC[C@@H](C)O 2104-1-33 [0,0,0,0,1,0|2,0,1]=4 157 B7R0.6 C[C@H](O)CC[C@H](C)O 2104-1-27 [0,0,0,0,1,0|2,0,1]=4 158 B7R0.6 O=C(O)CCC(=O)O 2121-1-24 [0,0,0,0,1,0|2,0,1]=4 159 B7R0.6 O=C(O)CCC(F)F 2121-3-72 [0,0,0,0,1,0|2,0,0]=3 160 B9R0.55 CC(=N)NCCCN(C)C 3141-H-02 [0,0,0,0,0,1|3,0,0]=4 161 B9R0.55 CC(=O)CCOCC(C)C 2117-1-0G [0,0,0,0,0,1|1,0,0]=2 162 B9R0.55 CC(=O)CCOCC(C)F 2117-3-0M [0,0,0,0,0,1|2,0,0]=3 163 B9R0.55 CC(=O)CCOCC(F)F 2117-3-0S [0,0,0,0,0,1|3,0,0]=4 164 B9R0.55 CC(=O)NCCCC(=O)O 4158-1-15 [0,0,0,0,0,1|1,0,1]=3 165 B9R0.55 CC(C)CCCCC(=O)Cl 2116-5-19 [0,0,0,0,0,1|1,0,0]=2 166 B6R0.4 C=C(Br)CCCC 1300-9-19 [2,0,0,0,0,0|2,0,0]=4 167 B6R0.4 C=CCCC(=O)O 2321-1-0D [2,0,0,0,0,0|0,0,2]=4 168 B6R0.4 C=CCC[C@H](C)O 2302-1-S1 [2,0,0,0,0,0|1,0,1]=4 169 B6R0.4 CC(=O)CCCBr 2117-9-0A [2,0,0,0,0,0|2,0,0]=4 170 B6R0.4 CC(C)CCCCl 1100-5-44 [2,0,0,0,0,0|1,0,0]=3 171 B6R0.4 CC(C)CON=O 4145-1-01 [2,0,0,0,0,0|2,0,0]=4 172 B6R0.4 CC(C)NCCCl 3131-5-07 [2,0,0,0,0,0|2,0,0]=4 173 B6R0.4 CC(C)OCCBr 2107-9-09 [2,0,0,0,0,0|2,0,0]=4 174 B6R0.4 CC(C)OCCCl 2107-5-0P [2,0,0,0,0,0|2,0,0]=4 175 B6R0.4 CC(F)COC=O 2123-3-0J [2,0,0,0,0,0|2,0,0]=4 176 B6R0.4 CCCCC(=N)N 3141-1-03 [2,0,0,0,0,0|2,0,0]=4 177 B6R0.4 CCCCC(=O)Br 2116-9-0A [2,0,0,0,0,0|1,0,0]=3 178 B6R0.4 CCCCC(C)=O 2117-1-11 [2,0,0,0,0,0|1,0,0]=3 179 B6R0.4 CCCCC(C)O 2102-1-07 [2,0,0,0,0,0|1,0,1]=4 180 B6R0.4 CCCCC(N)=O 4148-1-0P [2,0,0,0,0,0|1,0,0]=3 181 B6R0.4 CCCC[C@@H](C)N 3130-1-R0 [2,0,0,0,0,0|1,0,1]=4 182 B6R0.4 CCCC[C@H](C)N 3130-1-S0 [2,0,0,0,0,0|1,0,1]=4 183 B6R0.4 CCCC[C@H](C)O 2102-1-S0 [2,0,0,0,0,0|1,0,1]=4 184 B6R0.4 CCCNC(C)C 3131-1-0E [2,0,0,0,0,0|1,0,1]=4 185 B6R0.4 CCCNC(N)=O 4153-1-00 [2,0,0,0,0,0|2,0,0]=4 186 B6R0.4 CCCOC(=O)Cl 2116-5-30 [2,0,0,0,0,0|2,0,0]=4 187 B6R0.4 CCCOC(N)=O 4156-1-2G [2,0,0,0,0,0|2,0,0]=4 188 B6R0.4 CCCSC(C)=O 6166-1-0A [2,0,0,0,0,0|2,0,0]=4 189 B6R0.4 CCNCC(=O)O 4158-1-76 [2,0,0,0,0,0|1,0,0]=3 190 B6R0.4 CCOCC(=O)O 2121-1-20 [2,0,0,0,0,0|1,0,0]=3 191 B6R0.4 CC\C=C\C(=O)O 2321-1-X5 [2,0,0,0,0,0|0,0,2]=4 192 B6R0.4 CN(C)CCCN 3130-1-27 [2,0,0,0,0,0|2,0,0]=4 193 B6R0.4 CNCCC(=O)O 4157-1-11 [2,0,0,0,0,0|1,0,0]=3 194 B6R0.4 COCCC(=O)Cl 2116-5-0C [2,0,0,0,0,0|2,0,0]=4 195 B6R0.4 COCCC(=O)O 2123-1-63 [2,0,0,0,0,0|1,0,0]=3 196 B6R0.4 CSCCC(=O)Cl 6166-5-01 [2,0,0,0,0,0|2,0,0]=4 197 B6R0.4 CSCCC(C)=O 6166-1-0J [2,0,0,0,0,0|2,0,0]=4 198 B6R0.4 N#CCCC(=O)O 4137-1-00 [2,0,0,0,0,0|1,0,1]=4 199 B6R0.4 O=C(Cl)CCCBr 2116-D-01 [2,0,0,0,0,0|2,0,0]=4 200 B6R0.4 O=C(O)CCCBr 2121-9-05 [2,0,0,0,0,0|1,0,0]=3 201 B6R0.6 C#CCCCCC 1500-1-X0 [2,0,0,0,0,0|1,0,1]=4 202 B6R0.6 C=CCCCCC 1300-1-X2 [2,0,0,0,0,0|1,0,0]=3 203 B6R0.6 C=CCCCCCl 1300-5-14 [2,0,0,0,0,0|2,0,0]=4 204 B6R0.6 CCCCCCI 1100-H-17 [2,0,0,0,0,0|1,0,1]=4 205 B6R0.6 CCCCCCN 3130-1-07 [2,0,0,0,0,0|1,0,1]=4 206 B6R0.6 CCCCCCS 5161-1-02 [2,0,0,0,0,0|0,1,1]=4 207 B6R0.6 CCCCCNC 3131-1-15 [2,0,0,0,0,0|2,0,0]=4 208 B6R0.6 CCCCC[Mg]Br 9612-9-02 [2,0,0,0,0,0|2,0,0]=4 209 B6R0.6 CCCCC[Mg]Br 9612-9-03 [2,0,0,0,0,0|2,0,0]=4 210 B6R0.6 CCCCC[Mg]Cl 9112-5-0J [2,0,0,0,0,0|2,0,0]=4 211 B6R0.6 CCCCC[Mg]Cl 9112-5-0K [2,0,0,0,0,0|2,0,0]=4 212 B6R0.6 CCCNCCO 4131-1-02 [2,0,0,0,0,0|1,0,1]=4 213 B6R0.6 CCC\C=C\C=O 2315-1-08 [2,0,0,0,0,0|0,0,2]=4 214 B6R0.6 CCOCCCO 2107-1-09 [2,0,0,0,0,0|1,0,1]=4 215 B6R0.6 NCCCCCO 4156-1-0A [2,0,0,0,0,0|1,0,1]=4 216 B6R0.6 O=CCCCC=O 2115-1-07 [2,0,0,0,0,0|1,0,1]=4 217 B6R0.6 O=CCCCCCl 2115-5-00 [2,0,0,0,0,0|1,0,0]=3 218 B6R0.6 O=CCCCCO 2120-1-05 [2,0,0,0,0,0|1,0,0]=3 219 B6R0.6 O=COCCCCl 2123-5-0V [2,0,0,0,0,0|2,0,0]=4 220 B6R0.6 O=COCCCF 2123-3-1F [2,0,0,0,0,0|2,0,0]=4 221 B6R0.6 OCCCCCO 2104-1-0B [2,0,0,0,0,0|1,0,1]=4 222 B8R0.5 CCC\C(C)=C\C(=O)O 2321-1-21 [1,1,0,0,0,0|0,0,2]=4 223 B8R0.6 C#CC(O)CCCCC 2502-1-03 [1,1,0,0,0,0|1,0,1]=4 224 B8R0.6 C#C[C@@H](O)CCCCC 2502-1-S0 [1,1,0,0,0,0|1,0,1]=4 225 B8R0.6 C=CC(O)CCCCC 2302-1-05 [1,1,0,0,0,0|1,0,1]=4 226 B8R0.6 C=CCCCC(=O)OC 2324-1-0B [1,1,0,0,0,0|0,0,2]=4 227 B8R0.6 CCCCCC(=O)OC 2123-1-90 [1,1,0,0,0,0|0,0,0]=2 228 B8R0.6 CCCCCC(O)CN 4156-1-96 [1,1,0,0,0,0|1,0,1]=4 229 B8R0.6 CCCCCC(O)CO 2104-1-0K [1,1,0,0,0,0|0,0,2]=4 230 B8R0.6 CCCCCN(C)N=O 4152-1-05 [1,1,0,0,0,0|2,0,0]=4 231 B8R0.6 CCCCC[C@H](O)CCl 2102-5-S1 [1,1,0,0,0,0|1,0,1]=4 232 B8R0.6 CCCCNC(=O)CC 4148-1-0Y [1,1,0,0,0,0|2,0,0]=4 233 B8R0.6 CCCCNC(=O)CCl 4148-5-0F [1,1,0,0,0,0|2,0,0]=4 234 B8R0.6 CCCCOC(=O)CF 2123-3-X1 [1,1,0,0,0,0|2,0,0]=4 235 B8R0.6 CCC\C=C\C(=O)OC 2323-1-0D [1,1,0,0,0,0|0,0,2]=4 236 B8R0.6 CCNCCC(=O)OC 4158-1-0D [1,1,0,0,0,0|1,0,0]=3 237 B8R0.6 COC(=O)CCCC#N 4137-1-0F [1,1,0,0,0,0|1,0,1]=4 238 B8R0.6 COC(=O)CCCCBr 2123-9-14 [1,1,0,0,0,0|1,0,0]=3 239 B8R0.6 COC(=O)CCCCCl 2123-5-1C [1,1,0,0,0,0|1,0,0]=3 240 B8R0.6 COC(=O)CCCCN 4158-5-0A [1,1,0,0,0,0|1,0,0]=3 241 B8R0.6 COC(=O)COCCBr 2123-9-0B [1,1,0,0,0,0|2,0,0]=4 242 B8R0.6 COC(=O)COCCCl 2123-5-0H [1,1,0,0,0,0|2,0,0]=4 243 B8R0.6 COC(=O)OCCCCl 2128-5-0P [1,1,0,0,0,0|2,0,0]=4 244 B8R0.6 COCCCC(=O)OC G311-A-58 [1,1,0,0,0,0|1,0,0]=3 245 B8R0.6 O=C(CO)OCCCCl 2129-5-0C [1,1,0,0,0,0|2,0,0]=4 246 B8R0.6 O=C(CO)OCCCF 2129-3-0N [1,1,0,0,0,0|2,0,0]=4 247 B8R0.7 C#CCCCCC(=O)O 2521-1-04 [1,1,0,0,0,0|0,0,1]=3 248 B8R0.7 C=C(Br)CCCCCC 1300-9-08 [1,1,0,0,0,0|2,0,0]=4 249 B8R0.7 C=C(Br)CCCCCCl 1300-D-03 [1,1,0,0,0,0|2,0,0]=4 250 B8R0.7 C=C(C)CCCCCCl 1300-5-32 [1,1,0,0,0,0|2,0,0]=4 251 B8R0.7 C=C(Cl)CCCCCC 1300-5-26 [1,1,0,0,0,0|2,0,0]=4 252 B8R0.7 C=C(Cl)CCCCCCl 1300-5-35 [1,1,0,0,0,0|2,0,0]=4 253 B8R0.7 C=CCCCCC(=O)O 2321-1-0N [1,1,0,0,0,0|0,0,1]=3 254 B8R0.7 C=CCOCCC(=O)O 2321-1-0Q [1,1,0,0,0,0|0,0,2]=4 255 B8R0.7 CC(=O)CCOCCBr 2117-9-00 [1,1,0,0,0,0|2,0,0]=4 256 B8R0.7 CC(=O)CCOCCCl 2117-5-0A [1,1,0,0,0,0|2,0,0]=4 257 B8R0.7 CC(=O)COCCCCl 2117-5-0D [1,1,0,0,0,0|2,0,0]=4 258 B8R0.7 CC(=O)COCCCF 2117-3-1G [1,1,0,0,0,0|2,0,0]=4 259 B8R0.7 CC(=O)OCCCCBr 2123-9-19 [1,1,0,0,0,0|2,0,0]=4 260 B8R0.7 CC(=O)OCCCCCl 2123-5-0W [1,1,0,0,0,0|2,0,0]=4 261 B8R0.7 CC(=O)OCCCCI 2123-H-02 [1,1,0,0,0,0|2,0,0]=4 262 B8R0.7 CC(C)CNCCCO 4256-1-0Y [1,1,0,0,0,0|0,0,1]=3 263 B8R0.7 CC(C)COCCC#N 4137-1-0W [1,1,0,0,0,0|1,0,1]=4 264 B8R0.7 CC(C)COCCCN 4156-1-3S [1,1,0,0,0,0|1,0,1]=4 265 B8R0.7 CC(C)NCCCCO 4131-1-01 [1,1,0,0,0,0|0,0,1]=3 266 B8R0.7 CCCCC#CC(=O)O 2521-1-0A [1,1,0,0,0,0|0,0,1]=3 267 B8R0.7 CCCCCC=C(F)F 1300-3-98 [1,1,0,0,0,0|2,0,0]=4 268 B8R0.7 CCCCCCB(O)O 6160-1-00 [1,1,0,0,0,0|1,0,1]=4 269 B8R0.7 CCCCCCC(C)=O 2117-1-X1 [1,1,0,0,0,0|1,0,0]=3 270 B8R0.7 CCCCCC[C@@H](C)O 2102-1-R1 [1,1,0,0,0,0|1,0,1]=4 271 B8R0.7 CCCCCO[N+](=O)[O-] 4154-1-0B [1,1,0,0,0,0|1,0,1]=4 272 B8R0.7 CCCCOCC(=O)O 2121-1-52 [1,1,0,0,0,0|0,0,0]=2 273 B8R0.7 COCCOCC(=O)Cl 2116-5-12 [1,1,0,0,0,0|2,0,0]=4 274 B8R0.7 COCCOCC(=O)O 2121-1-33A [1,1,0,0,0,0|1,0,0]=3 275 B8R0.7 COCCOCC(=O)O 2121-1-33B [1,1,0,0,0,0|1,0,0]=3 276 B8R0.7 COCCOCC(=O)O 2121-1-33C [1,1,0,0,0,0|1,0,0]=3 277 B8R0.7 CSCCCOC(C)=O 6166-1-0K [1,1,0,0,0,0|2,0,0]=4 278 B8R0.7 NC(=O)CCCCCBr 4148-9-07 [1,1,0,0,0,0|1,0,0]=3 279 B8R0.7 NCCCCCC(=O)O 4157-1-0B [1,1,0,0,0,0|0,0,0]=2 280 B8R0.7 O=C(O)CCCCCCl 2121-5-06 [1,1,0,0,0,0|0,0,0]=2 281 B8R0.7 O=C(O)CCCCCO 2129-1-0D [1,1,0,0,0,0|0,0,0]=2 282 B8R0.8 C#CCC[C@@H](N)C(=O)O 4557-1-R1 [1,1,0,0,0,0|0,0,2]=4 283 B8R0.8 CCCCC(Br)C(=O)O 2121-9-16 [1,1,0,0,0,0|0,0,0]=2 284 B8R0.8 CCCCC(C)C(=O)O 2121-1-0S [1,1,0,0,0,0|0,0,0]=2 285 B8R0.8 CCC\C=C(/C)C(=O)O 2321-1-0S [1,1,0,0,0,0|0,0,2]=4 286 B8R0.8 COCC[C@H](N)C(=O)O 4157-5-S8 [1,1,0,0,0,0|1,0,0]=3 287 B8R0.8 CSCCC(N)C(=O)O 8166-1-00 [1,1,0,0,0,0|1,0,0]=3 288 B8R0.8 NOCC[C@H](N)C(=O)O 4157-1-08 [1,1,0,0,0,0|2,0,0]=4 289 B8R0.8 [C@H](N)(CCSC)C(=O)O 8166-1-S5 [1,1,0,0,0,0|1,0,0]=3 290 B8R0.9 CCC(C)CCC(C)C 1100-1-26 [1,1,0,0,0,0|1,0,1]=4 291 B8R0.9 CCC(C)COC(=O)Cl 2116-5-28 [1,1,0,0,0,0|2,0,0]=4 292 B8R0.9 CCC(Cl)CCC(=O)Cl 2116-5-23 [1,1,0,0,0,0|1,0,0]=3 293 B8R0.9 CCC(O)CCC(C)C 2102-1-0B [1,1,0,0,0,0|1,0,1]=4 294 B8R0.9 C\C(CCC(C)C)=N/O 4147-1-0C [1,1,0,0,0,0|1,0,1]=4 295 B8R0.23 CC(=O)CC(C)C(=O)O 2129-1-0G [0,1,0,0,1,0|1,0,1]=4 296 B8R0.23 CC(C)C(N)CC(=O)O 4157-1-40 [0,1,0,0,1,0|0,0,0]=2 297 B8R0.23 CC(C)CC(Br)C(=O)O 2121-9-0D [0,1,0,0,1,0|0,0,0]=2 298 B8R0.23 CC(C)CC(O)C(=O)O 2129-1-0U [0,1,0,0,1,0|0,0,0]=2 299 B8R0.23 CC(C)C[C@@H](O)C(=O)O 2129-1-RB [0,1,0,0,1,0|0,0,0]=2 300 B8R0.23 CC(C)C[C@H](Cl)C(=O)O 2121-5-S2 [0,1,0,0,1,0|0,0,0]=2 301 B8R0.23 CC(C)C[C@H](F)C(=O)O 2121-3-S2 [0,1,0,0,1,0|0,0,0]=2 302 B8R0.23 CC(C)C[C@H](N)C(N)=O 4158-5-02 [0,1,0,0,1,0|1,0,0]=3 303 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-1-R40 [0,1,0,0,1,0|0,0,0]=2 304 B8R0.23 CC(C)[C@H](N)CC(=O)O 4157-5-10 [0,1,0,0,1,0|0,0,0]=2 305 B8R0.23 CS(=O)C[C@H](N)C(=O)O 8162-1-R0 [0,1,0,0,1,0|2,0,0]=4 306 B8R0.29 CC(=O)CSC(C)(C)C 6166-1-03 [0,1,0,0,1,0|2,0,0]=4 307 B8R0.29 CC(C)(C)CCC(=O)O 2121-1-36 [0,1,0,0,1,0|0,0,0]=2 308 B8R0.29 CC(C)(N)CCC(=O)O 4157-1-32 [0,1,0,0,1,0|0,0,0]=2 309 B8R0.29 CC(C)(N)CCC(=O)O 4157-5-13 [0,1,0,0,1,0|0,0,0]=2 310 B8R0.29 O=C(O)CCC(Cl)(Cl)Cl 2121-5-X2 [0,1,0,0,1,0|2,0,0]=4 311 B10R0.15 CC(=O)CCOCC(C)(F)F 2117-3-1N [0,1,0,0,0,1|2,0,0]=4 312 B10R0.15 CC(=O)SCCC[N+](C)(C)C 8166-H-02 [0,1,0,0,0,1|2,0,0]=4 313 B10R0.15 O=C(O)CCCSC(F)(F)F 6166-3-06 [0,1,0,0,0,1|2,0,0]=4 314 B10R0.55 C=CC(=O)NCCCN(C)C 4348-1-0A [0,1,0,0,0,1|2,0,0]=4 315 B10R0.96 CC(C)CC(=O)NCC(=O)O 4148-1-0Q [0,1,0,0,0,1|0,0,1]=3 316 B10R0.3 CCOC(=O)CCCC(=O)O 2123-1-76 [0,2,0,0,0,0|1,0,1]=4 317 B10R0.3 CCOC(=O)CCCC(C)=O 2129-1-37 [0,2,0,0,0,0|1,0,1]=4 318 B10R0.3 CCOC(=O)CCCN(C)C 4158-1-35 [0,2,0,0,0,0|1,0,0]=3 319 B10R0.57 COC(=O)C(C)CCC(=O)O 2123-1-16 [0,2,0,0,0,0|1,0,1]=4 320 B10R0.60 COC(=O)COCC(C)(F)F 2123-3-6T [0,2,0,0,0,0|2,0,0]=4 321 B10R0.65 CCC(C)(O)CCCC(C)C 2103-1-03 [0,2,0,0,0,0|1,0,1]=4 322 B10R0.82 COC(=O)CC[C@H](N)C(=O)O 4157-1-S0 [0,2,0,0,0,0|1,0,1]=4 323 B10R0.92 CS(=N)(=O)CC[C@@H](N)C(=O)O 8169-1-R1 [0,2,0,0,0,0|2,0,0]=4 324 B10R0.92 O=C(O)C(Br)CCC(F)(F)F 2121-B-55 [0,2,0,0,0,0|2,0,0]=4 325 B10R0.31 CC(CC(=O)O)CC(C)(C)C 2121-1-0Q [0,2,0,0,0,0|0,0,0]=2 326 B10R0.31 C[N+](C)(C)C[C@H](N)CC(=O)[O-] 4157-1-29 [0,2,0,0,0,0|1,0,1]=4 327 B8R1.1 CCC1CCC(=O)O1 2H25-1-20 [1,0,0,1,0,0|0,0,0]=2 328 B8R1.1 NCC1CCC(=O)N1 4H48-1-QQ [1,0,0,1,0,0|2,0,0]=4 329 B8R1.1 O=C1CC[C@@H](CBr)N1 4H48-9-S0 [1,0,0,1,0,0|2,0,0]=4 330 B8R1.1 O=C1CC[C@@H](CO)N1 4H48-1-KC [1,0,0,1,0,0|2,0,0]=4 331 B8R1.1 O=C1CC[C@@H](CO)O1 2H20-1-01 [1,0,0,1,0,0|1,0,0]=3 332 B8R1.1 O=C1CC[C@H](CBr)N1 4H48-9-R0 [1,0,0,1,0,0|2,0,0]=4 333 B8R1.1 O=C1NC[C@H](CO)O1 4H56-1-RP [1,0,0,1,0,0|2,0,0]=4 334 B8R1.1 O=C1OCC(CBr)O1 2H28-9-00 [1,0,0,1,0,0|2,0,0]=4 335 B8R1.1 O=C1OCC(CF)O1 2H28-3-05 [1,0,0,1,0,0|2,0,0]=4 336 B8R1.4 CC1=CC(=O)CCC1 2417-1-0F [1,0,0,1,0,0|0,0,2]=4 337 B8R1.4 CC1CC(=O)CCN1 4H56-5-0M [1,0,0,1,0,0|1,0,0]=3 338 B8R1.4 CC1CC(O)CCN1 4H56-1-012 [1,0,0,1,0,0|1,0,1]=4 339 B8R1.4 CC1CCCC(=O)C1 2217-1-0Z [1,0,0,1,0,0|0,0,0]=2 340 B8R1.4 CC1CCCC(=O)N1 4H48-1-CH [1,0,0,1,0,0|1,0,0]=3 341 B8R1.4 CC1CCCC(N)C1 3230-1-0H [1,0,0,1,0,0|1,0,1]=4 342 B8R1.4 CC1CCCC(O)C1 2202-1-1F [1,0,0,1,0,0|0,0,1]=3 343 B8R1.4 CN1CCCC(=O)C1 4H17-1-2E [1,0,0,1,0,0|1,0,0]=3 344 B8R1.4 CN1CCCC(=O)C1 4H17-5-1E [1,0,0,1,0,0|1,0,0]=3 345 B8R1.4 CN1CCC[C@@H](O)C1 4H56-1-R01 [1,0,0,1,0,0|1,0,1]=4 346 B8R1.4 CN1CCC[C@H](O)C1 4H56-1-S10 [1,0,0,1,0,0|1,0,1]=4 347 B8R1.4 C[C@@H]1CC(=O)CCN1 4H56-5-1P [1,0,0,1,0,0|1,0,0]=3 348 B8R1.4 C[C@H]1CC(=O)CCN1 4H29-3-S1 [1,0,0,1,0,0|1,0,0]=3 349 B8R1.4 NC1CCNC(=O)C1 4H22-1-10 [1,0,0,1,0,0|2,0,0]=4 350 B8R1.4 O=C1CCCC(=O)O1 2H26-1-0G [1,0,0,1,0,0|1,0,1]=4 351 B8R1.4 O[C@H]1CCC[C@@H](O)C1 2208-1-04 [1,0,0,1,0,0|1,0,1]=4 352 B8R1.7 CC(=O)C1CCCC1 2217-1-0X [1,0,0,1,0,0|1,0,0]=3 353 B8R1.7 CC(=O)C1CCNC1 4H17-5-3H [1,0,0,1,0,0|2,0,0]=4 354 B8R1.7 CC(C)C1CCCC1 1200-1-13 [1,0,0,1,0,0|1,0,1]=4 355 B8R1.7 CC(C)C1CCCN1 3H31-5-Y8 [1,0,0,1,0,0|1,0,1]=4 356 B8R1.7 CC(C)[C@@H]1CCCN1 3H31-1-SJ [1,0,0,1,0,0|1,0,1]=4 357 B8R1.7 CC(C)[C@H]1CCCN1 3H31-1-RJ [1,0,0,1,0,0|1,0,1]=4 358 B8R1.7 N=C(N)C1CCCC1 3241-5-00 [1,0,0,1,0,0|2,0,0]=4 359 B8R1.7 NC(=O)C1CCNC1 4H48-5-72 [1,0,0,1,0,0|2,0,0]=4 360 B8R1.7 NC(=O)C1CCOC1 4H48-1-AP [1,0,0,1,0,0|2,0,0]=4 361 B8R1.7 NC(=O)[C@@H]1CCNC1 4H48-5-R1 [1,0,0,1,0,0|2,0,0]=4 362 B8R1.7 O=C(O)C1CCCC1 2221-1-Y5 [1,0,0,1,0,0|0,0,0]=2 363 B8R1.7 O=C(O)C1CCCN1 4H58-1-010 [1,0,0,1,0,0|1,0,0]=3 364 B8R1.7 O=C(O)C1CCCO1 2H21-1-26 [1,0,0,1,0,0|1,0,0]=3 365 B8R1.7 O=C(O)[C@@H]1CCNC1 4H21-1-R5 [1,0,0,1,0,0|1,0,0]=3 366 B8R1.7 O=C(O)[C@@H]1CCOC1 2H21-1-R2 [1,0,0,1,0,0|1,0,0]=3 367 B8R1.7 O=[N+]([O-])C1CCCC1 4254-1-02 [1,0,0,1,0,0|1,0,1]=4 368 B8R1.7 [C@@H]1(C(=O)O)CCCN1 4H21-1-0P [1,0,0,1,0,0|1,0,0]=3 369 B8R1.19 CC1(C)CCCC1=O 2217-1-1K [1,0,0,1,0,0|0,0,0]=2 370 B8R1.19 CC1(C)CCOC1=O 2H25-1-2X [1,0,0,1,0,0|1,0,0]=3 371 B8R1.22 BrC1=CCCCCC1 1400-9-06 [1,0,0,1,0,0|2,0,0]=4 372 B8R1.22 O=C1C=CCCCC1 2417-1-0D [1,0,0,1,0,0|1,0,1]=4 373 B8R1.22 O=C1CCCCSC1 6H66-1-10 [1,0,0,1,0,0|2,0,0]=4 374 B8R1.22 O=C1CNCCCN1 4H48-1-4S [1,0,0,1,0,0|2,0,0]=4 375 B8R1.34 CC(=O)CC1COC1 2H17-1-01 [1,0,0,1,0,0|2,0,0]=4 376 B8R1.34 O=C(O)CC1CCC1 2221-1-52 [1,0,0,1,0,0|0,0,0]=2 377 B8R1.34 O=C(O)CC1COC1 2H21-1-45 [1,0,0,1,0,0|1,0,0]=3 378 B8R1.35 CC(=O)NCC1CC1 4248-1-00 [1,0,0,1,0,0|2,0,0]=4 379 B8R1.35 O=C(O)CCC1CC1 2221-1-24 [1,0,0,1,0,0|0,0,0]=2 380 B8R1.36 CCCCCC1CO1 2109-1-0D [1,0,0,1,0,0|1,0,1]=4 381 B8R1.43 NCC1CC1C(=O)O 4257-5-05 [1,0,0,1,0,0|1,0,0]=3 382 B8R1.72 CC1(C)CCCNC1 3H31-5-8E [1,0,0,1,0,0|2,0,0]=4 383 B8R1.72 CC1(C)CCOCO1 2H08-1-0F [1,0,0,1,0,0|1,0,1]=4 384 B8R1.72 CC1(C)CNCCO1 4H44-1-11 [1,0,0,1,0,0|1,0,1]=4 385 B8R1.72 CC1(O)CCCCC1 2603-1-02 [1,0,0,1,0,0|1,0,1]=4 386 B8R1.3 C=C1CCC(C)CC1 1300-1-47 [0,0,0,1,1,0|2,0,0]=4 387 B8R1.3 CC1CCC(=O)CC1 2217-1-X3 [0,0,0,1,1,0|1,0,0]=3 388 B8R1.3 CC1CCC(O)CC1 2202-1-02 [0,0,0,1,1,0|1,0,1]=4 389 B8R1.3 C[C@H]1CC[C@H](O)CC1 2202-1-17 [0,0,0,1,1,0|1,0,1]=4 390 B8R1.3 NC1CCC(=O)CC1 4256-1-01 [0,0,0,1,1,0|2,0,0]=4 391 B8R1.3 NC1CCC(=O)CC1 4256-5-56 [0,0,0,1,1,0|2,0,0]=4 392 B8R1.3 NC1CCC(=O)NC1 4H48-5-66 [0,0,0,1,1,0|2,0,0]=4 393 B8R1.3 O=C1CCC(O)CC1 2220-1-X3 [0,0,0,1,1,0|2,0,0]=4 394 B8R1.3 O=C1CCC(O)CN1 4H20-1-29 [0,0,0,1,1,0|2,0,0]=4 395 B8R1.23 CC1CC(C(=O)O)C1 2221-1-0B [0,0,0,1,1,0|0,0,0]=2 396 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 2221-1-29 [0,0,0,1,1,0|0,0,0]=2 397 B8R1.23 NC1CC(C(=O)O)C1 4257-1-29 [0,0,0,1,1,0|1,0,0]=3 398 B8R1.23 NC1CC(C(=O)O)C1 4257-5-14 [0,0,0,1,1,0|1,0,0]=3 399 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 4257-5-01 [0,0,0,1,1,0|1,0,0]=3 400 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 4257-5-07 [0,0,0,1,1,0|1,0,0]=3 401 B8R1.23 O=C(O)C1CC(F)C1 2221-3-09 [0,0,0,1,1,0|1,0,0]=3 402 B8R1.23 O=C(O)C1CC(O)C1 2229-1-89 [0,0,0,1,1,0|1,0,0]=3 403 B8R1.51 CC1(C)CCC(=O)N1 4H48-1-052 [0,0,0,1,1,0|1,0,0]=3 404 B8R1.51 CC1(C)CCC(=O)O1 2H25-1-54 [0,0,0,1,1,0|0,0,0]=2 405 B8R1.51 CC1(C)CNC(=O)C1 4H48-1-DU [0,0,0,1,1,0|2,0,0]=4 406 B8R1.51 CC1(C)COC(=O)N1 4H56-1-NJ [0,0,0,1,1,0|2,0,0]=4 407 B8R1.51 CC1(C)COC(=O)O1 2H28-1-16 [0,0,0,1,1,0|1,0,0]=3 408 B8R1.51 CC1CCS(=O)(=O)C1 6H63-1-0A [0,0,0,1,1,0|1,0,1]=4 409 B8R1.77 CC1(C)CC1C(=O)O 2221-1-0X [0,0,0,1,1,0|0,0,0]=2 410 B8R1.77 CC1(C)CC1C(N)=O 4248-1-07 [0,0,0,1,1,0|1,0,0]=3 411 B8R1.77 CC1(C)C[C@@H]1C(=O)O 2221-1-S0 [0,0,0,1,1,0|0,0,0]=2 412 B8R1.77 O=C(O)C1CC1(Cl)Cl 2221-5-02 [0,0,0,1,1,0|2,0,0]=4 413 B10R1.54 CC(C)C[C@H]1COC(=O)N1 4H56-1-S63 [0,0,0,1,0,1|1,0,0]=3 414 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-1-2S [0,0,0,1,0,1|2,0,0]=4 415 B10R1.113 CC(=O)C1CCCN(C)C1 4H17-5-0Z [0,0,0,1,0,1|2,0,0]=4 416 B10R1.113 CC(C)N1CCCC(=O)C1 4H17-1-9V [0,0,0,1,0,1|1,0,0]=3 417 B10R1.113 CC1CCCC(C(=O)O)N1 4H21-5-44 [0,0,0,1,0,1|1,0,0]=3 418 B10R1.113 CC1COCC(C(=O)O)N1 4H21-5-43 [0,0,0,1,0,1|1,0,0]=3 419 B10R1.113 CN1CCCC(C(=O)O)C1 4H21-5-Z1 [0,0,0,1,0,1|1,0,0]=3 420 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 4H21-1-R0 [0,0,0,1,0,1|1,0,0]=3 421 B10R1.113 CN1CCC[C@H](C(=O)O)C1 4H21-1-S0 [0,0,0,1,0,1|1,0,0]=3 422 B10R1.113 NC1CCCC(C(=O)O)C1 4257-1-X1 [0,0,0,1,0,1|1,0,0]=3 423 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 4257-5-0A [0,0,0,1,0,1|1,0,0]=3 424 B10R1.113 O=C(O)C1CCCC(O)C1 2229-1-0Z [0,0,0,1,0,1|1,0,0]=3 425 B10R1.113 O=C(O)C1CS(=O)CCN1 8H65-5-02 [0,0,0,1,0,1|2,0,0]=4 426 B10R1.113 O=C(O)[C@H]1C[C@@H](O)CCN1 4H29-5-0A [0,0,0,1,0,1|1,0,0]=3 427 B10R1.113 O=C1CC(C(=O)O)CCN1 4H58-1-C7 [0,0,0,1,0,1|1,0,1]=4 428 B10R1.128 C[C@@]1(N)CCC[C@@H]1C(=O)O 4257-5-19 [0,0,0,1,0,1|1,0,0]=3 429 B10R1.13 CC(C)C1CCC(=O)CC1 2217-1-13 [0,1,0,1,0,0|1,0,0]=3 430 B10R1.13 CC(C)C1CCC(O)CC1 2202-1-0H [0,1,0,1,0,0|1,0,1]=4 431 B10R1.13 CC(C)N1CCC(=O)CC1 4H17-1-24 [0,1,0,1,0,0|2,0,0]=4 432 B10R1.13 CC1CCC(C(N)=O)CN1 4H48-1-A6 [0,1,0,1,0,0|1,0,0]=3 433 B10R1.13 CN(C)C1CCC(=O)CC1 4256-1-84 [0,1,0,1,0,0|2,0,0]=4 434 B10R1.13 CN1CCN(C(=O)O)CC1 4H56-1-962 [0,1,0,1,0,0|2,0,0]=4 435 B10R1.13 NC1CCC(C(=O)O)CC1 4257-5-0B [0,1,0,1,0,0|1,0,0]=3 436 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 4257-5-X0 [0,1,0,1,0,0|1,0,0]=3 437 B10R1.13 O=C(O)C1CCC(Cl)CC1 2221-5-00 [0,1,0,1,0,0|1,0,0]=3 438 B10R1.13 O=C(O)C1CCC(O)CC1 2221-1-1M [0,1,0,1,0,0|1,0,0]=3 439 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 4H57-5-17 [0,1,0,1,0,0|1,0,0]=3 440 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 2229-1-1G [0,1,0,1,0,0|1,0,0]=3 441 B10R1.13 O=C1CCC(C(=O)O)CN1 4H58-1-A5 [0,1,0,1,0,0|1,0,1]=4 442 B10R1.14 COC(=O)C1CC(O)CN1 4H58-1-184 [0,1,0,1,0,0|2,0,0]=4 443 B10R1.14 COC(=O)[C@@H]1C[C@@H](F)CN1 4H58-7-08 [0,1,0,1,0,0|2,0,0]=4 444 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 4258-7-01 [0,1,0,1,0,0|2,0,0]=4 445 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 2229-1-92 [0,1,0,1,0,0|1,0,0]=3 446 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 4H29-1-09 [0,1,0,1,0,0|2,0,0]=4 447 B10R1.153 COC(=O)CCNC1CC1 4231-1-02 [0,1,0,1,0,0|1,0,0]=3 448 B10R1.194 CC(C)[C@H]1COC(=O)N1N 4H56-1-S0A [0,1,0,1,0,0|2,0,0]=4 449 B10R1.194 CN1C(=O)CC[C@H]1C(=O)O 4H56-1-GQ [0,1,0,1,0,0|1,0,1]=4 450 B10R1.194 CN1CCC(C(=O)O)C1=O 4H58-1-00L [0,1,0,1,0,0|1,0,1]=4 451 B10R1.58 CN1CC(C(=O)O)CC1=O 4H21-1-W6 [0,1,0,1,0,0|1,0,1]=4 452 B10R1.58 O=C(O)C1CC(Br)C(Br)C1 2221-9-07 [0,1,0,1,0,0|1,0,0]=3 453 B10R1.83 CC1(C)C(N)CC1C(=O)O 4257-1-00 [0,1,0,1,0,0|0,0,0]=2 454 B10R1.359 CC1(C)CCC(C(=O)O)C1 2221-1-45 [0,1,0,1,0,0|0,0,0]=2 455 B10R1.359 CC1(C)OCC(C(=O)O)O1 2H21-1-39 [0,1,0,1,0,0|1,0,0]=3 456 B10R1.359 CC1(C)OC[C@@H](C(=O)[O-])O1 2H10-1-S2 [0,1,0,1,0,0|1,0,1]=4 457 B10R1.359 O=C(O)C1CCC(F)(F)C1 2221-3-10 [0,1,0,1,0,0|1,0,0]=3 458 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 4H57-7-S0 [0,1,0,1,0,0|2,0,0]=4 459 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 4H58-3-S0 [0,1,0,1,0,0|2,0,0]=4 460 B10R1.359 O=C(O)[C@@H]1CCC(F)(F)C1 2221-3-R0 [0,1,0,1,0,0|1,0,0]=3 461 B10R1.359 O=C(O)[C@H]1CCC(F)(F)C1 2221-3-S0 [0,1,0,1,0,0|1,0,0]=3 462 B10R1.59 C=C1C[C@H](N)[C@H](C(=O)O)C1 4357-1-02 [0,1,0,1,0,0|0,0,2]=4 463 B10R1.329 CC1(C)CC(=O)CC(=O)N1 4H48-1-JP [0,1,0,1,0,0|1,0,1]=4 464 B10R1.329 CC1CC(=O)CC(C)(C)C1 2217-1-0S [0,1,0,1,0,0|1,0,0]=3 465 B10R1.329 CC1CC(O)CC(C)(C)C1 2202-1-0G [0,1,0,1,0,0|1,0,1]=4 466 B10R1.329 C[C@@H]1C[C@@H](O)CC(C)(C)C1 2202-1-1A [0,1,0,1,0,0|1,0,1]=4 467 B10R1.112 CC(C)(C)OC1CC(=O)C1 2217-1-08 [0,1,0,1,0,0|2,0,0]=4 468 B10R2.14 O=C1CC(C2CC2)CN1 4H48-1-04N [0,0,0,2,0,0|2,0,0]=4 469 B10R2.28 CC1(O)CC2CCC1C2 2203-1-07 [0,0,0,2,0,0|1,0,1]=4 470 B10R2.348 O=C(O)C12CC(CN1)C2 4H21-5-07 [0,0,0,2,0,0|1,0,0]=3 471 B10R2.355 [C@@H]12CNC(C(=O)O)[C@@H]1C2 4H57-1-V0 [0,0,0,2,0,0|1,0,0]=3 472 B10R2.179 CC12CCCC(=O)C1C2 2217-1-1S [0,0,0,2,0,0|1,0,0]=3 473 B10R2.179 CC12CCCC(=O)C1O2 2217-1-0R [0,0,0,2,0,0|2,0,0]=4 474 B10R2.236 OC12CCCC(CC1)C2 2203-1-08 [0,0,0,2,0,0|1,0,1]=4 475 B10R2.365 O=C(O)CC12CC(C1)C2 2221-1-48 [0,0,0,2,0,0|0,0,0]=2 476 B6R0.2 C=C(Br)CC(C)C 1300-9-16 [0,0,0,0,2,0|2,0,0]=4 477 B6R0.2 CC(C)CC(=O)O 2121-1-18 [0,0,0,0,2,0|0,0,0]=2 478 B6R0.2 CC(C)NC(N)=O 4153-1-10 [0,0,0,0,2,0|2,0,0]=4 479 B6R0.2 CC(C)OC(N)=O 4156-1-2S [0,0,0,0,2,0|2,0,0]=4 480 B6R0.2 CC(C)SC(=O)Cl 6166-5-00 [0,0,0,0,2,0|2,0,0]=4 481 B6R0.2 CC(Cl)CC(=O)O 2121-5-09 [0,0,0,0,2,0|1,0,0]=3 482 B6R0.2 CN(C)CC(=O)O 4158-1-41 [0,0,0,0,2,0|1,0,0]=3 483 B6R0.2 C[C@@H](N)CC(=O)O 4157-1-12 [0,0,0,0,2,0|1,0,0]=3 484 B6R0.2 C[C@H](N)CC(=O)O 4157-5-06 [0,0,0,0,2,0|1,0,0]=3