0 B6R0.1 CCCC(NN)=O AK-95909 [0,0,0,0,0,0|3,0,0]=3 1 B6R0.1 O=C(NCC)CN AK-65785 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.1 O=C(NN)COC AK110451 [0,0,0,0,0,0|4,0,0]=4 3 B6R0.1 O=C(OC)CCBr AK-91613 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 O=C(OC)CCN AK-46776 [0,0,0,0,0,0|3,0,1]=4 5 B6R0.1 O=C(OC)CCO AK-83355 [0,0,0,0,0,0|3,0,1]=4 6 B6R0.1 O=C(OC)CNC AK-58375 [0,0,0,0,0,0|3,0,1]=4 7 B6R0.1 O=C(OC)OCC AK397345 [0,0,0,0,0,0|1,0,1]=2 8 B6R0.1 O=C(OCC)CO AK-98662 [0,0,0,0,0,0|1,0,1]=2 9 B5R0.1 C(C(=O)O)NC AK-47434 [1,0,0,0,0,0|3,0,0]=4 10 B5R0.1 CC#CC(O)=O AK-49957 [1,0,0,0,0,0|2,0,1]=4 11 B5R0.1 CNCC(N)=O AK-90265 [1,0,0,0,0,0|3,0,0]=4 12 B5R0.1 NCCC(N)=O AK-26218 [1,0,0,0,0,0|3,0,0]=4 13 B5R0.1 NCCC(O)=O AK-41261 [1,0,0,0,0,0|3,0,0]=4 14 B5R0.1 O=C(N)CSC AK-34209 [1,0,0,0,0,0|3,0,0]=4 15 B5R0.1 [O+](=C(N)N)CC AK-50388 [1,0,0,0,0,0|2,0,1]=4 16 B5R0.2 C=CCCCO AK325629 [1,0,0,0,0,0|2,0,1]=4 17 B5R0.3 C=CC(NC)=O AK115593 [1,0,0,0,0,0|1,0,0]=2 18 B5R0.3 C=C[C@H](N)CO AK-78923 [1,0,0,0,0,0|2,0,1]=4 19 B5R0.3 CCC(CN)=O AK-38468 [1,0,0,0,0,0|1,0,1]=3 20 B5R0.3 CCC(CO)=O AK149491 [1,0,0,0,0,0|1,0,1]=3 21 B5R0.3 CNC(=O)CCl AK-82796 [1,0,0,0,0,0|2,0,1]=4 22 B5R0.3 NCC(OC)=O AK-43994 [1,0,0,0,0,0|1,0,1]=3 23 B5R0.3 NNC(=O)CO AK-89508 [1,0,0,0,0,0|3,0,0]=4 24 B5R0.3 NNC(OC)=O AK109362 [1,0,0,0,0,0|2,0,0]=3 25 B5R0.3 NOC(C=C)C AK550274 [1,0,0,0,0,0|2,0,1]=4 26 B5R0.3 O=C(CO)CO AK-46682 [1,0,0,0,0,0|2,0,1]=4 27 B5R0.3 O=C(OC)CO AK-98661 [1,0,0,0,0,0|1,0,1]=3 28 B7R0.2 C[C@@H](N)CC(OC)=O AK175410 [0,1,0,0,0,0|2,0,1]=4 29 B7R0.2 C[C@@H](O)CC(OC)=O AK-54453 [0,1,0,0,0,0|2,0,1]=4 30 B7R0.2 C[C@H](O)CC(OC)=O AK-48318 [0,1,0,0,0,0|2,0,1]=4 31 B7R0.2 OCC(OC(C)C)=O AK-48397 [0,1,0,0,0,0|1,0,1]=3 32 B7R0.3 C=CC(NCCN)=O AK142923 [0,1,0,0,0,0|1,0,0]=2 33 B7R0.3 CCCCC(NN)=O AK114657 [0,1,0,0,0,0|3,0,0]=4 34 B7R0.3 O=C(OC)CCCBr AK-94853 [0,1,0,0,0,0|2,0,1]=4 35 B7R0.3 O=C(OC)CCNC AK-85857 [0,1,0,0,0,0|2,0,1]=4 36 B7R0.5 CC(C)C(OCCl)=O AK163215 [0,1,0,0,0,0|1,0,2]=4 37 B7R0.5 CCOC(=O)C(C)N AK-46063 [0,1,0,0,0,0|0,0,2]=3 38 B7R0.5 CCOC(=O)C(N)=O AK-45440 [0,1,0,0,0,0|1,0,0]=2 39 B7R0.5 CCOC([C@@H](C)O)=O AK-46630 [0,1,0,0,0,0|0,0,2]=3 40 B7R0.5 C[C@H](N)C(OCC)=O AK-49256 [0,1,0,0,0,0|0,0,2]=3 41 B7R0.5 N[C@H](C)C(OCC)=O AK-49997 [0,1,0,0,0,0|0,0,2]=3 42 B7R0.5 O=C(OCC)C(N)=S AK-45462 [0,1,0,0,0,0|1,0,0]=2 43 B7R0.7 C(C)OC(CCI)=O AK-46570 [0,1,0,0,0,0|0,0,2]=3 44 B7R0.7 CC#CC(OCC)=O AK-44989 [0,1,0,0,0,0|0,0,2]=3 45 B7R0.7 CCOC(=O)CCBr AK-76993 [0,1,0,0,0,0|0,0,2]=3 46 B7R0.7 CCOC(=O)CCO AK-41251 [0,1,0,0,0,0|0,0,2]=3 47 B7R0.7 C\C(OCC)=N/C#N AK162386 [0,1,0,0,0,0|2,0,1]=4 48 B7R0.7 O=C(NCC)NCC AK116700 [0,1,0,0,0,0|1,0,2]=4 49 B7R0.7 O=C(OCC)C#CBr AK127753 [0,1,0,0,0,0|0,0,2]=3 50 B7R0.7 O=C(OCC)CCN AK-49791 [0,1,0,0,0,0|0,0,2]=3 51 B7R0.7 O=C(OCC)CNC AK-44190 [0,1,0,0,0,0|0,0,2]=3 52 B7R0.7 O=C(OCC)CNN AK-50556 [0,1,0,0,0,0|1,0,1]=3 53 B7R0.7 O=C(OCC)OCCl AK128867 [0,1,0,0,0,0|1,0,1]=3 54 B7R0.7 O=C(OCC)\C=C\I AK117013 [0,1,0,0,0,0|0,0,0]=1 55 B7R0.10 CCC(N)C(OC)=O AK115477 [0,1,0,0,0,0|2,0,1]=4 56 B7R0.10 CC[C@@H](C(OC)=O)N AK342755 [0,1,0,0,0,0|2,0,1]=4 57 B7R0.10 CC[C@@H](N)C(OC)=O AK115954 [0,1,0,0,0,0|2,0,1]=4 58 B7R0.10 CC[C@H](N)C(OC)=O AK158355 [0,1,0,0,0,0|2,0,1]=4 59 B7R1.2 C1=C(SC(=C1)Br)C AK-36324 [0,0,0,1,0,0|1,1,1]=4 60 B7R1.2 C1=C[N](N=C1C)C AK-47383 [0,0,0,1,0,0|3,0,0]=4 61 B7R1.2 C1=C[N](N=C1N)C AK-25543 [0,0,0,1,0,0|3,0,0]=4 62 B7R1.2 CN1C=CC(I)=N1 AK-86815 [0,0,0,1,0,0|3,0,0]=4 63 B7R1.2 CN1N=C(Br)C=C1 AK-28794 [0,0,0,1,0,0|3,0,0]=4 64 B7R1.2 FC1COC(=O)O1 AK111108 [0,0,0,1,0,0|2,0,1]=4 65 B7R1.2 O=C1NN(C)C=C1 AK-67583 [0,0,0,1,0,0|2,0,0]=3 66 B7R1.2 O=C1OC(C)=CC1 AK601784 [0,0,0,1,0,0|0,0,2]=3 67 B7R1.2 O=C1OC(C)CC1 AK117314 [0,0,0,1,0,0|0,0,2]=3 68 B7R1.2 O=C1OC[C@@H](C)N1 AK115788 [0,0,0,1,0,0|2,0,1]=4 69 B7R1.2 O=C1OC[C@@H](C)O1 AK109386 [0,0,0,1,0,0|1,0,1]=3 70 B7R1.2 O=C1OC[C@H](C)O1 AK109427 [0,0,0,1,0,0|1,0,1]=3 71 B7R1.3 O=C1C=CC=NN1 AK-29318 [0,0,0,1,0,0|2,0,1]=4 72 B7R1.3 O=C1C=COC=C1 AK110934 [0,0,0,1,0,0|2,0,1]=4 73 B7R1.3 O=C1CCCCO1 AK101117 [0,0,0,1,0,0|0,0,2]=3 74 B7R1.3 O=C1CCCOC1 AK-32516 [0,0,0,1,0,0|2,0,1]=4 75 B7R1.3 O=C1CNCCC1 AK-38925 [0,0,0,1,0,0|2,0,1]=4 76 B7R1.3 O=C1CNCCC1 AK-64363 [0,0,0,1,0,0|2,0,1]=4 77 B7R1.3 O=C1COCC=C1 AK120133 [0,0,0,1,0,0|2,0,0]=3 78 B7R1.3 O=C1COCCN1 AK-37649 [0,0,0,1,0,0|2,0,1]=4 79 B7R1.3 O=C1CSCCC1 AK112945 [0,0,0,1,0,0|2,0,1]=4 80 B7R1.3 O=C1NC=NC=C1 Ak-75843 [0,0,0,1,0,0|2,0,1]=4 81 B7R1.3 O=C1NCCC=C1 AK110027 [0,0,0,1,0,0|1,0,0]=2 82 B7R1.3 O=C1NCCCN1 AK-40132 [0,0,0,1,0,0|2,0,1]=4 83 B7R1.3 O=C1NCCNC1 AK-26132 [0,0,0,1,0,0|2,0,1]=4 84 B7R1.3 O=C1NCCSC1 AK-94004 [0,0,0,1,0,0|2,0,1]=4 85 B7R1.3 O=C1OCCOC1 AK117129 [0,0,0,1,0,0|1,0,1]=3 86 B7R1.3 O=S1OCCCO1 AK307879 [0,0,0,1,0,0|2,0,1]=4 87 B7R1.4 NN1CCCC1=O AK-78653 [0,0,0,1,0,0|3,0,0]=4 88 B7R1.4 N[C@@H]1CCOC1=O AK-44454 [0,0,0,1,0,0|1,0,1]=3 89 B7R1.4 N[C@H]1CCOC1=O AK-41531 [0,0,0,1,0,0|1,0,1]=3 90 B7R1.4 O=C1C(CCO1)Br AK-35370 [0,0,0,1,0,0|1,0,1]=3 91 B7R1.4 O=C1C(N)CCS1 AK117085 [0,0,0,1,0,0|1,1,1]=4 92 B7R1.4 O=C1C(O)=CCC1 AK-43709 [0,0,0,1,0,0|2,0,1]=4 93 B7R1.4 O=C1NCCN1C AK-78526 [0,0,0,1,0,0|2,0,1]=4 94 B7R1.4 O=C1NCC[C@@H]1O AK-39196 [0,0,0,1,0,0|2,0,1]=4 95 B7R1.4 O=C1NCC[C@H]1N AK-43088 [0,0,0,1,0,0|2,0,1]=4 96 B7R1.4 O=C1NCC[C@H]1O AK-39107 [0,0,0,1,0,0|2,0,1]=4 97 B7R1.4 O=C1OCCC1N AK543042 [0,0,0,1,0,0|1,0,1]=3 98 B7R1.4 O=C1OCC[C@@H]1O AK-86194 [0,0,0,1,0,0|1,0,1]=3 99 B7R1.4 OC1CCNC1=O AK-39164 [0,0,0,1,0,0|2,0,1]=4 100 B4R0.1 C(N)C(=O)C AK-42698 [2,0,0,0,0,0|1,0,1]=4 101 B4R0.1 C=CC([O-])=O AK160082 [2,0,0,0,0,0|0,0,1]=3 102 B4R0.1 CCC(N)=N AK-48186 [2,0,0,0,0,0|2,0,0]=4 103 B4R0.1 N=C(N)OC AK-48234 [2,0,0,0,0,0|2,0,0]=4 104 B4R0.1 NC(=O)CI AK110349 [2,0,0,0,0,0|2,0,0]=4 105 B4R0.1 NC(OC)=N AK116935 [2,0,0,0,0,0|2,0,0]=4 106 B4R0.1 NCC(N)=O AK-41459 [2,0,0,0,0,0|2,0,0]=4 107 B4R0.1 O=C(N)CBr AK-50036 [2,0,0,0,0,0|2,0,0]=4 108 B4R0.1 O=C(O)CN AK-77854 [2,0,0,0,0,0|1,0,1]=4 109 B4R0.1 O=C([O-])CN AK114167 [2,0,0,0,0,0|2,0,0]=4 110 B4R0.2 C=CCCN AK165308 [2,0,0,0,0,0|1,0,1]=4 111 B4R0.2 NOCC=C AK208821 [2,0,0,0,0,0|1,0,1]=4 112 B6R0.2 CC(NC(C)C)=O AK-86542 [1,1,0,0,0,0|1,0,1]=4 113 B6R0.2 C[C@@H](N)CC(O)=O AK-44656 [1,1,0,0,0,0|2,0,0]=4 114 B6R0.2 C[C@@H](N)CC(O)=O AK112818 [1,1,0,0,0,0|2,0,0]=4 115 B6R0.2 C[C@@H](O)CC(O)=O AK-89074 [1,1,0,0,0,0|2,0,0]=4 116 B6R0.2 C[C@@H](O)CC([O-])=O AK-51650 [1,1,0,0,0,0|2,0,0]=4 117 B6R0.2 C[C@H](N)CC(O)=O AK-34921 [1,1,0,0,0,0|2,0,0]=4 118 B6R0.2 C[C@H](N)CC(O)=O AK-75919 [1,1,0,0,0,0|2,0,0]=4 119 B6R0.3 C(C(N)C(O)=O)C AK-46591 [1,1,0,0,0,0|2,0,0]=4 120 B6R0.3 CC(N(CC)C)=O AK149250 [1,1,0,0,0,0|1,0,1]=4 121 B6R0.3 CCC(=O)C(O)=O AK-48379 [1,1,0,0,0,0|2,0,0]=4 122 B6R0.3 CC[C@@H](C)C(O)=O AK-77439 [1,1,0,0,0,0|2,0,0]=4 123 B6R0.3 CC[C@@H](N)C(O)=O AK-41592 [1,1,0,0,0,0|2,0,0]=4 124 B6R0.3 CC[C@H](N)C(N)=O AK-49090 [1,1,0,0,0,0|2,0,0]=4 125 B6R0.3 CC[C@H](N)C(O)=O AK-46752 [1,1,0,0,0,0|2,0,0]=4 126 B6R0.3 CC[C@H](O)C(O)=O AK-34732 [1,1,0,0,0,0|2,0,0]=4 127 B6R0.4 CC(CCCCl)=O AK-48368 [1,1,0,0,0,0|1,0,1]=4 128 B6R0.4 CC(OCCBr)=O AK165045 [1,1,0,0,0,0|0,0,1]=3 129 B6R0.4 CCCCC([O-])=O AK163205 [1,1,0,0,0,0|2,0,0]=4 130 B6R0.4 NC(OCCC)=O AK116320 [1,1,0,0,0,0|1,0,0]=3 131 B6R0.4 O=C(N)NCCO AK121931 [1,1,0,0,0,0|2,0,0]=4 132 B6R0.4 O=C(O)CCCCl AK113749 [1,1,0,0,0,0|2,0,0]=4 133 B6R0.4 O=C(O)CCCN AK-43987 [1,1,0,0,0,0|2,0,0]=4 134 B6R0.4 O=C(O)CCNC AK155866 [1,1,0,0,0,0|2,0,0]=4 135 B6R0.4 O=C(O)CCOC AK-88477 [1,1,0,0,0,0|2,0,0]=4 136 B6R0.5 CS(=O)(OCC)=O AK544582 [1,1,0,0,0,0|1,0,1]=4 137 B6R0.6 C=CCCCCBr AK-48086 [1,1,0,0,0,0|1,0,1]=4 138 B6R0.6 C\C=C\CCCO AK-46431 [1,1,0,0,0,0|1,0,1]=4 139 B8R0.5 C(C(OCC)=O)C(C)O AK-73006 [0,2,0,0,0,0|0,0,2]=4 140 B8R0.5 CCOC(=O)OC(C)Cl AK109787 [0,2,0,0,0,0|0,0,2]=4 141 B8R0.5 O=C(OCC)CC(N)=O AK-44357 [0,2,0,0,0,0|0,0,1]=3 142 B8R0.5 O=C(OCC)CC(N)=S AK109338 [0,2,0,0,0,0|0,0,1]=3 143 B8R0.5 O=C([O-])CC(OCC)=O AK-88661 [0,2,0,0,0,0|0,0,1]=3 144 B8R0.5 O[C@@H](CC(=O)OCC)C AK-44441 [0,2,0,0,0,0|0,0,2]=4 145 B8R0.23 CC(C)OC([C@H](C)N)=O AK-40023 [0,2,0,0,0,0|0,0,2]=4 146 B8R0.23 C[C@H](N)C(OC(C)C)=O AK136097 [0,2,0,0,0,0|0,0,2]=4 147 B8R0.24 CC(C)(C)OC(=O)CN AK-84881 [0,2,0,0,0,0|1,0,1]=4 148 B8R0.24 CC(C)(C)OC(=O)CO AK-77037 [0,2,0,0,0,0|1,0,1]=4 149 B8R0.24 CC(OC(NN)=O)(C)C AK-47385 [0,2,0,0,0,0|2,0,0]=4 150 B8R0.24 CC(OC(NO)=O)(C)C AK-47671 [0,2,0,0,0,0|2,0,0]=4 151 B8R0.24 O=C(OC(C)(C)C)CI AK130198 [0,2,0,0,0,0|1,0,1]=4 152 B8R0.24 O=C(OC(C)(C)C)CN AK-46074 [0,2,0,0,0,0|1,0,1]=4 153 B8R0.24 O=C(OC(C)(C)C)NC AK-77399 [0,2,0,0,0,0|1,0,1]=4 154 B8R0.1 CCOC(=O)CCCI AK102411 [0,2,0,0,0,0|0,0,2]=4 155 B8R0.1 CCOC(=O)CCCN AK-47111 [0,2,0,0,0,0|0,0,2]=4 156 B8R0.1 O=C(OCC)CCCBr AK-41609 [0,2,0,0,0,0|0,0,2]=4 157 B8R0.3 C(OC(C(=NO)Cl)=O)C AK-23903 [0,2,0,0,0,0|1,0,0]=3 158 B8R0.3 C=C(CO)C(OCC)=O AK-45452 [0,2,0,0,0,0|0,0,0]=2 159 B8R0.3 CC(C#N)C(OCC)=O AK-98818 [0,2,0,0,0,0|0,0,2]=4 160 B8R0.3 CCC(C(OCC)=O)=O AK-75904 [0,2,0,0,0,0|0,0,1]=3 161 B8R0.3 CCOC(=O)C(N)CO AK-81620 [0,2,0,0,0,0|0,0,2]=4 162 B8R0.3 CCOC([C@@H](CO)N)=O AK-49218 [0,2,0,0,0,0|0,0,2]=4 163 B8R0.3 CC[C@H](N)C(OCC)=O AK342326 [0,2,0,0,0,0|0,0,2]=4 164 B8R0.3 N[C@@H](CS)C(OCC)=O AK-49182 [0,2,0,0,0,0|0,0,2]=4 165 B8R0.3 O=C(OCC)C(CBr)=O AK-96394 [0,2,0,0,0,0|0,0,1]=3 166 B8R0.3 O=C(OCC)C(NN)=O AK-65253 [0,2,0,0,0,0|1,0,0]=3 167 B8R0.3 [C@H](N)(CO)C(=O)OCC AK-49623 [0,2,0,0,0,0|0,0,2]=4 168 B8R0.6 C=CC(CCCCC)=O AK164478 [0,2,0,0,0,0|1,0,0]=3 169 B8R0.6 O=C(OC)COCCCl AK-44958 [0,2,0,0,0,0|1,0,1]=4 170 B8R0.9 C=CC(OCC(O)C)=O AK110453 [0,2,0,0,0,0|0,0,0]=2 171 B8R0.14 CCOC(=O)C(C)(C)N AK-54013 [0,2,0,0,0,0|0,0,2]=4 172 B6R1.2 O=C1OCC=C1 AK163254 [1,0,0,1,0,0|0,0,1]=3 173 B6R1.2 O=C1OCCN1 AK-94050 [1,0,0,1,0,0|1,0,0]=3 174 B6R1.2 O=C1OCCO1 AK101077 [1,0,0,1,0,0|1,0,0]=3 175 B6R1.2 O=C1SCCN1 AK-89361 [1,0,0,1,0,0|1,1,0]=4 176 B6R1.1 C1CC=CCN1 AK-91689 [1,0,0,1,0,0|1,0,1]=4 177 B8R1.1 CC1=CC=C(S1)C=O AK-30245 [0,1,0,1,0,0|0,1,1]=4 178 B8R1.1 CCC1=CC=C(C)S1 AK103790 [0,1,0,1,0,0|1,1,0]=4 179 B8R1.1 C[N]1C=CC(=N1)C=O AK-39769 [0,1,0,1,0,0|2,0,0]=4 180 B8R1.1 O=C1O[C@H](CCl)CN1 AK110469 [0,1,0,1,0,0|1,0,1]=4 181 B8R1.1 O=CC1=CC=C(Br)O1 AK-32379 [0,1,0,1,0,0|1,0,1]=4 182 B8R1.1 O=CC1=CC=C(C)O1 AK-94177 [0,1,0,1,0,0|0,0,1]=3 183 B8R1.1 O=CC1=CC=C(Cl)O1 AK158080 [0,1,0,1,0,0|1,0,1]=4 184 B8R1.1 O=CC1=CN=C(C)O1 AK-25452 [0,1,0,1,0,0|1,0,1]=4 185 B8R1.1 OCC1=CC=C(C)O1 AK135169 [0,1,0,1,0,0|0,0,2]=4 186 B8R1.4 CC1=CC(C=CN1)=O AK-25534 [0,1,0,1,0,0|1,0,1]=4 187 B8R1.4 CN1CCOC(=O)C1 AK-33826 [0,1,0,1,0,0|0,0,2]=4 188 B8R1.4 N1CCC(CC1=O)=O AK-23571 [0,1,0,1,0,0|1,0,1]=4 189 B8R1.4 NC=1CCCC(C1)=O AK-49851 [0,1,0,1,0,0|1,0,0]=3 190 B8R1.4 O=C1C=CC=C(C)N1 AK-29158 [0,1,0,1,0,0|1,0,1]=4 191 B8R1.4 O=C1CC(CCC1)=O AK-44688 [0,1,0,1,0,0|1,0,1]=4 192 B8R1.4 O=C1NC(C)=NC=C1 AK-46845 [0,1,0,1,0,0|1,0,1]=4 193 B8R1.18 CC1=C(OC(O1)=O)C AK-49114 [0,1,0,1,0,0|0,0,2]=4 194 B8R1.18 O=C1C(Br)=CC(O1)=O AK-43651 [0,1,0,1,0,0|1,0,1]=4 195 B8R1.18 O=C1C(C)CC(O1)=O AK113612 [0,1,0,1,0,0|2,0,0]=4 196 B8R1.18 O=C1N[C@@H](C)C(O1)=O AK109319 [0,1,0,1,0,0|2,0,0]=4 197 B8R1.18 O=C1OC(O)C(C)=C1 AK-59834 [0,1,0,1,0,0|1,0,0]=3 198 B8R1.51 O=C1OC(C)(C)CC1 AK-44637 [0,1,0,1,0,0|0,0,2]=4 199 B8R1.2 N#CC1=CCCCO1 AK-78862 [0,1,0,1,0,0|1,0,1]=4 200 B8R1.3 O=C1C=CC(C)=NN1 AK-33134 [0,1,0,1,0,0|1,0,1]=4 201 B8R1.3 O=C1COC(O)C=C1 AK-82130 [0,1,0,1,0,0|1,0,0]=3 202 B8R1.5 O=C1C(CCCC1)=O AK-46655 [0,1,0,1,0,0|1,0,1]=4 203 B8R1.5 O=C1C(O)=CC=CO1 AK-77266 [0,1,0,1,0,0|0,0,2]=4 204 B8R1.22 O=C1C=CCCCC1 AK-88461 [0,1,0,1,0,0|1,0,0]=3 205 B8R1.22 O=C1OCCCCC1 AK164169 [0,1,0,1,0,0|0,0,2]=4 206 B8R1.50 CC=1CCC(C1O)=O AK103328 [0,1,0,1,0,0|2,0,0]=4 207 B8R1.50 O=C1OC[C@@H](O)[C@H]1O AK158528 [0,1,0,1,0,0|1,0,1]=4 208 B8R1.54 OC(=O)C(=O)C1CC1 AK110685 [0,1,0,1,0,0|2,0,0]=4 209 B8R1.8 C1=CN=C(CCC)[NH]1 AK-49074 [0,1,0,1,0,0|2,0,0]=4 210 B8R1.8 CCCC1=NC=CS1 AK-60893 [0,1,0,1,0,0|1,1,0]=4 211 B8R1.8 CCOC1=NC=CS1 AK-79313 [0,1,0,1,0,0|0,1,0]=3 212 B8R1.11 CCN1N=CC=C1N AK-57067 [0,1,0,1,0,0|2,0,0]=4