0 B14R1.164 CC(=O)OC1CC(C)CCC1C(O)=O Amb25063292 [0,0,0,0,0,0|2,0,1]=3 1 B14R1.164 CC(=O)O[C@@H]1C[C@@H](C)CC[C@@H]1C(O)=O Amb24512941 [0,0,0,0,0,0|2,0,1]=3 2 B14R1.164 CC(=O)O[C@H]1C[C@H](C)CC[C@H]1C(O)=O Amb24512940 [0,0,0,0,0,0|2,0,1]=3 3 B14R1.164 CC(C)=C1CCC(C)CC1CC(O)=O Amb25817546 [0,0,0,0,0,0|2,0,2]=4 4 B14R1.164 CC(C)=C1CC[C@@H](C)CC1CC(O)=O Amb25815093 [0,0,0,0,0,0|2,0,2]=4 5 B14R1.164 CC(C)=C1CC[C@@H](C)C[C@H]1CC(O)=O Amb25209954 [0,0,0,0,0,0|2,0,2]=4 6 B14R1.164 CC(C)C1CCC(C)CC1CC(C)=C Amb24526829 [0,0,0,0,0,0|2,0,0]=2 7 B14R1.164 CC(C)C1CCC(C)CC1CC(N)=O Amb25200983 [0,0,0,0,0,0|2,0,0]=2 8 B14R1.164 CC(C)C1CCC(C)CC1NC(C)=S Amb24467067 [0,0,0,0,0,0|1,1,0]=2 9 B14R1.164 CC(C)C1CCC(C)CC1NC(N)=O Amb25708464 [0,0,0,0,0,0|2,0,0]=2 10 B14R1.164 CC(C)C1CCC(C)CC1OB([O-])[O-] Amb22232326 [0,0,0,0,0,0|2,0,1]=3 11 B14R1.164 CC(C)C1CCC(C)CC1OC(Cl)=O Amb17678766 [0,0,0,0,0,0|1,0,0]=1 12 B14R1.164 CC(C)C=1CCC(C)CC1CC(O)=O Amb25103561 [0,0,0,0,0,0|2,0,2]=4 13 B14R1.164 CC(C)[C@@H]/1CC[C@@H](C)C\C1=C/C(O)=O Amb25201490 [0,0,0,0,0,0|2,0,1]=3 14 B14R1.164 CC(C)[C@@H]1CCC(C)=CC1NC(C)=O Amb25695434 [0,0,0,0,0,0|1,0,2]=3 15 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)CC1CC(O)=O Amb25274086 [0,0,0,0,0,0|2,0,0]=2 16 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OC(C)=O Amb22336235 [0,0,0,0,0,0|0,0,0]=0 17 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1NC(N)=O Amb24563410 [0,0,0,0,0,0|2,0,0]=2 18 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)Cl Amb20242385 [0,0,0,0,0,0|1,0,0]=1 19 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(C)=O Amb18511844 [0,0,0,0,0,0|0,0,0]=0 20 B14R1.164 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(N)=O Amb17844396 [0,0,0,0,0,0|1,0,0]=1 21 B14R1.164 CC(C)[C@@H]1CC[C@H](C)C[C@H]1OC(N)=O Amb25339646 [0,0,0,0,0,0|1,0,0]=1 22 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(N)=O Amb24527797 [0,0,0,0,0,0|2,0,0]=2 23 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(C)=O Amb25315502 [0,0,0,0,0,0|0,0,0]=0 24 B14R1.164 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(N)=O Amb24695164 [0,0,0,0,0,0|1,0,0]=1 25 B14R1.164 CC(C)[C@H]1CC[C@H](C)C[C@H]1OC(C)=O Amb22232055 [0,0,0,0,0,0|0,0,0]=0 26 B14R1.164 CC1CCC([C@@H](C1)NC(C)C)C(C)C Amb25763535 [0,0,0,0,0,0|2,0,1]=3 27 B14R1.164 CC=1CCC(C(CC(O)=O)C1)C(C)C Amb24423860 [0,0,0,0,0,0|2,0,2]=4 28 B14R1.164 CN(C)C1CCN(C)CC1CC(O)=O Amb18187392 [0,0,0,0,0,0|4,0,0]=4 29 B14R1.164 C[C@@H]1CC[C@H](C(C1)OC(=O)C)C(C)C Amb10559468 [0,0,0,0,0,0|0,0,0]=0 30 B14R1.164 C[C@@H]1CC[C@H]([C@@H](C1)NC(C)C)C(C)C Amb25295342 [0,0,0,0,0,0|2,0,1]=3 31 B14R1.164 C[C@@H]1CC[C@H]([C@@H](C1)OC(C)=O)C(C)=C Amb22801079 [0,0,0,0,0,0|0,0,2]=2 32 B13R1.356 CC(C)C/1CCC(C)C\C1=C\C=O Amb24440993 [1,0,0,0,0,0|1,0,1]=3 33 B13R1.356 CC(C)C1CCC(C)CC1=NOC Amb25120546 [1,0,0,0,0,0|2,0,1]=4 34 B13R1.356 CC(C)C1CCC(C)CC1CCN Amb18326146 [1,0,0,0,0,0|2,0,1]=4 35 B13R1.356 CC(C)C1CCC(C)CC1CCO Amb24531683 [1,0,0,0,0,0|1,0,2]=4 36 B13R1.356 CC(C)C1CCC(C)CC1N=[N+]=[N-] Amb25828538 [1,0,0,0,0,0|3,0,0]=4 37 B13R1.356 CC(C)C1CCC(C)CC1NOC Amb24492081 [1,0,0,0,0,0|2,0,0]=3 38 B13R1.356 CC(C)C1CCC(C)CC1OCCl Amb25690513 [1,0,0,0,0,0|1,0,1]=3 39 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)CC1CC=C Amb24515046 [1,0,0,0,0,0|1,0,1]=3 40 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)CC1CCO Amb24579434 [1,0,0,0,0,0|1,0,2]=4 41 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)CC1N=C=O Amb25269526 [1,0,0,0,0,0|1,0,1]=3 42 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1NC=O Amb25198898 [1,0,0,0,0,0|1,0,0]=2 43 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1NCC Amb24617202 [1,0,0,0,0,0|1,0,1]=3 44 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1OCCl Amb22799447 [1,0,0,0,0,0|1,0,1]=3 45 B13R1.356 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1N=C=O Amb24589371 [1,0,0,0,0,0|1,0,1]=3 46 B13R1.356 CC(C)[C@@H]1CC[C@H](C)C[C@H]1NC=O Amb25249111 [1,0,0,0,0,0|1,0,0]=2 47 B13R1.356 CC(C)[C@@H]1CC[C@H](C)C[C@H]1OCCl Amb22337997 [1,0,0,0,0,0|1,0,1]=3 48 B13R1.356 CC(C)[C@H]1CC[C@@H](C)C[C@H]1N=[N+]=[N-] Amb25259169 [1,0,0,0,0,0|3,0,0]=4 49 B13R1.356 CC(C)[C@H]1CC[C@H](C)C[C@H]1N=[N+]=[N-] Amb24761307 [1,0,0,0,0,0|3,0,0]=4 50 B13R1.356 O=COC1CC(C)CCC1C(C)C Amb10562527 [1,0,0,0,0,0|0,0,0]=1 51 B13R1.589 CC(=O)N[C@H]1CCCC[C@@H]1N(C)C Amb24681173 [1,0,0,0,0,0|2,0,0]=3 52 B13R1.589 CC(=O)OC1CCCCC1C(=O)Cl Amb25222643 [1,0,0,0,0,0|2,0,1]=4 53 B13R1.589 CC(=O)OC1CCCCC1C(O)=O Amb25276247 [1,0,0,0,0,0|2,0,1]=4 54 B13R1.589 CC(=O)OC1OCCCC1N(C)C Amb25809401 [1,0,0,0,0,0|2,0,0]=3 55 B13R1.589 CC(=O)O[C@@H]1CCCC[C@@H]1C(=O)Cl Amb25288486 [1,0,0,0,0,0|2,0,1]=4 56 B13R1.589 CC(=O)O[C@@H]1CCCC[C@@H]1C(O)=O Amb25322063 [1,0,0,0,0,0|2,0,1]=4 57 B13R1.589 CC(C)C1CCCCC1NC(C)=N Amb25721765 [1,0,0,0,0,0|2,0,0]=3 58 B13R1.589 CC(C)C1CCCCC1NC(C)C Amb25677883 [1,0,0,0,0,0|2,0,1]=4 59 B13R1.589 CC(C)C1CCCCC1NC(N)=N Amb25726685 [1,0,0,0,0,0|3,0,0]=4 60 B13R1.589 CC(C)C1CCCCC1NC(N)=S Amb24395870 [1,0,0,0,0,0|2,1,0]=4 61 B13R1.589 CC(C)C1CCCCC1NN(C)C Amb24739103 [1,0,0,0,0,0|3,0,0]=4 62 B13R1.589 CC(C)C1CCCCC1OC(C)=O Amb25188505 [1,0,0,0,0,0|0,0,0]=1 63 B13R1.589 CC(C)N1CCCCC1CC(C)=O Amb25062751 [1,0,0,0,0,0|2,0,0]=3 64 B13R1.589 CC(C)N1CCCCC1CC(N)=O Amb25725326 [1,0,0,0,0,0|3,0,0]=4 65 B13R1.589 CC(C)N1CCCCC1CC(O)=O Amb18971241 [1,0,0,0,0,0|3,0,0]=4 66 B13R1.589 CC(C)[C@@H]1NCCC[C@H]1CC(O)=O Amb18191312 [1,0,0,0,0,0|3,0,0]=4 67 B13R1.589 CN(C)C1CCCCC1CC(O)=O Amb18822385 [1,0,0,0,0,0|3,0,0]=4 68 B13R1.589 CN(C)C1CCCCC1NC(N)=O Amb25791028 [1,0,0,0,0,0|3,0,0]=4 69 B13R1.589 CN(C)[C@@H]1CCCC[C@@H]1CC(O)=O Amb25264058 [1,0,0,0,0,0|3,0,0]=4 70 B13R1.3089 CC1CC(OC(C)=O)C(CO)CO1 Amb24414941 [1,0,0,0,0,0|2,0,0]=3 71 B13R1.3089 CC1CN(CC(C)=O)C(CO1)CC Amb18319082 [1,0,0,0,0,0|3,0,0]=4 72 B13R1.3089 CO[C@H]1OC[C@H](O)C[C@H]1OC(C)=O Amb25345139 [1,0,0,0,0,0|3,0,0]=4 73 B15R1.3825 BrCC(=O)OC1C[C@H](C)CC[C@H]1C(C)C Amb10559469 [0,1,0,0,0,0|0,0,0]=1 74 B15R1.3825 CC(C)C1CCC(C)CC1NC(=O)CBr Amb25770251 [0,1,0,0,0,0|1,0,0]=2 75 B15R1.3825 CC(C)C1CCC(C)CC1OC(=O)C=C Amb17934078 [0,1,0,0,0,0|0,0,1]=2 76 B15R1.3825 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C#C Amb17779643 [0,1,0,0,0,0|0,0,1]=2 77 B15R1.3825 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C=O Amb22800348 [0,1,0,0,0,0|0,0,1]=2 78 B15R1.3825 O=CC(=O)OC1C[C@H](C)CCC1C(C)C Amb16232551 [0,1,0,0,0,0|0,0,1]=2 79 B15R1.3825 OCC(=O)OC1CC(C)CCC1C(C)C Amb1111301 [0,1,0,0,0,0|0,0,0]=1 80 B15R1.8416 CC(C(O)=O)=C1CC(C)CCC1C(C)C Amb25050408 [0,1,0,0,0,0|2,0,1]=4 81 B15R1.8416 CC(C)C1CCC(C)CC1=C(F)C(O)=O Amb24701697 [0,1,0,0,0,0|2,0,1]=4 82 B15R1.8416 CC(C)C1CCC(C)CC1C(O)C(O)=O Amb24445904 [0,1,0,0,0,0|2,0,0]=3 83 B15R1.8416 CC1CCC(C(C1)C(=O)C(C)C)C(C)C Amb25141919 [0,1,0,0,0,0|2,0,1]=4 84 B15R1.8423 CC(C)C1CCC(C)CC1(N)CC(O)=O Amb24369319 [0,1,0,0,0,0|2,0,0]=3 85 B15R1.8423 CC(C)C1CCC(C)CC1(O)CC(O)=O Amb25123661 [0,1,0,0,0,0|2,0,0]=3 86 B15R1.12198 CN(C)C1CCC(C)(C)CC1CC(O)=O Amb18170267 [0,1,0,0,0,0|3,0,0]=4 87 B13R0.53 CC(C)=C(COC(C)=O)CCC(C)C Amb24063770 [0,0,1,0,0,0|0,0,2]=3 88 B13R0.53 CC(C)CCC(COC(C)=O)C(C)C Amb22734821 [0,0,1,0,0,0|0,0,0]=1 89 B13R0.1398 CC(=O)OCCC(C)CCCC(C)=C Amb22353574 [0,0,1,0,0,0|0,0,2]=3 90 B13R0.1398 CC(CCOC(C)=O)CCC=C(C)C Amb17679059 [0,0,1,0,0,0|0,0,2]=3 91 B15R2.7491 CC1CC=2NC(=O)CC(C)(C)C2CC1 Amb25325027 [0,0,0,1,0,0|1,0,2]=4 92 B15R2.7569 CC1CCC(C(C1)NC2CC2)C(C)C Amb1120311 [0,0,0,1,0,0|2,0,1]=4 93 B15R2.9809 CC1=CC(OC(C)=O)C2CC1C2(C)C Amb25806061 [0,0,0,1,0,0|0,0,2]=3 94 B15R2.9809 CC1=CC(OC(C)=O)[C@H]2C[C@@H]1C2(C)C Amb25354085 [0,0,0,1,0,0|0,0,2]=3 95 B15R2.14564 CC(C)C1CCC(C)C2C1C2C(N)=O Amb25228367 [0,0,0,1,0,0|2,0,0]=3 96 B15R2.14564 CC(C)[C@@H]1CC[C@@H](C)C2C1C2C(O)=O Amb24519482 [0,0,0,1,0,0|2,0,0]=3 97 B15R2.53056 CC(=O)NC1=C[C@H](C)C[C@H]2[C@@H]1C2(C)C Amb25324505 [0,0,0,1,0,0|1,0,2]=4 98 B15R2.63911 CC1CC2NC(C)(C)CC(C)C2CC1 Amb25664305 [0,0,0,1,0,0|2,0,1]=4 99 B15R2.68082 CC1(C)C2CCC1(C)CC2CC(O)=O Amb23589662 [0,0,0,1,0,0|2,0,0]=3 100 B15R2.68082 CC1(C)C2CCC1(C)CC2NC(C)=O Amb25165799 [0,0,0,1,0,0|1,0,0]=2 101 B15R2.68082 CC1(C)C2CCC1(C)CC2SC(N)=N Amb25200183 [0,0,0,1,0,0|2,1,0]=4 102 B15R2.68082 CC1(C)[C@@H]2CC[C@@]1(C)CC2CC(O)=O Amb25176042 [0,0,0,1,0,0|2,0,0]=3 103 B15R2.68082 CC1(C)[C@@H]2CC[C@]1(C)C[C@H]2CC(O)=O Amb25176105 [0,0,0,1,0,0|2,0,0]=3 104 B15R2.68082 CC1(C)[C@H]2CC[C@]1(C)C[C@H]2NC(C)=O Amb24513112 [0,0,0,1,0,0|1,0,0]=2 105 B13R1.165 CC(C)C1CCC(C)CC1C(C)=O Amb25355463 [0,0,0,0,1,0|0,0,0]=1 106 B13R1.165 CC(C)C1CCC(C)CC1C(C)Cl Amb25830109 [0,0,0,0,1,0|1,0,1]=3 107 B13R1.165 CC(C)C1CCC(C)CC1C(C)O Amb24490017 [0,0,0,0,1,0|0,0,2]=3 108 B13R1.165 CC(C)C1CCC(C)CC1C(O)=O Amb18318870 [0,0,0,0,1,0|1,0,0]=2 109 B13R1.165 CC(C)C1CCC(C)CC1N(C)C Amb17689172 [0,0,0,0,1,0|2,0,0]=3 110 B13R1.165 CC(C)C1NCC(C)CC1C(O)=O Amb25083263 [0,0,0,0,1,0|2,0,0]=3 111 B13R1.165 CC(C)C=1CCC(C)CC1C(N)=O Amb24490078 [0,0,0,0,1,0|1,0,2]=4 112 B13R1.165 CC(C)N1CCC(C)CC1C(N)=O Amb25145153 [0,0,0,0,1,0|2,0,0]=3 113 B13R1.165 CC(C)N1CCC(C)CC1C(O)=O Amb25340776 [0,0,0,0,1,0|2,0,0]=3 114 B13R1.165 CC(C)[C@@H]1CCC(C)CC1C(O)=O Amb25269458 [0,0,0,0,1,0|1,0,0]=2 115 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)CC1C(C)=O Amb24761425 [0,0,0,0,1,0|0,0,0]=1 116 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1C(O)=O Amb25241231 [0,0,0,0,1,0|1,0,0]=2 117 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(=O)Cl Amb24602894 [0,0,0,0,1,0|1,0,0]=2 118 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(N)=O Amb25233002 [0,0,0,0,1,0|1,0,0]=2 119 B13R1.165 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(O)=O Amb22169743 [0,0,0,0,1,0|1,0,0]=2 120 B13R1.165 CC1NCC(N(C1)C(=O)C)C(C)C Amb17578363 [0,0,0,0,1,0|2,0,0]=3 121 B13R1.165 CN(C)C1CCN(C)CC1C(O)=O Amb18822006 [0,0,0,0,1,0|3,0,0]=4 122 B13R1.165 C[C@H]1CC[C@@H](C(C1)C(C)=O)C(C)=O Amb24598816 [0,0,0,0,1,0|1,0,1]=3 123 B13R1.3496 CC(C)C1CCC(C)C1CC(O)=O Amb25363155 [0,0,0,0,1,0|2,0,0]=3 124 B13R1.3496 CC(C)C1CCC(C)C1NC(C)=O Amb25289237 [0,0,0,0,1,0|1,0,0]=2 125 B13R1.3496 CC(C)C1CCC(C)C1NC(N)=O Amb24346983 [0,0,0,0,1,0|2,0,0]=3 126 B15R1.8435 CC(C)C/1CCC(C)C\C1=N\NC(N)=O Amb21947900 [0,0,0,0,0,1|2,0,1]=4 127 B15R1.8435 CC(C)C1CCC(C)CC1NNC(N)=O Amb24070151 [0,0,0,0,0,1|2,0,0]=3 128 B15R1.8435 CC1CCC(C(C1)NCC(=O)N)C(C)C Amb1113204 [0,0,0,0,0,1|2,0,0]=3 129 B15R1.8435 CC1CCC(C(C1)OCC(=O)Cl)C(C)C Amb16233700 [0,0,0,0,0,1|1,0,0]=2 130 B15R1.29351 CC(C)C1CCC(C)CCN1CC(N)=O Amb19370950 [0,0,0,0,0,1|3,0,0]=4 131 B12R0.41 CC(=O)OC(CC(C)C)CC(C)C Amb22732150 [1,0,1,0,0,0|0,0,0]=2 132 B12R0.233 CCCCCC(C)CCCC(O)=O Amb24062978 [1,0,1,0,0,0|2,0,0]=4 133 B12R0.233 CCCCCC(CCCC(C)C)C Amb10069381 [1,0,1,0,0,0|1,0,1]=4 134 B12R0.268 CC(C)CCCCCCCC(O)=O Amb24117911 [1,0,1,0,0,0|2,0,0]=4 135 B12R1.57 CC(C)C1CC=C(C)CC1C=O Amb24357262 [2,0,0,0,0,0|0,0,2]=4 136 B12R1.57 CC(C)C1CCC(C)=CC1C=O Amb24342025 [2,0,0,0,0,0|0,0,2]=4 137 B12R1.57 CC(C)C1CCC(C)CC1C#C Amb24375357 [2,0,0,0,0,0|0,0,2]=4 138 B12R1.57 CC(C)C1CCC(C)CC1CO Amb24752232 [2,0,0,0,0,0|0,0,2]=4 139 B12R1.57 CC(C)C1CCC(C)CC1ON Amb24441659 [2,0,0,0,0,0|1,0,0]=3 140 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)CC1NO Amb24601981 [2,0,0,0,0,0|1,0,1]=4 141 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)CC1[Mg]Cl Amb22897313 [2,0,0,0,0,0|2,0,0]=4 142 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1CCl Amb25326794 [2,0,0,0,0,0|1,0,1]=4 143 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1NC Amb25338691 [2,0,0,0,0,0|1,0,0]=3 144 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C#N Amb22232807 [2,0,0,0,0,0|1,0,1]=4 145 B12R1.57 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C=O Amb24513203 [2,0,0,0,0,0|0,0,0]=2 146 B12R1.57 CC(C)[C@@H]1CC[C@H](C)C[C@@H]1C#N Amb22747540 [2,0,0,0,0,0|1,0,1]=4 147 B12R1.57 CC(C)[C@H]1CCC(C)=C[C@@H]1C=O Amb25339626 [2,0,0,0,0,0|0,0,2]=4 148 B12R1.57 CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC Amb24655073 [2,0,0,0,0,0|1,0,0]=3 149 B12R1.57 CC(C)[C@H]1CC[C@@H](C)C[C@H]1C#N Amb25259156 [2,0,0,0,0,0|1,0,1]=4 150 B12R1.57 CC(C)[C@H]1CC[C@H](C)C[C@H]1C=O Amb25326691 [2,0,0,0,0,0|0,0,0]=2 151 B12R1.57 CC1CCC(C(C1)C=O)C(C)=C Amb24382859 [2,0,0,0,0,0|0,0,2]=4 152 B12R1.57 CNC1CC(C)CCC1C(C)C Amb1115756 [2,0,0,0,0,0|1,0,0]=3 153 B12R1.57 NCC1CC(C)CCC1C(C)C Amb10610272 [2,0,0,0,0,0|1,0,1]=4 154 B12R1.268 CC1CCC(NC)C(C1)OCC Amb18807046 [2,0,0,0,0,0|1,0,1]=4 155 B12R1.283 CC(C)C1CCCCC1CNC Amb25850478 [2,0,0,0,0,0|2,0,0]=4 156 B12R1.283 CC(C)C1CCCCC1NCC Amb18801654 [2,0,0,0,0,0|1,0,1]=4 157 B12R1.283 CC(C)C1CCCCN1CC=O Amb25195968 [2,0,0,0,0,0|2,0,0]=4 158 B12R1.283 CC(C)N1CCCCC1CC=O Amb24527639 [2,0,0,0,0,0|2,0,0]=4 159 B12R1.75 CC(=O)NC1CCCCC1CBr Amb25036201 [2,0,0,0,0,0|2,0,0]=4 160 B12R1.75 CC(=O)NC1CCCCC1CCl Amb25036202 [2,0,0,0,0,0|2,0,0]=4 161 B12R1.75 CC(=O)N[C@@H]1CCCC[C@H]1CO Amb25216727 [2,0,0,0,0,0|2,0,0]=4 162 B12R1.75 CC(=O)OC1CCCCC1C=O Amb18647323 [2,0,0,0,0,0|1,0,1]=4 163 B12R1.75 CC(=O)OC1CCCCC1CN Amb25159282 [2,0,0,0,0,0|1,0,0]=3 164 B12R1.75 CC(=O)OC1CCCC[C@H]1CN Amb25152601 [2,0,0,0,0,0|1,0,0]=3 165 B12R1.75 CCC1CCCCC1CC(O)=O Amb25152261 [2,0,0,0,0,0|2,0,0]=4 166 B12R1.75 CCC1CCCCC1NC(C)=N Amb25712483 [2,0,0,0,0,0|2,0,0]=4 167 B12R1.75 CCC1CCCCC1NC(N)=O Amb18801890 [2,0,0,0,0,0|2,0,0]=4 168 B12R1.75 CNC1CCCCC1NC(C)=O Amb21862533 [2,0,0,0,0,0|2,0,0]=4 169 B12R1.75 COC1CCCCC1CC(C)=O Amb25112608 [2,0,0,0,0,0|2,0,0]=4 170 B12R1.75 CO[C@@H]1CCCC[C@H]1NC(C)=O Amb25220849 [2,0,0,0,0,0|2,0,0]=4 171 B12R1.75 CS[C@H]1CCCC[C@@H]1NC(C)=O Amb24668924 [2,0,0,0,0,0|2,0,0]=4 172 B12R1.75 NC(=O)OC1CCCCC1CBr Amb24703160 [2,0,0,0,0,0|2,0,0]=4 173 B12R1.127 CC(=O)OC1CC(=O)CCC1C Amb25371745 [2,0,0,0,0,0|1,0,1]=4 174 B12R1.127 CC(=O)OC1CC(C)CCC1=O Amb24532708 [2,0,0,0,0,0|1,0,1]=4 175 B12R1.127 CC(=O)O[C@@H]1C[C@@H](C)CCC1=O Amb24631563 [2,0,0,0,0,0|1,0,1]=4 176 B12R1.127 CC(=O)O[C@H]1CC(=O)CC[C@@H]1C Amb24621327 [2,0,0,0,0,0|1,0,1]=4 177 B12R1.127 CC1CC(CC(O)=O)C(C)CC1 Amb25793973 [2,0,0,0,0,0|2,0,0]=4 178 B12R1.127 CC1CSC(C)CC1NC(C)=O Amb25359911 [2,0,0,0,0,0|2,0,0]=4 179 B12R1.127 C[C@@H]1CS[C@@H](C)C[C@H]1NC(C)=O Amb25285549 [2,0,0,0,0,0|2,0,0]=4 180 B14R1.440 CC1CCC(C(C1)N=C=O)C(C)(C)C Amb25689481 [1,1,0,0,0,0|1,0,1]=4 181 B14R1.440 CC1CCC(C(C1)NC=O)C(C)(C)O Amb24440186 [1,1,0,0,0,0|1,0,0]=3 182 B14R1.440 C[C@@H]1CC[C@H]([C@@H](C1)N=C=O)C(C)(C)C Amb24544758 [1,1,0,0,0,0|1,0,1]=4 183 B14R1.707 CC(C)C1CCC(C)CC1C(=O)CC Amb25247714 [1,1,0,0,0,0|1,0,1]=4 184 B14R1.707 CC(C)C1CCC(C)CC1C(Br)CC Amb25091443 [1,1,0,0,0,0|1,0,1]=4 185 B14R1.707 CC(C)C1CCC(C)CC1C(C)NC Amb25832993 [1,1,0,0,0,0|2,0,0]=4 186 B14R1.707 CC(C)C1CCC(C)CC1C(O)CC Amb25857713 [1,1,0,0,0,0|1,0,1]=4 187 B14R1.760 CC(C)C/1CCC(C)C\C1=C/CC=O Amb25783762 [1,1,0,0,0,0|1,0,1]=4 188 B14R1.760 CC(C)[C@@H]1CC[C@@H](C)CC1\C=C\C=O Amb24690530 [1,1,0,0,0,0|1,0,0]=3 189 B14R1.760 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1\C=C\C=O Amb25143342 [1,1,0,0,0,0|1,0,0]=3 190 B14R1.6545 CC(C)C1CCC(C)(C)CC1=CC=O Amb24633602 [1,1,0,0,0,0|1,0,1]=4 191 B14R1.14833 CC(C)C1CCC(C)C(=O)C1CC=O Amb25116515 [1,1,0,0,0,0|1,0,1]=4 192 B14R1.17362 CC(C)C1CCC(C)CC1(O)CNC Amb19085914 [1,1,0,0,0,0|2,0,0]=4 193 B14R1.17362 CC(C)C1CCC(C)CC1(O)COC Amb24759969 [1,1,0,0,0,0|2,0,0]=4 194 B14R1.17362 CC(C)[C@@H]1CC[C@@H](C)C[C@@]1(O)CC=C Amb20242996 [1,1,0,0,0,0|1,0,1]=4 195 B14R1.429 CC(C)C1CCCCC1C(O)C(O)=O Amb25321615 [1,1,0,0,0,0|2,0,0]=4 196 B14R1.815 CC(=O)NC1CCCCC1C(C)(C)C Amb2109803 [1,1,0,0,0,0|1,0,0]=3 197 B14R1.1503 CC(O)C1CCCCC1(C)NC(C)=O Amb24336436 [1,1,0,0,0,0|2,0,0]=4 198 B14R1.3302 CC(C)C/1CCCC\C1=C\C(=O)OC Amb25668098 [1,1,0,0,0,0|1,0,1]=4 199 B14R1.3302 CC(C)C1CCCCC1NC(=O)CBr Amb24639654 [1,1,0,0,0,0|1,0,0]=3 200 B14R1.3302 CC(C)C1CCCCC1NC(=O)CN Amb24645931 [1,1,0,0,0,0|1,0,0]=3 201 B14R1.3302 CC(C)C1CCCCC1NC(=O)NN Amb25668280 [1,1,0,0,0,0|2,0,0]=4 202 B14R1.3302 CC(C)C1CCCCC1NC(=O)OC Amb24720392 [1,1,0,0,0,0|1,0,0]=3 203 B14R1.3302 CN(C)C1CCCCC1NC(=O)CCl Amb21862355 [1,1,0,0,0,0|2,0,0]=4 204 B14R1.3302 CN(C)C1CCCCC1NC(=O)CN Amb21862367 [1,1,0,0,0,0|2,0,0]=4 205 B14R1.3302 COC(=O)NC1CCCCC1N(C)C Amb25315253 [1,1,0,0,0,0|2,0,0]=4 206 B14R1.6312 CC(C)C1CCCCC1NS(C)(=O)=O Amb25185895 [1,1,0,0,0,0|2,0,0]=4 207 B14R1.6312 CC(C)C1CCCCC1OS(C)(=O)=O Amb24714170 [1,1,0,0,0,0|1,0,0]=3 208 B14R1.104 CC(C)N1CCC(CC1C(O)=O)CC Amb24372941 [0,1,0,0,1,0|2,0,0]=4 209 B14R1.6044 CC(C)C1CCC(C)CC1S(N)(=O)=O Amb24344984 [0,1,0,0,1,0|2,0,0]=4 210 B14R1.6051 CC(C)(C)C1CCC(F)CC1C(O)=O Amb25671769 [0,1,0,0,1,0|2,0,0]=4 211 B14R1.6051 CC1CCC(C(C1)C(O)=O)[Si](C)(C)C Amb25278226 [0,1,0,0,1,0|1,1,0]=4 212 B14R1.6064 CC(C)C1CCC(C)CC1(N)C(N)=O Amb19055443 [0,1,0,0,1,0|1,0,0]=3 213 B14R1.6064 CC(C)C1CCC(C)CC1(O)C(N)=O Amb19089338 [0,1,0,0,1,0|1,0,0]=3 214 B14R1.6064 CC(C)C1CCC(C)CC1(O)C(O)=O Amb19039062 [0,1,0,0,1,0|1,0,0]=3 215 B14R1.6064 CC(C)[C@@H]1CC[C@@H](C)C[C@@]1(N)C(O)=O Amb24649824 [0,1,0,0,1,0|1,0,0]=3 216 B14R1.16615 CC(C)C1CCC(C)(O)CC1C(O)=O Amb25827181 [0,1,0,0,1,0|1,0,0]=3 217 B14R1.16615 CC(C)C1CCC(F)(F)CC1C(O)=O Amb24672549 [0,1,0,0,1,0|2,0,0]=4 218 B14R1.16615 CC(C1CNC(CN1C(=O)C)(C)C)C Amb17578749 [0,1,0,0,1,0|2,0,0]=4 219 B16R1.1302 CC(C)C1CCC(C)CC1OCC(O)CO Amb24061577 [0,1,0,0,0,1|0,0,2]=4 220 B16R1.11435 CC(=C)C(=O)OC1CC(C)CCC1C(C)C Amb17934080 [0,1,0,0,0,1|1,0,0]=3 221 B16R1.11435 CC(=C)C(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C Amb17934079 [0,1,0,0,0,1|1,0,0]=3 222 B16R1.11435 CC(=O)C(=O)OC1CC(C)CCC1C(C)C Amb22546812 [0,1,0,0,0,1|0,0,0]=2 223 B16R1.11435 CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)[C@H](C)O Amb22338441 [0,1,0,0,0,1|0,0,2]=4 224 B16R1.11435 CC1CCC(C(C1)OC(=O)C(O)C)C(C)C Amb1953961 [0,1,0,0,0,1|0,0,2]=4 225 B16R1.1519 CC(C)C1CCC(C)CC1OC(=O)OCC Amb22731390 [0,2,0,0,0,0|0,0,0]=2 226 B16R1.1519 N#CCC(=O)OC1CC(C)CCC1C(C)C Amb2386150 [0,2,0,0,0,0|0,0,0]=2 227 B14R1.3151 CC(C)CC1OC(=O)CC(C)(C)C1Cl Amb25838708 [0,0,1,1,0,0|1,0,0]=3 228 B14R1.3151 CC(C)C[C@H]1OC(=O)CC(C)(C)[C@@H]1Cl Amb24520020 [0,0,1,1,0,0|1,0,0]=3 229 B14R1.15553 CC(C)C(C)C=1CC(C)(C)CC(=O)C1 Amb25290958 [0,0,1,1,0,0|1,0,1]=4 230 B14R1.6338 CC(=O)OCC1CC(C(C)=C)C1(C)C Amb21965174 [0,0,1,1,0,0|0,0,2]=4 231 B14R1.6433 CC(C1NCC(N(C1)C(=O)C)(C)C)C Amb17578737 [0,0,1,1,0,0|2,0,0]=4 232 B14R1.6325 CC(C)N1CCCCCC1CC(C)=O Amb24498423 [0,0,1,1,0,0|2,0,0]=4 233 B14R1.327 CC1CCCCCN1C(C)CC(C)=O Amb24510849 [0,0,1,1,0,0|2,0,0]=4 234 B14R1.6048 CC1CC(C)C(CC1)C(O)CC(C)=O Amb25813858 [0,0,1,1,0,0|2,0,0]=4 235 B14R1.5977 CC1CCCC(C)(C)C1CCC(C)=O Amb22734102 [0,0,1,1,0,0|1,0,0]=3 236 B14R1.5977 CC1CCCC(C)(C)C1CCC(O)=O Amb24373127 [0,0,1,1,0,0|2,0,0]=4 237 B14R2.4640 CC1CC2OCSC(C)(C)C2CC1 Amb24376223 [1,0,0,1,0,0|0,1,1]=4 238 B14R2.6942 CC1CC(NCC)C2CC1C2(C)C Amb24743367 [1,0,0,1,0,0|1,0,1]=4 239 B14R2.6942 C[C@@H]1C[C@@H](NCC)[C@H]2C[C@@H]1C2(C)C Amb25212944 [1,0,0,1,0,0|1,0,1]=4 240 B14R2.7891 CC(C)C1CC2C(O)CC1C=C2C Amb25306484 [1,0,0,1,0,0|2,0,0]=4 241 B14R2.29365 CC1CC(=O)NC2CC(N)CCC21 Amb24475920 [1,0,0,1,0,0|2,0,0]=4 242 B14R2.29365 C[C@H]1CC(=O)C=C2C[C@@H](C)CC[C@@H]21 Amb25366519 [1,0,0,1,0,0|1,0,1]=4 243 B14R2.8189 CC1(C)CC(=O)C=C2CCCCC12 Amb24466985 [1,0,0,1,0,0|1,0,1]=4 244 B14R2.8189 CC1(O)CC(=O)OC2CCCCC12 Amb25267889 [1,0,0,1,0,0|1,0,0]=3 245 B14R2.25733 CC1CN(C2CCCCC12)C(C)=O Amb24541459 [1,0,0,1,0,0|1,0,0]=3 246 B14R2.25733 CC1CN(C2CCCCC21)C(N)=O Amb24354076 [1,0,0,1,0,0|2,0,0]=4 247 B14R2.28273 CC(C)C1CCCCC12CC(=O)N2 Amb24492678 [1,0,0,1,0,0|1,0,0]=3 248 B14R2.31793 CC(=O)NC1CCC2CC1C2(C)C Amb25291611 [1,0,0,1,0,0|1,0,0]=3 249 B14R2.31793 CC(=O)\C=C/1\CCC2CC1C2(C)C Amb25213245 [1,0,0,1,0,0|1,0,1]=4 250 B14R2.31793 CC1(C)[C@@H]2C[C@H]1CC[C@@H]2CC(O)=O Amb24512175 [1,0,0,1,0,0|2,0,0]=4 251 B14R2.31793 CC1(C)[C@H]2C[C@@H]1CC[C@@H]2CC(O)=O Amb24715944 [1,0,0,1,0,0|2,0,0]=4 252 B14R2.31793 CC1(C)[C@H]2C[C@@H]1CC[C@H]2CC(O)=O Amb24064910 [1,0,0,1,0,0|2,0,0]=4 253 B14R2.5653 CC(=O)O[C@H]1[C@@H]2CC[C@H]1CC[C@@H]2O Amb24541610 [1,0,0,1,0,0|1,0,0]=3 254 B14R2.5816 CN1CC2C(CCN2C(C)=O)CC1 Amb25334568 [1,0,0,1,0,0|2,0,0]=4 255 B14R2.9572 CC(=O)N[C@H]1C[C@H]2CCC[C@@H]1CC2 Amb24642506 [1,0,0,1,0,0|1,0,0]=3 256 B14R2.36560 CC(=O)OC1C[N+]2(C)CCC1CC2 Amb2224448 [1,0,0,1,0,0|1,0,0]=3 257 B14R2.4643 CC1CCC2C(C1)C(=S)NC2(C)C Amb24344192 [0,0,0,1,1,0|1,1,0]=4 258 B14R2.4643 CC1CCN2C(C1)C(=O)NC2(C)C Amb24502959 [0,0,0,1,1,0|2,0,0]=4 259 B14R2.4643 CC1CC[C@H]2[C@@H](N1)C(=O)OC2(C)C Amb25295344 [0,0,0,1,1,0|2,0,0]=4 260 B14R2.4643 CC1CC[C@H]2[C@H](N1)C(=O)OC2(C)C Amb25179162 [0,0,0,1,1,0|2,0,0]=4 261 B14R2.6085 CC1=CC(C2CC1C2(C)C)C(C)=O Amb25286709 [0,0,0,1,1,0|0,0,2]=4 262 B14R2.6085 CC1=C[C@@H]([C@@H]2C[C@H]1C2(C)C)C(C)=O Amb24584487 [0,0,0,1,1,0|0,0,2]=4 263 B14R2.6085 CC1=C[C@H]([C@@H]2C[C@H]1C2(C)C)C(C)=O Amb25179764 [0,0,0,1,1,0|0,0,2]=4 264 B14R2.6130 CC1CC2C(C(C1)C(C)O)C2(C)C Amb24495878 [0,0,0,1,1,0|0,0,2]=4 265 B14R2.7890 CC1=CC2C(CC1CC2=O)C(C)C Amb25373405 [0,0,0,1,1,0|0,0,2]=4 266 B14R2.8664 CC1=CC[C@@H]([C@@H]2[C@H]1CC2=O)C(C)C Amb25347428 [0,0,0,1,1,0|0,0,2]=4 267 B14R2.9205 CC1CNC(C(C1)C(O)=O)C2CC2 Amb24685006 [0,0,0,1,1,0|2,0,0]=4 268 B14R2.62308 CC1(C)C2CCC1(C)CC2C(N)=O Amb25060054 [0,0,0,1,1,0|1,0,0]=3 269 B14R2.62308 CC1(C)C2CCC1(C)CC2C(O)=O Amb17778084 [0,0,0,1,1,0|1,0,0]=3 270 B14R2.62308 CC1(C)[C@@H]2CC[C@@]1(C)C=C2C(C)=O Amb24576051 [0,0,0,1,1,0|0,0,2]=4 271 B14R2.62308 CC1(C)[C@H]2CC[C@]1(C)C[C@@H]2C(O)=O Amb24511916 [0,0,0,1,1,0|1,0,0]=3 272 B14R2.62308 CC1(C)[C@H]2CC[C@]1(C)C[C@H]2C(O)=O Amb24710121 [0,0,0,1,1,0|1,0,0]=3 273 B16R2.146468 CC(=O)OC1CC2CC1(CC2)OC(C)=O Amb22730291 [0,0,0,1,0,1|1,0,1]=4 274 B16R2.179899 CC(=O)OCC1CC2(C)CCC1C2(C)C Amb17778096 [0,0,0,1,0,1|0,0,0]=2 275 B16R2.343255 CC1(C)C2CCC1(C)[C@H](O)[C@H]2CC(O)=O Amb22336438 [0,1,0,1,0,0|2,0,0]=4 276 B16R2.126136 O=C1CC2CC(O1)(C)CCC2C(O)(C)C Amb2496442 [0,1,0,1,0,0|2,0,0]=4 277 B16R3.1177878 CC12CC3C(C(O)=O)C(C)(C1)C3CC2 Amb25817636 [0,0,0,2,0,0|2,0,0]=4 278 B16R3.1177878 C[C@@]12C[C@@H]3[C@@H](C(O)=O)[C@](C)(C1)[C@@H]3CC2 Amb25233000 [0,0,0,2,0,0|2,0,0]=4 279 B16R3.111511 CC1C2CC(C3NC(=O)OC13)C2(C)C Amb25183587 [0,0,0,2,0,0|2,0,0]=4 280 B16R3.471042 CC1(C)C2CCC1(C)C3NC(=O)CC32 Amb24674220 [0,0,0,2,0,0|2,0,0]=4 281 B16R3.471042 CC1(C)C2CCC1(C)C3NC(=O)NC23 Amb17777954 [0,0,0,2,0,0|2,0,0]=4 282 B16R3.471042 CC1(C)C2CCC1(C)C3NC(=O)NC32 Amb24402196 [0,0,0,2,0,0|2,0,0]=4 283 B16R3.471042 CC1(C)C2CCC1(C)C3NC(=S)OC32 Amb25166100 [0,0,0,2,0,0|1,1,0]=4 284 B16R3.471042 CC1(C)[C@@H]2CC[C@@]1(C)[C@@H]3OC(=O)N[C@@H]32 Amb25339635 [0,0,0,2,0,0|2,0,0]=4 285 B16R3.471042 CC1(C)[C@H]2CC[C@]1(C)[C@H]3OC(=O)N[C@H]32 Amb25208984 [0,0,0,2,0,0|2,0,0]=4 286 B12R1.489 CC(C)[C@H]/1CC[C@H](C)\C1=C/C=O Amb24548908 [1,0,0,0,1,0|1,0,1]=4 287 B12R1.261 CC(C)C1CCCCC1C(C)=O Amb24358154 [1,0,0,0,1,0|0,0,0]=2 288 B12R1.261 CC(C)C1CCCCC1C(C)O Amb25291141 [1,0,0,0,1,0|0,0,2]=4 289 B12R1.261 CC(C)C1CCCCN1C(C)=N Amb24601488 [1,0,0,0,1,0|2,0,0]=4 290 B12R1.261 CC(C)C1CCCNC1C(O)=O Amb25082701 [1,0,0,0,1,0|2,0,0]=4 291 B12R1.261 CC(C)C1CCNCC1C(O)=O Amb18198521 [1,0,0,0,1,0|2,0,0]=4 292 B12R1.261 CC(C)C1OCCCC1C(O)=O Amb25311827 [1,0,0,0,1,0|2,0,0]=4 293 B12R1.261 CC(C)N1CCCCC1C(O)=O Amb19373990 [1,0,0,0,1,0|2,0,0]=4 294 B12R1.261 CC(C)N1CCCC[C@@H]1C(O)=O Amb23401417 [1,0,0,0,1,0|2,0,0]=4 295 B12R1.261 CC(C)[C@@H]1NCCC[C@H]1C(O)=O Amb18198546 [1,0,0,0,1,0|2,0,0]=4 296 B12R1.261 CC(C)[C@@H]1OCCC[C@@H]1C(O)=O Amb25374170 [1,0,0,0,1,0|2,0,0]=4 297 B12R1.261 CC(C)[C@H]1CCCC[C@@H]1C(C)=O Amb24600967 [1,0,0,0,1,0|0,0,0]=2 298 B12R1.261 CC(C)[C@H]1CCCC[C@@H]1C(O)=O Amb24550501 [1,0,0,0,1,0|1,0,0]=3 299 B12R1.261 CC(C)[C@H]1CCCC[C@H]1C(C)=O Amb24714939 [1,0,0,0,1,0|0,0,0]=2 300 B12R1.261 CC(C)[C@H]1CCCN[C@@H]1C(O)=O Amb24573089 [1,0,0,0,1,0|2,0,0]=4 301 B12R1.261 CC(C1CNCCN1C(=O)C)C Amb17578203 [1,0,0,0,1,0|2,0,0]=4 302 B12R1.261 CC(N)C1CCCCC1C(O)=O Amb25051421 [1,0,0,0,1,0|2,0,0]=4 303 B12R1.261 CC(N)C1CCCCN1C(C)=O Amb25189612 [1,0,0,0,1,0|2,0,0]=4 304 B12R1.261 CC(N1CCCC[C@H]1C(=O)O)C Amb13886258 [1,0,0,0,1,0|2,0,0]=4 305 B12R1.261 CN(C)C1CCCCC1C(O)=O Amb18288576 [1,0,0,0,1,0|2,0,0]=4 306 B12R1.261 CN(C)[C@@H]1CCCC[C@H]1C(O)=O Amb25257931 [1,0,0,0,1,0|2,0,0]=4 307 B12R1.392 CC(=O)N[C@@H]1CCC[C@H]1N(C)C Amb25180040 [1,0,0,0,1,0|2,0,0]=4 308 B12R1.392 CC(=O)OC1COCC1N(C)C Amb24484090 [1,0,0,0,1,0|2,0,0]=4 309 B12R1.392 CC(C)C1CCCN1CC(C)=O Amb25212215 [1,0,0,0,1,0|2,0,0]=4 310 B12R1.392 CC(C)[C@@H]1CNC[C@H]1NC(C)=O Amb25337806 [1,0,0,0,1,0|2,0,0]=4 311 B12R1.392 CC(C)[C@@H]1COC[C@H]1CC(C)=O Amb24662407 [1,0,0,0,1,0|2,0,0]=4 312 B12R1.65 CC1CC(CC)N(C1)CC(C)=O Amb24585574 [1,0,0,0,1,0|2,0,0]=4 313 B12R1.65 CCC1CN(C)CC1NC(C)=O Amb25154507 [1,0,0,0,1,0|2,0,0]=4 314 B12R1.620 CC1CCC(CC)N1CC(C)=O Amb25817251 [1,0,0,0,1,0|2,0,0]=4 315 B12R1.620 COC1CCC(Cl)C1OC(C)=O Amb25751780 [1,0,0,0,1,0|2,0,0]=4 316 B12R1.620 CO[C@@H]1CC[C@H](Cl)[C@H]1OC(C)=O Amb25210885 [1,0,0,0,1,0|2,0,0]=4 317 B12R1.498 CC(C)C1CCC(C)C1C(C)=O Amb17777984 [0,0,0,0,2,0|0,0,0]=2 318 B12R1.498 CC(C)C1CCC(C)C1C(O)=O Amb17777979 [0,0,0,0,2,0|1,0,0]=3 319 B12R1.498 CC(C)C1CCC(N)C1C(O)=O Amb24443801 [0,0,0,0,2,0|2,0,0]=4 320 B12R1.498 CC(C)C1CN=C(C)C1C(C)=O Amb25674183 [0,0,0,0,2,0|1,0,1]=4 321 B12R1.498 CC(C)N1CCC(C)C1C(O)=O Amb25807798 [0,0,0,0,2,0|2,0,0]=4 322 B12R1.498 CC(C)[C@H]1CCN(C)[C@@H]1C(O)=O Amb24592615 [0,0,0,0,2,0|2,0,0]=4 323 B12R1.498 CC(C)[C@H]1CC[C@H](C)[C@@H]1C(O)=O Amb24580409 [0,0,0,0,2,0|1,0,0]=3 324 B12R1.498 CC(C)[C@H]1CC[C@H](N)[C@@H]1C(O)=O Amb25238287 [0,0,0,0,2,0|2,0,0]=4 325 B12R1.498 CC(O)C1CCC(C)C1C(O)=O Amb25858289 [0,0,0,0,2,0|2,0,0]=4 326 B12R1.498 CC(O)[C@@H]1CC[C@H](C)[C@H]1C(O)=O Amb24595426 [0,0,0,0,2,0|2,0,0]=4 327 B12R1.498 CC1CCC(C1C(C)=O)C(C)=C Amb24378950 [0,0,0,0,2,0|0,0,2]=4 328 B14R0.67 CC(C)CCCC(C)NCCCC(O)=O Amb25388560 [0,0,1,0,0,1|2,0,0]=4 329 B14R0.67 CC(C)CCCC(C)NCCOC(C)C Amb24771030 [0,0,1,0,0,1|1,0,1]=4 330 B14R1.814 CC(=O)OC1CCCCC1OC(C)=O Amb22734719 [1,0,0,0,0,1|1,0,1]=4 331 B14R1.814 CC(=O)O[C@H]1CCCC[C@@H]1NC(C)=O Amb24513254 [1,0,0,0,0,1|1,0,1]=4 332 B14R1.814 CC(=O)O[C@H]1CCCC[C@H]1NC(C)=O Amb24592532 [1,0,0,0,0,1|1,0,1]=4 333 B14R1.814 CC(C)NC1CCCCC1NC(C)=O Amb21862536 [1,0,0,0,0,1|1,0,0]=3 334 B14R1.4522 CC(C)C1CCCCC1NNC(N)=O Amb25097163 [1,0,0,0,0,1|2,0,0]=4 335 B14R1.676 CC(C)C1CC(CC(O)=O)C(C)CC1 Amb25067164 [0,0,0,0,1,1|2,0,0]=4 336 B14R1.676 CC(C)C1CC(NC(N)=O)C(C)CC1 Amb25815015 [0,0,0,0,1,1|2,0,0]=4 337 B14R1.676 CC(C)C1CC(OC(C)=O)C(C)CC1 Amb24079995 [0,0,0,0,1,1|0,0,0]=2 338 B14R1.676 CC(C)[C@@H]1C[C@@H](NC(C)=O)[C@H](C)CC1 Amb25233072 [0,0,0,0,1,1|1,0,0]=3 339 B14R1.676 CC(C)[C@@H]1C[C@H](NC(C)=O)C(C)CC1 Amb25258448 [0,0,0,0,1,1|1,0,0]=3 340 B14R1.676 C[C@@H]1CC[C@H](C[C@H]1OC(C)=O)C(C)=C Amb18511840 [0,0,0,0,1,1|0,0,2]=4