0 B11R1.24 CCNC[C@H]1CCCN(C)C1 AM91277 [0,0,0,0,0,0|4,0,0]=4 1 B10R1.17 BrCCCN1CCCCO1 AM805966 [1,0,0,0,0,0|2,0,1]=4 2 B10R1.17 BrCCC[C@H]1CCCCN1 AM90469 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.17 BrCCC[C@H]1CCCNC1 AM100963 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.17 BrCCO[C@@H]1CCCCO1 AMY24778 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.17 CCCCC1CCNCC1 AM20090599 [1,0,0,0,0,0|2,0,1]=4 6 B10R1.17 CCCCC1CCNCC1 AM807077 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.17 CCNC[C@H]1CCCCN1 AM91126 [1,0,0,0,0,0|2,0,1]=4 8 B10R1.17 CCNC[C@H]1CCCNC1 AM91187 [1,0,0,0,0,0|3,0,0]=4 9 B10R1.17 CNCC[C@H]1CCCNC1 AM91410 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.17 COCC[C@H]1CCCCN1 AMY21766 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.17 COCC[C@H]1CCCCN1 AMY37440 [1,0,0,0,0,0|2,0,1]=4 12 B10R1.17 ClCCC[C@H]1CCCCN1 AM101200 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.17 ClCCC[C@H]1CCCNC1 AM100437 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.17 ICCC[C@H]1CCCCN1 AM99908 [1,0,0,0,0,0|2,0,1]=4 15 B10R1.17 ICCC[C@H]1CCCNC1 AM99360 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.17 NCCCC1CCCCC1 AMY23927 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.17 NCCC[C@H]1CCCCN1 AM101040 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.17 NCCC[C@H]1CCCNC1 AM100709 [1,0,0,0,0,0|3,0,0]=4 19 B10R1.17 OCCC[C@H]1CCCCN1 AM101541 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.17 OCCC[C@H]1CCCNC1 AM100426 [1,0,0,0,0,0|3,0,0]=4 21 B10R1.17 OCCO[C@@H]1CCCCO1 AMY202100048 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.17 SCCC[C@H]1CCCCN1 AM97529 [1,0,0,0,0,0|2,0,1]=4 23 B10R1.17 SCCC[C@H]1CCCNC1 AM99471 [1,0,0,0,0,0|3,0,0]=4 24 B12R1.17 CCOC(=O)[C@H]1CCCC(=O)C1 AMY10882 [0,1,0,0,0,0|2,0,1]=4 25 B10R0.1 CCOC(=O)CCCCCBr AMY18076 [0,0,1,0,0,0|3,0,0]=4 26 B10R0.1 CCOC(=O)CCCCCO AMY38458 [0,0,1,0,0,0|3,0,0]=4 27 B10R0.4 CCCCCCCCB(O)O AMY30008 [0,0,1,0,0,0|1,0,1]=3 28 B10R0.4 CCCCCCCOC(=O)Cl AMY3945 [0,0,1,0,0,0|2,0,0]=3 29 B10R0.4 CCCCCCOCC(=O)O AMY3242 [0,0,1,0,0,0|1,0,0]=2 30 B10R0.4 NCCOCCOCC(=O)O AMY3343 [0,0,1,0,0,0|3,0,0]=4 31 B10R0.4 NCCOCCOCC(=O)O AMY3347 [0,0,1,0,0,0|3,0,0]=4 32 B10R0.4 O=C(O)CCCCCCCBr AMY31536 [0,0,1,0,0,0|1,0,0]=2 33 B10R0.4 O=C(O)CCCCCCCO AMY5109 [0,0,1,0,0,0|1,0,0]=2 34 B10R0.4 [N-]=[N+]=NCCCCCC(=O)O AMY21582 [0,0,1,0,0,0|3,0,0]=4 35 B10R0.91 CCCC[C@H](O)COCCO AMY33452 [0,0,1,0,0,0|1,0,2]=4 36 B12R2.24 O=C1CCC2CCCCC2N1 AMY15967 [0,0,0,1,0,0|1,0,0]=2 37 B12R2.24 O=C1CCC2CCCNC2C1 AM806886 [0,0,0,1,0,0|2,0,0]=3 38 B12R2.1081 O=C1COC[C@@H]2CNCCN12 AM806359 [0,0,0,1,0,0|3,0,0]=4 39 B12R2.1081 O=C1COC[C@H]2CNCCN12 AMY34460 [0,0,0,1,0,0|3,0,0]=4 40 B12R2.5121 O=C1CCOC2(CCCC2)C1 AMY16780 [0,0,0,1,0,0|2,0,0]=3 41 B10R1.29 CCNC[C@H]1CCCN1C AM101140 [0,0,0,0,1,0|3,0,0]=4 42 B10R1.29 CCNC[C@H]1CCCN1C AM96804 [0,0,0,0,1,0|3,0,0]=4 43 B10R1.29 O=C1CCCN1CCCBr AM85059 [0,0,0,0,1,0|2,0,0]=3 44 B9R0.5 CCOC(=O)CCCCBr AM20080354 [1,0,1,0,0,0|2,0,0]=4 45 B9R0.45 CCCCCCCCC=O AMY15728 [1,0,1,0,0,0|0,0,0]=2 46 B9R0.45 OCCCCCCCCCl AM62618 [1,0,1,0,0,0|1,0,1]=4 47 B9R0.2 CCCCCCCC(=O)[O-] AMY19799 [1,0,1,0,0,0|0,0,1]=3 48 B9R0.2 CCCCCCOC(=O)Cl AMY4168 [1,0,1,0,0,0|2,0,0]=4 49 B9R0.2 NCCCCCCC(=O)O AM20120334 [1,0,1,0,0,0|1,0,0]=3 50 B9R0.2 O=C(O)CCCCCCBr AMY10966 [1,0,1,0,0,0|1,0,0]=3 51 B9R0.2 O=C(O)CCCCCCO AM20090595 [1,0,1,0,0,0|1,0,0]=3 52 B9R0.2 O=C(O)CNCCCCO AM806410 [1,0,1,0,0,0|2,0,0]=4 53 B9R0.18 CCCCC(O)CCCC AMY19319 [1,0,1,0,0,0|0,0,1]=3 54 B9R1.2 O=C1CCC[C@@H](CO)N1 AMY16344 [2,0,0,0,0,0|2,0,0]=4 55 B9R1.2 O=C1CCC[C@H](CO)C1 AMY18909 [2,0,0,0,0,0|2,0,0]=4 56 B9R1.2 O=C1CCC[C@H](CO)N1 AMY16343 [2,0,0,0,0,0|2,0,0]=4 57 B9R1.2 O=C1CCC[C@H](CO)N1 AMY16345 [2,0,0,0,0,0|2,0,0]=4 58 B9R1.8 OCC[C@@H]1C=CCCC1 AM86042 [2,0,0,0,0,0|2,0,0]=4 59 B11R0.4 CCCCCCOC(=O)CC#N AMY3820 [0,1,1,0,0,0|1,0,1]=4 60 B11R0.4 CCOC(=O)CCCCCCN AM20090397 [0,1,1,0,0,0|2,0,0]=4 61 B11R0.4 CCOC(=O)CCCCCCN AM82451 [0,1,1,0,0,0|2,0,0]=4 62 B11R0.4 CCOC(=O)CCCCCCO AM20130051 [0,1,1,0,0,0|2,0,0]=4 63 B11R0.155 CCCCCC(=O)C(=O)OCC AM85553 [0,1,1,0,0,0|2,0,0]=4 64 B11R0.30 CC(C)CCCCCCC(=O)O AMY41999 [0,1,1,0,0,0|0,0,0]=2 65 B11R0.30 O=C(O)CCCCCCC(=O)O AM20100233 [0,1,1,0,0,0|1,0,1]=4 66 B11R0.40 CCCCCCCCC(=O)NO AM806756 [0,1,1,0,0,0|0,0,0]=2 67 B11R0.42 C=CCCCCC[C@@H](N)C(=O)O AMY7198 [0,1,1,0,0,0|0,0,2]=4 68 B11R0.42 C=CCCCCC[C@H](N)C(=O)O AMY6921 [0,1,1,0,0,0|0,0,2]=4 69 B11R0.42 CCCCCCC[C@H](N)C(=O)O AMY7202 [0,1,1,0,0,0|0,0,0]=2 70 B11R0.111 CC[C@H](C)CCCCCC(=O)O AM20120579 [0,1,1,0,0,0|0,0,0]=2 71 B11R0.148 CCCCCCCCOC(=O)Cl AMY4096 [0,1,1,0,0,0|1,0,0]=3 72 B11R0.148 CCC\C=C\CCCCC(=O)O AMY22527 [0,1,1,0,0,0|0,0,1]=3 73 B11R0.148 O=C(O)CCCCCCCCBr AM803870 [0,1,1,0,0,0|0,0,0]=2 74 B11R0.148 O=C(O)CCCCCCCCO AM20100011 [0,1,1,0,0,0|0,0,0]=2 75 B11R0.77 C=C[C@H](CCCCC)OC(C)=O AM84828 [0,1,1,0,0,0|0,0,2]=4 76 B11R1.28 BrCCCO[C@@H]1CCCCO1 AMY9122 [1,1,0,0,0,0|1,0,1]=4 77 B11R1.28 CCNCC[C@H]1CCCNC1 AM101301 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.28 CNCCC[C@H]1CCCCN1 AM91314 [1,1,0,0,0,0|1,0,1]=4 79 B11R1.28 CNCCC[C@H]1CCCNC1 AM91374 [1,1,0,0,0,0|2,0,0]=4 80 B11R1.199 CCOC(=O)[C@@H]1CCCC1=O AM20100487 [0,1,0,0,1,0|1,0,1]=4 81 B11R1.57 O=C(O)CN1CCC[C@@H]1CBr AM92240 [0,0,1,1,0,0|2,0,0]=4 82 B11R1.57 O=C(O)CN1CCC[C@@H]1CCl AM92314 [0,0,1,1,0,0|2,0,0]=4 83 B11R1.57 O=C(O)CN1CCC[C@@H]1CI AM94367 [0,0,1,1,0,0|2,0,0]=4 84 B11R1.57 O=C(O)CN1CCC[C@@H]1CO AM100296 [0,0,1,1,0,0|2,0,0]=4 85 B11R1.57 O=C(O)CN1CCC[C@@H]1CO AM100586 [0,0,1,1,0,0|2,0,0]=4 86 B11R1.86 CC(=O)OC1CCCCC1C AMY307 [0,0,1,1,0,0|2,0,0]=4 87 B11R1.742 O=C(O)CN1CCCCCC1 AMY21705 [0,0,1,1,0,0|1,0,0]=3 88 B11R1.20 CC(=O)NC1CCC(Br)CC1 AM100882 [0,0,1,1,0,0|2,0,0]=4 89 B11R1.20 CC(=O)NC1CCC(Cl)CC1 AM94324 [0,0,1,1,0,0|2,0,0]=4 90 B11R1.20 CC(=O)NC1CCC(I)CC1 AM94860 [0,0,1,1,0,0|2,0,0]=4 91 B11R1.20 CC(=O)NC1CCC(N)CC1 AM100317 [0,0,1,1,0,0|2,0,0]=4 92 B11R1.20 CC(=O)N[C@H]1CC[C@H](N)CC1 AM101430 [0,0,1,1,0,0|2,0,0]=4 93 B11R2.678 O=C1CC2CCCC(C1)N2 AMY5583 [1,0,0,1,0,0|2,0,0]=4 94 B11R2.20 C1CCC2CNCCC2C1 AM20070504 [1,0,0,1,0,0|2,0,0]=4 95 B11R2.20 C1COC2CNCCC2C1 AM806432 [1,0,0,1,0,0|1,0,1]=4 96 B11R2.20 C1CO[C@H]2CNCC[C@@H]2C1 AM806430 [1,0,0,1,0,0|1,0,1]=4 97 B11R2.1261 C1CCC2(C1)CCCNC2 AM806443 [1,0,0,1,0,0|2,0,0]=4 98 B11R2.1261 C1CCC2(CCCC2)NC1 AMY18748 [1,0,0,1,0,0|1,0,1]=4 99 B11R2.10 O=C1NC2CCNCC2O1 AMY35734 [0,0,0,1,1,0|2,0,0]=4 100 B11R2.3 O=C1NCC[C@]12CCNC2 AM20080148 [0,0,0,1,1,0|2,0,0]=4 101 B11R2.60 O=C1CCC2C(=O)CCC12 AMY205 [0,0,0,1,1,0|1,0,1]=4 102 B13R2.13501 O=C1CC(=O)OC2(CCCC2)O1 AMY41371 [0,1,0,1,0,0|1,0,1]=4 103 B9R0.8 CCCC[C@H](Br)C(=O)OC AMY21797 [0,0,1,0,1,0|2,0,0]=4 104 B9R0.8 CCCC[C@H](N)C(=O)OC AM82593 [0,0,1,0,1,0|2,0,0]=4 105 B9R0.13 CCCC[C@H](CC)C(=O)O AM9656 [0,0,1,0,1,0|1,0,0]=3 106 B9R0.13 CCCC[C@H](CC)C(=O)O AM9657 [0,0,1,0,1,0|1,0,0]=3 107 B9R0.13 CCCC[C@H](NC)C(=O)O AM9198 [0,0,1,0,1,0|2,0,0]=4 108 B9R1.7 CCC[C@H]1COC(=O)C1 AMY16477 [1,0,0,0,1,0|2,0,0]=4 109 B9R1.33 NCCN1CCCC1=O AMY19233 [1,0,0,0,1,0|2,0,0]=4 110 B9R1.33 O=C1CCCN1CCBr AM20210013 [1,0,0,0,1,0|2,0,0]=4 111 B9R1.12 CCNC[C@H]1CCCN1 AM91659 [1,0,0,0,1,0|2,0,0]=4 112 B9R1.12 ClCCCC1OCCO1 AM20080476 [1,0,0,0,1,0|2,0,0]=4