0 B10R1.363 CC1(CCOCC1)C(O)=O AC182684 [1,0,0,0,0,0|1,0,0]=2 1 B10R1.363 C[C@@]1(CCCCN1)C(O)=O AC020355 [1,0,0,0,0,0|1,0,0]=2 2 B10R1.363 C[C@]1(CCCCN1)C(O)=O AC020354 [1,0,0,0,0,0|1,0,0]=2 3 B10R1.363 NC1(CCNCC1)C(O)=O AC051172 [1,0,0,0,0,0|1,0,0]=2 4 B12R1.2627 CCNC1(CCNCC1)C(N)=O AC180665 [0,1,0,0,0,0|2,0,0]=3 5 B12R2.8 O=C1NCCC12CCNCC2 AC160558 [0,0,0,1,0,0|3,0,0]=4 6 B12R2.8 O=C1OCCC12CCNCC2 AC020048 [0,0,0,1,0,0|2,0,0]=3 7 B12R2.6473 OC(=O)C12CCN(CC1)CC2 AC260006 [0,0,0,1,0,0|2,0,0]=3 8 B10R1.477 CC[C@@]1(CCCN1)C(O)=O AC020104 [0,0,0,0,1,0|2,0,0]=3 9 B10R1.477 CC[C@]1(CCCN1)C(O)=O AC020105 [0,0,0,0,1,0|2,0,0]=3 10 B12R1.3862 NCC1(CC(O)=O)CCCCC1 HY-A0057 [0,0,0,0,0,1|2,0,0]=3 11 B12R1.3862 NCC1(CC(O)=O)CCCCC1 HY-A0057A [0,0,0,0,0,1|2,0,0]=3 12 B9R0.47 CCCCC[C@H](N)C(O)=O AC512037 [1,0,1,0,0,0|0,0,0]=2 13 B9R0.47 NCCCC[C@@H](N)C(O)=O AC180292 [1,0,1,0,0,0|1,0,0]=3 14 B9R0.47 NCCOC[C@H](N)C(O)=O HY-U00097 [1,0,1,0,0,0|2,0,0]=4 15 B9R0.74 CCCC(C)(CC)C(O)=O AC050574 [1,0,1,0,0,0|0,0,0]=2 16 B9R1.6 C1CNC(CN1)C(=O)O LN00009512 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.6 CC(=O)C1CCCCC1 AC510963 [2,0,0,0,0,0|1,0,0]=3 18 B9R1.6 CC(=O)C1CCOCC1 AC220050 [2,0,0,0,0,0|2,0,0]=4 19 B9R1.6 ClC(=O)C1CCOCC1 AC220193 [2,0,0,0,0,0|2,0,0]=4 20 B9R1.6 ClC(=O)N1CCCCC1 AC100058 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.6 NC(=O)C1CCCNC1 AC180121 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.6 NC(=O)C1CCNCC1 AC511687 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.6 NC(=O)C1CCOCC1 AC220035 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.6 OB(O)C1CCCCC1 AC510772 [2,0,0,0,0,0|1,0,1]=4 25 B9R1.6 OC(=O)C1CCCCC1 AC190179 [2,0,0,0,0,0|0,0,0]=2 26 B9R1.6 OC(=O)C1CCCCN1 AC130051 [2,0,0,0,0,0|1,0,0]=3 27 B9R1.6 OC(=O)C1CCCCN1 AC510756 [2,0,0,0,0,0|1,0,0]=3 28 B9R1.6 OC(=O)C1CCCCO1 AC170058 [2,0,0,0,0,0|1,0,0]=3 29 B9R1.6 OC(=O)C1CCCOC1 AC170092 [2,0,0,0,0,0|1,0,0]=3 30 B9R1.6 OC(=O)C1CCNCC1 AC180124 [2,0,0,0,0,0|1,0,0]=3 31 B9R1.6 OC(=O)C1CCOCC1 AC180391 [2,0,0,0,0,0|1,0,0]=3 32 B9R1.6 OC(=O)C1CNCCN1 AC180739 [2,0,0,0,0,0|2,0,0]=4 33 B9R1.6 OC(=O)C1COCCN1 AC170096 [2,0,0,0,0,0|2,0,0]=4 34 B9R1.6 OC(=O)[C@@H]1CCC=CC1 AC310100 [2,0,0,0,0,0|0,0,2]=4 35 B9R1.6 OC(=O)[C@@H]1CNCCN1 AC020777 [2,0,0,0,0,0|2,0,0]=4 36 B9R1.6 OC(=O)[C@@H]1COCCN1 AC181656 [2,0,0,0,0,0|2,0,0]=4 37 B9R1.6 OC(=O)[C@H]1CCC=CC1 AC310113 [2,0,0,0,0,0|0,0,2]=4 38 B9R1.6 OC(=O)[C@H]1CCCCN1 AC180578 [2,0,0,0,0,0|1,0,0]=3 39 B9R1.6 OC(=O)[C@H]1CNCCN1 AC181744 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.118 CC1(CO)CCNCC1 AC182548 [2,0,0,0,0,0|1,0,1]=4 41 B11R1.878 COC(=O)C1(N)CCCCC1 AC100022 [1,1,0,0,0,0|0,0,0]=2 42 B11R1.878 COC(=O)C1(O)CCNCC1 AC050647 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.878 COC(=O)C1(O)CCOCC1 AC050250 [1,1,0,0,0,0|2,0,0]=4 44 B13R1.4942 CCC1(CCCCC1)OC(=O)C=C AC220189 [0,1,0,0,0,1|2,0,0]=4 45 B11R1.3 NC[C@H]1CC[C@@H](CC1)C(O)=O HY-B0149 [0,0,1,1,0,0|2,0,0]=4 46 B11R1.3 OC[C@H]1CC[C@@H](CC1)C(O)=O AC130363 [0,0,1,1,0,0|2,0,0]=4 47 B9R1.163 C1CCC(C1)(C(=O)O)O LN00159103 [1,0,0,0,1,0|1,0,0]=3 48 B9R1.163 C1COCC1(C(=O)O)N LN00170684 [1,0,0,0,1,0|1,0,0]=3 49 B9R1.163 C[C@@]1(CCCN1)C(=O)O LN00231771 [1,0,0,0,1,0|1,0,0]=3 50 B9R1.163 C[C@@]1(CCCN1)C(O)=O AC021002 [1,0,0,0,1,0|1,0,0]=3 51 B9R1.163 C[C@]1(CCCN1)C(O)=O AC020387 [1,0,0,0,1,0|1,0,0]=3 52 B9R1.163 C[C@]1(CCCN1)C(O)=O AC021246 [1,0,0,0,1,0|1,0,0]=3 53 B9R1.163 NC1(CCCC1)C(O)=O AC511825 [1,0,0,0,1,0|0,0,0]=2 54 B9R1.163 NC1(CCNC1)C(O)=O AC021073 [1,0,0,0,1,0|1,0,0]=3