0 B12R0.239 CCCCOC(=O)CC(=O)OCC S810886 [0,0,0,0,0,0|1,0,2]=3 1 B11R0.4 CCCCCC#CC(=O)OCC S414107 [1,0,0,0,0,0|0,0,2]=3 2 B11R0.4 CCCCCCCC(=O)CCC CDS001481 [1,0,0,0,0,0|1,0,0]=2 3 B11R0.4 CCCCCCCC(=O)OCCl PH007966 [1,0,0,0,0,0|1,0,0]=2 4 B11R0.4 CCOC(=O)CCCC/C=N/O T240672 [1,0,0,0,0,0|2,0,1]=4 5 B11R0.4 CCOC(=O)CCCCCCO R174513 [1,0,0,0,0,0|1,0,0]=2 6 B11R0.5 CCCCC(N)CC(=O)OCC CBR00803 [1,0,0,0,0,0|1,0,0]=2 7 B11R0.154 CCCCCC(C)NC(=O)CCl S380253 [1,0,0,0,0,0|3,0,0]=4 8 B13R1.463 CCOC(=O)C1CCCCCC1=O PH000254 [0,0,0,1,0,0|0,0,2]=3 9 B13R1.1575 C(=C\1/CCCCCN1)\C(=O)OCC T284157 [0,0,0,1,0,0|1,0,2]=4 10 B13R1.1575 CCOC(=O)NN1CCCCCC1 PH009331 [0,0,0,1,0,0|3,0,0]=4 11 B13R1.2570 CCOC(=O)CC1(CCCCC1)N CBR01025 [0,0,0,1,0,0|1,0,0]=2 12 B13R1.2570 CCOC(=O)CC1(CCCCC1)O S37339 [0,0,0,1,0,0|0,0,0]=1 13 B13R1.2570 CCOC(=O)CC1(CCCCC1)O S853046 [0,0,0,1,0,0|0,0,0]=1 14 B13R1.2851 CCCCCC1CC1C(=O)OCC T172472 [0,0,0,1,0,0|1,0,0]=2 15 B10R0.1 CCCNCCC(=O)OCC OTV000022 [2,0,0,0,0,0|1,0,0]=3 16 B10R0.71 CCCCCCCCSCC S570656 [2,0,0,0,0,0|0,1,1]=4 17 B10R0.74 CCCCCC#CC(=O)CC S128325 [2,0,0,0,0,0|0,0,2]=4 18 B10R0.74 CCCCCCCC(=O)CC S544043 [2,0,0,0,0,0|0,0,0]=2 19 B10R0.74 CCCCCCCC(=O)NO CDS000528 [2,0,0,0,0,0|2,0,0]=4 20 B10R0.74 CCCCCCCC(=O)N[O-] S756199 [2,0,0,0,0,0|2,0,0]=4 21 B10R0.74 CCCCCCCC(O)CC CDS001495 [2,0,0,0,0,0|0,0,2]=4 22 B10R0.74 CCCCCCNC(=O)NC S892793 [2,0,0,0,0,0|2,0,0]=4 23 B10R0.74 CCCCCCOC(=O)CCl OTV000847 [2,0,0,0,0,0|2,0,0]=4 24 B10R0.2 CCCC(N)CC(=O)OCC CBR01547 [2,0,0,0,0,0|1,0,0]=3 25 B10R0.2 CCOC(=O)CC(O)COC S877271 [2,0,0,0,0,0|1,0,0]=3 26 B10R0.6 CCCCCC(O)CC(C)C S417432 [2,0,0,0,0,0|1,0,1]=4 27 B12R0.1 CCCCOCCOC(=O)CCC PH008717 [1,1,0,0,0,0|2,0,0]=4 28 B12R0.4 CCCCCCCC(=O)CC(C)C S350397 [1,1,0,0,0,0|1,0,0]=3 29 B12R0.4 CCCCCCCC(=O)CC(C)C S879290 [1,1,0,0,0,0|1,0,0]=3 30 B12R0.4 CCCCCCCC(=O)OC(C)C CDS000544 [1,1,0,0,0,0|0,0,0]=2 31 B12R0.114 CCOC(=O)C(=O)CCCCCCl CDS020993 [1,1,0,0,0,0|1,0,1]=4 32 B12R0.69 CCOC(=O)C[C@H](O)C(=O)OCC PH015187 [1,1,0,0,0,0|1,0,1]=4 33 B12R1.32 CCCC(=O)NC1CCCCC1 PH009069 [1,0,0,1,0,0|2,0,0]=4 34 B12R1.32 CCNC(=O)NC1CCCCC1 S603562 [1,0,0,1,0,0|2,0,0]=4 35 B12R1.32 CCOC(=O)CC1=CCCCC1 S368830 [1,0,0,1,0,0|0,0,2]=4 36 B12R1.32 CCOC(=O)CC1CCCNC1 PH010419 [1,0,0,1,0,0|1,0,0]=3 37 B12R1.32 CCOC(=O)CC1CCCNC1 PHB00138 [1,0,0,1,0,0|1,0,0]=3 38 B12R1.32 CCOC(=O)CC1CCNCC1 CDS003461 [1,0,0,1,0,0|1,0,0]=3 39 B12R1.32 CCOC(=O)CN1CCOCC1 PH011005 [1,0,0,1,0,0|2,0,0]=4 40 B12R1.32 CCOC(=O)NC1CCCCC1 S361593 [1,0,0,1,0,0|1,0,0]=3 41 B12R1.37 CCCCCCCC1=NCCS1 PH008234 [1,0,0,1,0,0|1,1,0]=4 42 B12R1.318 CCOC(=O)CC1CCCC1=O T175358 [1,0,0,1,0,0|1,0,1]=4 43 B12R1.1564 CCOC(=O)N1CCCCCC1 T168556 [1,0,0,1,0,0|1,0,0]=3 44 B12R1.1564 CCOC(=O)N1CCCNCC1 PH015507 [1,0,0,1,0,0|2,0,0]=4 45 B12R1.55 CCOC(=O)C(=O)C1CCCC1 PH014421 [0,0,0,1,1,0|0,0,2]=4 46 B12R1.55 CCOC(=O)C(Br)C1CCCC1 PH016311 [0,0,0,1,1,0|1,0,0]=3 47 B12R1.55 CCOC(=O)C(N)C1CCOC1 CDS021189 [0,0,0,1,1,0|2,0,0]=4 48 B12R1.55 CCOC(=O)C(O)C1CCOC1 CDS021290 [0,0,0,1,1,0|1,0,0]=3 49 B12R1.150 O=C1CCCCCCCCC1O S116742 [0,0,0,1,1,0|1,0,0]=3 50 B12R1.556 CCOC(=O)C(C)CNC1CC1 OTV000474 [0,0,0,1,1,0|2,0,0]=4 51 B12R1.1595 CCOC(=O)C1(CCCCC1)Br S918504 [0,0,0,1,1,0|1,0,0]=3 52 B12R1.1595 CCOC(=O)C1(CCCCC1)C PH015725 [0,0,0,1,1,0|1,0,0]=3 53 B12R1.1595 CCOC(=O)C1(CCCCC1)N CDS003919 [0,0,0,1,1,0|1,0,0]=3 54 B12R1.1595 CCOC(=O)C1(CCCCC1)O CDS020967 [0,0,0,1,1,0|0,0,0]=2 55 B12R1.1595 CCOC(=O)C1(CCOCC1)N CBR01670 [0,0,0,1,1,0|2,0,0]=4 56 B12R1.1595 CCOC(=O)C1(CCOCC1)O T177628 [0,0,0,1,1,0|1,0,0]=3 57 B14R1.29 CCOC(=O)CC(=O)C1CCCCC1 CDS005285 [0,1,0,1,0,0|0,0,2]=4 58 B14R1.36 CCOC(=O)C(Br)C1CCCC(C1)C PH006095 [0,1,0,1,0,0|1,0,0]=3 59 B14R1.18801 CCOC(=O)[C@]1(C(=O)CCC[C@H]1C)C T223093 [0,1,0,1,0,0|0,0,2]=4 60 B10R0.83 CCCCCC(O)C(C)CC S417440 [1,0,0,0,1,0|1,0,1]=4 61 B10R0.83 COC(=O)C(Br)CCCCBr S943185 [1,0,0,0,1,0|2,0,0]=4