0 B10R0.6 CCCCCC(=O)CC(=O)C MCULE-8236892696 [1,0,0,0,0,0|2,0,0]=3 1 B10R0.6 CCCCCC(C)CC(=O)O MCULE-2066533125 [1,0,0,0,0,0|2,0,1]=4 2 B10R0.6 CCCCCC(N)CC(=O)O MCULE-1332766356 [1,0,0,0,0,0|2,0,1]=4 3 B10R0.6 CCCCCC(N)CC(=O)O MCULE-6217126659 [1,0,0,0,0,0|2,0,1]=4 4 B10R0.6 CCCCCC(O)CC(=O)O MCULE-4825961688 [1,0,0,0,0,0|1,0,2]=4 5 B10R0.6 CCCCC[C@@H](O)CC(=O)O MCULE-2570880673 [1,0,0,0,0,0|1,0,2]=4 6 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-3222730819 [1,0,0,0,0,0|1,0,2]=4 7 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-6407518730 [1,0,0,0,0,0|1,0,2]=4 8 B10R0.6 CCCCNC(=O)CC(=O)C MCULE-6483428410 [1,0,0,0,0,0|3,0,0]=4 9 B10R0.6 CCCCOC(=O)CC(=O)C MCULE-4579556378 [1,0,0,0,0,0|3,0,0]=4 10 B10R0.22 CCCCCCCP(=O)(O)O MCULE-4624203907 [1,0,0,0,0,0|0,0,1]=2 11 B10R0.22 COCCOCCP(=O)(O)O MCULE-3281524690 [1,0,0,0,0,0|2,0,1]=4 12 B10R0.22 O=P(O)(O)CCCCCCBr MCULE-1779770763 [1,0,0,0,0,0|1,0,1]=3 13 B12R1.2240 O=P(O)(O)CN1CCCCCC1 MCULE-8678712147 [0,0,0,1,0,0|2,0,0]=3 14 B10R0.5 CCCCC[C@H](N)P(=O)(O)O MCULE-5419319712 [0,0,0,0,1,0|1,0,1]=3 15 B9R0.2 CCCC/C=C/CC(=O)O MCULE-3008379579 [2,0,0,0,0,0|1,0,1]=4 16 B9R0.2 CCCCC/C=C/B(O)O MCULE-4174871813 [2,0,0,0,0,0|1,0,1]=4 17 B9R0.2 CCCCC/C=C/C(=O)O MCULE-5661205729 [2,0,0,0,0,0|1,0,1]=4 18 B9R0.2 CCCCC=CCC(=O)O MCULE-1531958630 [2,0,0,0,0,0|1,0,1]=4 19 B9R0.2 CCCCCC=CB(O)O MCULE-8986052883 [2,0,0,0,0,0|1,0,1]=4 20 B9R0.2 CCCCCC=CC(=O)O MCULE-6969617806 [2,0,0,0,0,0|1,0,1]=4 21 B9R0.2 CCCCCCCB(O)O MCULE-2487835239 [2,0,0,0,0,0|1,0,1]=4 22 B9R0.2 CCCCCCCC(=O)O MCULE-5193957469 [2,0,0,0,0,0|1,0,1]=4 23 B9R0.2 CCCCCOCC(=O)O MCULE-8190672624 [2,0,0,0,0,0|2,0,0]=4 24 B9R0.4 CCCCC(=O)CC(=O)C MCULE-9961207967 [2,0,0,0,0,0|2,0,0]=4 25 B9R0.5 CCCCCC(=O)CCC MCULE-5706146235 [2,0,0,0,0,0|2,0,0]=4 26 B9R0.38 CCCCCCP(=O)(Cl)Cl MCULE-7092836822 [2,0,0,0,0,0|2,0,0]=4 27 B9R0.38 CCCCCCP(=O)(O)O MCULE-9622755834 [2,0,0,0,0,0|0,0,0]=2 28 B9R0.38 CCCCCCS(=O)(=O)O MCULE-4883139983 [2,0,0,0,0,0|1,0,1]=4 29 B9R0.38 CCCCNCP(=O)(C)O MCULE-4370254909 [2,0,0,0,0,0|2,0,0]=4 30 B9R0.38 O=P(O)(O)CCOCCCl MCULE-4452895182 [2,0,0,0,0,0|2,0,0]=4 31 B11R0.2 CCCCCCC(=O)CC(=O)C MCULE-1947947048 [1,1,0,0,0,0|2,0,0]=4 32 B11R0.2 CCCCCCC(=O)CC(=O)O MCULE-9513160139 [1,1,0,0,0,0|1,0,0]=3 33 B11R0.2 CCCCCOC(=O)CC(=O)C MCULE-7604289070 [1,1,0,0,0,0|2,0,0]=4 34 B11R0.139 CCCCCC(=O)C(C)C(=O)C MCULE-5133752809 [1,1,0,0,0,0|2,0,0]=4 35 B11R0.154 CCCCCC(=O)CC(=O)OC MCULE-9153189731 [1,1,0,0,0,0|1,0,0]=3 36 B11R0.324 CCCCCS(=O)(=O)CC(=O)O MCULE-4902734422 [1,1,0,0,0,0|2,0,0]=4 37 B11R0.159 CCCCCCCCP(=O)(O)O MCULE-2397771742 [1,1,0,0,0,0|0,0,1]=3 38 B11R0.159 CCCCOCCOP(=O)(O)O MCULE-9697884879 [1,1,0,0,0,0|1,0,1]=4 39 B13R0.824 CCCCCC(=O)CP(=O)(OC)OC MCULE-5055046552 [0,2,0,0,0,0|0,0,0]=2 40 B11R1.34 CCCC1CC(=O)CC(=O)C1 MCULE-9341468829 [1,0,0,1,0,0|2,0,0]=4 41 B11R1.143 O=C1CCCCCC1N(=O)=O MCULE-1997641437 [1,0,0,1,0,0|0,1,1]=4 42 B11R1.230 CCCCC1OC(=O)NC1=O MCULE-8951289616 [1,0,0,1,0,0|2,0,0]=4 43 B11R1.485 O=C(O)CC(=O)NCC1CC1 MCULE-1335842286 [1,0,0,1,0,0|2,0,0]=4 44 B11R1.87 O=P(O)(O)C1CCCCC1O MCULE-7151108069 [1,0,0,1,0,0|1,0,1]=4 45 B11R1.509 CP(=O)(O)CN1CCCCC1 MCULE-4560988571 [1,0,0,1,0,0|2,0,0]=4 46 B9R0.47 CCCCCC(=O)C(=O)C MCULE-3171324169 [1,0,0,0,1,0|2,0,0]=4 47 B9R0.47 CCCCCC(=O)C(=O)O MCULE-2334480456 [1,0,0,0,1,0|1,0,0]=3 48 B9R0.47 CCCCOC(=O)C(O)O MCULE-4196473277 [1,0,0,0,1,0|2,0,0]=4 49 B9R0.3 CCCCC(N)P(=O)(O)O MCULE-6746003648 [1,0,0,0,1,0|1,0,1]=4 50 B11R0.46 CCCCCC(=O)CCC(=O)O MCULE-5964650416 [1,0,0,0,0,1|1,0,0]=3 51 B11R0.46 CCCCCC(=O)NCC(=O)O MCULE-3960557642 [1,0,0,0,0,1|1,0,0]=3 52 B11R0.46 CCCCNC(=O)CCC(=O)O MCULE-8929331080 [1,0,0,0,0,1|2,0,0]=4 53 B13R0.196 CCCCCC(=O)NCCS(=O)(=O)O MCULE-9008979390 [0,0,0,0,0,2|1,0,1]=4