0 B11R0.106 COC(=O)C/C=C/CC(=O)OC PH000155 [0,0,0,0,0,0|0,0,2]=2 1 B11R0.106 COC(=O)NCCNC(=O)OC T330965 [0,0,0,0,0,0|2,0,0]=2 2 B11R0.106 COC(=O)OCCOC(=O)OC S348406 [0,0,0,0,0,0|2,0,0]=2 3 B10R0.55 C(=C/C(=O)OC)\CCC(=C)C T252778 [1,0,0,0,0,0|1,0,2]=4 4 B10R0.55 CC[C@H](O)CCCCC(=O)C T263230 [1,0,0,0,0,0|1,0,2]=4 5 B10R0.55 COC(=O)CCCNC(=N)N S784184 [1,0,0,0,0,0|3,0,0]=4 6 B10R0.55 COC(=O)CNCCN(C)C CDS023468 [1,0,0,0,0,0|3,0,0]=4 7 B10R0.55 CSC(=S)NCCCC(=O)O PH009425 [1,0,0,0,0,0|1,2,0]=4 8 B10R0.74 CCCCCCCC(=O)CC S544043 [1,0,0,0,0,0|2,0,1]=4 9 B12R0.147 CCC(=O)COC(=O)CC(=O)OC T243000 [0,1,0,0,0,0|2,0,1]=4 10 B12R0.156 COC(=O)CCCC(C)C(=O)OC S412007 [0,1,0,0,0,0|0,0,0]=1 11 B12R1.26 COC(=O)CCC1CCC(=O)N1 PH009358 [0,0,0,1,0,0|2,0,0]=3 12 B10R0.59 COC(=O)NCNC(=O)OC S608270 [0,0,0,0,1,0|2,0,0]=3 13 B12R0.183 CCC(=O)CCCCCC(=O)CC S872482 [0,0,0,0,0,1|2,0,0]=3 14 B9R0.2 COCCCCCC(=O)O CBR00492 [2,0,0,0,0,0|0,0,1]=3 15 B9R0.46 COC(=O)CCCCCBr S125334 [2,0,0,0,0,0|1,0,1]=4 16 B9R0.55 CC(=O)NCCNC(=O)C S389382 [2,0,0,0,0,0|2,0,0]=4 17 B9R0.55 NC(=O)CSCCC(=O)O EME00025 [2,0,0,0,0,0|2,0,0]=4 18 B9R0.55 O=C(O)CCSCC(=O)O PH001934 [2,0,0,0,0,0|1,0,0]=3 19 B9R0.55 O=C([O-])CCCCC(=O)[O-] S566012 [2,0,0,0,0,0|0,0,2]=4 20 B11R0.93 COC(=O)CC(=O)OCC(=O)C T295388 [1,1,0,0,0,0|1,0,1]=4 21 B11R0.109 C=C(CCCC(=O)OC)C(=O)O T284890 [1,1,0,0,0,0|0,0,1]=3 22 B11R0.176 CCCC(=O)OCCCC(=O)C R396044 [1,1,0,0,0,0|2,0,0]=4 23 B11R0.176 CCOC(=O)CSCCC(=O)C PH010101 [1,1,0,0,0,0|1,0,0]=3 24 B11R0.4 CCCCCCCC(=O)OCCl PH007966 [1,1,0,0,0,0|1,0,1]=4 25 B11R0.4 CCOC(=O)CCCC/C=N/O T240672 [1,1,0,0,0,0|2,0,0]=4 26 B11R0.110 COC(=O)/C=C(\Cl)/CC(=O)OC S884758 [0,1,0,0,1,0|0,0,2]=4 27 B11R0.110 COC(=O)C=C(N)CC(=O)OC S407925 [0,1,0,0,1,0|0,0,2]=4 28 B11R0.120 COC(=O)CCC(Br)C(=O)OC PH016114 [0,1,0,0,1,0|0,0,0]=2 29 B11R0.120 COC(=O)CCC(N)C(=O)OC S338427 [0,1,0,0,1,0|0,0,0]=2 30 B13R0.250 COC(=O)CCCCC(C)C(=O)OC T271365 [0,1,0,0,0,1|0,0,0]=2 31 B13R0.961 COC(=O)CCN(C)CCC(=O)OC PH015296 [0,1,0,0,0,1|0,0,0]=2 32 B13R0.961 COC(=O)CCN(C)CCC(=O)OC R372242 [0,1,0,0,0,1|0,0,0]=2 33 B13R0.110 COC(=O)C(Br)CCC(Br)C(=O)OC S915092 [0,2,0,0,0,0|0,0,0]=2 34 B13R0.110 COC(=O)C(C)CCC(C)C(=O)OC S417009 [0,2,0,0,0,0|0,0,0]=2 35 B13R0.110 COC(=O)[C@@H](Br)CC[C@@H](Br)C(=O)OC T168106 [0,2,0,0,0,0|0,0,0]=2 36 B13R0.367 CCOC(=O)CSSCC(=O)OCC T160482 [0,2,0,0,0,0|2,0,0]=4 37 B13R0.367 CCOC(=O)NCCNC(=O)OCC S360511 [0,2,0,0,0,0|2,0,0]=4 38 B11R1.23 COC(=O)C1CCCN(C1)C PH014092 [1,0,0,1,0,0|2,0,0]=4 39 B11R1.75 CC(=O)CCC1CCC(=O)C1 T242535 [1,0,0,1,0,0|1,0,0]=3 40 B11R1.75 O=C(O)CCC1CCC(=O)N1 PH009802 [1,0,0,1,0,0|2,0,0]=4 41 B11R1.25 COC(=O)CCC1CCCC1 EME00045 [1,0,0,1,0,0|1,0,1]=4 42 B11R1.40 COC(=O)CC1CCNCC1 CDS003616 [1,0,0,1,0,0|2,0,0]=4 43 B11R1.44 COC(=O)C1CCC(=N1)OC PH015636 [0,0,0,1,1,0|1,0,0]=3 44 B13R1.2680 COC(=O)CC1CCS(=O)(=O)CC1 PHB00066 [0,1,0,1,0,0|2,0,0]=4 45 B13R1.2052 COC(=O)CCC1(CCC(=O)N1)C PH007822 [0,1,0,1,0,0|2,0,0]=4 46 B13R1.534 COC(=O)C1CSC(N1)C(=O)OC CDS000184 [0,1,0,1,0,0|1,0,0]=3 47 B13R1.41 CCOC(=O)CCC1CCC(=O)N1 PH008560 [0,1,0,1,0,0|2,0,0]=4 48 B13R1.41 CCOC(=O)CCC1CCC(=O)O1 PH008738 [0,1,0,1,0,0|2,0,0]=4 49 B13R2.342 O=C1CCCC2C1CCCC2=O S906689 [0,0,0,2,0,0|2,0,0]=4 50 B13R2.1155 COC(=O)C1CC2CC(=O)C1C2 PH000971 [0,0,0,2,0,0|1,0,0]=3 51 B13R2.5120 N1CC2(CCC1=O)COC(=O)C2 S113859 [0,0,0,2,0,0|1,0,0]=3 52 B13R2.10772 [C@H]12CC(=O)[C@@H]([C@H]1CC(=O)[C@@H]2C)C T287555 [0,0,0,2,0,0|2,0,0]=4 53 B9R0.1 C=C(Br)CCCC(=O)OC T287547 [1,0,0,0,1,0|1,0,1]=4 54 B9R0.1 COC(=O)CSCC(=O)C PH010376 [1,0,0,0,1,0|1,0,0]=3 55 B9R0.24 CNC(=O)CCC(=O)NC S374857 [0,0,0,0,2,0|2,0,0]=4 56 B13R0.201 COC(=O)C#CCCC#CC(=O)OC T173649 [0,0,0,0,0,2|0,0,2]=4 57 B13R0.201 COC(=O)NCCCCNC(=O)OC PH009279 [0,0,0,0,0,2|0,0,0]=2