0 B10R1.119 C1(O)C=CC(O)C(Br)C1Br SCSA01110 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.119 OC1COC(O)C(O)C1O HR133729 [0,0,0,0,0,0|0,0,0]=0 2 B10R1.119 OC1COC(O)C(O)C1O HR134003 [0,0,0,0,0,0|0,0,0]=0 3 B10R1.119 OC1COC(O)C(O)C1O HR146544 [0,0,0,0,0,0|0,0,0]=0 4 B10R1.119 OC1COC(O)C(O)C1O SOSA06001 [0,0,0,0,0,0|0,0,0]=0 5 B10R1.119 OC1COC(O)C(O)C1O XYJL03605 [0,0,0,0,0,0|0,0,0]=0 6 B10R1.119 OC1COC(O)C(O)C1O XYJL03607 [0,0,0,0,0,0|0,0,0]=0 7 B11R1.32 CC1OC(O)C(O)C(O)C1O HR128074 [0,1,0,0,0,0|0,0,0]=1 8 B11R1.32 CC1OC(O)C(O)C(O)C1O HR134570 [0,1,0,0,0,0|0,0,0]=1 9 B11R1.278 COC1OCC(O)C(O)C1O HR141683 [0,1,0,0,0,0|0,0,0]=1 10 B11R1.278 OCC1NCC(O)C(O)C1O HR135959 [0,1,0,0,0,0|1,0,0]=2 11 B11R1.278 OCC1NCC(O)C(O)C1O HR149362 [0,1,0,0,0,0|1,0,0]=2 12 B11R1.278 OCC1NCC(O)C(O)C1O HR149417 [0,1,0,0,0,0|1,0,0]=2 13 B11R1.278 OCC1NCC(O)C(O)C1O HR149771 [0,1,0,0,0,0|1,0,0]=2 14 B11R1.278 OCC1OCC(O)C(O)C1O HR117494 [0,1,0,0,0,0|0,0,0]=1 15 B9R0.8 COCCC(O)C(O)CO HR125913 [0,0,1,0,0,0|3,0,0]=4 16 B9R0.24 CCC(O)CCC(O)CC HR139878 [0,0,1,0,0,0|3,0,0]=4 17 B9R0.24 O=C(CS)OCC(O)CO HR101354 [0,0,1,0,0,0|0,1,2]=4 18 B9R0.27 O=CC(O)C(O)C(O)CO HR102751 [0,0,1,0,0,0|0,0,2]=3 19 B9R0.27 O=CC(O)C(O)C(O)CO HR123552 [0,0,1,0,0,0|0,0,2]=3 20 B9R0.27 O=CC(O)C(O)C(O)CO HR137681 [0,0,1,0,0,0|0,0,2]=3 21 B9R0.27 O=CC(O)C(O)C(O)CO HR142170 [0,0,1,0,0,0|0,0,2]=3 22 B9R0.27 O=CC(O)C(O)C(O)CO HR144065 [0,0,1,0,0,0|0,0,2]=3 23 B9R0.27 O=CC(O)C(O)C(O)CO XYJL03608 [0,0,1,0,0,0|0,0,2]=3 24 B9R0.27 OCC(O)C(O)C(O)CO HR101259 [0,0,1,0,0,0|0,0,0]=1 25 B9R0.27 OCC(O)C(O)C(O)CO HR138986 [0,0,1,0,0,0|0,0,0]=1 26 B9R0.27 OCC(O)C(O)C(O)CO XYJL036 [0,0,1,0,0,0|0,0,0]=1 27 B8R0.3 O=CCC(O)C(O)CO HR131624 [1,0,1,0,0,0|0,0,2]=4 28 B8R0.3 O=CCC(O)C(O)CO HR134366 [1,0,1,0,0,0|0,0,2]=4 29 B8R0.6 C#CCOCC(O)CO HR132728 [1,0,1,0,0,0|1,0,1]=4 30 B8R0.6 OCCCCC(O)CO HR123795 [1,0,1,0,0,0|1,0,0]=3 31 B8R0.9 CC(=O)OCC(O)CO HR119576 [1,0,1,0,0,0|0,0,2]=4 32 B8R0.9 CC(O)COC(C)CO HR100186 [1,0,1,0,0,0|1,0,0]=3 33 B8R0.2 CC(O)C(O)C(O)C=O HR125158 [1,0,1,0,0,0|0,0,2]=4 34 B8R0.2 O=C(O)C(O)C(O)CO HR18483 [1,0,1,0,0,0|0,0,2]=4 35 B8R1.4 CC1CC(O)CCO1 HR120725 [2,0,0,0,0,0|1,0,0]=3 36 B8R1.4 CC1CC(O)CCO1 HR121039 [2,0,0,0,0,0|1,0,0]=3 37 B8R1.4 NC1CCCC(O)C1 HR12673 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.4 OC1CCCC(O)C1 HR133806 [2,0,0,0,0,0|1,0,0]=3 39 B8R1.5 CC1CCCCC1O HR10840 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.5 NC1CCCCC1O HR105750 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.5 NC1CCCCC1O HR106708 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.5 NC1CCCCC1O HR106746 [2,0,0,0,0,0|2,0,0]=4 43 B8R1.5 NC1CCCCC1O HR108115 [2,0,0,0,0,0|2,0,0]=4 44 B8R1.5 NC1CCCCC1O HR14514 [2,0,0,0,0,0|2,0,0]=4 45 B8R1.5 NC1CCCCC1O HR146109 [2,0,0,0,0,0|2,0,0]=4 46 B8R1.5 NC1CCCCC1O HR146110 [2,0,0,0,0,0|2,0,0]=4 47 B8R1.5 NC1CCCCC1O HR146111 [2,0,0,0,0,0|2,0,0]=4 48 B8R1.5 NC1CCCCC1O HR146112 [2,0,0,0,0,0|2,0,0]=4 49 B8R1.5 NC1CCCCC1O HR148126 [2,0,0,0,0,0|2,0,0]=4 50 B8R1.5 NC1CCOCC1F HR150486 [2,0,0,0,0,0|2,0,0]=4 51 B8R1.5 NC1CCOCC1F HR150488 [2,0,0,0,0,0|2,0,0]=4 52 B8R1.5 OC1CCCCC1Cl HR136648 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.5 OC1CCCCC1O HR136389 [2,0,0,0,0,0|1,0,0]=3 54 B8R1.5 OC1CCCCC1O HR140132 [2,0,0,0,0,0|1,0,0]=3 55 B8R1.5 OC1CCNCC1F HR151100 [2,0,0,0,0,0|2,0,0]=4 56 B8R1.5 OC1CCOCC1F HR150480 [2,0,0,0,0,0|1,0,0]=3 57 B8R1.3 CC1CCC(O)CC1 HR102432 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.3 CC1CCC(O)CC1 HR142762 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.3 NC1CCC(O)CC1 HR106375 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.3 NC1CCC(O)CC1 HR108164 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.3 NC1CCC(O)CC1 HR111079 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.3 NC1CCC(O)CC1 HR146550 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.3 NC1CCC(O)CC1 VOJL00905 [2,0,0,0,0,0|2,0,0]=4 64 B8R1.3 OC1CCC(Cl)CC1 HR140569 [2,0,0,0,0,0|2,0,0]=4 65 B8R1.3 OC1CCC(O)CC1 HR124198 [2,0,0,0,0,0|1,0,0]=3 66 B8R1.3 OC1CCC(O)CC1 HR143769 [2,0,0,0,0,0|1,0,0]=3 67 B8R1.3 OC1CSC(O)CS1 APSA07201 [2,0,0,0,0,0|1,1,0]=4 68 B10R0.56 CC(O)C(O)C(O)C(O)C=O HR122493 [0,1,1,0,0,0|0,0,2]=4 69 B10R0.56 CC(O)C(O)C(O)C(O)C=O HR137423 [0,1,1,0,0,0|0,0,2]=4 70 B10R0.56 CC(O)C(O)C(O)C(O)C=O HR143446 [0,1,1,0,0,0|0,0,2]=4 71 B10R0.56 CC(O)C(O)C(O)C(O)C=O HR143575 [0,1,1,0,0,0|0,0,2]=4 72 B10R0.56 O=C([O-])C(O)C(O)C(O)CO HR120979 [0,1,1,0,0,0|0,0,2]=4 73 B10R1.2 OCC1OC=CC(O)C1O HR10609 [1,1,0,0,0,0|0,0,2]=4 74 B10R1.2 OCC1OC=CC(O)C1O HR125371 [1,1,0,0,0,0|0,0,2]=4 75 B10R1.34 O=C1OC(CO)C(O)C1O HR105434 [0,1,0,0,1,0|0,0,2]=4 76 B10R1.34 OCC1OC(O)C(O)C1O ROSA05301 [0,1,0,0,1,0|0,0,0]=2 77 B12R1.14 NC1C(O)OC(CO)C(O)C1O ACCQ02301 [0,2,0,0,0,0|1,0,0]=3 78 B12R1.14 NC1C(O)OC(CO)C(O)C1O ACCQ02302 [0,2,0,0,0,0|1,0,0]=3 79 B12R1.14 NC1C(O)OC(CO)C(O)C1O HR121197 [0,2,0,0,0,0|1,0,0]=3 80 B12R1.14 NC1C(O)OC(CO)C(O)C1O HR125630 [0,2,0,0,0,0|1,0,0]=3 81 B12R1.14 NC1C(O)OC(CO)C(O)C1O HR131906 [0,2,0,0,0,0|1,0,0]=3 82 B12R1.14 NC1C(O)OC(CO)C(O)C1O HR132586 [0,2,0,0,0,0|1,0,0]=3 83 B12R1.14 NC1C(O)OC(CO)C(O)C1O HR132863 [0,2,0,0,0,0|1,0,0]=3 84 B12R1.14 NC1C(O)OC(CO)C(O)C1O HR137688 [0,2,0,0,0,0|1,0,0]=3 85 B12R1.14 O=C1OC(CO)C(O)C(O)C1O HR100863 [0,2,0,0,0,0|0,0,1]=3 86 B12R1.14 O=C1OC(CO)C(O)C(O)C1O HR130762 [0,2,0,0,0,0|0,0,1]=3 87 B12R1.14 OCC1NC(O)C(O)C(O)C1O HR149773 [0,2,0,0,0,0|1,0,0]=3 88 B12R1.14 OCC1OC(O)C(O)C(O)C1O CISA08102 [0,2,0,0,0,0|0,0,0]=2 89 B12R1.14 OCC1OC(O)C(O)C(O)C1O HR129623 [0,2,0,0,0,0|0,0,0]=2 90 B12R1.14 OCC1OC(O)C(O)C(O)C1O HR129916 [0,2,0,0,0,0|0,0,0]=2 91 B12R1.14 OCC1OC(O)C(O)C(O)C1O HR141301 [0,2,0,0,0,0|0,0,0]=2 92 B12R1.14 OCC1O[13CH](O)C(O)C(O)C1O HR143808 [0,2,0,0,0,0|0,0,0]=2 93 B12R1.98 CN1CC(O)C(O)C(O)C1CO HR149436 [0,2,0,0,0,0|1,0,0]=3 94 B12R1.3795 OC1C(O)C(O)C(O)C(O)C1O HR120519 [0,2,0,0,0,0|1,0,0]=3 95 B12R1.3795 OC1C(O)C(O)C(O)C(O)C1O HR125151 [0,2,0,0,0,0|1,0,0]=3 96 B12R1.3795 OC1C(O)C(O)C(O)C(O)C1O SCSA011 [0,2,0,0,0,0|1,0,0]=3 97 B12R1.3795 OC1C(O)C(O)C(O)C(O)C1O SCSA01104 [0,2,0,0,0,0|1,0,0]=3 98 B12R1.3860 OCC1(O)OCC(O)C(O)C1O HR135521 [0,2,0,0,0,0|0,0,0]=2 99 B12R1.3860 OCC1(O)OCC(O)C(O)C1O HR143535 [0,2,0,0,0,0|0,0,0]=2 100 B12R2.2345 OC1C2COC(O2)C(O)C1O HR102294 [0,0,0,1,0,1|0,0,0]=2 101 B12R2.2345 OC1C2COC(O2)C(O)C1O HR130080 [0,0,0,1,0,1|0,0,0]=2 102 B8R1.50 O=C1OCC(O)C1O HR120212 [1,0,0,0,1,0|0,0,2]=4 103 B10R0.59 OCC(O)COCC(O)CO HR136100 [0,0,1,0,0,1|0,0,0]=2