0 B12R0.337 CCCCC(C(C)=O)C(=O)OCC 2129-1-32 [0,0,0,0,0,0|0,0,0]=0 1 B11R0.57 C=CCC(C(C)=O)C(=O)OCC 2329-1-X0 [1,0,0,0,0,0|0,0,2]=3 2 B13R0.753 CCOC(=O)C(C(C)=O)C(=O)OCC 2129-1-09 [0,1,0,0,0,0|1,0,1]=3 3 B13R1.463 CCOC(=O)C1CCCCCC1=O 2229-1-09 [0,0,0,1,0,0|0,0,0]=1 4 B13R1.463 CCOC(=O)C1CNCCCC1=O 4H58-5-6C [0,0,0,1,0,0|1,0,0]=2 5 B13R1.1511 CCOC(=O)C1CCC(=O)C=C1C 2229-1-1J [0,0,0,1,0,0|2,0,1]=4 6 B13R1.1511 CCOC(=O)C1CCC(C)CC1=O 2229-1-1U [0,0,0,1,0,0|0,0,0]=1 7 B13R1.4458 CCOC(=O)C1(C(=O)O)CC=CC1 2423-1-0A [0,0,0,1,0,0|1,0,2]=4 8 B13R1.4458 CCOC(=O)C1(C(C)=O)CCCC1 2223-1-87 [0,0,0,1,0,0|0,0,0]=1 9 B13R0.159 CCOC(=O)C(CCSC)NC(C)=O 8166-1-02 [0,0,0,0,0,1|1,0,0]=2 10 B10R0.101 CCOC(=O)C(CC)C(C)=O 2129-1-1B [2,0,0,0,0,0|0,0,0]=2 11 B10R0.17 CCCCC(C(C)=O)C(C)=O 2118-1-0B [2,0,0,0,0,0|0,0,0]=2 12 B10R0.19 CCCCC(=O)C(=O)OCC 2129-1-48 [2,0,0,0,0,0|0,0,1]=3 13 B10R0.19 CCCCC(Br)C(=O)OCC 2123-9-28 [2,0,0,0,0,0|1,0,0]=3 14 B10R0.19 CCOC(=O)[C@@H](N)CCSC 8166-5-01 [2,0,0,0,0,0|2,0,0]=4 15 B12R0.73 CCOC(=O)C(CC(C)=O)C(C)=O 2129-1-X7 [1,1,0,0,0,0|0,0,1]=3 16 B12R1.308 CCOC(=O)C1=C(C)OCCC1 2H23-1-40 [1,0,0,1,0,0|0,0,2]=4 17 B12R1.308 CCOC(=O)C1=C(N)CCCC1 4458-1-08 [1,0,0,1,0,0|1,0,1]=4 18 B12R1.308 CCOC(=O)C1CCCCC1O 2229-1-1Q [1,0,0,1,0,0|0,0,2]=4 19 B12R1.308 CCOC(=O)C1CCCCN1C 4H23-1-HH [1,0,0,1,0,0|2,0,0]=4 20 B12R1.308 CCOC(=O)C1CCCNC1C 4H23-5-1X [1,0,0,1,0,0|1,0,1]=4 21 B12R1.308 CCOC(=O)C1CCCSC1=O 6H29-1-10 [1,0,0,1,0,0|1,0,0]=3 22 B12R1.308 CCOC(=O)C1CCOCC1=O 2H29-1-29 [1,0,0,1,0,0|1,0,0]=3 23 B12R1.308 CCOC(=O)C1CNCCC1=O 4H29-5-03 [1,0,0,1,0,0|1,0,0]=3 24 B12R1.308 CCOC(=O)[C@@H]1CCCC[C@@H]1O 2229-1-1A [1,0,0,1,0,0|0,0,2]=4 25 B12R1.308 CCOC(=O)[C@H]1CCCN[C@@H]1C 4H23-5-1U [1,0,0,1,0,0|1,0,1]=4 26 B12R1.1599 CCOC(=O)C1(C(=O)O)CCC1 2223-1-72 [1,0,0,1,0,0|1,0,0]=3 27 B12R1.365 COC(=O)C1CCCCCC1=O 2229-1-85 [1,0,0,1,0,0|0,0,0]=2 28 B12R1.16 CCOC(=O)C1CCC(O)CC1 2229-1-1R [1,0,0,1,0,0|1,0,1]=4 29 B12R1.16 CCOC(=O)[C@H]1CC[C@H](N)CC1 4258-5-E0 [1,0,0,1,0,0|1,0,1]=4 30 B12R1.16 CCOC(=O)[C@H]1CC[C@H](O)CC1 2229-1-1F [1,0,0,1,0,0|1,0,1]=4 31 B12R1.16 CCOC(=O)[C@H]1CC[C@H](O)CO1 2H29-1-47 [1,0,0,1,0,0|2,0,0]=4 32 B12R1.1564 CCOC(=O)C1CCCCCC1 2223-1-59 [1,0,0,1,0,0|0,0,1]=3 33 B12R1.1579 CCOC(=O)C1CCN(C)C1=O 4H29-1-5A [1,0,0,1,0,0|1,0,0]=3 34 B12R1.3395 CCOC(=O)C1(C#N)CCCC1 4237-1-14 [1,0,0,1,0,0|1,0,1]=4 35 B12R0.284 C#CCC(NC(C)=O)C(=O)OCC 4548-1-04 [1,0,0,0,0,1|0,0,2]=4 36 B12R0.247 CCCC[C@H](CC(=O)O)C(=O)OC 2123-1-17 [1,0,0,0,0,1|1,0,0]=3