0 B9R0.2 NC(=O)CCCCCCO AC4329 [1,0,0,0,0,0|2,0,1]=4 1 B9R0.5 CCCCNC(=O)CCC D86376 [1,0,0,0,0,0|2,0,1]=4 2 B11R1.166 C[C@H]1CC(=O)CC[C@@H]1C(=O)O P18309 [0,0,0,1,0,0|0,0,0]=1 3 B11R1.201 CCOC(=O)C[C@H]1C[C@@H](O)C1 P13501 [0,0,0,1,0,0|2,0,1]=4 4 B11R1.201 CCOC(=O)C[C@H]1C[C@H](O)C1 P13500 [0,0,0,1,0,0|2,0,1]=4 5 B11R0.176 O=C(O)CCCC[C@H](S)CCS 68441 [0,0,0,0,0,1|1,1,1]=4 6 B8R0.7 NCCOCCC(=O)O C72750 [2,0,0,0,0,0|2,0,0]=4 7 B8R0.28 NC(=O)CNCC(=O)O A10558 [2,0,0,0,0,0|2,0,0]=4 8 B10R0.4 C#CCCCCCCC(=O)O AT18741 [1,1,0,0,0,0|0,0,2]=4 9 B10R0.4 O=C(O)COCCOCCO C70220 [1,1,0,0,0,0|2,0,0]=4 10 B10R0.74 COC(=O)CCCCCCO W16829 [1,1,0,0,0,0|1,0,1]=4 11 B10R0.96 CC(=O)CC(=O)CCC(=O)O H10298 [0,1,0,0,1,0|0,0,1]=3 12 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CC1 C90647 [1,0,0,1,0,0|1,0,1]=4 13 B10R1.54 O=C(O)C[C@@H]1CC[C@H](O)C1 P19536 [1,0,0,1,0,0|0,0,2]=4 14 B10R1.408 COC(=O)[C@H]1C[C@H]1C(=O)O P19533 [1,0,0,1,0,0|1,0,0]=3 15 B10R1.18 O=C(O)C[C@H]1CNCCO1 C72399 [1,0,0,1,0,0|2,0,0]=4 16 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O D85978 [1,0,0,1,0,0|1,0,1]=4 17 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O Y13544 [1,0,0,1,0,0|1,0,1]=4 18 B10R1.348 O=C(O)[C@@H]1CCCCCN1 P19284 [1,0,0,1,0,0|1,0,1]=4 19 B10R1.348 O=C(O)[C@@H]1CCCCCN1 P20954 [1,0,0,1,0,0|1,0,1]=4 20 B10R1.113 O=C(O)[C@H]1CCC[C@H](O)C1 P19276 [0,0,0,1,1,0|0,0,2]=4 21 B12R1.16 CCOC(=O)[C@@H]1CCC(=O)CO1 P13576 [0,1,0,1,0,0|1,0,0]=3 22 B12R1.1611 CCOC(=O)C1(F)CC1C(=O)O 71669 [0,1,0,1,0,0|1,0,0]=3 23 B8R0.5 CCC[C@H](N)CC(=O)O Y13601 [0,0,0,0,2,0|1,0,1]=4