0 B10R1.17 CCCC[C@@H]1CCCNC1 DIY [1,0,0,0,0,0|2,0,0]=3 1 B10R0.4 C(CCCC(=O)O)CCCN 8AC [0,0,1,0,0,0|1,0,0]=2 2 B10R0.4 C(CCCNC(=O)O)CCN CMY [0,0,1,0,0,0|2,0,0]=3 3 B10R0.4 C(COCCOCC(=O)O)O TEG [0,0,1,0,0,0|3,0,0]=4 4 B10R0.4 CCCCCCCCC(=O)O KNA [0,0,1,0,0,0|0,0,0]=1 5 B10R0.4 CCCCCCCC[N+](=O)[O-] N8C [0,0,1,0,0,0|1,0,1]=3 6 B10R0.91 CCCCC[C@@H](CCCO)O HND [0,0,1,0,0,0|2,0,1]=4 7 B12R2.24 C1CC[C@@H]2[C@H](C1)CSC(=N2)N 4RW [0,0,0,1,0,0|3,0,0]=4 8 B10R1.16 CCCC[C@H]1CC[S@](=O)C1 SSB [0,0,0,0,1,0|2,0,0]=3 9 B9R0.45 C(CCCCO)CCCO ODI [1,0,1,0,0,0|1,0,1]=4 10 B9R0.45 CCCCCCCCCC D10 [1,0,1,0,0,0|1,0,1]=4 11 B9R0.45 CCCCCCCCCO F09 [1,0,1,0,0,0|0,0,1]=3 12 B9R0.45 CCCCCCCNC=O HPL [1,0,1,0,0,0|1,0,0]=3 13 B9R0.45 CCCCCONCC=O AOP [1,0,1,0,0,0|2,0,0]=4 14 B9R0.2 C(CCCN)CCC(=O)O 011 [1,0,1,0,0,0|1,0,0]=3 15 B9R0.2 C(CCNCC(=O)O)CN NLY [1,0,1,0,0,0|2,0,0]=4 16 B9R0.2 CCCCCCCC(=O)O OCA [1,0,1,0,0,0|0,0,0]=2 17 B9R1.8 CCO[C@@H]1CCC=CO1 JZ7 [2,0,0,0,0,0|1,0,1]=4 18 B11R0.30 C(CCCC(=O)O)CCC(=O)O OCE [0,1,1,0,0,0|1,0,1]=4 19 B11R0.30 CC(C)CCCCCCC(=O)O T55 [0,1,1,0,0,0|0,0,0]=2 20 B11R0.40 CCCCCCCCC(=O)OC NON [0,1,1,0,0,0|0,0,0]=2 21 B11R0.42 C(CCCN)CC[C@@H](C(=O)O)N HHK [0,1,1,0,0,0|1,0,0]=3 22 B11R0.42 CCCCCCC[C@@H](C(=O)O)N AN8 [0,1,1,0,0,0|0,0,0]=2 23 B11R0.42 CCCCSSC[C@@H](C(=O)O)N BUC [0,1,1,0,0,0|2,0,0]=4 24 B11R0.42 CCNCCCC[C@@H](C(=O)O)N LDH [0,1,1,0,0,0|1,0,0]=3 25 B11R0.111 C(CCNC(=O)O)C[C@@H](CO)N LCX [0,1,1,0,0,0|2,0,0]=4 26 B11R0.148 CCCCCCCCCC(=O)C UOC [0,1,1,0,0,0|1,0,0]=3 27 B11R0.148 CCCCCCCCCC(=O)O CRC [0,1,1,0,0,0|0,0,0]=2 28 B11R0.148 CCCCCCCCCC(=O)O DKA [0,1,1,0,0,0|0,0,0]=2 29 B11R0.159 [B-](CCCCCCCC)(O)(O)O 3QK [0,1,1,0,0,0|1,0,1]=4 30 B11R1.27 CCCCC[C@@H]1CC[C@H](O1)O HNB [0,1,0,0,1,0|0,0,2]=4 31 B11R1.27 CCCCC[C@H]1CC[C@@H](O1)O 2LE [0,1,0,0,1,0|0,0,2]=4 32 B13R1.568 CCCCN1CCCC(=C1)C(=O)N XEN [0,2,0,0,0,0|2,0,0]=4 33 B9R0.8 CCCC[C@@H](C(=O)OC)N NLO [0,0,1,0,1,0|2,0,0]=4 34 B9R0.13 CCCC[C@H](C(=O)O)NC DNM [0,0,1,0,1,0|2,0,0]=4 35 B9R1.12 COCC[C@@H]1CCCN1 49F [1,0,0,0,1,0|2,0,0]=4