0 B13R0.1422 CC(C)(C)[C@H](O)C(=O)NCCC(=O)N WXVL_AK00443SB3694 [1,0,0,0,0,0|1,0,0]=2 1 B13R0.1422 CC(C)(C)[C@H](O)C(=O)NCCC(=O)N WXVL_AK00443SB3694 [1,0,0,0,0,0|1,0,0]=2 2 B13R0.1422 CC(C)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0068SB3694 [1,0,0,0,0,0|2,0,1]=4 3 B13R0.1422 CC(C)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0068SB3694 [1,0,0,0,0,0|2,0,1]=4 4 B13R0.1422 CN(C)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0058SB3694 [1,0,0,0,0,0|3,0,0]=4 5 B13R0.1422 CN(C)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0058SB3694 [1,0,0,0,0,0|3,0,0]=4 6 B12R0.54 CCC[C@H](O)C(=O)NCCC(=O)N WXVL_AK00443SB3627 [2,0,0,0,0,0|2,0,0]=4 7 B12R0.54 CCC[C@H](O)C(=O)NCCC(=O)N WXVL_AK00443SB3627 [2,0,0,0,0,0|2,0,0]=4 8 B12R0.240 CCC(C)CC(=O)NCCC(=O)N WXVL_AK00443SB0353 [2,0,0,0,0,0|2,0,0]=4 9 B12R0.240 CCC(C)CC(=O)NCCC(=O)N WXVL_AK00443SB0353 [2,0,0,0,0,0|2,0,0]=4 10 B12R0.240 CC[C@@H](C)CC(=O)NCCC(=O)N WXVL_AK00443SB8650 [2,0,0,0,0,0|2,0,0]=4 11 B12R0.240 CC[C@@H](C)CC(=O)NCCC(=O)N WXVL_AK00443SB8650 [2,0,0,0,0,0|2,0,0]=4 12 B12R0.686 CC(C)C(O)C(=O)NCCC(=O)N WXVL_AK00443SB1147 [2,0,0,0,0,0|1,0,0]=3 13 B12R0.686 CC(C)C(O)C(=O)NCCC(=O)N WXVL_AK00443SB1147 [2,0,0,0,0,0|1,0,0]=3 14 B12R0.140 CC(C)(C)CC(=O)NCCC(=O)N WXVL_AK00443SB0062 [2,0,0,0,0,0|1,0,0]=3 15 B12R0.140 CC(C)(C)CC(=O)NCCC(=O)N WXVL_AK00443SB0062 [2,0,0,0,0,0|1,0,0]=3 16 B12R0.140 CC(C)(C)OC(=O)NCCC(=O)N WXVL_AK0084SB2042 [2,0,0,0,0,0|2,0,0]=4 17 B12R0.140 CC(C)(C)OC(=O)NCCC(=O)N WXVL_AK0084SB2042 [2,0,0,0,0,0|2,0,0]=4 18 B12R0.140 CC(C)(O)CC(=O)NCCC(=O)N WXVL_AK00443SB0163 [2,0,0,0,0,0|1,0,0]=3 19 B12R0.140 CC(C)(O)CC(=O)NCCC(=O)N WXVL_AK00443SB0163 [2,0,0,0,0,0|1,0,0]=3 20 B12R0.143 C#CCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK3109SB3694 [2,0,0,0,0,0|1,0,1]=4 21 B12R0.143 C#CCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK3109SB3694 [2,0,0,0,0,0|1,0,1]=4 22 B12R0.143 C=CCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK00138SB3694 [2,0,0,0,0,0|1,0,0]=3 23 B12R0.143 C=CCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK00138SB3694 [2,0,0,0,0,0|1,0,0]=3 24 B12R0.143 CC(C)(C)[C@H](O)C(=O)NCCC#N WXVL_AK0087SB3694 [2,0,0,0,0,0|1,0,1]=4 25 B12R0.143 CC(C)(C)[C@H](O)C(=O)NCCC#N WXVL_AK0087SB3694 [2,0,0,0,0,0|1,0,1]=4 26 B12R0.143 CC(C)(C)[C@H](O)C(=O)NCCCO WXVL_AK0073SB3694 [2,0,0,0,0,0|0,0,1]=3 27 B12R0.143 CC(C)(C)[C@H](O)C(=O)NCCCO WXVL_AK0073SB3694 [2,0,0,0,0,0|0,0,1]=3 28 B12R0.143 CCCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK00588SB3694 [2,0,0,0,0,0|1,0,1]=4 29 B12R0.143 CCCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK00588SB3694 [2,0,0,0,0,0|1,0,1]=4 30 B12R0.143 CSCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK00440SB3694 [2,0,0,0,0,0|2,0,0]=4 31 B12R0.143 CSCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK00440SB3694 [2,0,0,0,0,0|2,0,0]=4 32 B14R0.19 CC(CO)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK4143SB3694 [1,1,0,0,0,0|1,0,1]=4 33 B14R0.19 CC(CO)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK4143SB3694 [1,1,0,0,0,0|1,0,1]=4 34 B14R0.4444 CC(C)(C)[C@H](O)C(=O)NCCS(=O)(=O)C WXVL_AK0333SB3694 [1,1,0,0,0,0|1,0,1]=4 35 B14R0.4444 CC(C)(C)[C@H](O)C(=O)NCCS(=O)(=O)C WXVL_AK0333SB3694 [1,1,0,0,0,0|1,0,1]=4 36 B14R0.4444 CC(C)(O)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK1558SB3694 [1,1,0,0,0,0|1,0,1]=4 37 B14R0.4444 CC(C)(O)CCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK1558SB3694 [1,1,0,0,0,0|1,0,1]=4 38 B14R1.5946 CC(C)(C)[C@H](O)C(=O)NC1CC(C1)O WXVL_AK0306SB3694 [1,0,0,1,0,0|1,0,1]=4 39 B14R1.5946 CC(C)(C)[C@H](O)C(=O)NC1CC(C1)O WXVL_AK0306SB3694 [1,0,0,1,0,0|1,0,1]=4 40 B14R1.5946 CC(C)(C)[C@H](O)C(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB3694 [1,0,0,1,0,0|1,0,1]=4 41 B14R1.5946 CC(C)(C)[C@H](O)C(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB3694 [1,0,0,1,0,0|1,0,1]=4 42 B14R1.13036 CC(C)(C)[C@H](O)C(=O)N1CCC(C1)O WXVL_AN0158SB3694 [1,0,0,1,0,0|1,0,1]=4 43 B14R1.13036 CC(C)(C)[C@H](O)C(=O)N1CCC(C1)O WXVL_AN0158SB3694 [1,0,0,1,0,0|1,0,1]=4 44 B14R1.13036 CC(C)(C)[C@H](O)C(=O)N1CC[C@@H](C1)O WXVL_AN00391SB3694 [1,0,0,1,0,0|1,0,1]=4 45 B14R1.13036 CC(C)(C)[C@H](O)C(=O)N1CC[C@@H](C1)O WXVL_AN00391SB3694 [1,0,0,1,0,0|1,0,1]=4 46 B14R1.13036 CC(C)(C)[C@H](O)C(=O)N1CC[C@H](C1)O WXVL_AN00543SB3694 [1,0,0,1,0,0|1,0,1]=4 47 B12R0.349 CC(C)(CCl)C(=O)NCCC(=O)N WXVL_AK00443SB3392 [1,0,0,0,1,0|2,0,0]=4 48 B12R0.349 CC(C)(CCl)C(=O)NCCC(=O)N WXVL_AK00443SB3392 [1,0,0,0,1,0|2,0,0]=4 49 B12R0.349 CCC(C)(C)C(=O)NCCC(=O)N WXVL_AK00443SB0355 [1,0,0,0,1,0|2,0,0]=4 50 B12R0.349 CCC(C)(C)C(=O)NCCC(=O)N WXVL_AK00443SB0355 [1,0,0,0,1,0|2,0,0]=4 51 B12R0.595 CC(=O)CCC(=O)NC(C)(C)CO WXVL_AK0025SB0072 [1,0,0,0,1,0|2,0,0]=4 52 B12R0.595 CC(=O)CCC(=O)NC(C)(C)CO WXVL_AK0025SB0072 [1,0,0,0,1,0|2,0,0]=4 53 B12R0.595 CC(C)(CO)NC(=O)CCC(=O)N WXVL_AK0025SB0358 [1,0,0,0,1,0|2,0,0]=4 54 B12R0.595 CC(C)(CO)NC(=O)CCC(=O)N WXVL_AK0025SB0358 [1,0,0,0,1,0|2,0,0]=4 55 B12R0.259 C=C(C)CNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0761SB3694 [1,0,0,0,1,0|2,0,0]=4 56 B12R0.259 C=C(C)CNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0761SB3694 [1,0,0,0,1,0|2,0,0]=4 57 B12R0.259 CC(C)(C)[C@H](O)C(=O)NCC(=O)N WXVL_AK0147SB3694 [1,0,0,0,1,0|1,0,0]=3 58 B12R0.259 CC(C)(C)[C@H](O)C(=O)NCC(=O)N WXVL_AK0147SB3694 [1,0,0,0,1,0|1,0,0]=3 59 B12R0.259 CC(O)CNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0052SB3694 [1,0,0,0,1,0|1,0,1]=4 60 B12R0.259 CC(O)CNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0052SB3694 [1,0,0,0,1,0|1,0,1]=4 61 B12R0.259 C[C@H](O)CNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0113SB3694 [1,0,0,0,1,0|1,0,1]=4 62 B12R0.259 C[C@H](O)CNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0113SB3694 [1,0,0,0,1,0|1,0,1]=4 63 B14R0.1435 CC(=O)NCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0057SB3694 [1,0,0,0,0,1|1,0,0]=3 64 B14R0.1435 CC(=O)NCCNC(=O)[C@@H](O)C(C)(C)C WXVL_AK0057SB3694 [1,0,0,0,0,1|1,0,0]=3