0 B11R0.160 CCSC[C@H](NC(C)=O)C(=O)O RT5440 [0,0,0,0,0,0|2,0,0]=2 1 B10R0.23 COCC(NC(C)=O)C(=O)O YH65955 [1,0,0,0,0,0|0,1,0]=2 2 B10R0.23 CSC[C@H](NC(C)=O)C(=O)O RT5630 [1,0,0,0,0,0|0,0,0]=1 3 B10R0.88 CCCCC(CCC)C(=O)O RT1090 [1,0,0,0,0,0|2,0,1]=4 4 B12R0.120 C=CCSC[C@H](NC(C)=O)C(=O)O RT5776 [0,1,0,0,0,0|1,0,1]=3 5 B12R0.120 CC(=O)N[C@@H](CCCCN)C(=O)O JZ1197 [0,1,0,0,0,0|1,0,0]=2 6 B12R0.120 CC(=O)N[C@@H](CCCCN)C(N)=O RT5735 [0,1,0,0,0,0|2,0,0]=3 7 B12R0.120 CCCSC[C@H](NC(C)=O)C(=O)O RT5629 [0,1,0,0,0,0|1,0,0]=2 8 B12R0.138 CC(=O)NC(CCC(=O)O)C(=O)O HL3032 [0,1,0,0,0,0|2,0,0]=3 9 B12R0.138 CC(=O)NC(CCC(=O)O)C(N)=O RT5011 [0,1,0,0,0,0|3,0,0]=4 10 B12R0.138 CC(=O)NC(CCC(N)=O)C(=O)O JZ0537 [0,1,0,0,0,0|2,0,0]=3 11 B12R0.138 CC(=O)NC(CSC(C)=O)C(=O)O RT5774 [0,1,0,0,0,0|2,0,0]=3 12 B12R0.138 CC(=O)N[C@@H](CCC(=O)O)C(=O)O JZ0416 [0,1,0,0,0,0|2,0,0]=3 13 B12R0.138 NC(=O)N[C@@H](CCC(=O)O)C(=O)O JZ4441 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.261 O=C(O)[C@H]1CCCC[C@H]1C(=O)O LT4574 [0,0,0,1,0,0|3,0,0]=4 15 B10R0.17 CCCCC(C(C)=O)C(=O)[O-] HL0104 [0,0,0,0,1,0|1,0,1]=3 16 B10R0.17 CCCCC(C(C)=O)C(C)=O JZ4609 [0,0,0,0,1,0|2,0,0]=3 17 B9R0.15 C=CCC(CCC)C(=O)O RT16821 [2,0,0,0,0,0|1,0,1]=4 18 B9R0.15 CCCC(CCC)C(=O)O HL1293 [2,0,0,0,0,0|1,0,1]=4 19 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O JZ1685 [2,0,0,0,0,0|0,0,0]=2 20 B9R0.39 CCC(CC(=O)O)C(=O)O JZ4023 [2,0,0,0,0,0|2,0,0]=4 21 B9R0.39 CCC(NC(C)=O)C(=O)O RT4978 [2,0,0,0,0,0|0,0,0]=2 22 B9R0.39 NC(=O)N[C@@H](CS)C(=O)O RT5777 [2,0,0,0,0,0|1,0,0]=3 23 B11R0.32 CC(=O)NC(CC(C)C)C(=O)O JZ1689 [1,1,0,0,0,0|0,0,0]=2 24 B11R0.32 CC(=O)NC(CC(C)C)C(=O)O LT7375 [1,1,0,0,0,0|0,0,0]=2 25 B11R0.32 CC(=O)N[C@H](CC(C)C)C(=O)O JZ1218 [1,1,0,0,0,0|0,0,0]=2 26 B11R0.32 [C@@H](CC(C)C)(NC(C)=O)C(=O)O LT7374 [1,1,0,0,0,0|0,0,0]=2 27 B11R0.115 CCC(C)[C@H](NC(C)=O)C(=O)O JZ0539 [1,1,0,0,0,0|0,0,0]=2 28 B13R0.281 CC(=O)N[C@@H](CSCCC#N)C(=O)O RT5793 [0,2,0,0,0,0|1,0,1]=4 29 B13R0.281 CCCCCCC(NC(C)=O)C(C)=O RT0142 [0,2,0,0,0,0|2,0,0]=4 30 B13R0.432 CNC(=O)SC[C@H](NC(C)=O)C(=O)O RT5637 [0,2,0,0,0,0|1,0,1]=4 31 B13R0.443 CC(=O)N[C@@H](CSCC(C)O)C(=O)[O-] RT5633 [0,2,0,0,0,0|1,0,1]=4 32 B13R0.253 COC(=O)[C@H](CSC(C)=O)NC(C)=O LT7382 [0,2,0,0,0,0|2,0,0]=4 33 B13R0.630 CC(=O)NC(CCP(C)(=O)[O-])C(=O)[O-] RT12950 [0,2,0,0,0,0|1,0,1]=4 34 B11R1.178 CC(=O)N1CCC[C@H]1C(N)=O LT6094 [1,0,0,1,0,0|1,0,0]=3 35 B11R1.230 CSCC[C@@H]1NC(=O)OC1=O YH37315 [1,0,0,1,0,0|1,0,0]=3 36 B11R1.50 CC(=O)C1CC(CCl)OC1=O YH66060 [0,0,0,1,1,0|2,0,0]=4 37 B9R0.33 CCCC(C(=O)O)C(C)C RT0043 [1,0,0,0,1,0|1,0,1]=4