0 B14R1.150 CC1=CC([C@H](N)[C@H](O)C(=O)O)=CC=C1 DY700945 [1,0,0,0,0,0|3,0,0]=4 1 B14R1.686 NC(CC1=CC(O)=C(O)C=C1)B(O)O DY442660 [1,0,0,0,0,0|1,0,1]=3 2 B14R1.686 N[C@@H](CC1=CC(Br)=C(O)C=C1)C(=O)O DY552519 [1,0,0,0,0,0|1,0,0]=2 3 B14R1.686 N[C@@H](CC1=CC(Cl)=C(Cl)C=C1)C(=O)O NO21669 [1,0,0,0,0,0|2,0,0]=3 4 B14R1.686 N[C@H](CC1=CC(Cl)=C(Cl)C=C1)C(=O)O NO21667 [1,0,0,0,0,0|2,0,0]=3 5 B16R2.133342 CC1=C(O)C2=CC=C(O)C(O)=C2OC1=O DY755911 [0,0,0,1,0,0|1,0,2]=4 6 B16R2.133342 O=C1OC2=C(O)C(O)=CC=C2C(O)C1O DY771045 [0,0,0,1,0,0|1,0,0]=2 7 B13R1.132 NC(CC(=O)O)C1=CC=C(Br)C=C1 NO15527 [2,0,0,0,0,0|2,0,0]=4 8 B13R1.132 NC(CC(=O)O)C1=CC=C(F)C=C1 NO10885 [2,0,0,0,0,0|2,0,0]=4 9 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(Br)C=C1 DY628347 [2,0,0,0,0,0|2,0,0]=4 10 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 NO13598 [2,0,0,0,0,0|2,0,0]=4 11 B13R1.133 CC(Oc1ccc(O)cc1)C(=O)O DY566757 [2,0,0,0,0,0|2,0,0]=4 12 B13R1.133 Cc1ccc(CC(N)C(=O)O)cc1 DY555471 [2,0,0,0,0,0|1,0,0]=3 13 B13R1.133 NC(CC1=CC=C(Br)C=C1)C(=O)O DY703045 [2,0,0,0,0,0|1,0,0]=3 14 B13R1.133 N[13C@@H]([13CH2][13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1)[13C](=O)O DY454737 [2,0,0,0,0,0|0,0,0]=2 15 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O NO10882 [2,0,0,0,0,0|1,0,0]=3 16 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O NO10886 [2,0,0,0,0,0|1,0,0]=3 17 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O NO22841 [2,0,0,0,0,0|1,0,0]=3 18 B13R1.133 N[C@@H](CC1=CC=C(I)C=C1)C(=O)O NO10887 [2,0,0,0,0,0|1,0,0]=3 19 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O NO19180 [2,0,0,0,0,0|0,0,0]=2 20 B13R1.133 N[C@@H](Cc1ccc(Cl)cc1)C(=O)O DY436856 [2,0,0,0,0,0|1,0,0]=3 21 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O NO10883 [2,0,0,0,0,0|1,0,0]=3 22 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O DY428053 [2,0,0,0,0,0|1,0,0]=3 23 B13R1.133 N[C@H](CC1=CC=C(O)C=C1)C(=O)O NO19139 [2,0,0,0,0,0|0,0,0]=2 24 B13R1.133 Nc1ccc(C[C@H](N)C(=O)O)cc1 DY436187 [2,0,0,0,0,0|1,0,0]=3 25 B13R1.152 N[C@@H](C1=CC=CC=C1)[C@@H](O)C(=O)O NO13600 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.152 N[C@H](C1=CC=CC=C1)[C@@H](O)C(=O)O DY528723 [2,0,0,0,0,0|2,0,0]=4 27 B13R1.147 CC1=CC(C(N)CC(=O)O)=CC=C1 DY567051 [2,0,0,0,0,0|2,0,0]=4 28 B13R1.147 CC1=CC=CC([C@H](N)CC(=O)O)=C1 DY701869 [2,0,0,0,0,0|2,0,0]=4 29 B13R1.147 N[C@@H](CC(=O)O)C1=CC(O)=CC=C1 DY701881 [2,0,0,0,0,0|1,0,0]=3 30 B13R1.148 NC(CC1=CC(Br)=CC=C1)C(=O)O NO14986 [2,0,0,0,0,0|1,0,0]=3 31 B13R1.148 NC(CC1=CC(I)=CC=C1)C(=O)O DY702859 [2,0,0,0,0,0|1,0,0]=3 32 B13R1.148 N[C@@H](CC1=CC(Br)=CC=C1)C(=O)O DY20846 [2,0,0,0,0,0|1,0,0]=3 33 B13R1.148 N[C@@H](Cc1cccc(O)c1)C(=O)O DY561945 [2,0,0,0,0,0|0,0,0]=2 34 B13R1.466 CNCC(O)c1ccc(O)c(O)c1 DY548871 [2,0,0,0,0,0|2,0,0]=4 35 B13R1.466 CNC[C@H](O)c1ccc(O)c(O)c1 DY559935 [2,0,0,0,0,0|2,0,0]=4 36 B13R1.511 O=C(O)CCC1=CC(F)=C(Cl)C=C1 NO13209 [2,0,0,0,0,0|2,0,0]=4 37 B13R1.511 O=C(O)CCC1=CC(F)=C(F)C=C1 DY40201 [2,0,0,0,0,0|2,0,0]=4 38 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(I)=C(O)C=C1 DY702877 [1,1,0,0,0,0|1,0,0]=3 39 B15R1.5521 COC(=O)[C@@H](N)Cc1ccc(Cl)c(Cl)c1 DY439085 [1,1,0,0,0,0|2,0,0]=4 40 B15R1.8394 N[C@@H](CC1=C(O)C=C(O)C(O)=C1)C(=O)O DY793299 [1,1,0,0,0,0|0,0,0]=2 41 B15R1.28955 NC(CC1=CC(F)=C(F)C(F)=C1)C(=O)O NO17935 [1,1,0,0,0,0|2,0,0]=4 42 B15R1.28955 NC(CC1=CC(I)=C(O)C(I)=C1)C(=O)O DY113502 [1,1,0,0,0,0|1,0,0]=3 43 B15R2.1102 O=C(O)C1=CC2=CC(O)=C(O)C=C2N1 NO16586 [1,0,0,1,0,0|0,0,2]=4