0 B14R1.686 N[C@@H](CC1=CC(O)=C(O)C=C1)C(=O)O BB_NC-01739 [0,0,0,0,0,0|0,0,0]=0 1 B14R1.686 [C@H](N)(CC1=CC(N)=C(O)C=C1)C(=O)O BB_NC-02024 [0,0,0,0,0,0|1,0,0]=1 2 B13R1.133 NC(CC1=CC=C(Cl)C=C1)C(=O)O BB_NC-01998 [1,0,0,0,0,0|1,0,0]=2 3 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O BB_NC-01194 [1,0,0,0,0,0|0,0,0]=1 4 B13R1.511 O=C(O)CCC1=CC=C(O)C(O)=C1 BB_NC-02271 [1,0,0,0,0,0|0,0,0]=1 5 B13R1.511 O=C(O)\C=C\C1=CC=C(O)C(O)=C1 BB_NC-02102 [1,0,0,0,0,0|0,0,2]=3 6 B15R1.5521 COC(=O)[C@@H](N)CC1=CC(O)=C(O)C=C1 BB_NC-03072 [0,1,0,0,0,0|0,0,0]=1 7 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 BB_NC-00186 [2,0,0,0,0,0|1,0,0]=3 8 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 BB_NC-02824 [2,0,0,0,0,0|1,0,0]=3 9 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 BB_SC-01486 [2,0,0,0,0,0|2,0,0]=4 10 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 BB_NC-00339 [2,0,0,0,0,0|0,0,0]=2 11 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 BB_NC-02990 [2,0,0,0,0,0|1,0,0]=3 12 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 BB_NC-02249 [2,0,0,0,0,0|0,0,2]=4 13 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 BB_NC-02378 [2,0,0,0,0,0|1,0,0]=3 14 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O BB_NC-03303 [2,0,0,0,0,0|1,0,0]=3 15 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 BB_SC-03069 [2,0,0,0,0,0|2,0,0]=4 16 B12R1.226 NC1=CC=CC(CCC(=O)[O-])=C1 BB_SC-11395 [2,0,0,0,0,0|1,0,1]=4 17 B12R1.226 NC1=CC=CC(OCC(=O)O)=C1 BB_SC-07541 [2,0,0,0,0,0|2,0,0]=4 18 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 BB_NC-02248 [2,0,0,0,0,0|0,0,2]=4 19 B14R1.3 [C@H](N)(CC1=CC=C(OC)C=C1)C(=O)O BB_NC-02034 [1,1,0,0,0,0|0,0,0]=2 20 B14R1.42 COC1=C(O)C=CC(CCC(C)=O)=C1 BB_NC-01538 [1,1,0,0,0,0|1,0,0]=3 21 B14R1.42 COC1=CC(\C=C\C(=O)O)=CC=C1O BB_NC-01070 [1,1,0,0,0,0|0,0,2]=4 22 B14R1.685 NC(CC(=O)O)C1=CC=C(F)C(Br)=C1 BB_SC-06278 [1,1,0,0,0,0|2,0,0]=4 23 B14R1.3653 COC1=CC=C(\C=C\C(=O)O)C=C1O BB_NC-03267 [1,1,0,0,0,0|0,0,2]=4 24 B16R1.94545 C[C@@](CC1=CC(O)=C(O)C=C1)(NN)C(=O)O BB_SC-05095 [0,2,0,0,0,0|0,0,0]=2 25 B16R1.1058 [C@@H](N)(CC1=CC=C(O)C([N+](=O)[O-])=C1)C(=O)O BB_NC-00471 [0,2,0,0,0,0|0,0,1]=3 26 B14R2.4513 O=C1C=CC2=C(O1)C(O)=C(O)C=C2 BB_NC-03277 [1,0,0,1,0,0|0,0,2]=4 27 B12R1.20 NC(=O)[C@H](N)C1=CC=C(O)C=C1 BB_SC-09536 [1,0,0,0,1,0|1,0,0]=3 28 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 BB_NC-02014 [1,0,0,0,1,0|0,0,0]=2