0 B15R1.889 CC(C)NCC(O)C1=CC=C(O)C(O)=C1 D01390 [0,0,0,0,0,0|0,0,0]=0 1 B15R1.889 CC(C)NCC(O)C1=CC=C(O)C(O)=C1 D02066 [0,0,0,0,0,0|0,0,0]=0 2 B15R1.889 CC(C)NCC(O)C1=CC=C(O)C(O)=C1 D08090 [0,0,0,0,0,0|0,0,0]=0 3 B15R1.889 CC(C)NC[C@H](O)C1=CC=C(O)C(O)=C1 D02150 [0,0,0,0,0,0|0,0,0]=0 4 B14R1.678 CC(C)NCC(O)C1=CC=C(O)C=C1 D03700 [1,0,0,0,0,0|0,0,0]=1 5 B16R1.4709 CC(C)NCC(O)C1=CC(C#N)=C(N)C=C1 D03502 [0,1,0,0,0,0|2,0,0]=3 6 B16R1.16536 CC(C)(C)NCC(O)C1=CC=C(O)C(O)=C1 D03587 [0,1,0,0,0,0|0,0,0]=1 7 B13R1.18 CCNCC(O)C1=CC(O)=CC=C1 D01573 [2,0,0,0,0,0|0,0,0]=2 8 B13R1.18 CCNCC(O)C1=CC(O)=CC=C1 D07931 [2,0,0,0,0,0|0,0,0]=2 9 B13R1.466 CNCC(=O)C1=CC(O)=C(O)C=C1 D02774 [2,0,0,0,0,0|0,0,2]=4 10 B13R1.466 CNCC(=O)C1=CC(O)=C(O)C=C1 D07560 [2,0,0,0,0,0|0,0,2]=4 11 B13R1.466 CNCC(O)C1=CC(O)=C(O)C=C1 D05688 [2,0,0,0,0,0|0,0,0]=2 12 B13R1.466 CNCC(O)C1=CC(O)=C(O)C=C1 D05689 [2,0,0,0,0,0|0,0,0]=2 13 B13R1.466 CNC[C@H](O)C1=CC=C(O)C(O)=C1 D00095 [2,0,0,0,0,0|0,0,0]=2 14 B13R1.466 CNC[C@H](O)C1=CC=C(O)C(O)=C1 D00996 [2,0,0,0,0,0|0,0,0]=2 15 B13R1.466 CNC[C@H](O)C1=CC=C(O)C(O)=C1 D02149 [2,0,0,0,0,0|0,0,0]=2 16 B15R1.5450 CC(C)NCC(O)C1=CC(O)=CC(O)=C1 D00685 [1,1,0,0,0,0|0,0,0]=2 17 B15R1.5450 CC(C)NCC(O)C1=CC(O)=CC(O)=C1 D08300 [1,1,0,0,0,0|0,0,0]=2 18 B17R1.2672 CCC(NC(C)C)C(O)C1=CC(O)=C(O)C=C1 D02093 [0,2,0,0,0,0|0,0,0]=2 19 B17R1.2672 CCC(NC(C)C)C(O)C1=CC(O)=C(O)C=C1 D04625 [0,2,0,0,0,0|0,0,0]=2 20 B17R1.2672 CCC(NC(C)C)C(O)C1=CC(O)=C(O)C=C1 D04626 [0,2,0,0,0,0|0,0,0]=2 21 B17R1.5286 CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=C1 D00683 [0,2,0,0,0,0|0,0,0]=2 22 B17R1.5286 CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=C1 D02147 [0,2,0,0,0,0|0,0,0]=2 23 B17R1.5286 CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=N1 D00686 [0,2,0,0,0,0|1,0,0]=3 24 B17R1.5286 CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=N1 D01349 [0,2,0,0,0,0|1,0,0]=3 25 B17R1.5286 CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=N1 D08387 [0,2,0,0,0,0|1,0,0]=3 26 B17R1.5286 CC(C)(C)NC[C@H](O)C1=CC=C(O)C(CO)=C1 D02281 [0,2,0,0,0,0|0,0,0]=2 27 B17R1.5286 CC(C)(C)NC[C@H](O)C1=CC=C(O)C(CO)=C1 D04701 [0,2,0,0,0,0|0,0,0]=2 28 B17R1.5286 CC(C)(C)NC[C@H](O)C1=CC=C(O)C(CO)=C1 D04703 [0,2,0,0,0,0|0,0,0]=2 29 B17R1.5286 CC(C)(C)NC[C@H](O)C1=CC=C(O)C(CO)=C1 D08124 [0,2,0,0,0,0|0,0,0]=2 30 B17R1.304823 CC(C)(C)NCC(O)C1=CC(Cl)=C(N)C(Cl)=C1 D01360 [0,2,0,0,0,0|2,0,0]=4 31 B17R1.304823 CC(C)(C)NCC(O)C1=CC(Cl)=C(N)C(Cl)=C1 D07713 [0,2,0,0,0,0|2,0,0]=4 32 B13R1.510 C[C@H](N)[C@H](O)C1=CC=C(O)C(O)=C1 D02388 [0,0,0,0,2,0|1,0,0]=3