0  B15R1.889  CC(C)NCC(c1ccc(c(c1)O)O)O CHEBI:64317 [0,0,0,0,0,0|0,0,0]=0
1  B15R1.889  CC(C)NC[C@@H](c1ccc(c(c1)O)O)O CHEBI:6257 [0,0,0,0,0,0|0,0,0]=0
2  B16R1.16536  CC(C)(C)NCC(c1ccc(c(c1)O)O)O CHEBI:73085 [0,1,0,0,0,0|0,0,0]=1
3  B13R1.466  CNCC(c1ccc(c(c1)O)O)O CHEBI:33568 [2,0,0,0,0,0|0,0,0]=2
4  B13R1.466  CNC[C@@H](c1ccc(c(c1)O)O)O CHEBI:28918 [2,0,0,0,0,0|0,0,0]=2
5  B13R1.466  CNC[C@@H](c1ccc(c(c1)O)O)O CHEBI:6213 [2,0,0,0,0,0|0,0,0]=2
6  B13R1.466  CNC[C@H](c1ccc(c(c1)O)O)O CHEBI:40751 [2,0,0,0,0,0|0,0,0]=2
7  B13R1.466  C[NH2+]C[C@@H](c1ccc(c(c1)O)O)O CHEBI:71406 [2,0,0,0,0,0|0,0,1]=3
8  B15R1.5450  CC(C)NCC(c1cc(cc(c1)O)O)O CHEBI:83329 [1,1,0,0,0,0|0,0,0]=2
9  B15R1.5450  CC(C)NC[C@@H](c1cc(cc(c1)O)O)O CHEBI:83330 [1,1,0,0,0,0|0,0,0]=2
10  B15R1.5450  CC(C)NC[C@@H](c1cc(cc(c1)O)O)O CHEBI:83333 [1,1,0,0,0,0|0,0,0]=2
11  B15R1.5450  CC(C)NC[C@H](c1cc(cc(c1)O)O)O CHEBI:83331 [1,1,0,0,0,0|0,0,0]=2
12  B15R1.5450  CC(C)NC[C@H](c1cc(cc(c1)O)O)O CHEBI:83337 [1,1,0,0,0,0|0,0,0]=2
13  B15R1.5450  CC(C)[NH2+]C[C@@H](c1cc(cc(c1)O)O)O CHEBI:83340 [1,1,0,0,0,0|0,0,1]=3
14  B15R1.5450  CC(C)[NH2+]C[C@H](c1cc(cc(c1)O)O)O CHEBI:83338 [1,1,0,0,0,0|0,0,1]=3
15  B17R1.5286  CC(C)(C)NCC(c1ccc(c(c1)CO)O)O CHEBI:2549 [0,2,0,0,0,0|0,0,0]=2
16  B17R1.5286  CC(C)(C)NC[C@@H](c1ccc(c(c1)CO)O)O CHEBI:8746 [0,2,0,0,0,0|0,0,0]=2
17  B17R1.304823  CC(C)(C)NCC(c1cc(c(c(c1)Cl)N)Cl)O CHEBI:174690 [0,2,0,0,0,0|2,0,0]=4
18  B17R1.304823  CC(C)(C)NCC(c1cc(c(c(c1)Cl)N)Cl)O CHEBI:31410 [0,2,0,0,0,0|2,0,0]=4
19  B17R1.304823  CC(C)(C)NC[C@@H](c1cc(c(c(c1)Cl)N)Cl)O CHEBI:59567 [0,2,0,0,0,0|2,0,0]=4
20  B17R1.304823  CC(C)(C)NC[C@@H](c1cc(c(c(c1)Cl)N)Cl)O CHEBI:59569 [0,2,0,0,0,0|2,0,0]=4
21  B17R1.304823  CC(C)(C)NC[C@H](c1cc(c(c(c1)Cl)N)Cl)O CHEBI:59568 [0,2,0,0,0,0|2,0,0]=4
22  B17R1.304823  CC(C)(C)NC[C@H](c1cc(c(c(c1)Cl)N)Cl)O CHEBI:59570 [0,2,0,0,0,0|2,0,0]=4