0 B13R1.587 CC(=O)N1CCCC(CC(=O)O)C1 4H58-1-472 [0,0,0,1,0,1|1,0,1]=4 1 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O 4357-1-R0 [0,0,0,0,2,0|1,0,0]=3 2 B9R0.7 CC(C)=CC[C@H](N)C(=O)O 4357-1-S0 [0,0,0,0,2,0|1,0,0]=3