CC(C)CC(=O)O[C@H](CNC(C)C)COc1cccc2ccccc12    mol34452    0_1
CC(C)CC(=[OH+])O[C@H](CNC(C)C)COc1cccc2ccccc12    mol34452    1_1
CC(C)CC(=O)O[C@H](C[NH2+]C(C)C)COc1cccc2ccccc12    mol34452    1_2