CC1=C(CCO)S[C@H]([O-])N1Cc1cnc(C)[nH+]c1N    mol36011    0_1
CC1=C(CCO)S[C@H]([O-])N1Cc1c[nH+]c(C)nc1N    mol36011    0_2
CC1=C(CCO)S[C@H]([O-])N1Cc1cnc(C)nc1[NH3+]    mol36011    0_3
CC1=C(CCO)S[C@H](O)N1Cc1cnc(C)nc1N    mol36011    0_4
CC1=C(CCO)S[C@H]([O-])[NH+]1Cc1cnc(C)nc1N    mol36011    0_5
CC1=C(CCO)S[C@H]([O-])N1Cc1c[nH+]c(C)[nH+]c1N    mol36011    1_1
CC1=C(CC[OH2+])S[C@H](O)N1Cc1cnc(C)nc1N    mol36011    1_2
CC1=C(CCO)S[C@H](O)[NH+]1Cc1cnc(C)nc1N    mol36011    1_3
CC1=C(CCO)S[C@H](O)N1Cc1cnc(C)nc1[NH3+]    mol36011    1_4
CC1=C(CCO)S[C@H]([O-])[NH+]1Cc1c[nH+]c(C)nc1N    mol36011    1_5
CC1=C(CCO)S[C@H]([O-])[NH+]1Cc1cnc(C)nc1[NH3+]    mol36011    1_6
CC1=C(CCO)S[C@H]([O-])N1Cc1cnc(C)[nH+]c1[NH3+]    mol36011    1_7
CC1=C(CCO)S[C@H](O)N1Cc1cnc(C)[nH+]c1N    mol36011    1_8
CC1=C(CCO)S[C@H](O)N1Cc1c[nH+]c(C)nc1N    mol36011    1_9
CC1=C(CCO)S[C@H]([O-])N1Cc1c[nH+]c(C)nc1[NH3+]    mol36011    1_10
CC1=C(CCO)S[C@H]([O-])[NH+]1Cc1cnc(C)[nH+]c1N    mol36011    1_11