Reaction smiles
cc1ccc[nH]1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>C=CC(C)(C)n1cccc1c.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]1:[#6]:[#6]:[#7H]:[#6]:1:[#6].[CH2]=[CH1][CH0:1]([CH3])([CH3])[O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]=[#6]-[#6](-[#6])(-[#6])-[#7]1:[#6]:[#6]:[#6]:[#6]:1:[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
3
Size
9
Atom
3
ID
PTDBDEP01086
Smiles
ccc1[nH]cc(C)c1c
Reaction smiles
ccc1[nH]cc(C)c1c.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>C=CC(C)(C)n1cc(C)c(c)c1cc.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]:[#6]:[#6]1:[#7H]:[#6]:[#6](:[#6]:1:[#6])-[#6].[CH2]=[CH1][CH0:1]([CH3])([CH3])[O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]=[#6]-[#6](-[#6])(-[#6])-[#7]1:[#6]:[#6](-[#6]):[#6](:[#6]):[#6]:1:[#6]:[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
12
Atom
9
ID
PTDBDEP01087
Smiles
CCc1c[nH]c2cc(C)ccc12
Reaction smiles
CCc1c[nH]c2cc(C)ccc12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>C=CC(C)(C)n1cc(CC)c2ccc(C)cc21.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6]1:[#6]:[#6]:[#6]2:[#6](-[#6]-[#6H]):[#6]:[#7H]:[#6]:2:[#6]:1.[CH2]=[CH1][CH0:1]([CH3])([CH3])[O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]=[#6]-[#6](-[#6])(-[#6])-[#7]1:[#6]:[#6](-[#6]-[#6H]):[#6]2:[#6]:[#6]:[#6](-[#6]):[#6]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
5
Size
14
Atom
11
ID
PTDBDEP01088
Smiles
Cc1ccc2c(C[C@H](C)N)c[nH]c2c1
Reaction smiles
Cc1ccc2c(C[C@H](C)N)c[nH]c2c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>C=CC(C)(C)n1cc(C[C@H](C)N)c2ccc(C)cc21.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6]1:[#6]:[#6]:[#6]2:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]:[#7H]:[#6]:2:[#6]:1.[CH2]=[CH1][CH0:1]([CH3])([CH3])[O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]=[#6]-[#6](-[#6])(-[#6])-[#7]1:[#6]:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]2:[#6]:[#6]:[#6](-[#6]):[#6]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]