Reaction smiles
ccccc.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>ccc(cc)CC=C(C)C.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]:[#6]:[#6]:[#6]:[#6].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]:[#6]:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smiles
cc1ccccc1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc1cccc(CC=C(C)C)c1.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]:[#6]1:[#6]:[#6]:[#6]:[#6]:[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]1:[#6]:[#6]:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6]:1:[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
10
Atom
4
ID
PTDBDEP00955
Smiles
cc1c[nH]c2ccccc12
Reaction smiles
cc1c[nH]c2ccccc12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc1c[nH]c2ccc(CC=C(C)C)cc12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]:[#6]1:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:2:[#7H]:[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]1:[#7H]:[#6]2:[#6]:[#6]:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6]:2:[#6]:1:[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
5
Size
13
Atom
6
ID
PTDBDEP00956
Smiles
cc(C)c1c(c)[nH]c2ccccc21
Reaction smiles
cc(C)c1c(c)[nH]c2ccccc21.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc(C)c1c(c)[nH]c2ccc(CC=C(C)C)cc21.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6](:[#6]):[#6]1:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:2:[#7H]:[#6]:1:[#6].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]:[#6]1:[#7H]:[#6]2:[#6]:[#6]:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:[#6]:2:[#6]:1:[#6](:[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]