Reaction smiles
cccc(c)[nH].CCC=CCOP(=O)([O-])OP(=O)([O-])[O-]>>ccc(C/C=C/CC)c(c)[nH].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#7H]:[#6](:[#6]:[#6]:[#6]):[#6].[CH3][CH2][CH1]=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]-[#6]=[#6]-[#6]-[#6](:[#6]:[#6]):[#6](:[#7H]):[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
3
Size
9
Atom
4
ID
PTDBDEP00826
Smiles
c1ccc2[nH]ccc2c1
Reaction smiles
c1ccc2[nH]ccc2c1.CCC=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC/C=C/Cc1cccc2cc[nH]c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]1:[#6]:[#7H]:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:1:2.[CH3][CH2][CH1]=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]-[#6]=[#6]-[#6]-[#6]1:[#6]:[#6]:[#6]:[#6]2:[#6]:[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
10
Atom
5
ID
PTDBDEP00827
Smiles
Cc1c[nH]c2ccccc12
Reaction smiles
Cc1c[nH]c2ccccc12.CCC=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC/C=C/Cc1cccc2c(C)c[nH]c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6]1:[#6]:[#7H]:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:1:2.[CH3][CH2][CH1]=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]-[#6]=[#6]-[#6]-[#6]1:[#6]:[#6]:[#6]:[#6]2:[#6](-[#6]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
5
Size
11
Atom
6
ID
PTDBDEP00828
Smiles
CCc1c[nH]c2ccccc12
Reaction smiles
CCc1c[nH]c2ccccc12.CCC=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC/C=C/Cc1cccc2c(CC)c[nH]c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6H]-[#6]-[#6]1:[#6]:[#7H]:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:1:2.[CH3][CH2][CH1]=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]-[#6]=[#6]-[#6]-[#6]1:[#6]:[#6]:[#6]:[#6]2:[#6](-[#6]-[#6H]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]