Reaction smiles
cccc(c)c.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>ccc(CC=C(C)C)c(c)c.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]:[#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]):[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
3
Size
11
Atom
4
ID
PTDBDEP00482
Smiles
Cc1ccc2c(C)c[nH]c2c1
Reaction smiles
Cc1ccc2c(C)c[nH]c2c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC(C)=CCc1cc(C)cc2[nH]cc(C)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]1:[#6](-[#6]):[#6]:[#6]:[#6]2:[#6](-[#6]):[#6]:[#7H]:[#6]:1:2.[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]2:[#6](-[#6]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
13
Atom
5
ID
PTDBDEP00483
Smiles
CCc1c[nH]c2c(C)c(C)ccc12
Reaction smiles
CCc1c[nH]c2c(C)c(C)ccc12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1c[nH]c2c(C)c(C)cc(CC=C(C)C)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6]1:[#6](-[#6]):[#6]:[#6]:[#6]2:[#6](-[#6]-[#6H]):[#6]:[#7H]:[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]1:[#6](-[#6]):[#6]:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]2:[#6](-[#6]-[#6H]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
5
Size
16
Atom
6
ID
PTDBDEP00484
Smiles
CCc1c(C)ccc2c(C[C@H](C)N)c[nH]c12
Reaction smiles
CCc1c(C)ccc2c(C[C@H](C)N)c[nH]c12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1c(C)cc(CC=C(C)C)c2c(C[C@H](C)N)c[nH]c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6]-[#6]1:[#6](-[#6]):[#6]:[#6]:[#6]2:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]:[#7H]:[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]-[#6]1:[#6](-[#6]):[#6]:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]2:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]