Reaction smiles
cccc(c)[nH].CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1ccc(CC=C(C)C)cc1[nH].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]:[#6]:[#6]:[#6](:[#7H]):[#6].[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]:1:[#7H].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
3
Size
9
Atom
3
ID
PTDBDEP00530
Smiles
c1ccc2[nH]ccc2c1
Reaction smiles
c1ccc2[nH]ccc2c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>C=CCc1ccc(CC=C(C)C)c2cc[nH]c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]1:[#6]:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6]:[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]=[#6]-[#6]-[#6]1:[#6]:[#6]:[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]2:[#6]:[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
11
Atom
4
ID
PTDBDEP00531
Smiles
Cc1cccc2[nH]cc(C)c12
Reaction smiles
Cc1cccc2[nH]cc(C)c12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC(C)=CCc1ccc(CC=C(C)C)c2c(C)c[nH]c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6]1:[#6]:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]):[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6](-[#6])=[#6]-[#6]-[#6]1:[#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
5
Size
13
Atom
5
ID
PTDBDEP00532
Smiles
CCc1cccc2[nH]cc(CC)c12
Reaction smiles
CCc1cccc2[nH]cc(CC)c12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1c[nH]c2c(CC=C(C)C)ccc(CC=C(C)C)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#6]-[#6]1:[#6]:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]-[#6H]):[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6](-[#6])=[#6]-[#6]-[#6]1:[#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+]