Depth
2
Size
7
Atom
3
ID
PTDBDEP00357
Smiles
cc(O)cc(c)c
Reaction smiles
cc(O)cc(c)c.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc(O)c(CC=C(C)C)c(c)c.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#8]-[#6](:[#6]):[#6]:[#6](:[#6]):[#6].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#8]-[#6](:[#6]):[#6](:[#6](:[#6]):[#6])-[#6]-[#6]=[#6](-[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
3
Size
12
Atom
11
ID
PTDBDEP00358
Smiles
COc1ccc2[nH]cc(C)c2c1
Reaction smiles
COc1ccc2[nH]cc(C)c2c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>COc1ccc2[nH]cc(C)c2c1CC=C(C)C.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]):[#6]:2:[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]):[#6]:2:[#6]:1-[#6]-[#6]=[#6](-[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
13
Atom
12
ID
PTDBDEP00359
Smiles
CCc1c[nH]c2ccc(OC)cc12
Reaction smiles
CCc1c[nH]c2ccc(OC)cc12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1c[nH]c2ccc(OC)c(CC=C(C)C)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]-[#6H]):[#6]:2:[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]-[#6H]):[#6]:2:[#6]:1-[#6]-[#6]=[#6](-[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
5
Size
15
Atom
14
ID
PTDBDEP00360
Smiles
COc1ccc2[nH]cc(C[C@H](C)N)c2c1
Reaction smiles
COc1ccc2[nH]cc(C[C@H](C)N)c2c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>COc1ccc2[nH]cc(C[C@H](C)N)c2c1CC=C(C)C.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]:2:[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6]:[#6]:[#6]2:[#7H]:[#6]:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]:2:[#6]:1-[#6]-[#6]=[#6](-[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]