Depth
2
Size
7
Atom
2
ID
PTDBDEP01229
Smiles
cc(C)cc(c)O
Reaction smiles
cc(C)cc(c)O.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc(C)c(CC=C(C)C)c(c)O.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]:[#6](:[#6]:[#6](:[#6])-[#6H])-[#8].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]:[#6](:[#6](:[#6](:[#6])-[#6H])-[#6]-[#6]=[#6](-[#6])-[#6])-[#8].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
3
Size
11
Atom
8
ID
PTDBDEP01230
Smiles
C[C@H](O)c1ccc(O)c(O)c1
Reaction smiles
C[C@H](O)c1ccc(O)c(O)c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC(C)=CCc1c([C@H](C)O)ccc(O)c1O.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#8]-[#6]1:[#6]:[#6]:[#6](-[#6H](-[#6])-[#8]):[#6]:[#6]:1-[#8].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#8]-[#6]1:[#6]:[#6]:[#6](-[#6H](-[#6])-[#8]):[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:1-[#8].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
4
Size
14
Atom
11
ID
PTDBDEP01231
Smiles
CC[C@H](Oc)c1ccc(OC)c(O)c1
Reaction smiles
CC[C@H](Oc)c1ccc(OC)c(O)c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC[C@H](Oc)c1ccc(OC)c(O)c1CC=C(C)C.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6](-[#6H](-[#6]-[#6])-[#8]-[#6]):[#6]:[#6]:1-[#8].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6]:[#6]:[#6](-[#6H](-[#6]-[#6])-[#8]-[#6]):[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:1-[#8].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Depth
5
Size
17
Atom
14
ID
PTDBDEP01232
Smiles
cc1cC(=O)C[C@@H](c2ccc(OC)c(O)c2)O1
Reaction smiles
cc1cC(=O)C[C@@H](c2ccc(OC)c(O)c2)O1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc1cC(=O)C[C@@H](c2ccc(OC)c(O)c2CC=C(C)C)O1.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]
Reaction smarts
[#6]-[#8]-[#6]1:[#6]:[#6]:[#6](-[#6H]2-[#6]-[#6](=[#8])-[#6]:[#6](:[#6])-[#8]-2):[#6]:[#6]:1-[#8].[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6]:[#6]:[#6](-[#6H]2-[#6]-[#6](=[#8])-[#6]:[#6](:[#6])-[#8]-2):[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]:1-[#8].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]