Reaction

PTDBREC00474

Enzyme

PTDBENZ00014

Reference

PTDBDOC00039

Depth

2

Size

6

Atom

2

ID

PTDBDEP01893

Smiles

cccc(c)O

Smarts

[#8]-[#6](:[#6]:[#6]:[#6]):[#6]

Reaction smiles

cccc(c)O.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>ccc(CC=C(C)C)c(c)O.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#8]-[#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].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

3

Size

8

Atom

2

ID

PTDBDEP01894

Smiles

cc1ccc(O)cc1

Smarts

[#8]-[#6]1:[#6]:[#6]:[#6](:[#6]):[#6]:[#6]:1

Reaction smiles

cc1ccc(O)cc1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc1ccc(OC)c(CC=C(C)C)c1.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#8]-[#6]1:[#6]:[#6]:[#6](:[#6]):[#6]:[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#8]-[#6]1:[#6]:[#6]:[#6](:[#6]):[#6]:[#6]:1-[#6]-[#6]=[#6](-[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

4

Size

10

Atom

2

ID

PTDBDEP01895

Smiles

ccc1ccc(O)cc1c

Smarts

[#8]-[#6]1:[#6]:[#6]:[#6](:[#6]:[#6]):[#6](:[#6]):[#6]:1

Reaction smiles

ccc1ccc(O)cc1c.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>ccc1cc(CC=C(C)C)c(OCC)cc1c.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#8]-[#6]1:[#6]:[#6]:[#6](:[#6]:[#6]):[#6](:[#6]):[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]-[#8]-[#6]1:[#6]:[#6](:[#6]):[#6](:[#6]:[#6]):[#6]:[#6]:1-[#6]-[#6]=[#6](-[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

5

Size

11

Atom

2

ID

PTDBDEP01896

Smiles

Oc1ccc2ccccc2c1

Smarts

[#8]-[#6]1:[#6]:[#6]:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:2:[#6]:1

Reaction smiles

Oc1ccc2ccccc2c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>C=CCOc1cc2ccccc2cc1CC=C(C)C.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#8]-[#6]1:[#6]:[#6]:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:2:[#6]:1.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]=[#6]-[#6]-[#8]-[#6]1:[#6]:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:2:[#6]:[#6]:1-[#6]-[#6]=[#6](-[#6])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]