Reaction

Enzyme

Reference


Depth

2

Size

7

Atom

2

ID

PTDBDEP01325

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

Depth

3

Size

9

Atom

2

ID

PTDBDEP01326

Smiles

Cc1ccc(C)c(O)c1

Reaction smiles

Cc1ccc(C)c(O)c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC(C)=CCc1c(C)ccc(C)c1O.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]-[#6]1:[#6]:[#6](-[#8]):[#6](:[#6]:[#6]:1)-[#6].[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]:1-[#8])-[#6].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

4

Size

12

Atom

2

ID

PTDBDEP01327

Smiles

Cc1cc(O)c(C(C)O)c(O)c1

Reaction smiles

Cc1cc(O)c(C(C)O)c(O)c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC(C)=CCc1c(C)cc(O)c(C(C)O)c1O.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]-[#6]1:[#6]:[#6](-[#8]):[#6](:[#6](:[#6]:1)-[#8])-[#6](-[#6])-[#8].[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]:1-[#8])-[#6](-[#8])-[#6])-[#8].[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

5

Size

13

Atom

2

ID

PTDBDEP01328

Smiles

Cc1cc(O)c2c(c1)OCCC2O

Reaction smiles

Cc1cc(O)c2c(c1)OCCC2O.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC(C)=CCc1c(C)cc2c(c1O)C(O)CCO2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]-[#6]1:[#6]:[#6](-[#8]):[#6]2:[#6](:[#6]:1)-[#8]-[#6H]-[#6]-[#6]-2-[#8].[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]2:[#6](:[#6]:1-[#8])-[#6](-[#8])-[#6]-[#6H]-[#8]-2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]