Reaction

Enzyme

Reference


Depth

2

Size

5

Atom

2

ID

PTDBDEP00961

Smiles

ccccc

Reaction smiles

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

Reaction smarts

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

Depth

3

Size

7

Atom

3

ID

PTDBDEP00962

Smiles

cc1ccccc1

Reaction smiles

cc1ccccc1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc1cccc(CC=C(C)C)c1.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

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

Depth

4

Size

10

Atom

4

ID

PTDBDEP00963

Smiles

cc1c[nH]c2ccccc12

Reaction smiles

cc1c[nH]c2ccccc12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc1c[nH]c2ccc(CC=C(C)C)cc12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]:[#6]1:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:2:[#7H]:[#6]:1.[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]2:[#7H]:[#6]:[#6](:[#6]):[#6]:2:[#6]:1.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

5

Size

13

Atom

6

ID

PTDBDEP00964

Smiles

cc(C)c1c(c)[nH]c2ccccc21

Reaction smiles

cc(C)c1c(c)[nH]c2ccccc21.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>cc(C)c1c(c)[nH]c2ccc(CC=C(C)C)cc21.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]-[#6](:[#6]):[#6]1:[#6]2:[#6]:[#6]:[#6]:[#6]:[#6]:2:[#7H]:[#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]2:[#7H]:[#6](:[#6]):[#6](:[#6](:[#6])-[#6]):[#6]:2:[#6]:1.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]