Reaction

Enzyme

Reference


Depth

2

Size

7

Atom

3

ID

PTDBDEP00473

Smiles

cc(C)cc(c)c

Reaction smiles

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

Reaction smarts

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

Depth

3

Size

11

Atom

4

ID

PTDBDEP00474

Smiles

Cc1ccc2[nH]cc(C)c2c1

Reaction smiles

Cc1ccc2[nH]cc(C)c2c1.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CC(C)=CCc1c(C)ccc2[nH]cc(C)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]1:[#6]:[#6](-[#6]):[#6]:[#6]2:[#6](-[#6]):[#6]:[#7H]:[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]1:[#6]:[#6](-[#6]):[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]2:[#6](-[#6]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

4

Size

13

Atom

5

ID

PTDBDEP00475

Smiles

CCc1c[nH]c2c(C)cc(C)cc12

Reaction smiles

CCc1c[nH]c2c(C)cc(C)cc12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1c[nH]c2c(C)cc(C)c(CC=C(C)C)c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]-[#6]1:[#6]:[#6](-[#6]):[#6]:[#6]2:[#6](-[#6]-[#6H]):[#6]:[#7H]:[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]1:[#6]:[#6](-[#6]):[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]2:[#6](-[#6]-[#6H]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Depth

5

Size

16

Atom

6

ID

PTDBDEP00476

Smiles

CCc1cc(C)cc2c(C[C@H](C)N)c[nH]c12

Reaction smiles

CCc1cc(C)cc2c(C[C@H](C)N)c[nH]c12.CC(C)=CCOP(=O)([O-])OP(=O)([O-])[O-]>>CCc1cc(C)c(CC=C(C)C)c2c(C[C@H](C)N)c[nH]c12.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]

Reaction smarts

[#6]-[#6]-[#6]1:[#6]:[#6](-[#6]):[#6]:[#6]2:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]:[#7H]:[#6]:1:2.[CH3][CH0]([CH3])=[CH1][CH2:1][O:2]P(=O)([O-])OP(=O)([O-])([O-])>>[#6]-[#6]-[#6]1:[#6]:[#6](-[#6]):[#6](-[#6]-[#6]=[#6](-[#6])-[#6]):[#6]2:[#6](-[#6]-[#6H](-[#7])-[#6]):[#6]:[#7H]:[#6]:1:2.[O-]P(=O)([O-])OP(=O)([O-])([O-]).[H+]