All rules > rule id: 800656

Reaction SMARTS

[#6+0:1]12-[#6+0:2](-[#6,#1;+0:6])(-[#6+0:7]-[#6+0:16](-[#6+0:5](-[#6+0:3]=1-[#1+0:4])=[#8+0:15])(-[#1,#6;+0:17])-[#1,#6;+0:18])-[#6+0:14]-[#6+0:13]-[#6+0:10](-[#6+0:8]-2(-[#1+0:9])-[#1+0:20])(-[#1,#6;+0:11])-[#1,#6;+0:12].[#8-:19]-[#6+0:21](=[#8+0:22])-[#6,#1;+0:23]>>[#6+0:1]12-[#6+0:2](-[#6,#1;+0:6])(-[#6+0:7]-[#6+0:16](-[#6+0:5](=[#6+0:3]-1-[#1+0:4])-[#8-:15])(-[#1,#6;+0:17])-[#1,#6;+0:18])-[#6+0:14]-[#6+0:13]-[#6+0:10](-[#6+0:8]=2-[#1+0:9])(-[#1,#6;+0:11])-[#1,#6;+0:12].[#8+0:19](-[#1+0:20])-[#6+0:21](=[#8+0:22])-[#6,#1;+0:23]

Simplified SMARTS

C12=C([H])C(=O)C(*)(*)CC1(*)CCC(*)(*)C2([H])[H].[O-]C(=O)*>>C12=C([H])C(*)(*)CCC1(*)CC(*)(*)C([O-])=C2[H].O([H])C(=O)*

Rule Set Version: 0.2
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Complete rule seen in 1 catalytic steps

m-csa:822 - cholesterol oxidase - mechanism: 1 - step: 4

Rule partially seen in 2 catalytic steps

m-csa:349 - delta 5-3-ketosteroid isomerase - mechanism: 2 - step: 2
m-csa:354 - cholesterol oxidase (GMC type) - mechanism: 1 - step: 4