All rules > rule id: 800995

Reaction SMARTS

[#7+:1]1(-[#6+0:2](-[#6,#1;+0:3])=[#6+0:4]-[#7+0:7]-[#6+0:5]=1-[#1,#6;+0:6])-[#1+0:8].[#7+0:9]1-[#6+0:10](=[#6+0:11](-[#6,#1;+0:12])-[#7+0:13](-[#6+0:14]=1-[#1+0:15])-[#1+0:18])-[#1,#6;+0:16].[#8+0:17](-[#6+0:19](-[#6,#1;+0:20])=[#6+0:21])-[#1+0:23].[#8+0:22](-[#6+0:24](-[#6,#1;+0:25])=[#6+0:26])-[#1+0:27].[#8-:28]-[#1+0:29]>>[#7+0:1]1-[#6+0:2](-[#6,#1;+0:3])=[#6+0:4]-[#7+0:7]-[#6+0:5]=1-[#1,#6;+0:6].[#1+0:8]-[#7+0:9]1-[#6+0:10](=[#6+0:11](-[#6,#1;+0:12])-[#7+0:13]=[#6+0:14]-1-[#1+0:15])-[#1,#6;+0:16].[#8+0:17](-[#1+0:18])-[#6+0:19](-[#6,#1;+0:20])=[#6+0:21].[#8+0:22](-[#1+0:23])-[#6+0:24](-[#6,#1;+0:25])=[#6+0:26].[#1+0:27]-[#8+0:28]-[#1+0:29]

Simplified SMARTS

[N+]1([H])=C(*)NC=C1*.N1=C([H])N([H])C(*)=C1*.O(C(*)=C)[H].O(C(*)=C)[H].[O-][H]>>N1=C(*)NC=C1*.[H]N1C(*)=C(*)N=C1[H].O([H])C(*)=C.O([H])C(*)=C.[H]O[H]

Rule Set Version: 0.2

Complete rule seen in 0 catalytic steps

Rule partially seen in 7 catalytic steps

m-csa:182 - methylisocitrate lyase - mechanism: 4 - step: 3
m-csa:254 - squalene-hopene cyclase - mechanism: 1 - step: 6
m-csa:254 - squalene-hopene cyclase - mechanism: 2 - step: 6
m-csa:740 - arylesterase - mechanism: 1 - step: 1
m-csa:829 - endo-alpha-sialidase - mechanism: 2 - step: 1