EVODEX.1-P4087

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12](=[C:13]([C:14]([C:15](=[C:16]([C:17]([C:18]([C:19]([C:20](=[O:21])[O:22][H:26])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[H:33])[H:34])([H:35])[H:36])[H:37])[H:38])([H:39])[H:40])[H:41])[H:42])([H:43])[H:44])[H:45])[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57].[H][O:25][C:24]([C:23]([H:61])([H:62])[H:63])([H:59])[H:60]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12](=[C:13]([C:14]([C:15](=[C:16]([C:17]([C:18]([C:19]([C:20](=[O:21])[O:25][C:24]([C:23]([H:61])([H:62])[H:63])([H:59])[H:60])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[H:33])[H:34])([H:35])[H:36])[H:37])[H:38])([H:39])[H:40])[H:41])[H:42])([H:43])[H:44])[H:45])[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57].[H][O:22][H:26]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E157 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:1]-[#6:2](=[#8:3])-[#8:4]-[H:15].[#6:13]-[#8:14]-[H]>>[#6:1]-[#6:2](=[#8:3])-[#8:14]-[#6:13].[#8:4](-[H:15])-[H]

EVODEX.1-C1 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:5]-[#8:6].[H]-[#8:44]>>[#6:5]-[#8:44].[H]-[#8:6]

EVODEX.1-N601 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:17]-[#6:18](=[#8:19])-[#8:20]-[H:25].[H]-[#8:21]-[#6:22]>>[#6:17]-[#6:18](=[#8:19])-[#8:21]-[#6:22].[H]-[#8:20]-[H:25]

EVODEX.1-Em582 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:17]-[#6:18](=[#8:19])-[#8:20].[H]-[#8:21]-[#6:22]>>[#6:17]-[#6:18](=[#8:19])-[#8:21]-[#6:22].[H]-[#8:20]

EVODEX.1-Cm2 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:5]-[#8:6].[H]-[#8:44]>>[#6:5]-[#8:44].[H]-[#8:6]

EVODEX.1-Nm522 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:17]-[#6:18](=[#8:19])-[#8:20].[H]-[#8:21]-[#6:22]>>[#6:17]-[#6:18](=[#8:19])-[#8:21]-[#6:22].[H]-[#8:20]

Source Full Reactions

EVODEX.1-R4930

Full Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12](=[C:13]([C:14]([C:15](=[C:16]([C:17]([C:18]([C:19]([C:20](=[O:21])[O:22][H:26])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[H:33])[H:34])([H:35])[H:36])[H:37])[H:38])([H:39])[H:40])[H:41])[H:42])([H:43])[H:44])[H:45])[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57].[H][O:25][C:24]([C:23]([H:61])([H:62])[H:63])([H:59])[H:60]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6](=[C:7]([C:8]([C:9](=[C:10]([C:11]([C:12](=[C:13]([C:14]([C:15](=[C:16]([C:17]([C:18]([C:19]([C:20](=[O:21])[O:25][C:24]([C:23]([H:61])([H:62])[H:63])([H:59])[H:60])([H:27])[H:28])([H:29])[H:30])([H:31])[H:32])[H:33])[H:34])([H:35])[H:36])[H:37])[H:38])([H:39])[H:40])[H:41])[H:42])([H:43])[H:44])[H:45])[H:46])([H:47])[H:48])([H:49])[H:50])([H:51])[H:52])([H:53])[H:54])([H:55])([H:56])[H:57].[H][O:22][H:26]