EVODEX.1-P190

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([O:2][C:3](=[O:4])[C@@:5]([C:6]([C:7]([S:8][C:9]([H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([N:10]([C:11](=[O:12])[O:13][C:14]([C:15]([H:27])([H:28])[H:29])([C:16]([H:30])([H:31])[H:32])[C:17]([H:33])([H:34])[H:35])[H:36])[H:37])([H:38])([H:39])[H:40].[H][O:19][O:18][H:42]>>[C:1]([O:2][C:3](=[O:4])[C@@:5]([C:6]([C:7]([S:8]([C:9]([H:20])([H:21])[H:22])=[O:19])([H:23])[H:24])([H:25])[H:26])([N:10]([C:11](=[O:12])[O:13][C:14]([C:15]([H:27])([H:28])[H:29])([C:16]([H:30])([H:31])[H:32])[C:17]([H:33])([H:34])[H:35])[H:36])[H:37])([H:38])([H:39])[H:40].[H][O:18][H:42]

Derived Operators

EVODEX.1-F7 - Elemental Balance

EVODEX.1-M1 - Mass Difference

0.0

EVODEX.1-E14 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:3]-[#16:4]-[#6:5].[#8:59]=[#8:60]>>[#6:3]-[#16@@:4](-[#6:5])=[#8:60].[#8:59](-[H])-[H]

EVODEX.1-C79 - Reaction Operator C

Reaction Operator C SMIRKS

[#16:2]-[#8:5].[H]-[#8:16]>>[#16:2]-[#8:16].[H]-[#8:5]

EVODEX.1-N119 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:6]-[#16:7]-[#6:8].[#8:59]=[#8:60]>>[#6:6]-[#16:7](-[#6:8])=[#8:60].[H]-[#8:59]-[H]

EVODEX.1-Em198 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:6]-[#16:7]-[#6:8].[#8:59]=[#8:60]>>[#6:6]-[#16:7](-[#6:8])=[#8:60].[H]-[#8:59]-[H]

EVODEX.1-Cm64 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[H]-[#8:11].[#8:40]-[#16:41]>>[#8:11]-[#16:41].[H]-[#8:40]

EVODEX.1-Nm198 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:6]-[#16:7]-[#6:8].[#8:59]=[#8:60]>>[#6:6]-[#16:7](-[#6:8])=[#8:60].[H]-[#8:59]-[H]

Source Full Reactions

EVODEX.1-R239

Full Reaction Rendering

[C:1]([O:2][C:3](=[O:4])[C@@:5]([C:6]([C:7]([S:8][C:9]([H:20])([H:21])[H:22])([H:23])[H:24])([H:25])[H:26])([N:10]([C:11](=[O:12])[O:13][C:14]([C:15]([H:27])([H:28])[H:29])([C:16]([H:30])([H:31])[H:32])[C:17]([H:33])([H:34])[H:35])[H:36])[H:37])([H:38])([H:39])[H:40].[H][O:19][O:18][H:42]>>[C:1]([O:2][C:3](=[O:4])[C@@:5]([C:6]([C:7]([S:8]([C:9]([H:20])([H:21])[H:22])=[O:19])([H:23])[H:24])([H:25])[H:26])([N:10]([C:11](=[O:12])[O:13][C:14]([C:15]([H:27])([H:28])[H:29])([C:16]([H:30])([H:31])[H:32])[C:17]([H:33])([H:34])[H:35])[H:36])[H:37])([H:38])([H:39])[H:40].[H][O:18][H:42]