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EVODEX.1-P4310

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([O:9][C@:10]1([H:22])[O:11][C@@:12]([C:13]([O:14][H:23])([H:24])[H:25])([H:26])[C@:15]([O:16][H:27])([H:28])[C@@:17]([O:18][H:29])([H:30])[C@:19]1([O:20][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]O[C:8]([C:7]([C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:47])([H:48])[H:49])([H:45])[H:46])([H:43])[H:44])([H:41])[H:42])([H:39])[H:40])([H:37])[H:38])([H:35])[H:36])([H:33])[H:34].[H][O:9][C:10]1([H:22])[O:11][C@@:12]([C:13]([O:14][H:23])([H:24])[H:25])([H:26])[C@:15]([O:16][H:27])([H:28])[C@@:17]([O:18][H:29])([H:30])[C@:19]1([O:20][H:31])[H:32]

Derived Operators

EVODEX.1-F9 - Elemental Balance

O1
H2

EVODEX.1-M2 - Mass Difference

18.010559999999998

EVODEX.1-E383 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:4]-[#6:5](-[#8:6]-[#6@:7](-[H:19])(-[#8:8])-[#6@:16])(-[H:30])-[H:31]>>[#6:4]-[#6:5](-[#8]-[H])(-[H:30])-[H:31].[#8:6](-[#6:7](-[H:19])(-[#8:8])-[#6@:16])-[H]

EVODEX.1-C525 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:19]-[#8:20]-[#6@@:21]>>[H]-[#8]-[#6:19].[H]-[#8:20]-[#6:21]

EVODEX.1-N1249 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:18]-[#6:19](-[#8:20]-[#6@@:21](-[H:38])(-[#8:22])-[#6@:30])(-[H:49])-[H:50]>>[H]-[#8]-[#6:19](-[#6:18])(-[H:49])-[H:50].[H]-[#8:20]-[#6:21](-[H:38])(-[#8:22])-[#6@:30]

EVODEX.1-Em115 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:18]-[#6:19]-[#8:20]-[#6:21]>>[H]-[#8]-[#6:19]-[#6:18].[H]-[#8:20]-[#6:21]

EVODEX.1-Cm11 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:3]-[#8:4]>>[#8]-[#6:3].[H]-[#8:4]

EVODEX.1-Nm147 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:18]-[#6:19]-[#8:20]-[#6:21]>>[H]-[#8]-[#6:19]-[#6:18].[H]-[#8:20]-[#6:21]

Source Full Reactions

EVODEX.1-R5157

Full Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([O:9][C@:10]1([H:22])[O:11][C@@:12]([C:13]([O:14][H:23])([H:24])[H:25])([H:26])[C@:15]([O:16][H:27])([H:28])[C@@:17]([O:18][H:29])([H:30])[C@:19]1([O:20][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][O:21][H:50]>>[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]([C:7]([C:8]([O:21][H:50])([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][O:9][C:10]1([H:22])[O:11][C@@:12]([C:13]([O:14][H:23])([H:24])[H:25])([H:26])[C@:15]([O:16][H:27])([H:28])[C@@:17]([O:18][H:29])([H:30])[C@:19]1([O:20][H:31])[H:32]