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EVODEX.1-P4370

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]([C:3](=[C:4]([C:5]([C:6]([O:7][C@:8]1([H:29])[O:9][C@@:10]([C:11]([O:12][C@:13]2([H:30])[O:14][C:15]([H:31])([H:32])[C@:16]([O:17][H:33])([H:34])[C@@:18]([O:19][H:35])([H:36])[C@:20]2([O:21][H:37])[H:38])([H:39])[H:40])([H:41])[C@:22]([O:23][H:42])([H:43])[C@@:24]([O:25][H:44])([H:45])[C@:26]1([O:27][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:58]>>[H]O[C:6]([C:5]([C:4](=[C:3]([C:2]([C:1]([H:56])([H:57])[H:58])([H:54])[H:55])[H:53])[H:52])([H:50])[H:51])([H:48])[H:49].[H][O:7][C@:8]1([H:29])[O:9][C@@:10]([C:11]([O:12][C@:13]2([H:30])[O:14][C:15]([H:31])([H:32])[C@:16]([O:17][H:33])([H:34])[C@@:18]([O:19][H:35])([H:36])[C@:20]2([O:21][H:37])[H:38])([H:39])[H:40])([H:41])[C@:22]([O:23][H:42])([H:43])[C@@:24]([O:25][H:44])([H:45])[C@:26]1([O:27][H:46])[H:47]

Derived Operators

EVODEX.1-F9 - Elemental Balance

O1
H2

EVODEX.1-M2 - Mass Difference

18.010559999999998

EVODEX.1-E344 - Reaction Operator E

Reaction Operator E SMIRKS

[#6:2]-[#6:3](-[#8:4]-[#6:5])(-[H:20])-[H:21]>>[#6:2]-[#6:3](-[#8]-[H])(-[H:20])-[H:21].[#8:4](-[#6:5])-[H]

EVODEX.1-C7 - Reaction Operator C

Reaction Operator C SMIRKS

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

EVODEX.1-N1241 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:5]-[#6:6](-[#8:7]-[#6@:8])(-[H:48])-[H:49]>>[H]-[#8]-[#6:6](-[#6:5])(-[H:48])-[H:49].[H]-[#8:7]-[#6@:8]

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-R5209

Full Reaction Rendering

[C:1]([C:2]([C:3](=[C:4]([C:5]([C:6]([O:7][C@:8]1([H:29])[O:9][C@@:10]([C:11]([O:12][C@:13]2([H:30])[O:14][C:15]([H:31])([H:32])[C@:16]([O:17][H:33])([H:34])[C@@:18]([O:19][H:35])([H:36])[C@:20]2([O:21][H:37])[H:38])([H:39])[H:40])([H:41])[C@:22]([O:23][H:42])([H:43])[C@@:24]([O:25][H:44])([H:45])[C@:26]1([O:27][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:58].[H][O:28][H:59]>>[C:1]([C:2]([C:3](=[C:4]([C:5]([C:6]([O:28][H:59])([H:48])[H:49])([H:50])[H:51])[H:52])[H:53])([H:54])[H:55])([H:56])([H:57])[H:58].[H][O:7][C@:8]1([H:29])[O:9][C@@:10]([C:11]([O:12][C@:13]2([H:30])[O:14][C:15]([H:31])([H:32])[C@:16]([O:17][H:33])([H:34])[C@@:18]([O:19][H:35])([H:36])[C@:20]2([O:21][H:37])[H:38])([H:39])[H:40])([H:41])[C@:22]([O:23][H:42])([H:43])[C@@:24]([O:25][H:44])([H:45])[C@:26]1([O:27][H:46])[H:47]