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EVODEX.1-P4548

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]1([H:25])[O:7][C:8]1([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15](=[C:16]([C:17](=[C:18]([C:19](=[C:20]([C:21](=[O:22])[O:23][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]O[C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:54])([H:55])[H:56])([H:52])[H:53])([H:50])[H:51])([H:48])[H:49])([H:46])[H:47])([C:8]([O:7][H])([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15](=[C:16]([C:17](=[C:18]([C:19](=[C:20]([C:21](=[O:22])[O:23][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:25]

Derived Operators

EVODEX.1-F9 - Elemental Balance

O1
H2

EVODEX.1-M2 - Mass Difference

18.010559999999998

EVODEX.1-E348 - Reaction Operator E

Reaction Operator E SMIRKS

[#8:9]1-[#6@@:8]-[#6@@:10]-1(-[#6:11])-[H:40]>>[#8:9](-[#6@@:8]-[#6@:10](-[#6:11])(-[#8]-[H])-[H:40])-[H]

EVODEX.1-C68 - Reaction Operator C

Reaction Operator C SMIRKS

[#6:9]-[#8:11]>>([H]-[#8]-[#6:9].[#8:11]-[H])

EVODEX.1-N692 - Reaction Operator N

Reaction Operator N SMIRKS

[#6:8]-[#6:9]1(-[H:17])-[#6:10]-[#8:11]-1>>[H]-[#8]-[#6:9](-[#6:8])(-[#6:10]-[#8:11]-[H])-[H:17]

EVODEX.1-Em125 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#6:5]-[#6:6]1-[#8:7]-[#6:8]-1>>[H]-[#8]-[#6:6](-[#6:5])-[#6:8]-[#8:7]-[H]

EVODEX.1-Cm69 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6:6]-[#8:7]>>([#8]-[#6:6].[#8:7]-[H])

EVODEX.1-Nm159 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#6:5]-[#6:6]1-[#8:7]-[#6:8]-1>>[H]-[#8]-[#6:6](-[#6:5])-[#6:8]-[#8:7]-[H]

Source Full Reactions

EVODEX.1-R5384

Full Reaction Rendering

[C:1]([C:2]([C:3]([C:4]([C:5]([C:6]1([H:25])[O:7][C:8]1([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15](=[C:16]([C:17](=[C:18]([C:19](=[C:20]([C:21](=[O:22])[O:23][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][O:24][H:57]>>[H][O:7][C:8]([C:6]([C:5]([C:4]([C:3]([C:2]([C:1]([H:54])([H:55])[H:56])([H:52])[H:53])([H:50])[H:51])([H:48])[H:49])([H:46])[H:47])([O:24][H:57])[H:25])([C:9]([C:10]([C:11]([C:12]([C:13]([C:14]([C:15](=[C:16]([C:17](=[C:18]([C:19](=[C:20]([C:21](=[O:22])[O:23][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]