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EVODEX.1-P4340

Partial Hydrogen-Mapped Reactions

SMIRKS

Partial Reaction Rendering

[H]OC(=O)[C@]1([H])O[C@]([H])([O:9][C@@:10]2([H:30])[C:11]([O:12][H:31])([H:32])[O:13][C:14]([H:33])([H:34])[C@:15]([O:16][H:35])([H:36])[C@@:17]2([O:18][H:37])[H:38])[C@@]([H])(O[H])[C@]([H])(O[H])[C@@]1([H])OC([H])([H])[H]>>[H][O:9][C@@:10]1([H:30])[C:11]([O:12][H:31])([H:32])[O:13][C:14]([H:33])([H:34])[C@:15]([O:16][H:35])([H:36])[C@@:17]1([O:18][H:37])[H:38]

Derived Operators

EVODEX.1-F467 - Elemental Balance

C-7
O-6
H-10

EVODEX.1-M448 - Mass Difference

-190.0477

EVODEX.1-E1278 - Reaction Operator E

Reaction Operator E SMIRKS

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

EVODEX.1-C528 - Reaction Operator C

Reaction Operator C SMIRKS

[H]-[#8]-[#6](=[#8])-[#6@@]1(-[H])-[#8]-[#6@](-[H])(-[#8:9])-[#6@](-[H])(-[#8]-[H])-[#6@@](-[H])(-[#8]-[H])-[#6@]-1(-[H])-[#8]-[#6](-[H])(-[H])-[H]>>[H]-[#8:9]

EVODEX.1-N672 - Reaction Operator N

Reaction Operator N SMIRKS

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

EVODEX.1-Em15 - Reaction Operator Em

Reaction Operator Em SMIRKS

[#8]-[#6](-[H])(-[#8:2]-[#6:1])-[#6]>>[H]-[#8:2]-[#6:1]

EVODEX.1-Cm8 - Reaction Operator Cm

Reaction Operator Cm SMIRKS

[#6]-[#8:2]>>[H]-[#8:2]

EVODEX.1-Nm18 - Reaction Operator Nm

Reaction Operator Nm SMIRKS

[#8]-[#6](-[H])(-[#8:2]-[#6:1])-[#6]>>[H]-[#8:2]-[#6:1]

Source Full Reactions

EVODEX.1-R5184

Full Reaction Rendering

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